USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 835 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 533 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 536 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 470 ASN : amide:sc= -0.242 K(o=0.3,f=-1.3) USER MOD Set 2.2: A 472 SER OG : rot -84:sc= 0.538 USER MOD Set 3.1: A 467 GLN : amide:sc= -1.03 X(o=-0.87,f=-1.2!) USER MOD Set 3.2: A 510 THR OG1 : rot 78:sc= 0.167 USER MOD Set 4.1: A 455 SER OG : rot -170:sc= 0 USER MOD Set 4.2: A 471 ASN : amide:sc= -0.129 K(o=-0.13,f=-2.6!) USER MOD Single : A 453 SER OG : rot 22:sc= 0.0899 USER MOD Single : A 464 LYS NZ :NH3+ -154:sc= 0.882 (180deg=0.124) USER MOD Single : A 469 LYS NZ :NH3+ -112:sc= 0.135 (180deg=-0.626) USER MOD Single : A 474 LYS NZ :NH3+ 168:sc= -0.004 (180deg=-0.142) USER MOD Single : A 476 GLN : amide:sc= 0.00193 X(o=0.0019,f=-0.085) USER MOD Single : A 477 SER OG : rot 30:sc= 0.0375 USER MOD Single : A 480 ASN : amide:sc= -0.124 X(o=-0.12,f=0) USER MOD Single : A 484 LYS NZ :NH3+ -156:sc= 1.1 (180deg=0.674) USER MOD Single : A 486 GLN : amide:sc= 0.405 K(o=0.41,f=-2.8!) USER MOD Single : A 495 TYR OH : rot 30:sc= 0 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 THR OG1 : rot 180:sc= -0.238 USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 TYR OH : rot 30:sc= 0 USER MOD Single : A 507 GLN : amide:sc= -0.185 X(o=-0.18,f=-0.14) USER MOD Single : A 508 MET CE :methyl -159:sc= -0.0951 (180deg=-0.564) USER MOD Single : A 520 HIS : no HE2:sc= -0.335 K(o=-0.34,f=-1.3) USER MOD Single : A 521 SER OG : rot 67:sc= 0.294 USER MOD Single : A 524 SER OG : rot 180:sc= 0 USER MOD Single : A 525 THR OG1 : rot 180:sc= 0 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 GLN : amide:sc=-0.00593 K(o=-0.0059,f=-0.76) USER MOD Single : A 532 SER OG : rot 180:sc=0.000396 USER MOD Single : A 539 SER OG : rot 180:sc= 0 USER MOD Single : A 542 THR OG1 : rot 180:sc= 0 USER MOD Single : A 546 ASN : amide:sc= -5.83! K(o=-5.8!,f=-2) USER MOD Single : A 554 MET CE :methyl -143:sc= -0.121 (180deg=-2.38!) USER MOD Single : A 556 THR OG1 : rot 180:sc= 0 USER MOD Single : A 558 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 559 LYS NZ :NH3+ -131:sc= 1.21 (180deg=-0.175) USER MOD ----------------------------------------------------------------- ATOM 40 N SER A 453 9.341 3.335 -6.183 1.00 0.00 N ATOM 41 CA SER A 453 10.229 2.946 -5.064 1.00 0.00 C ATOM 42 C SER A 453 11.498 2.242 -5.597 1.00 0.00 C ATOM 43 O SER A 453 12.618 2.622 -5.247 1.00 0.00 O ATOM 44 CB SER A 453 9.468 2.050 -4.067 1.00 0.00 C ATOM 45 OG SER A 453 8.280 2.684 -3.614 1.00 0.00 O ATOM 0 HA SER A 453 10.546 3.846 -4.537 1.00 0.00 H new ATOM 0 HB2 SER A 453 9.219 1.101 -4.542 1.00 0.00 H new ATOM 0 HB3 SER A 453 10.109 1.821 -3.216 1.00 0.00 H new ATOM 0 HG SER A 453 8.006 3.366 -4.262 1.00 0.00 H new ATOM 51 N VAL A 454 11.297 1.214 -6.448 1.00 0.00 N ATOM 52 CA VAL A 454 12.382 0.487 -7.138 1.00 0.00 C ATOM 53 C VAL A 454 12.105 0.514 -8.658 1.00 0.00 C ATOM 54 O VAL A 454 10.964 0.292 -9.087 1.00 0.00 O ATOM 55 CB VAL A 454 12.508 -1.013 -6.656 1.00 0.00 C ATOM 56 CG1 VAL A 454 13.753 -1.699 -7.273 1.00 0.00 C ATOM 57 CG2 VAL A 454 12.507 -1.141 -5.110 1.00 0.00 C ATOM 0 H VAL A 454 10.367 0.862 -6.677 1.00 0.00 H new ATOM 0 HA VAL A 454 13.323 0.983 -6.899 1.00 0.00 H new ATOM 0 HB VAL A 454 11.620 -1.533 -7.016 1.00 0.00 H new ATOM 0 HG11 VAL A 454 13.812 -2.729 -6.922 1.00 0.00 H new ATOM 0 HG12 VAL A 454 13.672 -1.690 -8.360 1.00 0.00 H new ATOM 0 HG13 VAL A 454 14.652 -1.161 -6.971 1.00 0.00 H new ATOM 0 HG21 VAL A 454 12.596 -2.191 -4.832 1.00 0.00 H new ATOM 0 HG22 VAL A 454 13.349 -0.584 -4.698 1.00 0.00 H new ATOM 0 HG23 VAL A 454 11.576 -0.738 -4.712 1.00 0.00 H new ATOM 67 N SER A 455 13.147 0.801 -9.454 1.00 0.00 N ATOM 68 CA SER A 455 13.088 0.798 -10.928 1.00 0.00 C ATOM 69 C SER A 455 14.005 -0.301 -11.508 1.00 0.00 C ATOM 70 O SER A 455 14.746 -0.966 -10.772 1.00 0.00 O ATOM 71 CB SER A 455 13.511 2.188 -11.461 1.00 0.00 C ATOM 72 OG SER A 455 12.732 3.216 -10.878 1.00 0.00 O ATOM 0 H SER A 455 14.068 1.045 -9.089 1.00 0.00 H new ATOM 0 HA SER A 455 12.066 0.586 -11.243 1.00 0.00 H new ATOM 0 HB2 SER A 455 14.565 2.359 -11.244 1.00 0.00 H new ATOM 0 HB3 SER A 455 13.401 2.214 -12.545 1.00 0.00 H new ATOM 0 HG SER A 455 12.906 4.062 -11.342 1.00 0.00 H new ATOM 78 N ILE A 456 13.919 -0.491 -12.837 1.00 0.00 N ATOM 79 CA ILE A 456 14.812 -1.387 -13.595 1.00 0.00 C ATOM 80 C ILE A 456 15.973 -0.545 -14.163 1.00 0.00 C ATOM 81 O ILE A 456 15.751 0.302 -15.040 1.00 0.00 O ATOM 82 CB ILE A 456 14.037 -2.089 -14.777 1.00 0.00 C ATOM 83 CG1 ILE A 456 12.736 -2.785 -14.264 1.00 0.00 C ATOM 84 CG2 ILE A 456 14.949 -3.098 -15.521 1.00 0.00 C ATOM 85 CD1 ILE A 456 11.835 -3.348 -15.362 1.00 0.00 C ATOM 0 H ILE A 456 13.224 -0.024 -13.419 1.00 0.00 H new ATOM 0 HA ILE A 456 15.190 -2.166 -12.932 1.00 0.00 H new ATOM 0 HB ILE A 456 13.744 -1.315 -15.487 1.00 0.00 H new ATOM 0 HG12 ILE A 456 13.016 -3.596 -13.592 1.00 0.00 H new ATOM 0 HG13 ILE A 456 12.164 -2.067 -13.677 1.00 0.00 H new ATOM 0 HG21 ILE A 456 14.389 -3.567 -16.330 1.00 0.00 H new ATOM 0 HG22 ILE A 456 15.811 -2.574 -15.933 1.00 0.00 H new ATOM 0 HG23 ILE A 456 15.289 -3.864 -14.824 1.00 0.00 H new ATOM 0 HD11 ILE A 456 10.958 -3.811 -14.911 1.00 0.00 H new ATOM 0 HD12 ILE A 456 11.519 -2.541 -16.023 1.00 0.00 H new ATOM 0 HD13 ILE A 456 12.384 -4.094 -15.937 1.00 0.00 H new ATOM 97 N GLU A 457 17.198 -0.766 -13.657 1.00 0.00 N ATOM 98 CA GLU A 457 18.376 0.042 -14.034 1.00 0.00 C ATOM 99 C GLU A 457 18.989 -0.460 -15.357 1.00 0.00 C ATOM 100 O GLU A 457 18.979 0.258 -16.367 1.00 0.00 O ATOM 101 CB GLU A 457 19.440 0.040 -12.902 1.00 0.00 C ATOM 102 CG GLU A 457 20.579 1.068 -13.084 1.00 0.00 C ATOM 103 CD GLU A 457 20.066 2.525 -13.163 1.00 0.00 C ATOM 104 OE1 GLU A 457 19.852 3.155 -12.101 1.00 0.00 O ATOM 105 OE2 GLU A 457 19.844 3.038 -14.288 1.00 0.00 O ATOM 0 H GLU A 457 17.401 -1.502 -12.981 1.00 0.00 H new ATOM 0 HA GLU A 457 18.041 1.069 -14.182 1.00 0.00 H new ATOM 0 HB2 GLU A 457 18.941 0.235 -11.953 1.00 0.00 H new ATOM 0 HB3 GLU A 457 19.876 -0.957 -12.834 1.00 0.00 H new ATOM 0 HG2 GLU A 457 21.279 0.979 -12.253 1.00 0.00 H new ATOM 0 HG3 GLU A 457 21.132 0.833 -13.993 1.00 0.00 H new ATOM 112 N GLU A 458 19.491 -1.713 -15.349 1.00 0.00 N ATOM 113 CA GLU A 458 20.150 -2.328 -16.530 1.00 0.00 C ATOM 114 C GLU A 458 19.396 -3.604 -16.913 1.00 0.00 C ATOM 115 O GLU A 458 18.776 -4.247 -16.060 1.00 0.00 O ATOM 116 CB GLU A 458 21.641 -2.685 -16.238 1.00 0.00 C ATOM 117 CG GLU A 458 22.492 -1.553 -15.640 1.00 0.00 C ATOM 118 CD GLU A 458 23.870 -2.060 -15.179 1.00 0.00 C ATOM 119 OE1 GLU A 458 23.950 -2.748 -14.144 1.00 0.00 O ATOM 120 OE2 GLU A 458 24.884 -1.787 -15.847 1.00 0.00 O ATOM 0 H GLU A 458 19.454 -2.325 -14.534 1.00 0.00 H new ATOM 0 HA GLU A 458 20.129 -1.605 -17.346 1.00 0.00 H new ATOM 0 HB2 GLU A 458 21.665 -3.533 -15.554 1.00 0.00 H new ATOM 0 HB3 GLU A 458 22.106 -3.012 -17.168 1.00 0.00 H new ATOM 0 HG2 GLU A 458 22.623 -0.766 -16.382 1.00 0.00 H new ATOM 0 HG3 GLU A 458 21.966 -1.110 -14.795 1.00 0.00 H new ATOM 127 N ILE A 459 19.444 -3.952 -18.204 1.00 0.00 N ATOM 128 CA ILE A 459 18.955 -5.239 -18.715 1.00 0.00 C ATOM 129 C ILE A 459 20.016 -5.814 -19.656 1.00 0.00 C ATOM 130 O ILE A 459 20.517 -5.108 -20.534 1.00 0.00 O ATOM 131 CB ILE A 459 17.576 -5.131 -19.476 1.00 0.00 C ATOM 132 CG1 ILE A 459 16.480 -4.487 -18.574 1.00 0.00 C ATOM 133 CG2 ILE A 459 17.119 -6.529 -19.971 1.00 0.00 C ATOM 134 CD1 ILE A 459 15.121 -4.309 -19.228 1.00 0.00 C ATOM 0 H ILE A 459 19.826 -3.345 -18.929 1.00 0.00 H new ATOM 0 HA ILE A 459 18.780 -5.890 -17.858 1.00 0.00 H new ATOM 0 HB ILE A 459 17.721 -4.483 -20.340 1.00 0.00 H new ATOM 0 HG12 ILE A 459 16.358 -5.103 -17.683 1.00 0.00 H new ATOM 0 HG13 ILE A 459 16.835 -3.512 -18.241 1.00 0.00 H new ATOM 0 HG21 ILE A 459 16.167 -6.437 -20.493 1.00 0.00 H new ATOM 0 HG22 ILE A 459 17.867 -6.937 -20.650 1.00 0.00 H new ATOM 0 HG23 ILE A 459 17.001 -7.197 -19.117 1.00 0.00 H new ATOM 0 HD11 ILE A 459 14.432 -3.854 -18.517 1.00 0.00 H new ATOM 0 HD12 ILE A 459 15.219 -3.665 -20.102 1.00 0.00 H new ATOM 0 HD13 ILE A 459 14.735 -5.281 -19.536 1.00 0.00 H new ATOM 146 N ASP A 460 20.361 -7.085 -19.438 1.00 0.00 N ATOM 147 CA ASP A 460 21.313 -7.816 -20.279 1.00 0.00 C ATOM 148 C ASP A 460 20.618 -8.279 -21.579 1.00 0.00 C ATOM 149 O ASP A 460 19.542 -8.879 -21.510 1.00 0.00 O ATOM 150 CB ASP A 460 21.866 -9.025 -19.477 1.00 0.00 C ATOM 151 CG ASP A 460 22.981 -9.824 -20.181 1.00 0.00 C ATOM 152 OD1 ASP A 460 23.678 -9.278 -21.058 1.00 0.00 O ATOM 153 OD2 ASP A 460 23.171 -11.004 -19.840 1.00 0.00 O ATOM 0 H ASP A 460 19.986 -7.640 -18.669 1.00 0.00 H new ATOM 0 HA ASP A 460 22.144 -7.168 -20.557 1.00 0.00 H new ATOM 0 HB2 ASP A 460 22.247 -8.663 -18.522 1.00 0.00 H new ATOM 0 HB3 ASP A 460 21.041 -9.702 -19.255 1.00 0.00 H new ATOM 158 N LEU A 461 21.231 -7.989 -22.748 1.00 0.00 N ATOM 159 CA LEU A 461 20.686 -8.418 -24.059 1.00 0.00 C ATOM 160 C LEU A 461 20.944 -9.914 -24.309 1.00 0.00 C ATOM 161 O LEU A 461 20.224 -10.552 -25.087 1.00 0.00 O ATOM 162 CB LEU A 461 21.195 -7.502 -25.227 1.00 0.00 C ATOM 163 CG LEU A 461 22.732 -7.184 -25.330 1.00 0.00 C ATOM 164 CD1 LEU A 461 23.597 -8.400 -25.733 1.00 0.00 C ATOM 165 CD2 LEU A 461 22.986 -6.000 -26.290 1.00 0.00 C ATOM 0 H LEU A 461 22.101 -7.461 -22.812 1.00 0.00 H new ATOM 0 HA LEU A 461 19.604 -8.293 -24.030 1.00 0.00 H new ATOM 0 HB2 LEU A 461 20.891 -7.965 -26.166 1.00 0.00 H new ATOM 0 HB3 LEU A 461 20.666 -6.552 -25.155 1.00 0.00 H new ATOM 0 HG LEU A 461 23.044 -6.909 -24.323 1.00 0.00 H new ATOM 0 HD11 LEU A 461 24.644 -8.101 -25.783 1.00 0.00 H new ATOM 0 HD12 LEU A 461 23.480 -9.191 -24.992 1.00 0.00 H new ATOM 0 HD13 LEU A 461 23.277 -8.766 -26.709 1.00 0.00 H new ATOM 0 HD21 LEU A 461 24.056 -5.799 -26.345 1.00 0.00 H new ATOM 0 HD22 LEU A 461 22.613 -6.250 -27.283 1.00 0.00 H new ATOM 0 HD23 LEU A 461 22.469 -5.114 -25.920 1.00 0.00 H new ATOM 177 N GLU A 462 21.977 -10.465 -23.639 1.00 0.00 N ATOM 178 CA GLU A 462 22.194 -11.924 -23.565 1.00 0.00 C ATOM 179 C GLU A 462 21.085 -12.561 -22.711 1.00 0.00 C ATOM 180 O GLU A 462 20.724 -13.717 -22.917 1.00 0.00 O ATOM 181 CB GLU A 462 23.584 -12.254 -22.970 1.00 0.00 C ATOM 182 CG GLU A 462 24.784 -11.776 -23.810 1.00 0.00 C ATOM 183 CD GLU A 462 24.869 -12.472 -25.181 1.00 0.00 C ATOM 184 OE1 GLU A 462 25.350 -13.624 -25.244 1.00 0.00 O ATOM 185 OE2 GLU A 462 24.431 -11.892 -26.192 1.00 0.00 O ATOM 0 H GLU A 462 22.677 -9.917 -23.139 1.00 0.00 H new ATOM 0 HA GLU A 462 22.160 -12.333 -24.575 1.00 0.00 H new ATOM 0 HB2 GLU A 462 23.653 -11.807 -21.978 1.00 0.00 H new ATOM 0 HB3 GLU A 462 23.659 -13.333 -22.839 1.00 0.00 H new ATOM 0 HG2 GLU A 462 24.711 -10.699 -23.959 1.00 0.00 H new ATOM 0 HG3 GLU A 462 25.705 -11.960 -23.257 1.00 0.00 H new ATOM 192 N GLY A 463 20.568 -11.772 -21.750 1.00 0.00 N ATOM 193 CA GLY A 463 19.403 -12.141 -20.958 1.00 0.00 C ATOM 194 C GLY A 463 19.721 -13.023 -19.765 1.00 0.00 C ATOM 195 O GLY A 463 18.852 -13.739 -19.290 1.00 0.00 O ATOM 0 H GLY A 463 20.956 -10.860 -21.508 1.00 0.00 H new ATOM 0 HA2 GLY A 463 18.914 -11.233 -20.605 1.00 0.00 H new ATOM 0 HA3 GLY A 463 18.690 -12.659 -21.599 1.00 0.00 H new ATOM 199 N LYS A 464 20.957 -12.948 -19.256 1.00 0.00 N ATOM 200 CA LYS A 464 21.389 -13.741 -18.089 1.00 0.00 C ATOM 201 C LYS A 464 20.957 -13.074 -16.777 1.00 0.00 C ATOM 202 O LYS A 464 20.781 -13.759 -15.762 1.00 0.00 O ATOM 203 CB LYS A 464 22.919 -13.934 -18.088 1.00 0.00 C ATOM 204 CG LYS A 464 23.466 -14.656 -19.335 1.00 0.00 C ATOM 205 CD LYS A 464 24.993 -14.872 -19.263 1.00 0.00 C ATOM 206 CE LYS A 464 25.785 -13.559 -19.139 1.00 0.00 C ATOM 207 NZ LYS A 464 25.542 -12.646 -20.286 1.00 0.00 N ATOM 0 H LYS A 464 21.684 -12.342 -19.635 1.00 0.00 H new ATOM 0 HA LYS A 464 20.908 -14.716 -18.164 1.00 0.00 H new ATOM 0 HB2 LYS A 464 23.397 -12.958 -18.009 1.00 0.00 H new ATOM 0 HB3 LYS A 464 23.202 -14.501 -17.201 1.00 0.00 H new ATOM 0 HG2 LYS A 464 22.969 -15.620 -19.441 1.00 0.00 H new ATOM 0 HG3 LYS A 464 23.225 -14.074 -20.224 1.00 0.00 H new ATOM 0 HD2 LYS A 464 25.223 -15.510 -18.410 1.00 0.00 H new ATOM 0 HD3 LYS A 464 25.321 -15.404 -20.156 1.00 0.00 H new ATOM 0 HE2 LYS A 464 25.509 -13.056 -18.212 1.00 0.00 H new ATOM 0 HE3 LYS A 464 26.850 -13.784 -19.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 26.363 -12.020 -20.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 25.398 -13.206 -21.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 24.695 -12.073 -20.100 1.00 0.00 H new ATOM 221 N PHE A 465 20.812 -11.729 -16.800 1.00 0.00 N ATOM 222 CA PHE A 465 20.469 -10.960 -15.594 1.00 0.00 C ATOM 223 C PHE A 465 19.594 -9.737 -15.908 1.00 0.00 C ATOM 224 O PHE A 465 19.531 -9.263 -17.052 1.00 0.00 O ATOM 225 CB PHE A 465 21.759 -10.541 -14.824 1.00 0.00 C ATOM 226 CG PHE A 465 22.616 -9.436 -15.454 1.00 0.00 C ATOM 227 CD1 PHE A 465 23.629 -9.731 -16.367 1.00 0.00 C ATOM 228 CD2 PHE A 465 22.418 -8.094 -15.112 1.00 0.00 C ATOM 229 CE1 PHE A 465 24.402 -8.722 -16.922 1.00 0.00 C ATOM 230 CE2 PHE A 465 23.189 -7.089 -15.667 1.00 0.00 C ATOM 231 CZ PHE A 465 24.183 -7.404 -16.569 1.00 0.00 C ATOM 0 H PHE A 465 20.928 -11.161 -17.639 1.00 0.00 H new ATOM 0 HA PHE A 465 19.877 -11.614 -14.954 1.00 0.00 H new ATOM 0 HB2 PHE A 465 21.467 -10.216 -13.825 1.00 0.00 H new ATOM 0 HB3 PHE A 465 22.383 -11.426 -14.702 1.00 0.00 H new ATOM 0 HD1 PHE A 465 23.814 -10.758 -16.645 1.00 0.00 H new ATOM 0 HD2 PHE A 465 21.647 -7.838 -14.400 1.00 0.00 H new ATOM 0 HE1 PHE A 465 25.178 -8.967 -17.632 1.00 0.00 H new ATOM 0 HE2 PHE A 465 23.013 -6.059 -15.394 1.00 0.00 H new ATOM 0 HZ PHE A 465 24.790 -6.621 -16.999 1.00 0.00 H new ATOM 241 N VAL A 466 18.914 -9.254 -14.855 1.00 0.00 N ATOM 242 CA VAL A 466 18.180 -7.982 -14.833 1.00 0.00 C ATOM 243 C VAL A 466 18.615 -7.219 -13.562 1.00 0.00 C ATOM 244 O VAL A 466 18.465 -7.728 -12.441 1.00 0.00 O ATOM 245 CB VAL A 466 16.608 -8.177 -14.839 1.00 0.00 C ATOM 246 CG1 VAL A 466 15.868 -6.810 -14.770 1.00 0.00 C ATOM 247 CG2 VAL A 466 16.149 -9.001 -16.076 1.00 0.00 C ATOM 0 H VAL A 466 18.860 -9.756 -13.968 1.00 0.00 H new ATOM 0 HA VAL A 466 18.418 -7.424 -15.739 1.00 0.00 H new ATOM 0 HB VAL A 466 16.343 -8.742 -13.945 1.00 0.00 H new ATOM 0 HG11 VAL A 466 14.791 -6.979 -14.776 1.00 0.00 H new ATOM 0 HG12 VAL A 466 16.149 -6.290 -13.854 1.00 0.00 H new ATOM 0 HG13 VAL A 466 16.145 -6.203 -15.632 1.00 0.00 H new ATOM 0 HG21 VAL A 466 15.066 -9.119 -16.053 1.00 0.00 H new ATOM 0 HG22 VAL A 466 16.438 -8.479 -16.988 1.00 0.00 H new ATOM 0 HG23 VAL A 466 16.621 -9.983 -16.054 1.00 0.00 H new ATOM 257 N GLN A 467 19.187 -6.026 -13.760 1.00 0.00 N ATOM 258 CA GLN A 467 19.637 -5.143 -12.673 1.00 0.00 C ATOM 259 C GLN A 467 18.488 -4.216 -12.247 1.00 0.00 C ATOM 260 O GLN A 467 17.947 -3.475 -13.081 1.00 0.00 O ATOM 261 CB GLN A 467 20.835 -4.292 -13.166 1.00 0.00 C ATOM 262 CG GLN A 467 21.346 -3.214 -12.183 1.00 0.00 C ATOM 263 CD GLN A 467 22.159 -3.789 -11.034 1.00 0.00 C ATOM 264 OE1 GLN A 467 21.629 -4.143 -9.987 1.00 0.00 O ATOM 265 NE2 GLN A 467 23.461 -3.900 -11.235 1.00 0.00 N ATOM 0 H GLN A 467 19.353 -5.640 -14.689 1.00 0.00 H new ATOM 0 HA GLN A 467 19.944 -5.747 -11.819 1.00 0.00 H new ATOM 0 HB2 GLN A 467 21.661 -4.964 -13.400 1.00 0.00 H new ATOM 0 HB3 GLN A 467 20.549 -3.802 -14.097 1.00 0.00 H new ATOM 0 HG2 GLN A 467 21.957 -2.495 -12.728 1.00 0.00 H new ATOM 0 HG3 GLN A 467 20.494 -2.667 -11.779 1.00 0.00 H new ATOM 0 HE21 GLN A 467 23.868 -3.595 -12.119 1.00 0.00 H new ATOM 0 HE22 GLN A 467 24.058 -4.291 -10.506 1.00 0.00 H new ATOM 274 N LEU A 468 18.122 -4.274 -10.957 1.00 0.00 N ATOM 275 CA LEU A 468 17.179 -3.335 -10.332 1.00 0.00 C ATOM 276 C LEU A 468 17.955 -2.299 -9.503 1.00 0.00 C ATOM 277 O LEU A 468 19.120 -2.519 -9.151 1.00 0.00 O ATOM 278 CB LEU A 468 16.170 -4.085 -9.428 1.00 0.00 C ATOM 279 CG LEU A 468 15.287 -5.174 -10.107 1.00 0.00 C ATOM 280 CD1 LEU A 468 14.294 -5.768 -9.089 1.00 0.00 C ATOM 281 CD2 LEU A 468 14.560 -4.623 -11.358 1.00 0.00 C ATOM 0 H LEU A 468 18.476 -4.981 -10.313 1.00 0.00 H new ATOM 0 HA LEU A 468 16.621 -2.828 -11.119 1.00 0.00 H new ATOM 0 HB2 LEU A 468 16.726 -4.556 -8.618 1.00 0.00 H new ATOM 0 HB3 LEU A 468 15.509 -3.347 -8.974 1.00 0.00 H new ATOM 0 HG LEU A 468 15.941 -5.975 -10.452 1.00 0.00 H new ATOM 0 HD11 LEU A 468 13.683 -6.528 -9.577 1.00 0.00 H new ATOM 0 HD12 LEU A 468 14.845 -6.220 -8.264 1.00 0.00 H new ATOM 0 HD13 LEU A 468 13.650 -4.977 -8.705 1.00 0.00 H new ATOM 0 HD21 LEU A 468 13.954 -5.412 -11.804 1.00 0.00 H new ATOM 0 HD22 LEU A 468 13.917 -3.792 -11.069 1.00 0.00 H new ATOM 0 HD23 LEU A 468 15.296 -4.277 -12.084 1.00 0.00 H new ATOM 293 N LYS A 469 17.288 -1.186 -9.185 1.00 0.00 N ATOM 294 CA LYS A 469 17.876 -0.072 -8.430 1.00 0.00 C ATOM 295 C LYS A 469 16.786 0.564 -7.567 1.00 0.00 C ATOM 296 O LYS A 469 15.704 0.871 -8.066 1.00 0.00 O ATOM 297 CB LYS A 469 18.485 0.939 -9.443 1.00 0.00 C ATOM 298 CG LYS A 469 19.244 2.168 -8.874 1.00 0.00 C ATOM 299 CD LYS A 469 18.338 3.385 -8.545 1.00 0.00 C ATOM 300 CE LYS A 469 19.143 4.679 -8.381 1.00 0.00 C ATOM 301 NZ LYS A 469 19.844 5.036 -9.645 1.00 0.00 N ATOM 0 H LYS A 469 16.315 -1.030 -9.446 1.00 0.00 H new ATOM 0 HA LYS A 469 18.672 -0.411 -7.767 1.00 0.00 H new ATOM 0 HB2 LYS A 469 19.171 0.392 -10.090 1.00 0.00 H new ATOM 0 HB3 LYS A 469 17.677 1.308 -10.075 1.00 0.00 H new ATOM 0 HG2 LYS A 469 19.771 1.867 -7.968 1.00 0.00 H new ATOM 0 HG3 LYS A 469 20.001 2.478 -9.595 1.00 0.00 H new ATOM 0 HD2 LYS A 469 17.604 3.514 -9.340 1.00 0.00 H new ATOM 0 HD3 LYS A 469 17.783 3.186 -7.628 1.00 0.00 H new ATOM 0 HE2 LYS A 469 18.477 5.491 -8.089 1.00 0.00 H new ATOM 0 HE3 LYS A 469 19.871 4.559 -7.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 20.871 4.934 -9.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 19.528 4.403 -10.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 19.623 6.020 -9.898 1.00 0.00 H new ATOM 315 N ASN A 470 17.083 0.768 -6.279 1.00 0.00 N ATOM 316 CA ASN A 470 16.128 1.360 -5.324 1.00 0.00 C ATOM 317 C ASN A 470 16.234 2.898 -5.372 1.00 0.00 C ATOM 318 O ASN A 470 17.254 3.468 -4.985 1.00 0.00 O ATOM 319 CB ASN A 470 16.380 0.832 -3.887 1.00 0.00 C ATOM 320 CG ASN A 470 15.274 1.206 -2.896 1.00 0.00 C ATOM 321 OD1 ASN A 470 14.098 1.275 -3.255 1.00 0.00 O ATOM 322 ND2 ASN A 470 15.635 1.471 -1.654 1.00 0.00 N ATOM 0 H ASN A 470 17.985 0.531 -5.867 1.00 0.00 H new ATOM 0 HA ASN A 470 15.118 1.066 -5.609 1.00 0.00 H new ATOM 0 HB2 ASN A 470 16.476 -0.253 -3.919 1.00 0.00 H new ATOM 0 HB3 ASN A 470 17.330 1.226 -3.525 1.00 0.00 H new ATOM 0 HD21 ASN A 470 14.933 1.741 -0.965 1.00 0.00 H new ATOM 0 HD22 ASN A 470 16.616 1.406 -1.383 1.00 0.00 H new ATOM 329 N ASN A 471 15.181 3.549 -5.887 1.00 0.00 N ATOM 330 CA ASN A 471 15.119 5.020 -6.061 1.00 0.00 C ATOM 331 C ASN A 471 14.728 5.749 -4.755 1.00 0.00 C ATOM 332 O ASN A 471 14.933 6.968 -4.641 1.00 0.00 O ATOM 333 CB ASN A 471 14.103 5.386 -7.184 1.00 0.00 C ATOM 334 CG ASN A 471 14.447 4.821 -8.573 1.00 0.00 C ATOM 335 OD1 ASN A 471 14.994 3.725 -8.703 1.00 0.00 O ATOM 336 ND2 ASN A 471 14.119 5.566 -9.623 1.00 0.00 N ATOM 0 H ASN A 471 14.336 3.070 -6.200 1.00 0.00 H new ATOM 0 HA ASN A 471 16.119 5.351 -6.341 1.00 0.00 H new ATOM 0 HB2 ASN A 471 13.116 5.024 -6.894 1.00 0.00 H new ATOM 0 HB3 ASN A 471 14.036 6.472 -7.255 1.00 0.00 H new ATOM 0 HD21 ASN A 471 14.319 5.234 -10.566 1.00 0.00 H new ATOM 0 HD22 ASN A 471 13.667 6.470 -9.486 1.00 0.00 H new ATOM 343 N SER A 472 14.155 5.008 -3.779 1.00 0.00 N ATOM 344 CA SER A 472 13.667 5.597 -2.512 1.00 0.00 C ATOM 345 C SER A 472 14.834 6.066 -1.614 1.00 0.00 C ATOM 346 O SER A 472 15.971 5.596 -1.747 1.00 0.00 O ATOM 347 CB SER A 472 12.744 4.595 -1.765 1.00 0.00 C ATOM 348 OG SER A 472 13.410 3.392 -1.434 1.00 0.00 O ATOM 0 H SER A 472 14.019 3.999 -3.846 1.00 0.00 H new ATOM 0 HA SER A 472 13.080 6.482 -2.758 1.00 0.00 H new ATOM 0 HB2 SER A 472 12.368 5.061 -0.854 1.00 0.00 H new ATOM 0 HB3 SER A 472 11.879 4.369 -2.388 1.00 0.00 H new ATOM 0 HG SER A 472 13.392 2.786 -2.204 1.00 0.00 H new ATOM 354 N ASP A 473 14.519 7.000 -0.690 1.00 0.00 N ATOM 355 CA ASP A 473 15.510 7.658 0.206 1.00 0.00 C ATOM 356 C ASP A 473 15.894 6.772 1.403 1.00 0.00 C ATOM 357 O ASP A 473 16.716 7.166 2.238 1.00 0.00 O ATOM 358 CB ASP A 473 14.937 9.008 0.725 1.00 0.00 C ATOM 359 CG ASP A 473 14.547 9.975 -0.394 1.00 0.00 C ATOM 360 OD1 ASP A 473 13.454 9.804 -0.976 1.00 0.00 O ATOM 361 OD2 ASP A 473 15.315 10.909 -0.694 1.00 0.00 O ATOM 0 H ASP A 473 13.564 7.325 -0.540 1.00 0.00 H new ATOM 0 HA ASP A 473 16.412 7.831 -0.381 1.00 0.00 H new ATOM 0 HB2 ASP A 473 14.062 8.809 1.344 1.00 0.00 H new ATOM 0 HB3 ASP A 473 15.678 9.486 1.366 1.00 0.00 H new ATOM 366 N LYS A 474 15.317 5.573 1.463 1.00 0.00 N ATOM 367 CA LYS A 474 15.477 4.646 2.586 1.00 0.00 C ATOM 368 C LYS A 474 15.456 3.207 2.061 1.00 0.00 C ATOM 369 O LYS A 474 15.253 2.977 0.859 1.00 0.00 O ATOM 370 CB LYS A 474 14.366 4.862 3.664 1.00 0.00 C ATOM 371 CG LYS A 474 12.922 4.456 3.258 1.00 0.00 C ATOM 372 CD LYS A 474 12.348 5.272 2.072 1.00 0.00 C ATOM 373 CE LYS A 474 10.886 4.934 1.767 1.00 0.00 C ATOM 374 NZ LYS A 474 9.992 5.306 2.893 1.00 0.00 N ATOM 0 H LYS A 474 14.716 5.211 0.723 1.00 0.00 H new ATOM 0 HA LYS A 474 16.435 4.839 3.068 1.00 0.00 H new ATOM 0 HB2 LYS A 474 14.641 4.299 4.556 1.00 0.00 H new ATOM 0 HB3 LYS A 474 14.359 5.916 3.942 1.00 0.00 H new ATOM 0 HG2 LYS A 474 12.913 3.398 2.996 1.00 0.00 H new ATOM 0 HG3 LYS A 474 12.266 4.576 4.120 1.00 0.00 H new ATOM 0 HD2 LYS A 474 12.430 6.336 2.296 1.00 0.00 H new ATOM 0 HD3 LYS A 474 12.952 5.086 1.184 1.00 0.00 H new ATOM 0 HE2 LYS A 474 10.572 5.458 0.864 1.00 0.00 H new ATOM 0 HE3 LYS A 474 10.793 3.867 1.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 9.001 5.255 2.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 10.140 4.649 3.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 10.208 6.275 3.202 1.00 0.00 H new ATOM 388 N ASP A 475 15.682 2.252 2.959 1.00 0.00 N ATOM 389 CA ASP A 475 15.600 0.824 2.644 1.00 0.00 C ATOM 390 C ASP A 475 14.117 0.420 2.445 1.00 0.00 C ATOM 391 O ASP A 475 13.263 0.732 3.285 1.00 0.00 O ATOM 392 CB ASP A 475 16.300 -0.005 3.764 1.00 0.00 C ATOM 393 CG ASP A 475 15.621 0.091 5.145 1.00 0.00 C ATOM 394 OD1 ASP A 475 15.829 1.106 5.848 1.00 0.00 O ATOM 395 OD2 ASP A 475 14.879 -0.839 5.533 1.00 0.00 O ATOM 0 H ASP A 475 15.928 2.445 3.930 1.00 0.00 H new ATOM 0 HA ASP A 475 16.124 0.612 1.712 1.00 0.00 H new ATOM 0 HB2 ASP A 475 16.331 -1.051 3.460 1.00 0.00 H new ATOM 0 HB3 ASP A 475 17.333 0.331 3.856 1.00 0.00 H new ATOM 400 N GLN A 476 13.813 -0.196 1.292 1.00 0.00 N ATOM 401 CA GLN A 476 12.461 -0.656 0.931 1.00 0.00 C ATOM 402 C GLN A 476 12.324 -2.171 1.174 1.00 0.00 C ATOM 403 O GLN A 476 13.183 -2.951 0.748 1.00 0.00 O ATOM 404 CB GLN A 476 12.167 -0.312 -0.561 1.00 0.00 C ATOM 405 CG GLN A 476 10.807 -0.823 -1.096 1.00 0.00 C ATOM 406 CD GLN A 476 9.590 -0.291 -0.326 1.00 0.00 C ATOM 407 OE1 GLN A 476 9.590 0.849 0.156 1.00 0.00 O ATOM 408 NE2 GLN A 476 8.584 -1.136 -0.134 1.00 0.00 N ATOM 0 H GLN A 476 14.509 -0.392 0.573 1.00 0.00 H new ATOM 0 HA GLN A 476 11.733 -0.144 1.561 1.00 0.00 H new ATOM 0 HB2 GLN A 476 12.204 0.771 -0.682 1.00 0.00 H new ATOM 0 HB3 GLN A 476 12.963 -0.730 -1.178 1.00 0.00 H new ATOM 0 HG2 GLN A 476 10.712 -0.540 -2.144 1.00 0.00 H new ATOM 0 HG3 GLN A 476 10.800 -1.912 -1.058 1.00 0.00 H new ATOM 0 HE21 GLN A 476 8.616 -2.069 -0.546 1.00 0.00 H new ATOM 0 HE22 GLN A 476 7.779 -0.852 0.425 1.00 0.00 H new ATOM 417 N SER A 477 11.233 -2.571 1.853 1.00 0.00 N ATOM 418 CA SER A 477 10.888 -3.980 2.065 1.00 0.00 C ATOM 419 C SER A 477 10.524 -4.635 0.717 1.00 0.00 C ATOM 420 O SER A 477 9.647 -4.149 -0.015 1.00 0.00 O ATOM 421 CB SER A 477 9.730 -4.102 3.084 1.00 0.00 C ATOM 422 OG SER A 477 8.632 -3.274 2.728 1.00 0.00 O ATOM 0 H SER A 477 10.567 -1.920 2.269 1.00 0.00 H new ATOM 0 HA SER A 477 11.749 -4.506 2.479 1.00 0.00 H new ATOM 0 HB2 SER A 477 9.401 -5.140 3.140 1.00 0.00 H new ATOM 0 HB3 SER A 477 10.087 -3.827 4.076 1.00 0.00 H new ATOM 0 HG SER A 477 8.597 -3.178 1.753 1.00 0.00 H new ATOM 428 N LEU A 478 11.232 -5.718 0.395 1.00 0.00 N ATOM 429 CA LEU A 478 11.105 -6.428 -0.888 1.00 0.00 C ATOM 430 C LEU A 478 10.654 -7.874 -0.582 1.00 0.00 C ATOM 431 O LEU A 478 10.911 -8.384 0.509 1.00 0.00 O ATOM 432 CB LEU A 478 12.482 -6.379 -1.637 1.00 0.00 C ATOM 433 CG LEU A 478 12.430 -6.370 -3.199 1.00 0.00 C ATOM 434 CD1 LEU A 478 11.703 -5.113 -3.723 1.00 0.00 C ATOM 435 CD2 LEU A 478 13.846 -6.474 -3.812 1.00 0.00 C ATOM 0 H LEU A 478 11.919 -6.136 1.022 1.00 0.00 H new ATOM 0 HA LEU A 478 10.365 -5.963 -1.540 1.00 0.00 H new ATOM 0 HB2 LEU A 478 13.017 -5.487 -1.309 1.00 0.00 H new ATOM 0 HB3 LEU A 478 13.072 -7.239 -1.321 1.00 0.00 H new ATOM 0 HG LEU A 478 11.864 -7.248 -3.511 1.00 0.00 H new ATOM 0 HD11 LEU A 478 11.682 -5.133 -4.813 1.00 0.00 H new ATOM 0 HD12 LEU A 478 10.683 -5.097 -3.340 1.00 0.00 H new ATOM 0 HD13 LEU A 478 12.231 -4.221 -3.387 1.00 0.00 H new ATOM 0 HD21 LEU A 478 13.773 -6.465 -4.900 1.00 0.00 H new ATOM 0 HD22 LEU A 478 14.449 -5.628 -3.482 1.00 0.00 H new ATOM 0 HD23 LEU A 478 14.316 -7.403 -3.487 1.00 0.00 H new ATOM 447 N GLY A 479 9.957 -8.519 -1.524 1.00 0.00 N ATOM 448 CA GLY A 479 9.441 -9.882 -1.300 1.00 0.00 C ATOM 449 C GLY A 479 8.117 -10.122 -1.970 1.00 0.00 C ATOM 450 O GLY A 479 7.944 -11.082 -2.721 1.00 0.00 O ATOM 0 H GLY A 479 9.737 -8.128 -2.440 1.00 0.00 H new ATOM 0 HA2 GLY A 479 10.167 -10.606 -1.671 1.00 0.00 H new ATOM 0 HA3 GLY A 479 9.337 -10.055 -0.229 1.00 0.00 H new ATOM 454 N ASN A 480 7.174 -9.220 -1.689 1.00 0.00 N ATOM 455 CA ASN A 480 5.856 -9.184 -2.348 1.00 0.00 C ATOM 456 C ASN A 480 5.997 -8.746 -3.828 1.00 0.00 C ATOM 457 O ASN A 480 5.069 -8.891 -4.638 1.00 0.00 O ATOM 458 CB ASN A 480 4.923 -8.213 -1.582 1.00 0.00 C ATOM 459 CG ASN A 480 4.771 -8.499 -0.077 1.00 0.00 C ATOM 460 OD1 ASN A 480 4.605 -7.575 0.720 1.00 0.00 O ATOM 461 ND2 ASN A 480 4.798 -9.769 0.330 1.00 0.00 N ATOM 0 H ASN A 480 7.300 -8.486 -0.992 1.00 0.00 H new ATOM 0 HA ASN A 480 5.423 -10.184 -2.333 1.00 0.00 H new ATOM 0 HB2 ASN A 480 5.301 -7.198 -1.706 1.00 0.00 H new ATOM 0 HB3 ASN A 480 3.936 -8.244 -2.043 1.00 0.00 H new ATOM 0 HD21 ASN A 480 4.680 -9.990 1.319 1.00 0.00 H new ATOM 0 HD22 ASN A 480 4.937 -10.519 -0.347 1.00 0.00 H new ATOM 468 N TRP A 481 7.184 -8.202 -4.145 1.00 0.00 N ATOM 469 CA TRP A 481 7.566 -7.735 -5.475 1.00 0.00 C ATOM 470 C TRP A 481 8.057 -8.920 -6.327 1.00 0.00 C ATOM 471 O TRP A 481 8.474 -9.964 -5.784 1.00 0.00 O ATOM 472 CB TRP A 481 8.674 -6.655 -5.337 1.00 0.00 C ATOM 473 CG TRP A 481 8.252 -5.381 -4.608 1.00 0.00 C ATOM 474 CD1 TRP A 481 7.628 -5.264 -3.384 1.00 0.00 C ATOM 475 CD2 TRP A 481 8.459 -4.041 -5.069 1.00 0.00 C ATOM 476 NE1 TRP A 481 7.451 -3.938 -3.074 1.00 0.00 N ATOM 477 CE2 TRP A 481 7.952 -3.170 -4.088 1.00 0.00 C ATOM 478 CE3 TRP A 481 9.027 -3.499 -6.223 1.00 0.00 C ATOM 479 CZ2 TRP A 481 7.990 -1.784 -4.230 1.00 0.00 C ATOM 480 CZ3 TRP A 481 9.067 -2.127 -6.362 1.00 0.00 C ATOM 481 CH2 TRP A 481 8.553 -1.284 -5.373 1.00 0.00 C ATOM 0 H TRP A 481 7.924 -8.074 -3.455 1.00 0.00 H new ATOM 0 HA TRP A 481 6.703 -7.294 -5.975 1.00 0.00 H new ATOM 0 HB2 TRP A 481 9.522 -7.092 -4.810 1.00 0.00 H new ATOM 0 HB3 TRP A 481 9.023 -6.386 -6.334 1.00 0.00 H new ATOM 0 HD1 TRP A 481 7.324 -6.092 -2.761 1.00 0.00 H new ATOM 0 HE1 TRP A 481 7.015 -3.583 -2.223 1.00 0.00 H new ATOM 0 HE3 TRP A 481 9.428 -4.142 -6.993 1.00 0.00 H new ATOM 0 HZ2 TRP A 481 7.591 -1.130 -3.468 1.00 0.00 H new ATOM 0 HZ3 TRP A 481 9.503 -1.697 -7.251 1.00 0.00 H new ATOM 0 HH2 TRP A 481 8.601 -0.214 -5.514 1.00 0.00 H new ATOM 492 N ARG A 482 8.016 -8.738 -7.660 1.00 0.00 N ATOM 493 CA ARG A 482 8.326 -9.800 -8.632 1.00 0.00 C ATOM 494 C ARG A 482 8.649 -9.198 -10.021 1.00 0.00 C ATOM 495 O ARG A 482 7.923 -8.325 -10.514 1.00 0.00 O ATOM 496 CB ARG A 482 7.137 -10.807 -8.704 1.00 0.00 C ATOM 497 CG ARG A 482 5.753 -10.159 -8.981 1.00 0.00 C ATOM 498 CD ARG A 482 4.571 -11.116 -8.717 1.00 0.00 C ATOM 499 NE ARG A 482 3.262 -10.486 -8.977 1.00 0.00 N ATOM 500 CZ ARG A 482 2.574 -9.710 -8.115 1.00 0.00 C ATOM 501 NH1 ARG A 482 3.083 -9.365 -6.933 1.00 0.00 N ATOM 502 NH2 ARG A 482 1.378 -9.273 -8.455 1.00 0.00 N ATOM 0 H ARG A 482 7.766 -7.849 -8.093 1.00 0.00 H new ATOM 0 HA ARG A 482 9.214 -10.340 -8.303 1.00 0.00 H new ATOM 0 HB2 ARG A 482 7.344 -11.537 -9.486 1.00 0.00 H new ATOM 0 HB3 ARG A 482 7.085 -11.354 -7.763 1.00 0.00 H new ATOM 0 HG2 ARG A 482 5.642 -9.273 -8.356 1.00 0.00 H new ATOM 0 HG3 ARG A 482 5.717 -9.824 -10.018 1.00 0.00 H new ATOM 0 HD2 ARG A 482 4.676 -12.000 -9.346 1.00 0.00 H new ATOM 0 HD3 ARG A 482 4.607 -11.456 -7.682 1.00 0.00 H new ATOM 0 HE ARG A 482 2.840 -10.652 -9.891 1.00 0.00 H new ATOM 0 HH11 ARG A 482 4.012 -9.689 -6.664 1.00 0.00 H new ATOM 0 HH12 ARG A 482 2.544 -8.777 -6.298 1.00 0.00 H new ATOM 0 HH21 ARG A 482 0.983 -9.522 -9.362 1.00 0.00 H new ATOM 0 HH22 ARG A 482 0.848 -8.685 -7.812 1.00 0.00 H new ATOM 516 N ILE A 483 9.762 -9.656 -10.626 1.00 0.00 N ATOM 517 CA ILE A 483 10.190 -9.245 -11.970 1.00 0.00 C ATOM 518 C ILE A 483 9.531 -10.155 -13.028 1.00 0.00 C ATOM 519 O ILE A 483 9.755 -11.367 -13.017 1.00 0.00 O ATOM 520 CB ILE A 483 11.755 -9.354 -12.154 1.00 0.00 C ATOM 521 CG1 ILE A 483 12.531 -8.684 -10.984 1.00 0.00 C ATOM 522 CG2 ILE A 483 12.195 -8.758 -13.521 1.00 0.00 C ATOM 523 CD1 ILE A 483 14.047 -8.873 -11.052 1.00 0.00 C ATOM 0 H ILE A 483 10.393 -10.328 -10.188 1.00 0.00 H new ATOM 0 HA ILE A 483 9.888 -8.205 -12.095 1.00 0.00 H new ATOM 0 HB ILE A 483 12.006 -10.415 -12.141 1.00 0.00 H new ATOM 0 HG12 ILE A 483 12.308 -7.617 -10.978 1.00 0.00 H new ATOM 0 HG13 ILE A 483 12.167 -9.091 -10.041 1.00 0.00 H new ATOM 0 HG21 ILE A 483 13.277 -8.845 -13.624 1.00 0.00 H new ATOM 0 HG22 ILE A 483 11.708 -9.304 -14.329 1.00 0.00 H new ATOM 0 HG23 ILE A 483 11.909 -7.707 -13.569 1.00 0.00 H new ATOM 0 HD11 ILE A 483 14.514 -8.377 -10.201 1.00 0.00 H new ATOM 0 HD12 ILE A 483 14.283 -9.937 -11.025 1.00 0.00 H new ATOM 0 HD13 ILE A 483 14.426 -8.440 -11.978 1.00 0.00 H new ATOM 535 N LYS A 484 8.724 -9.572 -13.922 1.00 0.00 N ATOM 536 CA LYS A 484 8.269 -10.249 -15.147 1.00 0.00 C ATOM 537 C LYS A 484 9.339 -10.077 -16.242 1.00 0.00 C ATOM 538 O LYS A 484 10.062 -9.074 -16.263 1.00 0.00 O ATOM 539 CB LYS A 484 6.929 -9.651 -15.660 1.00 0.00 C ATOM 540 CG LYS A 484 5.741 -9.732 -14.682 1.00 0.00 C ATOM 541 CD LYS A 484 4.495 -8.979 -15.220 1.00 0.00 C ATOM 542 CE LYS A 484 3.253 -9.124 -14.320 1.00 0.00 C ATOM 543 NZ LYS A 484 2.719 -10.512 -14.303 1.00 0.00 N ATOM 0 H LYS A 484 8.368 -8.622 -13.820 1.00 0.00 H new ATOM 0 HA LYS A 484 8.113 -11.303 -14.917 1.00 0.00 H new ATOM 0 HB2 LYS A 484 7.094 -8.604 -15.916 1.00 0.00 H new ATOM 0 HB3 LYS A 484 6.653 -10.164 -16.581 1.00 0.00 H new ATOM 0 HG2 LYS A 484 5.486 -10.777 -14.507 1.00 0.00 H new ATOM 0 HG3 LYS A 484 6.033 -9.310 -13.720 1.00 0.00 H new ATOM 0 HD2 LYS A 484 4.737 -7.921 -15.324 1.00 0.00 H new ATOM 0 HD3 LYS A 484 4.257 -9.352 -16.216 1.00 0.00 H new ATOM 0 HE2 LYS A 484 3.508 -8.824 -13.304 1.00 0.00 H new ATOM 0 HE3 LYS A 484 2.476 -8.444 -14.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 1.711 -10.493 -14.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 2.829 -10.938 -15.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 3.243 -11.077 -13.605 1.00 0.00 H new ATOM 557 N ARG A 485 9.451 -11.065 -17.124 1.00 0.00 N ATOM 558 CA ARG A 485 10.145 -10.928 -18.408 1.00 0.00 C ATOM 559 C ARG A 485 9.238 -11.519 -19.480 1.00 0.00 C ATOM 560 O ARG A 485 9.193 -12.747 -19.655 1.00 0.00 O ATOM 561 CB ARG A 485 11.531 -11.632 -18.428 1.00 0.00 C ATOM 562 CG ARG A 485 12.226 -11.567 -19.813 1.00 0.00 C ATOM 563 CD ARG A 485 13.516 -12.395 -19.912 1.00 0.00 C ATOM 564 NE ARG A 485 14.639 -11.801 -19.168 1.00 0.00 N ATOM 565 CZ ARG A 485 15.897 -12.252 -19.221 1.00 0.00 C ATOM 566 NH1 ARG A 485 16.213 -13.298 -19.984 1.00 0.00 N ATOM 567 NH2 ARG A 485 16.840 -11.661 -18.491 1.00 0.00 N ATOM 0 H ARG A 485 9.060 -11.994 -16.970 1.00 0.00 H new ATOM 0 HA ARG A 485 10.345 -9.872 -18.588 1.00 0.00 H new ATOM 0 HB2 ARG A 485 12.177 -11.170 -17.682 1.00 0.00 H new ATOM 0 HB3 ARG A 485 11.406 -12.676 -18.139 1.00 0.00 H new ATOM 0 HG2 ARG A 485 11.527 -11.913 -20.574 1.00 0.00 H new ATOM 0 HG3 ARG A 485 12.457 -10.527 -20.042 1.00 0.00 H new ATOM 0 HD2 ARG A 485 13.327 -13.399 -19.533 1.00 0.00 H new ATOM 0 HD3 ARG A 485 13.796 -12.498 -20.960 1.00 0.00 H new ATOM 0 HE ARG A 485 14.445 -10.994 -18.574 1.00 0.00 H new ATOM 0 HH11 ARG A 485 15.492 -13.763 -20.535 1.00 0.00 H new ATOM 0 HH12 ARG A 485 17.176 -13.633 -20.017 1.00 0.00 H new ATOM 0 HH21 ARG A 485 16.602 -10.868 -17.895 1.00 0.00 H new ATOM 0 HH22 ARG A 485 17.801 -12.001 -18.528 1.00 0.00 H new ATOM 581 N GLN A 486 8.476 -10.648 -20.151 1.00 0.00 N ATOM 582 CA GLN A 486 7.567 -11.049 -21.224 1.00 0.00 C ATOM 583 C GLN A 486 8.339 -11.113 -22.539 1.00 0.00 C ATOM 584 O GLN A 486 8.629 -10.083 -23.149 1.00 0.00 O ATOM 585 CB GLN A 486 6.367 -10.067 -21.320 1.00 0.00 C ATOM 586 CG GLN A 486 5.248 -10.543 -22.263 1.00 0.00 C ATOM 587 CD GLN A 486 4.016 -9.646 -22.241 1.00 0.00 C ATOM 588 OE1 GLN A 486 3.885 -8.718 -23.036 1.00 0.00 O ATOM 589 NE2 GLN A 486 3.129 -9.888 -21.287 1.00 0.00 N ATOM 0 H GLN A 486 8.474 -9.645 -19.963 1.00 0.00 H new ATOM 0 HA GLN A 486 7.161 -12.037 -21.007 1.00 0.00 H new ATOM 0 HB2 GLN A 486 5.951 -9.918 -20.324 1.00 0.00 H new ATOM 0 HB3 GLN A 486 6.729 -9.098 -21.662 1.00 0.00 H new ATOM 0 HG2 GLN A 486 5.636 -10.590 -23.281 1.00 0.00 H new ATOM 0 HG3 GLN A 486 4.956 -11.556 -21.986 1.00 0.00 H new ATOM 0 HE21 GLN A 486 3.271 -10.668 -20.645 1.00 0.00 H new ATOM 0 HE22 GLN A 486 2.304 -9.295 -21.195 1.00 0.00 H new ATOM 598 N VAL A 487 8.671 -12.341 -22.953 1.00 0.00 N ATOM 599 CA VAL A 487 9.473 -12.617 -24.161 1.00 0.00 C ATOM 600 C VAL A 487 8.632 -12.338 -25.443 1.00 0.00 C ATOM 601 O VAL A 487 7.431 -12.102 -25.351 1.00 0.00 O ATOM 602 CB VAL A 487 10.023 -14.103 -24.103 1.00 0.00 C ATOM 603 CG1 VAL A 487 11.008 -14.434 -25.254 1.00 0.00 C ATOM 604 CG2 VAL A 487 10.684 -14.397 -22.726 1.00 0.00 C ATOM 0 H VAL A 487 8.389 -13.185 -22.455 1.00 0.00 H new ATOM 0 HA VAL A 487 10.334 -11.949 -24.199 1.00 0.00 H new ATOM 0 HB VAL A 487 9.157 -14.752 -24.232 1.00 0.00 H new ATOM 0 HG11 VAL A 487 11.348 -15.465 -25.157 1.00 0.00 H new ATOM 0 HG12 VAL A 487 10.504 -14.307 -26.212 1.00 0.00 H new ATOM 0 HG13 VAL A 487 11.866 -13.763 -25.203 1.00 0.00 H new ATOM 0 HG21 VAL A 487 11.053 -15.422 -22.711 1.00 0.00 H new ATOM 0 HG22 VAL A 487 11.515 -13.710 -22.567 1.00 0.00 H new ATOM 0 HG23 VAL A 487 9.948 -14.265 -21.933 1.00 0.00 H new ATOM 614 N LEU A 488 9.287 -12.322 -26.620 1.00 0.00 N ATOM 615 CA LEU A 488 8.642 -12.117 -27.943 1.00 0.00 C ATOM 616 C LEU A 488 7.502 -13.121 -28.239 1.00 0.00 C ATOM 617 O LEU A 488 6.592 -12.811 -29.015 1.00 0.00 O ATOM 618 CB LEU A 488 9.744 -12.149 -29.050 1.00 0.00 C ATOM 619 CG LEU A 488 10.743 -13.375 -29.024 1.00 0.00 C ATOM 620 CD1 LEU A 488 10.197 -14.619 -29.750 1.00 0.00 C ATOM 621 CD2 LEU A 488 12.134 -12.982 -29.563 1.00 0.00 C ATOM 0 H LEU A 488 10.296 -12.453 -26.685 1.00 0.00 H new ATOM 0 HA LEU A 488 8.155 -11.142 -27.931 1.00 0.00 H new ATOM 0 HB2 LEU A 488 9.250 -12.133 -30.022 1.00 0.00 H new ATOM 0 HB3 LEU A 488 10.329 -11.232 -28.974 1.00 0.00 H new ATOM 0 HG LEU A 488 10.849 -13.653 -27.975 1.00 0.00 H new ATOM 0 HD11 LEU A 488 10.931 -15.423 -29.695 1.00 0.00 H new ATOM 0 HD12 LEU A 488 9.270 -14.940 -29.275 1.00 0.00 H new ATOM 0 HD13 LEU A 488 10.003 -14.375 -30.795 1.00 0.00 H new ATOM 0 HD21 LEU A 488 12.795 -13.848 -29.531 1.00 0.00 H new ATOM 0 HD22 LEU A 488 12.041 -12.635 -30.592 1.00 0.00 H new ATOM 0 HD23 LEU A 488 12.551 -12.185 -28.948 1.00 0.00 H new ATOM 633 N GLU A 489 7.553 -14.319 -27.620 1.00 0.00 N ATOM 634 CA GLU A 489 6.474 -15.333 -27.760 1.00 0.00 C ATOM 635 C GLU A 489 5.328 -15.069 -26.733 1.00 0.00 C ATOM 636 O GLU A 489 4.352 -15.820 -26.648 1.00 0.00 O ATOM 637 CB GLU A 489 7.050 -16.780 -27.640 1.00 0.00 C ATOM 638 CG GLU A 489 6.091 -17.887 -28.148 1.00 0.00 C ATOM 639 CD GLU A 489 6.673 -19.313 -28.103 1.00 0.00 C ATOM 640 OE1 GLU A 489 7.624 -19.604 -28.855 1.00 0.00 O ATOM 641 OE2 GLU A 489 6.153 -20.166 -27.351 1.00 0.00 O ATOM 0 H GLU A 489 8.324 -14.612 -27.020 1.00 0.00 H new ATOM 0 HA GLU A 489 6.041 -15.242 -28.756 1.00 0.00 H new ATOM 0 HB2 GLU A 489 7.982 -16.836 -28.202 1.00 0.00 H new ATOM 0 HB3 GLU A 489 7.294 -16.977 -26.596 1.00 0.00 H new ATOM 0 HG2 GLU A 489 5.180 -17.862 -27.550 1.00 0.00 H new ATOM 0 HG3 GLU A 489 5.805 -17.658 -29.175 1.00 0.00 H new ATOM 648 N GLY A 490 5.453 -13.959 -25.978 1.00 0.00 N ATOM 649 CA GLY A 490 4.453 -13.530 -24.988 1.00 0.00 C ATOM 650 C GLY A 490 4.646 -14.172 -23.615 1.00 0.00 C ATOM 651 O GLY A 490 3.982 -13.782 -22.650 1.00 0.00 O ATOM 0 H GLY A 490 6.256 -13.334 -26.041 1.00 0.00 H new ATOM 0 HA2 GLY A 490 4.497 -12.446 -24.884 1.00 0.00 H new ATOM 0 HA3 GLY A 490 3.457 -13.774 -25.359 1.00 0.00 H new ATOM 655 N GLU A 491 5.583 -15.140 -23.536 1.00 0.00 N ATOM 656 CA GLU A 491 5.826 -15.943 -22.329 1.00 0.00 C ATOM 657 C GLU A 491 6.518 -15.095 -21.257 1.00 0.00 C ATOM 658 O GLU A 491 7.717 -14.812 -21.355 1.00 0.00 O ATOM 659 CB GLU A 491 6.674 -17.202 -22.659 1.00 0.00 C ATOM 660 CG GLU A 491 6.069 -18.092 -23.764 1.00 0.00 C ATOM 661 CD GLU A 491 6.826 -19.410 -23.978 1.00 0.00 C ATOM 662 OE1 GLU A 491 7.785 -19.440 -24.782 1.00 0.00 O ATOM 663 OE2 GLU A 491 6.475 -20.424 -23.329 1.00 0.00 O ATOM 0 H GLU A 491 6.194 -15.384 -24.315 1.00 0.00 H new ATOM 0 HA GLU A 491 4.863 -16.278 -21.943 1.00 0.00 H new ATOM 0 HB2 GLU A 491 7.671 -16.886 -22.966 1.00 0.00 H new ATOM 0 HB3 GLU A 491 6.793 -17.796 -21.753 1.00 0.00 H new ATOM 0 HG2 GLU A 491 5.032 -18.315 -23.511 1.00 0.00 H new ATOM 0 HG3 GLU A 491 6.056 -17.535 -24.701 1.00 0.00 H new ATOM 670 N GLU A 492 5.740 -14.658 -20.262 1.00 0.00 N ATOM 671 CA GLU A 492 6.248 -13.862 -19.147 1.00 0.00 C ATOM 672 C GLU A 492 6.555 -14.761 -17.936 1.00 0.00 C ATOM 673 O GLU A 492 5.648 -15.356 -17.335 1.00 0.00 O ATOM 674 CB GLU A 492 5.267 -12.716 -18.782 1.00 0.00 C ATOM 675 CG GLU A 492 3.807 -13.139 -18.587 1.00 0.00 C ATOM 676 CD GLU A 492 2.933 -11.987 -18.088 1.00 0.00 C ATOM 677 OE1 GLU A 492 3.079 -11.601 -16.916 1.00 0.00 O ATOM 678 OE2 GLU A 492 2.097 -11.469 -18.853 1.00 0.00 O ATOM 0 H GLU A 492 4.739 -14.848 -20.209 1.00 0.00 H new ATOM 0 HA GLU A 492 7.182 -13.394 -19.457 1.00 0.00 H new ATOM 0 HB2 GLU A 492 5.615 -12.240 -17.865 1.00 0.00 H new ATOM 0 HB3 GLU A 492 5.307 -11.962 -19.568 1.00 0.00 H new ATOM 0 HG2 GLU A 492 3.409 -13.512 -19.531 1.00 0.00 H new ATOM 0 HG3 GLU A 492 3.761 -13.963 -17.874 1.00 0.00 H new ATOM 685 N ILE A 493 7.854 -14.886 -17.616 1.00 0.00 N ATOM 686 CA ILE A 493 8.318 -15.587 -16.401 1.00 0.00 C ATOM 687 C ILE A 493 8.449 -14.577 -15.251 1.00 0.00 C ATOM 688 O ILE A 493 8.772 -13.408 -15.478 1.00 0.00 O ATOM 689 CB ILE A 493 9.679 -16.341 -16.636 1.00 0.00 C ATOM 690 CG1 ILE A 493 10.782 -15.356 -17.138 1.00 0.00 C ATOM 691 CG2 ILE A 493 9.490 -17.540 -17.604 1.00 0.00 C ATOM 692 CD1 ILE A 493 12.133 -15.993 -17.364 1.00 0.00 C ATOM 0 H ILE A 493 8.610 -14.507 -18.187 1.00 0.00 H new ATOM 0 HA ILE A 493 7.579 -16.345 -16.142 1.00 0.00 H new ATOM 0 HB ILE A 493 10.015 -16.746 -15.682 1.00 0.00 H new ATOM 0 HG12 ILE A 493 10.448 -14.901 -18.070 1.00 0.00 H new ATOM 0 HG13 ILE A 493 10.891 -14.551 -16.411 1.00 0.00 H new ATOM 0 HG21 ILE A 493 10.445 -18.044 -17.750 1.00 0.00 H new ATOM 0 HG22 ILE A 493 8.771 -18.241 -17.179 1.00 0.00 H new ATOM 0 HG23 ILE A 493 9.121 -17.178 -18.564 1.00 0.00 H new ATOM 0 HD11 ILE A 493 12.838 -15.238 -17.711 1.00 0.00 H new ATOM 0 HD12 ILE A 493 12.493 -16.423 -16.430 1.00 0.00 H new ATOM 0 HD13 ILE A 493 12.044 -16.779 -18.114 1.00 0.00 H new ATOM 704 N ALA A 494 8.192 -15.037 -14.020 1.00 0.00 N ATOM 705 CA ALA A 494 8.150 -14.179 -12.831 1.00 0.00 C ATOM 706 C ALA A 494 9.175 -14.647 -11.787 1.00 0.00 C ATOM 707 O ALA A 494 9.015 -15.721 -11.189 1.00 0.00 O ATOM 708 CB ALA A 494 6.732 -14.179 -12.240 1.00 0.00 C ATOM 0 H ALA A 494 8.007 -16.020 -13.821 1.00 0.00 H new ATOM 0 HA ALA A 494 8.410 -13.161 -13.121 1.00 0.00 H new ATOM 0 HB1 ALA A 494 6.706 -13.540 -11.357 1.00 0.00 H new ATOM 0 HB2 ALA A 494 6.029 -13.801 -12.982 1.00 0.00 H new ATOM 0 HB3 ALA A 494 6.454 -15.195 -11.961 1.00 0.00 H new ATOM 714 N TYR A 495 10.246 -13.857 -11.610 1.00 0.00 N ATOM 715 CA TYR A 495 11.162 -14.006 -10.473 1.00 0.00 C ATOM 716 C TYR A 495 10.569 -13.273 -9.267 1.00 0.00 C ATOM 717 O TYR A 495 10.563 -12.044 -9.231 1.00 0.00 O ATOM 718 CB TYR A 495 12.581 -13.443 -10.770 1.00 0.00 C ATOM 719 CG TYR A 495 13.516 -13.510 -9.543 1.00 0.00 C ATOM 720 CD1 TYR A 495 14.021 -14.729 -9.097 1.00 0.00 C ATOM 721 CD2 TYR A 495 13.867 -12.363 -8.818 1.00 0.00 C ATOM 722 CE1 TYR A 495 14.836 -14.811 -7.985 1.00 0.00 C ATOM 723 CE2 TYR A 495 14.686 -12.445 -7.703 1.00 0.00 C ATOM 724 CZ TYR A 495 15.170 -13.666 -7.296 1.00 0.00 C ATOM 725 OH TYR A 495 15.987 -13.744 -6.189 1.00 0.00 O ATOM 0 H TYR A 495 10.498 -13.102 -12.248 1.00 0.00 H new ATOM 0 HA TYR A 495 11.274 -15.071 -10.272 1.00 0.00 H new ATOM 0 HB2 TYR A 495 13.026 -14.004 -11.592 1.00 0.00 H new ATOM 0 HB3 TYR A 495 12.495 -12.408 -11.100 1.00 0.00 H new ATOM 0 HD1 TYR A 495 13.769 -15.632 -9.634 1.00 0.00 H new ATOM 0 HD2 TYR A 495 13.493 -11.400 -9.133 1.00 0.00 H new ATOM 0 HE1 TYR A 495 15.210 -15.770 -7.657 1.00 0.00 H new ATOM 0 HE2 TYR A 495 14.944 -11.551 -7.154 1.00 0.00 H new ATOM 0 HH TYR A 495 16.600 -14.502 -6.288 1.00 0.00 H new ATOM 735 N LYS A 496 10.085 -14.029 -8.287 1.00 0.00 N ATOM 736 CA LYS A 496 9.559 -13.467 -7.040 1.00 0.00 C ATOM 737 C LYS A 496 10.686 -13.384 -5.996 1.00 0.00 C ATOM 738 O LYS A 496 11.610 -14.213 -5.994 1.00 0.00 O ATOM 739 CB LYS A 496 8.372 -14.322 -6.529 1.00 0.00 C ATOM 740 CG LYS A 496 8.707 -15.798 -6.201 1.00 0.00 C ATOM 741 CD LYS A 496 7.462 -16.604 -5.767 1.00 0.00 C ATOM 742 CE LYS A 496 6.793 -16.043 -4.499 1.00 0.00 C ATOM 743 NZ LYS A 496 5.539 -16.761 -4.177 1.00 0.00 N ATOM 0 H LYS A 496 10.045 -15.047 -8.331 1.00 0.00 H new ATOM 0 HA LYS A 496 9.187 -12.459 -7.220 1.00 0.00 H new ATOM 0 HB2 LYS A 496 7.967 -13.852 -5.633 1.00 0.00 H new ATOM 0 HB3 LYS A 496 7.584 -14.305 -7.282 1.00 0.00 H new ATOM 0 HG2 LYS A 496 9.154 -16.269 -7.076 1.00 0.00 H new ATOM 0 HG3 LYS A 496 9.452 -15.830 -5.406 1.00 0.00 H new ATOM 0 HD2 LYS A 496 6.737 -16.609 -6.581 1.00 0.00 H new ATOM 0 HD3 LYS A 496 7.750 -17.640 -5.591 1.00 0.00 H new ATOM 0 HE2 LYS A 496 7.483 -16.121 -3.659 1.00 0.00 H new ATOM 0 HE3 LYS A 496 6.580 -14.983 -4.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 5.118 -16.355 -3.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 4.871 -16.665 -4.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 5.746 -17.768 -4.019 1.00 0.00 H new ATOM 757 N PHE A 497 10.609 -12.365 -5.130 1.00 0.00 N ATOM 758 CA PHE A 497 11.592 -12.137 -4.055 1.00 0.00 C ATOM 759 C PHE A 497 11.123 -12.794 -2.737 1.00 0.00 C ATOM 760 O PHE A 497 9.984 -13.269 -2.633 1.00 0.00 O ATOM 761 CB PHE A 497 11.801 -10.609 -3.868 1.00 0.00 C ATOM 762 CG PHE A 497 12.478 -9.922 -5.050 1.00 0.00 C ATOM 763 CD1 PHE A 497 13.867 -9.865 -5.133 1.00 0.00 C ATOM 764 CD2 PHE A 497 11.733 -9.342 -6.077 1.00 0.00 C ATOM 765 CE1 PHE A 497 14.491 -9.251 -6.203 1.00 0.00 C ATOM 766 CE2 PHE A 497 12.357 -8.731 -7.147 1.00 0.00 C ATOM 767 CZ PHE A 497 13.736 -8.687 -7.208 1.00 0.00 C ATOM 0 H PHE A 497 9.862 -11.671 -5.153 1.00 0.00 H new ATOM 0 HA PHE A 497 12.541 -12.596 -4.332 1.00 0.00 H new ATOM 0 HB2 PHE A 497 10.833 -10.140 -3.695 1.00 0.00 H new ATOM 0 HB3 PHE A 497 12.400 -10.442 -2.973 1.00 0.00 H new ATOM 0 HD1 PHE A 497 14.465 -10.307 -4.350 1.00 0.00 H new ATOM 0 HD2 PHE A 497 10.654 -9.371 -6.035 1.00 0.00 H new ATOM 0 HE1 PHE A 497 15.569 -9.213 -6.251 1.00 0.00 H new ATOM 0 HE2 PHE A 497 11.767 -8.288 -7.936 1.00 0.00 H new ATOM 0 HZ PHE A 497 14.223 -8.210 -8.045 1.00 0.00 H new ATOM 777 N THR A 498 12.026 -12.824 -1.742 1.00 0.00 N ATOM 778 CA THR A 498 11.749 -13.347 -0.393 1.00 0.00 C ATOM 779 C THR A 498 11.310 -12.175 0.522 1.00 0.00 C ATOM 780 O THR A 498 11.966 -11.133 0.506 1.00 0.00 O ATOM 781 CB THR A 498 13.013 -14.081 0.186 1.00 0.00 C ATOM 782 OG1 THR A 498 14.123 -13.168 0.282 1.00 0.00 O ATOM 783 CG2 THR A 498 13.424 -15.276 -0.702 1.00 0.00 C ATOM 0 H THR A 498 12.980 -12.482 -1.853 1.00 0.00 H new ATOM 0 HA THR A 498 10.943 -14.079 -0.442 1.00 0.00 H new ATOM 0 HB THR A 498 12.750 -14.451 1.177 1.00 0.00 H new ATOM 0 HG1 THR A 498 14.902 -13.638 0.645 1.00 0.00 H new ATOM 0 HG21 THR A 498 14.301 -15.762 -0.275 1.00 0.00 H new ATOM 0 HG22 THR A 498 12.602 -15.990 -0.754 1.00 0.00 H new ATOM 0 HG23 THR A 498 13.659 -14.920 -1.705 1.00 0.00 H new ATOM 791 N PRO A 499 10.166 -12.297 1.281 1.00 0.00 N ATOM 792 CA PRO A 499 9.637 -11.198 2.154 1.00 0.00 C ATOM 793 C PRO A 499 10.619 -10.706 3.253 1.00 0.00 C ATOM 794 O PRO A 499 10.435 -9.606 3.796 1.00 0.00 O ATOM 795 CB PRO A 499 8.337 -11.805 2.763 1.00 0.00 C ATOM 796 CG PRO A 499 8.472 -13.286 2.578 1.00 0.00 C ATOM 797 CD PRO A 499 9.254 -13.472 1.300 1.00 0.00 C ATOM 0 HA PRO A 499 9.467 -10.291 1.573 1.00 0.00 H new ATOM 0 HB2 PRO A 499 8.238 -11.547 3.817 1.00 0.00 H new ATOM 0 HB3 PRO A 499 7.450 -11.424 2.257 1.00 0.00 H new ATOM 0 HG2 PRO A 499 8.990 -13.740 3.423 1.00 0.00 H new ATOM 0 HG3 PRO A 499 7.494 -13.762 2.511 1.00 0.00 H new ATOM 0 HD2 PRO A 499 9.808 -14.411 1.301 1.00 0.00 H new ATOM 0 HD3 PRO A 499 8.601 -13.488 0.428 1.00 0.00 H new ATOM 805 N LYS A 500 11.641 -11.525 3.580 1.00 0.00 N ATOM 806 CA LYS A 500 12.693 -11.152 4.557 1.00 0.00 C ATOM 807 C LYS A 500 13.702 -10.155 3.939 1.00 0.00 C ATOM 808 O LYS A 500 14.371 -9.409 4.667 1.00 0.00 O ATOM 809 CB LYS A 500 13.451 -12.419 5.043 1.00 0.00 C ATOM 810 CG LYS A 500 14.258 -13.145 3.937 1.00 0.00 C ATOM 811 CD LYS A 500 15.083 -14.333 4.470 1.00 0.00 C ATOM 812 CE LYS A 500 15.876 -15.042 3.360 1.00 0.00 C ATOM 813 NZ LYS A 500 16.678 -16.173 3.887 1.00 0.00 N ATOM 0 H LYS A 500 11.762 -12.455 3.180 1.00 0.00 H new ATOM 0 HA LYS A 500 12.203 -10.672 5.404 1.00 0.00 H new ATOM 0 HB2 LYS A 500 14.132 -12.135 5.845 1.00 0.00 H new ATOM 0 HB3 LYS A 500 12.731 -13.118 5.468 1.00 0.00 H new ATOM 0 HG2 LYS A 500 13.571 -13.503 3.170 1.00 0.00 H new ATOM 0 HG3 LYS A 500 14.928 -12.432 3.457 1.00 0.00 H new ATOM 0 HD2 LYS A 500 15.773 -13.978 5.235 1.00 0.00 H new ATOM 0 HD3 LYS A 500 14.416 -15.049 4.950 1.00 0.00 H new ATOM 0 HE2 LYS A 500 15.187 -15.409 2.600 1.00 0.00 H new ATOM 0 HE3 LYS A 500 16.536 -14.325 2.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 17.197 -16.624 3.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 17.354 -15.820 4.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 16.046 -16.870 4.330 1.00 0.00 H new ATOM 827 N TYR A 501 13.808 -10.168 2.596 1.00 0.00 N ATOM 828 CA TYR A 501 14.802 -9.380 1.857 1.00 0.00 C ATOM 829 C TYR A 501 14.393 -7.900 1.815 1.00 0.00 C ATOM 830 O TYR A 501 13.213 -7.569 1.709 1.00 0.00 O ATOM 831 CB TYR A 501 14.983 -9.944 0.421 1.00 0.00 C ATOM 832 CG TYR A 501 16.110 -9.278 -0.382 1.00 0.00 C ATOM 833 CD1 TYR A 501 17.445 -9.632 -0.177 1.00 0.00 C ATOM 834 CD2 TYR A 501 15.842 -8.286 -1.330 1.00 0.00 C ATOM 835 CE1 TYR A 501 18.464 -9.022 -0.884 1.00 0.00 C ATOM 836 CE2 TYR A 501 16.859 -7.673 -2.034 1.00 0.00 C ATOM 837 CZ TYR A 501 18.165 -8.048 -1.810 1.00 0.00 C ATOM 838 OH TYR A 501 19.179 -7.439 -2.509 1.00 0.00 O ATOM 0 H TYR A 501 13.203 -10.728 1.996 1.00 0.00 H new ATOM 0 HA TYR A 501 15.758 -9.454 2.375 1.00 0.00 H new ATOM 0 HB2 TYR A 501 15.182 -11.014 0.486 1.00 0.00 H new ATOM 0 HB3 TYR A 501 14.046 -9.827 -0.124 1.00 0.00 H new ATOM 0 HD1 TYR A 501 17.686 -10.396 0.547 1.00 0.00 H new ATOM 0 HD2 TYR A 501 14.819 -7.993 -1.515 1.00 0.00 H new ATOM 0 HE1 TYR A 501 19.491 -9.308 -0.711 1.00 0.00 H new ATOM 0 HE2 TYR A 501 16.632 -6.903 -2.757 1.00 0.00 H new ATOM 0 HH TYR A 501 19.925 -8.066 -2.616 1.00 0.00 H new ATOM 848 N ILE A 502 15.390 -7.018 1.913 1.00 0.00 N ATOM 849 CA ILE A 502 15.209 -5.557 1.851 1.00 0.00 C ATOM 850 C ILE A 502 16.265 -4.968 0.895 1.00 0.00 C ATOM 851 O ILE A 502 17.433 -5.384 0.919 1.00 0.00 O ATOM 852 CB ILE A 502 15.320 -4.914 3.295 1.00 0.00 C ATOM 853 CG1 ILE A 502 14.122 -5.363 4.206 1.00 0.00 C ATOM 854 CG2 ILE A 502 15.429 -3.375 3.233 1.00 0.00 C ATOM 855 CD1 ILE A 502 14.125 -4.805 5.628 1.00 0.00 C ATOM 0 H ILE A 502 16.363 -7.298 2.040 1.00 0.00 H new ATOM 0 HA ILE A 502 14.213 -5.326 1.473 1.00 0.00 H new ATOM 0 HB ILE A 502 16.242 -5.283 3.744 1.00 0.00 H new ATOM 0 HG12 ILE A 502 13.191 -5.068 3.722 1.00 0.00 H new ATOM 0 HG13 ILE A 502 14.121 -6.452 4.263 1.00 0.00 H new ATOM 0 HG21 ILE A 502 15.503 -2.974 4.244 1.00 0.00 H new ATOM 0 HG22 ILE A 502 16.317 -3.096 2.666 1.00 0.00 H new ATOM 0 HG23 ILE A 502 14.544 -2.967 2.745 1.00 0.00 H new ATOM 0 HD11 ILE A 502 13.255 -5.179 6.167 1.00 0.00 H new ATOM 0 HD12 ILE A 502 15.033 -5.121 6.141 1.00 0.00 H new ATOM 0 HD13 ILE A 502 14.089 -3.716 5.592 1.00 0.00 H new ATOM 867 N LEU A 503 15.837 -4.029 0.034 1.00 0.00 N ATOM 868 CA LEU A 503 16.721 -3.322 -0.911 1.00 0.00 C ATOM 869 C LEU A 503 17.022 -1.925 -0.325 1.00 0.00 C ATOM 870 O LEU A 503 16.109 -1.120 -0.169 1.00 0.00 O ATOM 871 CB LEU A 503 16.034 -3.210 -2.316 1.00 0.00 C ATOM 872 CG LEU A 503 16.957 -3.323 -3.578 1.00 0.00 C ATOM 873 CD1 LEU A 503 16.181 -2.968 -4.864 1.00 0.00 C ATOM 874 CD2 LEU A 503 18.256 -2.496 -3.454 1.00 0.00 C ATOM 0 H LEU A 503 14.862 -3.737 -0.027 1.00 0.00 H new ATOM 0 HA LEU A 503 17.653 -3.871 -1.048 1.00 0.00 H new ATOM 0 HB2 LEU A 503 15.274 -3.988 -2.383 1.00 0.00 H new ATOM 0 HB3 LEU A 503 15.515 -2.253 -2.362 1.00 0.00 H new ATOM 0 HG LEU A 503 17.269 -4.365 -3.643 1.00 0.00 H new ATOM 0 HD11 LEU A 503 16.844 -3.054 -5.725 1.00 0.00 H new ATOM 0 HD12 LEU A 503 15.341 -3.653 -4.983 1.00 0.00 H new ATOM 0 HD13 LEU A 503 15.809 -1.946 -4.794 1.00 0.00 H new ATOM 0 HD21 LEU A 503 18.852 -2.616 -4.359 1.00 0.00 H new ATOM 0 HD22 LEU A 503 18.006 -1.443 -3.321 1.00 0.00 H new ATOM 0 HD23 LEU A 503 18.828 -2.844 -2.594 1.00 0.00 H new ATOM 886 N ARG A 504 18.300 -1.650 -0.016 1.00 0.00 N ATOM 887 CA ARG A 504 18.727 -0.378 0.615 1.00 0.00 C ATOM 888 C ARG A 504 18.684 0.809 -0.379 1.00 0.00 C ATOM 889 O ARG A 504 18.662 0.605 -1.600 1.00 0.00 O ATOM 890 CB ARG A 504 20.151 -0.528 1.203 1.00 0.00 C ATOM 891 CG ARG A 504 20.316 -1.647 2.258 1.00 0.00 C ATOM 892 CD ARG A 504 21.765 -1.751 2.765 1.00 0.00 C ATOM 893 NE ARG A 504 21.968 -2.882 3.694 1.00 0.00 N ATOM 894 CZ ARG A 504 23.161 -3.421 4.003 1.00 0.00 C ATOM 895 NH1 ARG A 504 24.282 -2.982 3.438 1.00 0.00 N ATOM 896 NH2 ARG A 504 23.219 -4.427 4.861 1.00 0.00 N ATOM 0 H ARG A 504 19.068 -2.297 -0.194 1.00 0.00 H new ATOM 0 HA ARG A 504 18.022 -0.158 1.417 1.00 0.00 H new ATOM 0 HB2 ARG A 504 20.846 -0.717 0.385 1.00 0.00 H new ATOM 0 HB3 ARG A 504 20.441 0.420 1.655 1.00 0.00 H new ATOM 0 HG2 ARG A 504 19.650 -1.453 3.099 1.00 0.00 H new ATOM 0 HG3 ARG A 504 20.014 -2.601 1.825 1.00 0.00 H new ATOM 0 HD2 ARG A 504 22.436 -1.862 1.913 1.00 0.00 H new ATOM 0 HD3 ARG A 504 22.037 -0.822 3.266 1.00 0.00 H new ATOM 0 HE ARG A 504 21.141 -3.285 4.134 1.00 0.00 H new ATOM 0 HH11 ARG A 504 24.247 -2.223 2.757 1.00 0.00 H new ATOM 0 HH12 ARG A 504 25.177 -3.404 3.686 1.00 0.00 H new ATOM 0 HH21 ARG A 504 22.363 -4.788 5.282 1.00 0.00 H new ATOM 0 HH22 ARG A 504 24.120 -4.842 5.101 1.00 0.00 H new ATOM 910 N ALA A 505 18.690 2.045 0.171 1.00 0.00 N ATOM 911 CA ALA A 505 18.558 3.305 -0.604 1.00 0.00 C ATOM 912 C ALA A 505 19.695 3.483 -1.629 1.00 0.00 C ATOM 913 O ALA A 505 20.872 3.419 -1.266 1.00 0.00 O ATOM 914 CB ALA A 505 18.542 4.504 0.352 1.00 0.00 C ATOM 0 H ALA A 505 18.787 2.199 1.175 1.00 0.00 H new ATOM 0 HA ALA A 505 17.620 3.249 -1.156 1.00 0.00 H new ATOM 0 HB1 ALA A 505 18.445 5.426 -0.222 1.00 0.00 H new ATOM 0 HB2 ALA A 505 17.699 4.412 1.037 1.00 0.00 H new ATOM 0 HB3 ALA A 505 19.471 4.527 0.922 1.00 0.00 H new ATOM 920 N GLY A 506 19.319 3.667 -2.910 1.00 0.00 N ATOM 921 CA GLY A 506 20.281 3.917 -3.998 1.00 0.00 C ATOM 922 C GLY A 506 21.069 2.685 -4.435 1.00 0.00 C ATOM 923 O GLY A 506 21.817 2.744 -5.421 1.00 0.00 O ATOM 0 H GLY A 506 18.346 3.647 -3.217 1.00 0.00 H new ATOM 0 HA2 GLY A 506 19.743 4.314 -4.859 1.00 0.00 H new ATOM 0 HA3 GLY A 506 20.982 4.687 -3.677 1.00 0.00 H new ATOM 927 N GLN A 507 20.900 1.571 -3.707 1.00 0.00 N ATOM 928 CA GLN A 507 21.623 0.325 -3.960 1.00 0.00 C ATOM 929 C GLN A 507 20.957 -0.438 -5.100 1.00 0.00 C ATOM 930 O GLN A 507 19.764 -0.264 -5.377 1.00 0.00 O ATOM 931 CB GLN A 507 21.707 -0.542 -2.671 1.00 0.00 C ATOM 932 CG GLN A 507 22.533 0.095 -1.532 1.00 0.00 C ATOM 933 CD GLN A 507 23.986 0.371 -1.928 1.00 0.00 C ATOM 934 OE1 GLN A 507 24.853 -0.491 -1.788 1.00 0.00 O ATOM 935 NE2 GLN A 507 24.258 1.572 -2.417 1.00 0.00 N ATOM 0 H GLN A 507 20.252 1.514 -2.921 1.00 0.00 H new ATOM 0 HA GLN A 507 22.644 0.565 -4.256 1.00 0.00 H new ATOM 0 HB2 GLN A 507 20.697 -0.733 -2.309 1.00 0.00 H new ATOM 0 HB3 GLN A 507 22.143 -1.508 -2.924 1.00 0.00 H new ATOM 0 HG2 GLN A 507 22.062 1.029 -1.228 1.00 0.00 H new ATOM 0 HG3 GLN A 507 22.518 -0.567 -0.666 1.00 0.00 H new ATOM 0 HE21 GLN A 507 23.513 2.262 -2.519 1.00 0.00 H new ATOM 0 HE22 GLN A 507 25.212 1.807 -2.692 1.00 0.00 H new ATOM 944 N MET A 508 21.754 -1.271 -5.760 1.00 0.00 N ATOM 945 CA MET A 508 21.358 -1.998 -6.958 1.00 0.00 C ATOM 946 C MET A 508 21.482 -3.506 -6.699 1.00 0.00 C ATOM 947 O MET A 508 22.539 -3.978 -6.251 1.00 0.00 O ATOM 948 CB MET A 508 22.253 -1.557 -8.144 1.00 0.00 C ATOM 949 CG MET A 508 22.192 -0.061 -8.489 1.00 0.00 C ATOM 950 SD MET A 508 23.455 0.443 -9.683 1.00 0.00 S ATOM 951 CE MET A 508 24.965 0.194 -8.740 1.00 0.00 C ATOM 0 H MET A 508 22.713 -1.463 -5.470 1.00 0.00 H new ATOM 0 HA MET A 508 20.321 -1.777 -7.210 1.00 0.00 H new ATOM 0 HB2 MET A 508 23.286 -1.819 -7.916 1.00 0.00 H new ATOM 0 HB3 MET A 508 21.967 -2.129 -9.027 1.00 0.00 H new ATOM 0 HG2 MET A 508 21.206 0.173 -8.891 1.00 0.00 H new ATOM 0 HG3 MET A 508 22.311 0.522 -7.576 1.00 0.00 H new ATOM 0 HE1 MET A 508 25.768 0.790 -9.174 1.00 0.00 H new ATOM 0 HE2 MET A 508 24.804 0.501 -7.707 1.00 0.00 H new ATOM 0 HE3 MET A 508 25.241 -0.860 -8.766 1.00 0.00 H new ATOM 961 N VAL A 509 20.391 -4.247 -6.949 1.00 0.00 N ATOM 962 CA VAL A 509 20.356 -5.709 -6.800 1.00 0.00 C ATOM 963 C VAL A 509 20.346 -6.358 -8.197 1.00 0.00 C ATOM 964 O VAL A 509 19.399 -6.191 -8.979 1.00 0.00 O ATOM 965 CB VAL A 509 19.136 -6.194 -5.918 1.00 0.00 C ATOM 966 CG1 VAL A 509 17.765 -5.727 -6.466 1.00 0.00 C ATOM 967 CG2 VAL A 509 19.175 -7.726 -5.722 1.00 0.00 C ATOM 0 H VAL A 509 19.506 -3.847 -7.261 1.00 0.00 H new ATOM 0 HA VAL A 509 21.251 -6.026 -6.265 1.00 0.00 H new ATOM 0 HB VAL A 509 19.246 -5.718 -4.944 1.00 0.00 H new ATOM 0 HG11 VAL A 509 16.970 -6.092 -5.816 1.00 0.00 H new ATOM 0 HG12 VAL A 509 17.737 -4.638 -6.496 1.00 0.00 H new ATOM 0 HG13 VAL A 509 17.622 -6.122 -7.472 1.00 0.00 H new ATOM 0 HG21 VAL A 509 18.326 -8.037 -5.112 1.00 0.00 H new ATOM 0 HG22 VAL A 509 19.124 -8.218 -6.693 1.00 0.00 H new ATOM 0 HG23 VAL A 509 20.102 -8.005 -5.222 1.00 0.00 H new ATOM 977 N THR A 510 21.443 -7.050 -8.525 1.00 0.00 N ATOM 978 CA THR A 510 21.635 -7.674 -9.836 1.00 0.00 C ATOM 979 C THR A 510 21.144 -9.128 -9.789 1.00 0.00 C ATOM 980 O THR A 510 21.819 -9.999 -9.223 1.00 0.00 O ATOM 981 CB THR A 510 23.144 -7.619 -10.261 1.00 0.00 C ATOM 982 OG1 THR A 510 23.727 -6.373 -9.847 1.00 0.00 O ATOM 983 CG2 THR A 510 23.309 -7.759 -11.778 1.00 0.00 C ATOM 0 H THR A 510 22.225 -7.193 -7.885 1.00 0.00 H new ATOM 0 HA THR A 510 21.056 -7.124 -10.578 1.00 0.00 H new ATOM 0 HB THR A 510 23.649 -8.454 -9.775 1.00 0.00 H new ATOM 0 HG1 THR A 510 23.933 -6.410 -8.890 1.00 0.00 H new ATOM 0 HG21 THR A 510 24.368 -7.716 -12.034 1.00 0.00 H new ATOM 0 HG22 THR A 510 22.895 -8.714 -12.102 1.00 0.00 H new ATOM 0 HG23 THR A 510 22.782 -6.947 -12.278 1.00 0.00 H new ATOM 991 N VAL A 511 19.945 -9.375 -10.332 1.00 0.00 N ATOM 992 CA VAL A 511 19.344 -10.714 -10.328 1.00 0.00 C ATOM 993 C VAL A 511 19.788 -11.494 -11.580 1.00 0.00 C ATOM 994 O VAL A 511 19.245 -11.306 -12.672 1.00 0.00 O ATOM 995 CB VAL A 511 17.779 -10.660 -10.241 1.00 0.00 C ATOM 996 CG1 VAL A 511 17.180 -12.089 -10.195 1.00 0.00 C ATOM 997 CG2 VAL A 511 17.313 -9.798 -9.030 1.00 0.00 C ATOM 0 H VAL A 511 19.371 -8.662 -10.781 1.00 0.00 H new ATOM 0 HA VAL A 511 19.696 -11.231 -9.436 1.00 0.00 H new ATOM 0 HB VAL A 511 17.404 -10.176 -11.143 1.00 0.00 H new ATOM 0 HG11 VAL A 511 16.093 -12.026 -10.135 1.00 0.00 H new ATOM 0 HG12 VAL A 511 17.463 -12.631 -11.097 1.00 0.00 H new ATOM 0 HG13 VAL A 511 17.562 -12.616 -9.320 1.00 0.00 H new ATOM 0 HG21 VAL A 511 16.224 -9.779 -8.995 1.00 0.00 H new ATOM 0 HG22 VAL A 511 17.698 -10.230 -8.106 1.00 0.00 H new ATOM 0 HG23 VAL A 511 17.691 -8.781 -9.140 1.00 0.00 H new ATOM 1007 N TRP A 512 20.806 -12.344 -11.395 1.00 0.00 N ATOM 1008 CA TRP A 512 21.308 -13.275 -12.418 1.00 0.00 C ATOM 1009 C TRP A 512 20.517 -14.596 -12.416 1.00 0.00 C ATOM 1010 O TRP A 512 19.612 -14.795 -11.601 1.00 0.00 O ATOM 1011 CB TRP A 512 22.802 -13.580 -12.166 1.00 0.00 C ATOM 1012 CG TRP A 512 23.763 -12.430 -12.393 1.00 0.00 C ATOM 1013 CD1 TRP A 512 23.907 -11.313 -11.630 1.00 0.00 C ATOM 1014 CD2 TRP A 512 24.739 -12.315 -13.444 1.00 0.00 C ATOM 1015 NE1 TRP A 512 24.912 -10.531 -12.124 1.00 0.00 N ATOM 1016 CE2 TRP A 512 25.430 -11.112 -13.242 1.00 0.00 C ATOM 1017 CE3 TRP A 512 25.090 -13.112 -14.530 1.00 0.00 C ATOM 1018 CZ2 TRP A 512 26.452 -10.689 -14.081 1.00 0.00 C ATOM 1019 CZ3 TRP A 512 26.103 -12.696 -15.368 1.00 0.00 C ATOM 1020 CH2 TRP A 512 26.778 -11.490 -15.141 1.00 0.00 C ATOM 0 H TRP A 512 21.315 -12.406 -10.513 1.00 0.00 H new ATOM 0 HA TRP A 512 21.182 -12.797 -13.390 1.00 0.00 H new ATOM 0 HB2 TRP A 512 22.914 -13.923 -11.137 1.00 0.00 H new ATOM 0 HB3 TRP A 512 23.097 -14.407 -12.812 1.00 0.00 H new ATOM 0 HD1 TRP A 512 23.313 -11.078 -10.759 1.00 0.00 H new ATOM 0 HE1 TRP A 512 25.226 -9.649 -11.719 1.00 0.00 H new ATOM 0 HE3 TRP A 512 24.576 -14.044 -14.714 1.00 0.00 H new ATOM 0 HZ2 TRP A 512 26.972 -9.759 -13.903 1.00 0.00 H new ATOM 0 HZ3 TRP A 512 26.380 -13.310 -16.212 1.00 0.00 H new ATOM 0 HH2 TRP A 512 27.568 -11.188 -15.813 1.00 0.00 H new ATOM 1031 N ALA A 513 20.865 -15.481 -13.371 1.00 0.00 N ATOM 1032 CA ALA A 513 20.321 -16.852 -13.468 1.00 0.00 C ATOM 1033 C ALA A 513 21.254 -17.858 -12.774 1.00 0.00 C ATOM 1034 O ALA A 513 22.420 -17.548 -12.486 1.00 0.00 O ATOM 1035 CB ALA A 513 20.119 -17.227 -14.949 1.00 0.00 C ATOM 0 H ALA A 513 21.539 -15.263 -14.105 1.00 0.00 H new ATOM 0 HA ALA A 513 19.357 -16.886 -12.961 1.00 0.00 H new ATOM 0 HB1 ALA A 513 19.718 -18.238 -15.017 1.00 0.00 H new ATOM 0 HB2 ALA A 513 19.421 -16.528 -15.409 1.00 0.00 H new ATOM 0 HB3 ALA A 513 21.075 -17.180 -15.470 1.00 0.00 H new ATOM 1041 N ALA A 514 20.723 -19.064 -12.503 1.00 0.00 N ATOM 1042 CA ALA A 514 21.501 -20.189 -11.945 1.00 0.00 C ATOM 1043 C ALA A 514 22.581 -20.661 -12.927 1.00 0.00 C ATOM 1044 O ALA A 514 23.739 -20.856 -12.544 1.00 0.00 O ATOM 1045 CB ALA A 514 20.562 -21.347 -11.584 1.00 0.00 C ATOM 0 H ALA A 514 19.741 -19.288 -12.664 1.00 0.00 H new ATOM 0 HA ALA A 514 22.003 -19.842 -11.042 1.00 0.00 H new ATOM 0 HB1 ALA A 514 21.143 -22.172 -11.173 1.00 0.00 H new ATOM 0 HB2 ALA A 514 19.837 -21.010 -10.843 1.00 0.00 H new ATOM 0 HB3 ALA A 514 20.037 -21.683 -12.479 1.00 0.00 H new ATOM 1051 N GLY A 515 22.190 -20.808 -14.201 1.00 0.00 N ATOM 1052 CA GLY A 515 23.111 -21.267 -15.248 1.00 0.00 C ATOM 1053 C GLY A 515 23.980 -20.156 -15.830 1.00 0.00 C ATOM 1054 O GLY A 515 24.731 -20.391 -16.784 1.00 0.00 O ATOM 0 H GLY A 515 21.244 -20.616 -14.530 1.00 0.00 H new ATOM 0 HA2 GLY A 515 23.756 -22.043 -14.837 1.00 0.00 H new ATOM 0 HA3 GLY A 515 22.534 -21.724 -16.052 1.00 0.00 H new ATOM 1058 N ALA A 516 23.892 -18.946 -15.243 1.00 0.00 N ATOM 1059 CA ALA A 516 24.723 -17.789 -15.632 1.00 0.00 C ATOM 1060 C ALA A 516 26.178 -17.918 -15.102 1.00 0.00 C ATOM 1061 O ALA A 516 27.010 -17.035 -15.353 1.00 0.00 O ATOM 1062 CB ALA A 516 24.069 -16.491 -15.142 1.00 0.00 C ATOM 0 H ALA A 516 23.241 -18.743 -14.484 1.00 0.00 H new ATOM 0 HA ALA A 516 24.785 -17.765 -16.720 1.00 0.00 H new ATOM 0 HB1 ALA A 516 24.686 -15.641 -15.432 1.00 0.00 H new ATOM 0 HB2 ALA A 516 23.080 -16.391 -15.589 1.00 0.00 H new ATOM 0 HB3 ALA A 516 23.975 -16.518 -14.056 1.00 0.00 H new ATOM 1068 N GLY A 517 26.463 -19.021 -14.366 1.00 0.00 N ATOM 1069 CA GLY A 517 27.827 -19.371 -13.936 1.00 0.00 C ATOM 1070 C GLY A 517 28.409 -18.412 -12.900 1.00 0.00 C ATOM 1071 O GLY A 517 29.630 -18.208 -12.832 1.00 0.00 O ATOM 0 H GLY A 517 25.753 -19.686 -14.059 1.00 0.00 H new ATOM 0 HA2 GLY A 517 27.820 -20.379 -13.522 1.00 0.00 H new ATOM 0 HA3 GLY A 517 28.480 -19.389 -14.809 1.00 0.00 H new ATOM 1075 N VAL A 518 27.522 -17.854 -12.074 1.00 0.00 N ATOM 1076 CA VAL A 518 27.837 -16.783 -11.116 1.00 0.00 C ATOM 1077 C VAL A 518 27.443 -17.220 -9.688 1.00 0.00 C ATOM 1078 O VAL A 518 26.368 -17.811 -9.477 1.00 0.00 O ATOM 1079 CB VAL A 518 27.097 -15.456 -11.531 1.00 0.00 C ATOM 1080 CG1 VAL A 518 25.574 -15.686 -11.662 1.00 0.00 C ATOM 1081 CG2 VAL A 518 27.417 -14.285 -10.563 1.00 0.00 C ATOM 0 H VAL A 518 26.543 -18.137 -12.049 1.00 0.00 H new ATOM 0 HA VAL A 518 28.910 -16.591 -11.127 1.00 0.00 H new ATOM 0 HB VAL A 518 27.475 -15.166 -12.511 1.00 0.00 H new ATOM 0 HG11 VAL A 518 25.089 -14.753 -11.949 1.00 0.00 H new ATOM 0 HG12 VAL A 518 25.384 -16.443 -12.423 1.00 0.00 H new ATOM 0 HG13 VAL A 518 25.174 -16.024 -10.706 1.00 0.00 H new ATOM 0 HG21 VAL A 518 26.886 -13.390 -10.887 1.00 0.00 H new ATOM 0 HG22 VAL A 518 27.100 -14.550 -9.554 1.00 0.00 H new ATOM 0 HG23 VAL A 518 28.490 -14.092 -10.568 1.00 0.00 H new ATOM 1091 N ALA A 519 28.335 -16.953 -8.724 1.00 0.00 N ATOM 1092 CA ALA A 519 28.127 -17.302 -7.318 1.00 0.00 C ATOM 1093 C ALA A 519 27.149 -16.310 -6.657 1.00 0.00 C ATOM 1094 O ALA A 519 27.265 -15.089 -6.849 1.00 0.00 O ATOM 1095 CB ALA A 519 29.479 -17.344 -6.584 1.00 0.00 C ATOM 0 H ALA A 519 29.224 -16.486 -8.902 1.00 0.00 H new ATOM 0 HA ALA A 519 27.679 -18.293 -7.254 1.00 0.00 H new ATOM 0 HB1 ALA A 519 29.317 -17.604 -5.538 1.00 0.00 H new ATOM 0 HB2 ALA A 519 30.122 -18.091 -7.049 1.00 0.00 H new ATOM 0 HB3 ALA A 519 29.957 -16.366 -6.645 1.00 0.00 H new ATOM 1101 N HIS A 520 26.177 -16.848 -5.900 1.00 0.00 N ATOM 1102 CA HIS A 520 25.156 -16.045 -5.199 1.00 0.00 C ATOM 1103 C HIS A 520 25.817 -15.164 -4.126 1.00 0.00 C ATOM 1104 O HIS A 520 26.319 -15.676 -3.118 1.00 0.00 O ATOM 1105 CB HIS A 520 24.092 -16.987 -4.575 1.00 0.00 C ATOM 1106 CG HIS A 520 22.941 -16.291 -3.882 1.00 0.00 C ATOM 1107 ND1 HIS A 520 22.352 -16.744 -2.718 1.00 0.00 N ATOM 1108 CD2 HIS A 520 22.260 -15.165 -4.223 1.00 0.00 C ATOM 1109 CE1 HIS A 520 21.359 -15.904 -2.402 1.00 0.00 C ATOM 1110 NE2 HIS A 520 21.264 -14.929 -3.281 1.00 0.00 N ATOM 0 H HIS A 520 26.076 -17.853 -5.756 1.00 0.00 H new ATOM 0 HA HIS A 520 24.659 -15.386 -5.911 1.00 0.00 H new ATOM 0 HB2 HIS A 520 23.689 -17.625 -5.362 1.00 0.00 H new ATOM 0 HB3 HIS A 520 24.586 -17.641 -3.856 1.00 0.00 H new ATOM 0 HD1 HIS A 520 22.626 -17.573 -2.191 1.00 0.00 H new ATOM 0 HD2 HIS A 520 22.461 -14.551 -5.088 1.00 0.00 H new ATOM 0 HE1 HIS A 520 20.719 -16.012 -1.539 1.00 0.00 H new ATOM 1118 N SER A 521 25.817 -13.840 -4.360 1.00 0.00 N ATOM 1119 CA SER A 521 26.497 -12.860 -3.497 1.00 0.00 C ATOM 1120 C SER A 521 25.504 -11.753 -3.062 1.00 0.00 C ATOM 1121 O SER A 521 25.554 -10.631 -3.585 1.00 0.00 O ATOM 1122 CB SER A 521 27.715 -12.271 -4.256 1.00 0.00 C ATOM 1123 OG SER A 521 28.578 -13.305 -4.708 1.00 0.00 O ATOM 0 H SER A 521 25.342 -13.418 -5.158 1.00 0.00 H new ATOM 0 HA SER A 521 26.859 -13.348 -2.592 1.00 0.00 H new ATOM 0 HB2 SER A 521 27.369 -11.683 -5.106 1.00 0.00 H new ATOM 0 HB3 SER A 521 28.264 -11.594 -3.602 1.00 0.00 H new ATOM 0 HG SER A 521 28.122 -13.834 -5.395 1.00 0.00 H new ATOM 1129 N PRO A 522 24.559 -12.058 -2.113 1.00 0.00 N ATOM 1130 CA PRO A 522 23.566 -11.067 -1.639 1.00 0.00 C ATOM 1131 C PRO A 522 24.245 -9.929 -0.813 1.00 0.00 C ATOM 1132 O PRO A 522 25.299 -10.157 -0.205 1.00 0.00 O ATOM 1133 CB PRO A 522 22.591 -11.923 -0.782 1.00 0.00 C ATOM 1134 CG PRO A 522 23.419 -13.078 -0.299 1.00 0.00 C ATOM 1135 CD PRO A 522 24.387 -13.377 -1.422 1.00 0.00 C ATOM 0 HA PRO A 522 23.057 -10.544 -2.448 1.00 0.00 H new ATOM 0 HB2 PRO A 522 22.189 -11.348 0.052 1.00 0.00 H new ATOM 0 HB3 PRO A 522 21.741 -12.265 -1.373 1.00 0.00 H new ATOM 0 HG2 PRO A 522 23.949 -12.824 0.619 1.00 0.00 H new ATOM 0 HG3 PRO A 522 22.795 -13.944 -0.078 1.00 0.00 H new ATOM 0 HD2 PRO A 522 25.336 -13.755 -1.041 1.00 0.00 H new ATOM 0 HD3 PRO A 522 23.991 -14.134 -2.099 1.00 0.00 H new ATOM 1143 N PRO A 523 23.691 -8.670 -0.793 1.00 0.00 N ATOM 1144 CA PRO A 523 22.478 -8.258 -1.544 1.00 0.00 C ATOM 1145 C PRO A 523 22.785 -7.636 -2.935 1.00 0.00 C ATOM 1146 O PRO A 523 21.900 -7.060 -3.574 1.00 0.00 O ATOM 1147 CB PRO A 523 21.876 -7.223 -0.572 1.00 0.00 C ATOM 1148 CG PRO A 523 23.075 -6.508 -0.002 1.00 0.00 C ATOM 1149 CD PRO A 523 24.206 -7.533 0.032 1.00 0.00 C ATOM 0 HA PRO A 523 21.823 -9.092 -1.797 1.00 0.00 H new ATOM 0 HB2 PRO A 523 21.209 -6.533 -1.089 1.00 0.00 H new ATOM 0 HB3 PRO A 523 21.291 -7.705 0.211 1.00 0.00 H new ATOM 0 HG2 PRO A 523 23.346 -5.650 -0.618 1.00 0.00 H new ATOM 0 HG3 PRO A 523 22.863 -6.129 0.998 1.00 0.00 H new ATOM 0 HD2 PRO A 523 25.127 -7.124 -0.383 1.00 0.00 H new ATOM 0 HD3 PRO A 523 24.428 -7.848 1.051 1.00 0.00 H new ATOM 1157 N SER A 524 24.044 -7.764 -3.381 1.00 0.00 N ATOM 1158 CA SER A 524 24.526 -7.160 -4.641 1.00 0.00 C ATOM 1159 C SER A 524 24.181 -8.032 -5.863 1.00 0.00 C ATOM 1160 O SER A 524 24.003 -7.521 -6.974 1.00 0.00 O ATOM 1161 CB SER A 524 26.052 -6.949 -4.542 1.00 0.00 C ATOM 1162 OG SER A 524 26.384 -6.142 -3.418 1.00 0.00 O ATOM 0 H SER A 524 24.761 -8.289 -2.880 1.00 0.00 H new ATOM 0 HA SER A 524 24.025 -6.202 -4.782 1.00 0.00 H new ATOM 0 HB2 SER A 524 26.552 -7.914 -4.461 1.00 0.00 H new ATOM 0 HB3 SER A 524 26.417 -6.476 -5.454 1.00 0.00 H new ATOM 0 HG SER A 524 27.356 -6.024 -3.376 1.00 0.00 H new ATOM 1168 N THR A 525 24.088 -9.352 -5.642 1.00 0.00 N ATOM 1169 CA THR A 525 23.838 -10.339 -6.698 1.00 0.00 C ATOM 1170 C THR A 525 22.939 -11.465 -6.162 1.00 0.00 C ATOM 1171 O THR A 525 23.388 -12.305 -5.370 1.00 0.00 O ATOM 1172 CB THR A 525 25.192 -10.921 -7.257 1.00 0.00 C ATOM 1173 OG1 THR A 525 25.960 -9.870 -7.866 1.00 0.00 O ATOM 1174 CG2 THR A 525 24.985 -12.054 -8.286 1.00 0.00 C ATOM 0 H THR A 525 24.186 -9.766 -4.715 1.00 0.00 H new ATOM 0 HA THR A 525 23.325 -9.844 -7.522 1.00 0.00 H new ATOM 0 HB THR A 525 25.723 -11.346 -6.405 1.00 0.00 H new ATOM 0 HG1 THR A 525 26.801 -10.237 -8.210 1.00 0.00 H new ATOM 0 HG21 THR A 525 25.954 -12.412 -8.633 1.00 0.00 H new ATOM 0 HG22 THR A 525 24.441 -12.875 -7.819 1.00 0.00 H new ATOM 0 HG23 THR A 525 24.414 -11.676 -9.134 1.00 0.00 H new ATOM 1182 N LEU A 526 21.654 -11.438 -6.557 1.00 0.00 N ATOM 1183 CA LEU A 526 20.726 -12.557 -6.329 1.00 0.00 C ATOM 1184 C LEU A 526 20.775 -13.486 -7.548 1.00 0.00 C ATOM 1185 O LEU A 526 20.951 -13.025 -8.671 1.00 0.00 O ATOM 1186 CB LEU A 526 19.274 -12.064 -6.062 1.00 0.00 C ATOM 1187 CG LEU A 526 19.059 -11.212 -4.767 1.00 0.00 C ATOM 1188 CD1 LEU A 526 17.568 -10.870 -4.558 1.00 0.00 C ATOM 1189 CD2 LEU A 526 19.670 -11.892 -3.517 1.00 0.00 C ATOM 0 H LEU A 526 21.233 -10.645 -7.040 1.00 0.00 H new ATOM 0 HA LEU A 526 21.036 -13.098 -5.435 1.00 0.00 H new ATOM 0 HB2 LEU A 526 18.950 -11.473 -6.918 1.00 0.00 H new ATOM 0 HB3 LEU A 526 18.621 -12.935 -6.011 1.00 0.00 H new ATOM 0 HG LEU A 526 19.594 -10.273 -4.909 1.00 0.00 H new ATOM 0 HD11 LEU A 526 17.454 -10.278 -3.650 1.00 0.00 H new ATOM 0 HD12 LEU A 526 17.203 -10.299 -5.412 1.00 0.00 H new ATOM 0 HD13 LEU A 526 16.993 -11.791 -4.465 1.00 0.00 H new ATOM 0 HD21 LEU A 526 19.498 -11.266 -2.641 1.00 0.00 H new ATOM 0 HD22 LEU A 526 19.201 -12.864 -3.366 1.00 0.00 H new ATOM 0 HD23 LEU A 526 20.742 -12.025 -3.663 1.00 0.00 H new ATOM 1201 N VAL A 527 20.657 -14.793 -7.309 1.00 0.00 N ATOM 1202 CA VAL A 527 20.710 -15.822 -8.360 1.00 0.00 C ATOM 1203 C VAL A 527 19.396 -16.616 -8.348 1.00 0.00 C ATOM 1204 O VAL A 527 19.022 -17.191 -7.316 1.00 0.00 O ATOM 1205 CB VAL A 527 21.964 -16.764 -8.152 1.00 0.00 C ATOM 1206 CG1 VAL A 527 21.913 -18.023 -9.054 1.00 0.00 C ATOM 1207 CG2 VAL A 527 23.279 -15.971 -8.386 1.00 0.00 C ATOM 0 H VAL A 527 20.521 -15.175 -6.373 1.00 0.00 H new ATOM 0 HA VAL A 527 20.823 -15.349 -9.336 1.00 0.00 H new ATOM 0 HB VAL A 527 21.939 -17.114 -7.120 1.00 0.00 H new ATOM 0 HG11 VAL A 527 22.796 -18.636 -8.873 1.00 0.00 H new ATOM 0 HG12 VAL A 527 21.017 -18.600 -8.823 1.00 0.00 H new ATOM 0 HG13 VAL A 527 21.890 -17.720 -10.101 1.00 0.00 H new ATOM 0 HG21 VAL A 527 24.133 -16.632 -8.239 1.00 0.00 H new ATOM 0 HG22 VAL A 527 23.292 -15.581 -9.404 1.00 0.00 H new ATOM 0 HG23 VAL A 527 23.335 -15.143 -7.679 1.00 0.00 H new ATOM 1217 N TRP A 528 18.681 -16.604 -9.491 1.00 0.00 N ATOM 1218 CA TRP A 528 17.438 -17.365 -9.672 1.00 0.00 C ATOM 1219 C TRP A 528 17.803 -18.846 -9.860 1.00 0.00 C ATOM 1220 O TRP A 528 18.161 -19.272 -10.965 1.00 0.00 O ATOM 1221 CB TRP A 528 16.606 -16.816 -10.880 1.00 0.00 C ATOM 1222 CG TRP A 528 15.191 -17.387 -11.018 1.00 0.00 C ATOM 1223 CD1 TRP A 528 14.593 -18.363 -10.252 1.00 0.00 C ATOM 1224 CD2 TRP A 528 14.196 -16.986 -11.974 1.00 0.00 C ATOM 1225 NE1 TRP A 528 13.321 -18.598 -10.690 1.00 0.00 N ATOM 1226 CE2 TRP A 528 13.048 -17.768 -11.738 1.00 0.00 C ATOM 1227 CE3 TRP A 528 14.168 -16.052 -13.009 1.00 0.00 C ATOM 1228 CZ2 TRP A 528 11.889 -17.638 -12.496 1.00 0.00 C ATOM 1229 CZ3 TRP A 528 13.018 -15.920 -13.759 1.00 0.00 C ATOM 1230 CH2 TRP A 528 11.891 -16.711 -13.502 1.00 0.00 C ATOM 0 H TRP A 528 18.953 -16.064 -10.313 1.00 0.00 H new ATOM 0 HA TRP A 528 16.806 -17.256 -8.791 1.00 0.00 H new ATOM 0 HB2 TRP A 528 16.535 -15.732 -10.787 1.00 0.00 H new ATOM 0 HB3 TRP A 528 17.154 -17.022 -11.800 1.00 0.00 H new ATOM 0 HD1 TRP A 528 15.063 -18.870 -9.423 1.00 0.00 H new ATOM 0 HE1 TRP A 528 12.678 -19.285 -10.296 1.00 0.00 H new ATOM 0 HE3 TRP A 528 15.033 -15.441 -13.220 1.00 0.00 H new ATOM 0 HZ2 TRP A 528 11.019 -18.247 -12.298 1.00 0.00 H new ATOM 0 HZ3 TRP A 528 12.986 -15.194 -14.558 1.00 0.00 H new ATOM 0 HH2 TRP A 528 11.007 -16.587 -14.110 1.00 0.00 H new ATOM 1241 N LYS A 529 17.739 -19.603 -8.753 1.00 0.00 N ATOM 1242 CA LYS A 529 18.029 -21.044 -8.730 1.00 0.00 C ATOM 1243 C LYS A 529 16.965 -21.818 -9.536 1.00 0.00 C ATOM 1244 O LYS A 529 15.768 -21.529 -9.429 1.00 0.00 O ATOM 1245 CB LYS A 529 18.087 -21.550 -7.260 1.00 0.00 C ATOM 1246 CG LYS A 529 18.371 -23.061 -7.095 1.00 0.00 C ATOM 1247 CD LYS A 529 19.765 -23.468 -7.630 1.00 0.00 C ATOM 1248 CE LYS A 529 19.991 -24.991 -7.613 1.00 0.00 C ATOM 1249 NZ LYS A 529 21.372 -25.355 -8.026 1.00 0.00 N ATOM 0 H LYS A 529 17.482 -19.227 -7.840 1.00 0.00 H new ATOM 0 HA LYS A 529 18.999 -21.219 -9.195 1.00 0.00 H new ATOM 0 HB2 LYS A 529 18.859 -20.992 -6.730 1.00 0.00 H new ATOM 0 HB3 LYS A 529 17.138 -21.320 -6.776 1.00 0.00 H new ATOM 0 HG2 LYS A 529 18.299 -23.327 -6.040 1.00 0.00 H new ATOM 0 HG3 LYS A 529 17.604 -23.630 -7.620 1.00 0.00 H new ATOM 0 HD2 LYS A 529 19.879 -23.100 -8.650 1.00 0.00 H new ATOM 0 HD3 LYS A 529 20.535 -22.985 -7.029 1.00 0.00 H new ATOM 0 HE2 LYS A 529 19.800 -25.374 -6.611 1.00 0.00 H new ATOM 0 HE3 LYS A 529 19.275 -25.471 -8.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 21.481 -26.389 -8.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 21.547 -25.012 -8.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 22.055 -24.919 -7.375 1.00 0.00 H new ATOM 1263 N GLY A 530 17.426 -22.787 -10.352 1.00 0.00 N ATOM 1264 CA GLY A 530 16.539 -23.618 -11.177 1.00 0.00 C ATOM 1265 C GLY A 530 16.250 -23.015 -12.551 1.00 0.00 C ATOM 1266 O GLY A 530 15.601 -23.658 -13.388 1.00 0.00 O ATOM 0 H GLY A 530 18.416 -23.011 -10.454 1.00 0.00 H new ATOM 0 HA2 GLY A 530 16.991 -24.601 -11.307 1.00 0.00 H new ATOM 0 HA3 GLY A 530 15.598 -23.768 -10.648 1.00 0.00 H new ATOM 1270 N GLN A 531 16.743 -21.786 -12.786 1.00 0.00 N ATOM 1271 CA GLN A 531 16.561 -21.062 -14.058 1.00 0.00 C ATOM 1272 C GLN A 531 17.937 -20.934 -14.734 1.00 0.00 C ATOM 1273 O GLN A 531 18.819 -20.258 -14.204 1.00 0.00 O ATOM 1274 CB GLN A 531 15.945 -19.663 -13.784 1.00 0.00 C ATOM 1275 CG GLN A 531 15.345 -18.947 -15.013 1.00 0.00 C ATOM 1276 CD GLN A 531 14.004 -19.527 -15.485 1.00 0.00 C ATOM 1277 OE1 GLN A 531 13.225 -20.063 -14.692 1.00 0.00 O ATOM 1278 NE2 GLN A 531 13.714 -19.410 -16.770 1.00 0.00 N ATOM 0 H GLN A 531 17.282 -21.264 -12.095 1.00 0.00 H new ATOM 0 HA GLN A 531 15.880 -21.603 -14.715 1.00 0.00 H new ATOM 0 HB2 GLN A 531 15.164 -19.771 -13.031 1.00 0.00 H new ATOM 0 HB3 GLN A 531 16.716 -19.024 -13.354 1.00 0.00 H new ATOM 0 HG2 GLN A 531 15.208 -17.892 -14.774 1.00 0.00 H new ATOM 0 HG3 GLN A 531 16.060 -18.998 -15.834 1.00 0.00 H new ATOM 0 HE21 GLN A 531 14.376 -18.962 -17.404 1.00 0.00 H new ATOM 0 HE22 GLN A 531 12.828 -19.767 -17.127 1.00 0.00 H new ATOM 1287 N SER A 532 18.117 -21.590 -15.889 1.00 0.00 N ATOM 1288 CA SER A 532 19.424 -21.690 -16.562 1.00 0.00 C ATOM 1289 C SER A 532 19.835 -20.356 -17.227 1.00 0.00 C ATOM 1290 O SER A 532 20.878 -19.787 -16.913 1.00 0.00 O ATOM 1291 CB SER A 532 19.389 -22.836 -17.599 1.00 0.00 C ATOM 1292 OG SER A 532 18.289 -22.690 -18.484 1.00 0.00 O ATOM 0 H SER A 532 17.363 -22.066 -16.384 1.00 0.00 H new ATOM 0 HA SER A 532 20.178 -21.912 -15.807 1.00 0.00 H new ATOM 0 HB2 SER A 532 20.319 -22.845 -18.168 1.00 0.00 H new ATOM 0 HB3 SER A 532 19.321 -23.794 -17.084 1.00 0.00 H new ATOM 0 HG SER A 532 18.290 -23.426 -19.131 1.00 0.00 H new ATOM 1298 N SER A 533 18.976 -19.853 -18.115 1.00 0.00 N ATOM 1299 CA SER A 533 19.300 -18.720 -19.002 1.00 0.00 C ATOM 1300 C SER A 533 18.442 -17.469 -18.691 1.00 0.00 C ATOM 1301 O SER A 533 18.474 -16.500 -19.453 1.00 0.00 O ATOM 1302 CB SER A 533 19.091 -19.201 -20.459 1.00 0.00 C ATOM 1303 OG SER A 533 17.742 -19.585 -20.693 1.00 0.00 O ATOM 0 H SER A 533 18.032 -20.217 -18.244 1.00 0.00 H new ATOM 0 HA SER A 533 20.334 -18.412 -18.844 1.00 0.00 H new ATOM 0 HB2 SER A 533 19.369 -18.405 -21.149 1.00 0.00 H new ATOM 0 HB3 SER A 533 19.751 -20.044 -20.663 1.00 0.00 H new ATOM 0 HG SER A 533 17.643 -19.882 -21.622 1.00 0.00 H new ATOM 1309 N TRP A 534 17.686 -17.501 -17.559 1.00 0.00 N ATOM 1310 CA TRP A 534 16.703 -16.436 -17.164 1.00 0.00 C ATOM 1311 C TRP A 534 15.612 -16.274 -18.250 1.00 0.00 C ATOM 1312 O TRP A 534 14.969 -15.226 -18.335 1.00 0.00 O ATOM 1313 CB TRP A 534 17.419 -15.064 -16.852 1.00 0.00 C ATOM 1314 CG TRP A 534 17.020 -14.388 -15.552 1.00 0.00 C ATOM 1315 CD1 TRP A 534 17.693 -14.463 -14.374 1.00 0.00 C ATOM 1316 CD2 TRP A 534 15.882 -13.539 -15.293 1.00 0.00 C ATOM 1317 NE1 TRP A 534 17.069 -13.733 -13.411 1.00 0.00 N ATOM 1318 CE2 TRP A 534 15.955 -13.150 -13.944 1.00 0.00 C ATOM 1319 CE3 TRP A 534 14.814 -13.071 -16.060 1.00 0.00 C ATOM 1320 CZ2 TRP A 534 15.013 -12.319 -13.349 1.00 0.00 C ATOM 1321 CZ3 TRP A 534 13.878 -12.246 -15.473 1.00 0.00 C ATOM 1322 CH2 TRP A 534 13.981 -11.878 -14.128 1.00 0.00 C ATOM 0 H TRP A 534 17.737 -18.267 -16.887 1.00 0.00 H new ATOM 0 HA TRP A 534 16.218 -16.755 -16.241 1.00 0.00 H new ATOM 0 HB2 TRP A 534 18.496 -15.234 -16.835 1.00 0.00 H new ATOM 0 HB3 TRP A 534 17.218 -14.376 -17.673 1.00 0.00 H new ATOM 0 HD1 TRP A 534 18.602 -15.027 -14.223 1.00 0.00 H new ATOM 0 HE1 TRP A 534 17.383 -13.636 -12.445 1.00 0.00 H new ATOM 0 HE3 TRP A 534 14.722 -13.351 -17.099 1.00 0.00 H new ATOM 0 HZ2 TRP A 534 15.094 -12.033 -12.311 1.00 0.00 H new ATOM 0 HZ3 TRP A 534 13.051 -11.878 -16.062 1.00 0.00 H new ATOM 0 HH2 TRP A 534 13.230 -11.233 -13.697 1.00 0.00 H new ATOM 1333 N GLY A 535 15.394 -17.341 -19.048 1.00 0.00 N ATOM 1334 CA GLY A 535 14.470 -17.293 -20.181 1.00 0.00 C ATOM 1335 C GLY A 535 14.936 -16.302 -21.248 1.00 0.00 C ATOM 1336 O GLY A 535 14.362 -15.211 -21.388 1.00 0.00 O ATOM 0 H GLY A 535 15.851 -18.244 -18.921 1.00 0.00 H new ATOM 0 HA2 GLY A 535 14.381 -18.286 -20.621 1.00 0.00 H new ATOM 0 HA3 GLY A 535 13.478 -17.010 -19.830 1.00 0.00 H new ATOM 1340 N THR A 536 16.021 -16.668 -21.959 1.00 0.00 N ATOM 1341 CA THR A 536 16.617 -15.835 -23.017 1.00 0.00 C ATOM 1342 C THR A 536 15.617 -15.544 -24.153 1.00 0.00 C ATOM 1343 O THR A 536 14.961 -16.449 -24.677 1.00 0.00 O ATOM 1344 CB THR A 536 17.900 -16.503 -23.620 1.00 0.00 C ATOM 1345 OG1 THR A 536 17.630 -17.882 -23.908 1.00 0.00 O ATOM 1346 CG2 THR A 536 19.119 -16.400 -22.692 1.00 0.00 C ATOM 0 H THR A 536 16.508 -17.552 -21.814 1.00 0.00 H new ATOM 0 HA THR A 536 16.893 -14.893 -22.544 1.00 0.00 H new ATOM 0 HB THR A 536 18.147 -15.961 -24.533 1.00 0.00 H new ATOM 0 HG1 THR A 536 18.431 -18.300 -24.287 1.00 0.00 H new ATOM 0 HG21 THR A 536 19.977 -16.880 -23.163 1.00 0.00 H new ATOM 0 HG22 THR A 536 19.347 -15.350 -22.506 1.00 0.00 H new ATOM 0 HG23 THR A 536 18.900 -16.896 -21.747 1.00 0.00 H new ATOM 1354 N GLY A 537 15.516 -14.265 -24.490 1.00 0.00 N ATOM 1355 CA GLY A 537 14.799 -13.796 -25.662 1.00 0.00 C ATOM 1356 C GLY A 537 15.603 -12.720 -26.366 1.00 0.00 C ATOM 1357 O GLY A 537 16.452 -12.075 -25.737 1.00 0.00 O ATOM 0 H GLY A 537 15.939 -13.513 -23.945 1.00 0.00 H new ATOM 0 HA2 GLY A 537 14.615 -14.627 -26.342 1.00 0.00 H new ATOM 0 HA3 GLY A 537 13.826 -13.402 -25.369 1.00 0.00 H new ATOM 1361 N GLU A 538 15.383 -12.544 -27.670 1.00 0.00 N ATOM 1362 CA GLU A 538 15.999 -11.438 -28.422 1.00 0.00 C ATOM 1363 C GLU A 538 15.299 -10.124 -28.025 1.00 0.00 C ATOM 1364 O GLU A 538 15.916 -9.214 -27.467 1.00 0.00 O ATOM 1365 CB GLU A 538 15.886 -11.719 -29.944 1.00 0.00 C ATOM 1366 CG GLU A 538 16.421 -10.608 -30.865 1.00 0.00 C ATOM 1367 CD GLU A 538 16.331 -10.972 -32.356 1.00 0.00 C ATOM 1368 OE1 GLU A 538 15.228 -10.865 -32.940 1.00 0.00 O ATOM 1369 OE2 GLU A 538 17.361 -11.361 -32.951 1.00 0.00 O ATOM 0 H GLU A 538 14.784 -13.150 -28.231 1.00 0.00 H new ATOM 0 HA GLU A 538 17.059 -11.349 -28.184 1.00 0.00 H new ATOM 0 HB2 GLU A 538 16.423 -12.641 -30.166 1.00 0.00 H new ATOM 0 HB3 GLU A 538 14.838 -11.894 -30.186 1.00 0.00 H new ATOM 0 HG2 GLU A 538 15.859 -9.692 -30.685 1.00 0.00 H new ATOM 0 HG3 GLU A 538 17.460 -10.400 -30.609 1.00 0.00 H new ATOM 1376 N SER A 539 13.991 -10.077 -28.282 1.00 0.00 N ATOM 1377 CA SER A 539 13.120 -8.959 -27.908 1.00 0.00 C ATOM 1378 C SER A 539 12.224 -9.392 -26.733 1.00 0.00 C ATOM 1379 O SER A 539 11.553 -10.432 -26.818 1.00 0.00 O ATOM 1380 CB SER A 539 12.267 -8.549 -29.135 1.00 0.00 C ATOM 1381 OG SER A 539 13.079 -8.426 -30.299 1.00 0.00 O ATOM 0 H SER A 539 13.497 -10.828 -28.765 1.00 0.00 H new ATOM 0 HA SER A 539 13.713 -8.100 -27.595 1.00 0.00 H new ATOM 0 HB2 SER A 539 11.488 -9.292 -29.307 1.00 0.00 H new ATOM 0 HB3 SER A 539 11.765 -7.602 -28.935 1.00 0.00 H new ATOM 0 HG SER A 539 12.520 -8.168 -31.062 1.00 0.00 H new ATOM 1387 N PHE A 540 12.252 -8.624 -25.628 1.00 0.00 N ATOM 1388 CA PHE A 540 11.366 -8.845 -24.474 1.00 0.00 C ATOM 1389 C PHE A 540 11.075 -7.537 -23.715 1.00 0.00 C ATOM 1390 O PHE A 540 11.921 -6.635 -23.625 1.00 0.00 O ATOM 1391 CB PHE A 540 11.907 -9.963 -23.522 1.00 0.00 C ATOM 1392 CG PHE A 540 13.368 -9.868 -23.061 1.00 0.00 C ATOM 1393 CD1 PHE A 540 13.800 -8.862 -22.204 1.00 0.00 C ATOM 1394 CD2 PHE A 540 14.305 -10.833 -23.445 1.00 0.00 C ATOM 1395 CE1 PHE A 540 15.103 -8.817 -21.755 1.00 0.00 C ATOM 1396 CE2 PHE A 540 15.616 -10.779 -22.998 1.00 0.00 C ATOM 1397 CZ PHE A 540 16.014 -9.772 -22.152 1.00 0.00 C ATOM 0 H PHE A 540 12.888 -7.835 -25.512 1.00 0.00 H new ATOM 0 HA PHE A 540 10.416 -9.202 -24.871 1.00 0.00 H new ATOM 0 HB2 PHE A 540 11.276 -9.980 -22.633 1.00 0.00 H new ATOM 0 HB3 PHE A 540 11.776 -10.922 -24.024 1.00 0.00 H new ATOM 0 HD1 PHE A 540 13.102 -8.102 -21.884 1.00 0.00 H new ATOM 0 HD2 PHE A 540 14.001 -11.635 -24.102 1.00 0.00 H new ATOM 0 HE1 PHE A 540 15.412 -8.027 -21.087 1.00 0.00 H new ATOM 0 HE2 PHE A 540 16.325 -11.529 -23.315 1.00 0.00 H new ATOM 0 HZ PHE A 540 17.034 -9.729 -21.800 1.00 0.00 H new ATOM 1407 N ARG A 541 9.842 -7.456 -23.200 1.00 0.00 N ATOM 1408 CA ARG A 541 9.366 -6.371 -22.343 1.00 0.00 C ATOM 1409 C ARG A 541 9.491 -6.818 -20.876 1.00 0.00 C ATOM 1410 O ARG A 541 8.692 -7.628 -20.392 1.00 0.00 O ATOM 1411 CB ARG A 541 7.895 -6.011 -22.743 1.00 0.00 C ATOM 1412 CG ARG A 541 7.255 -4.788 -22.015 1.00 0.00 C ATOM 1413 CD ARG A 541 6.345 -5.171 -20.829 1.00 0.00 C ATOM 1414 NE ARG A 541 5.151 -5.942 -21.242 1.00 0.00 N ATOM 1415 CZ ARG A 541 4.065 -6.162 -20.475 1.00 0.00 C ATOM 1416 NH1 ARG A 541 3.987 -5.689 -19.238 1.00 0.00 N ATOM 1417 NH2 ARG A 541 3.053 -6.850 -20.958 1.00 0.00 N ATOM 0 H ARG A 541 9.130 -8.165 -23.375 1.00 0.00 H new ATOM 0 HA ARG A 541 9.964 -5.469 -22.469 1.00 0.00 H new ATOM 0 HB2 ARG A 541 7.870 -5.821 -23.816 1.00 0.00 H new ATOM 0 HB3 ARG A 541 7.268 -6.884 -22.559 1.00 0.00 H new ATOM 0 HG2 ARG A 541 8.050 -4.136 -21.654 1.00 0.00 H new ATOM 0 HG3 ARG A 541 6.673 -4.213 -22.735 1.00 0.00 H new ATOM 0 HD2 ARG A 541 6.919 -5.758 -20.112 1.00 0.00 H new ATOM 0 HD3 ARG A 541 6.025 -4.264 -20.316 1.00 0.00 H new ATOM 0 HE ARG A 541 5.150 -6.338 -22.182 1.00 0.00 H new ATOM 0 HH11 ARG A 541 4.759 -5.147 -18.850 1.00 0.00 H new ATOM 0 HH12 ARG A 541 3.155 -5.868 -18.675 1.00 0.00 H new ATOM 0 HH21 ARG A 541 3.092 -7.215 -21.910 1.00 0.00 H new ATOM 0 HH22 ARG A 541 2.229 -7.019 -20.381 1.00 0.00 H new ATOM 1431 N THR A 542 10.539 -6.321 -20.195 1.00 0.00 N ATOM 1432 CA THR A 542 10.819 -6.645 -18.783 1.00 0.00 C ATOM 1433 C THR A 542 10.034 -5.680 -17.877 1.00 0.00 C ATOM 1434 O THR A 542 9.906 -4.494 -18.185 1.00 0.00 O ATOM 1435 CB THR A 542 12.354 -6.563 -18.480 1.00 0.00 C ATOM 1436 OG1 THR A 542 13.071 -7.409 -19.395 1.00 0.00 O ATOM 1437 CG2 THR A 542 12.706 -6.968 -17.027 1.00 0.00 C ATOM 0 H THR A 542 11.218 -5.682 -20.609 1.00 0.00 H new ATOM 0 HA THR A 542 10.500 -7.668 -18.584 1.00 0.00 H new ATOM 0 HB THR A 542 12.647 -5.521 -18.605 1.00 0.00 H new ATOM 0 HG1 THR A 542 14.031 -7.356 -19.206 1.00 0.00 H new ATOM 0 HG21 THR A 542 13.783 -6.891 -16.879 1.00 0.00 H new ATOM 0 HG22 THR A 542 12.195 -6.304 -16.330 1.00 0.00 H new ATOM 0 HG23 THR A 542 12.388 -7.995 -16.848 1.00 0.00 H new ATOM 1445 N VAL A 543 9.490 -6.219 -16.778 1.00 0.00 N ATOM 1446 CA VAL A 543 8.620 -5.494 -15.837 1.00 0.00 C ATOM 1447 C VAL A 543 9.067 -5.783 -14.392 1.00 0.00 C ATOM 1448 O VAL A 543 9.539 -6.876 -14.100 1.00 0.00 O ATOM 1449 CB VAL A 543 7.116 -5.946 -15.987 1.00 0.00 C ATOM 1450 CG1 VAL A 543 6.175 -5.113 -15.098 1.00 0.00 C ATOM 1451 CG2 VAL A 543 6.642 -5.924 -17.448 1.00 0.00 C ATOM 0 H VAL A 543 9.644 -7.191 -16.511 1.00 0.00 H new ATOM 0 HA VAL A 543 8.699 -4.430 -16.062 1.00 0.00 H new ATOM 0 HB VAL A 543 7.075 -6.980 -15.645 1.00 0.00 H new ATOM 0 HG11 VAL A 543 5.149 -5.457 -15.232 1.00 0.00 H new ATOM 0 HG12 VAL A 543 6.464 -5.229 -14.053 1.00 0.00 H new ATOM 0 HG13 VAL A 543 6.245 -4.062 -15.379 1.00 0.00 H new ATOM 0 HG21 VAL A 543 5.601 -6.243 -17.498 1.00 0.00 H new ATOM 0 HG22 VAL A 543 6.731 -4.912 -17.844 1.00 0.00 H new ATOM 0 HG23 VAL A 543 7.258 -6.601 -18.040 1.00 0.00 H new ATOM 1461 N LEU A 544 8.928 -4.793 -13.510 1.00 0.00 N ATOM 1462 CA LEU A 544 8.963 -4.986 -12.057 1.00 0.00 C ATOM 1463 C LEU A 544 7.558 -4.662 -11.517 1.00 0.00 C ATOM 1464 O LEU A 544 6.952 -3.660 -11.912 1.00 0.00 O ATOM 1465 CB LEU A 544 10.042 -4.089 -11.409 1.00 0.00 C ATOM 1466 CG LEU A 544 10.207 -4.204 -9.862 1.00 0.00 C ATOM 1467 CD1 LEU A 544 10.458 -5.666 -9.410 1.00 0.00 C ATOM 1468 CD2 LEU A 544 11.313 -3.251 -9.381 1.00 0.00 C ATOM 0 H LEU A 544 8.786 -3.821 -13.786 1.00 0.00 H new ATOM 0 HA LEU A 544 9.229 -6.014 -11.811 1.00 0.00 H new ATOM 0 HB2 LEU A 544 11.001 -4.320 -11.872 1.00 0.00 H new ATOM 0 HB3 LEU A 544 9.813 -3.051 -11.651 1.00 0.00 H new ATOM 0 HG LEU A 544 9.270 -3.903 -9.394 1.00 0.00 H new ATOM 0 HD11 LEU A 544 10.567 -5.698 -8.326 1.00 0.00 H new ATOM 0 HD12 LEU A 544 9.615 -6.289 -9.709 1.00 0.00 H new ATOM 0 HD13 LEU A 544 11.369 -6.040 -9.877 1.00 0.00 H new ATOM 0 HD21 LEU A 544 11.422 -3.337 -8.300 1.00 0.00 H new ATOM 0 HD22 LEU A 544 12.255 -3.514 -9.863 1.00 0.00 H new ATOM 0 HD23 LEU A 544 11.047 -2.226 -9.638 1.00 0.00 H new ATOM 1480 N VAL A 545 7.036 -5.540 -10.654 1.00 0.00 N ATOM 1481 CA VAL A 545 5.692 -5.425 -10.049 1.00 0.00 C ATOM 1482 C VAL A 545 5.844 -5.461 -8.524 1.00 0.00 C ATOM 1483 O VAL A 545 6.840 -5.981 -8.022 1.00 0.00 O ATOM 1484 CB VAL A 545 4.762 -6.603 -10.540 1.00 0.00 C ATOM 1485 CG1 VAL A 545 3.358 -6.571 -9.888 1.00 0.00 C ATOM 1486 CG2 VAL A 545 4.644 -6.601 -12.076 1.00 0.00 C ATOM 0 H VAL A 545 7.542 -6.370 -10.346 1.00 0.00 H new ATOM 0 HA VAL A 545 5.228 -4.487 -10.353 1.00 0.00 H new ATOM 0 HB VAL A 545 5.238 -7.530 -10.220 1.00 0.00 H new ATOM 0 HG11 VAL A 545 2.763 -7.404 -10.263 1.00 0.00 H new ATOM 0 HG12 VAL A 545 3.457 -6.655 -8.806 1.00 0.00 H new ATOM 0 HG13 VAL A 545 2.863 -5.632 -10.135 1.00 0.00 H new ATOM 0 HG21 VAL A 545 3.999 -7.421 -12.392 1.00 0.00 H new ATOM 0 HG22 VAL A 545 4.217 -5.654 -12.407 1.00 0.00 H new ATOM 0 HG23 VAL A 545 5.633 -6.727 -12.517 1.00 0.00 H new ATOM 1496 N ASN A 546 4.864 -4.897 -7.795 1.00 0.00 N ATOM 1497 CA ASN A 546 4.850 -4.891 -6.319 1.00 0.00 C ATOM 1498 C ASN A 546 3.611 -5.614 -5.755 1.00 0.00 C ATOM 1499 O ASN A 546 2.860 -6.262 -6.493 1.00 0.00 O ATOM 1500 CB ASN A 546 4.947 -3.435 -5.788 1.00 0.00 C ATOM 1501 CG ASN A 546 3.844 -2.504 -6.269 1.00 0.00 C ATOM 1502 OD1 ASN A 546 2.816 -2.327 -5.604 1.00 0.00 O ATOM 1503 ND2 ASN A 546 4.039 -1.943 -7.448 1.00 0.00 N ATOM 0 H ASN A 546 4.058 -4.432 -8.212 1.00 0.00 H new ATOM 0 HA ASN A 546 5.722 -5.445 -5.971 1.00 0.00 H new ATOM 0 HB2 ASN A 546 4.933 -3.459 -4.698 1.00 0.00 H new ATOM 0 HB3 ASN A 546 5.910 -3.019 -6.085 1.00 0.00 H new ATOM 0 HD21 ASN A 546 3.325 -1.334 -7.847 1.00 0.00 H new ATOM 0 HD22 ASN A 546 4.904 -2.119 -7.960 1.00 0.00 H new ATOM 1510 N ALA A 547 3.426 -5.469 -4.427 1.00 0.00 N ATOM 1511 CA ALA A 547 2.381 -6.148 -3.635 1.00 0.00 C ATOM 1512 C ALA A 547 0.948 -5.916 -4.166 1.00 0.00 C ATOM 1513 O ALA A 547 0.099 -6.811 -4.092 1.00 0.00 O ATOM 1514 CB ALA A 547 2.500 -5.679 -2.178 1.00 0.00 C ATOM 0 H ALA A 547 4.016 -4.859 -3.861 1.00 0.00 H new ATOM 0 HA ALA A 547 2.547 -7.222 -3.716 1.00 0.00 H new ATOM 0 HB1 ALA A 547 1.736 -6.169 -1.574 1.00 0.00 H new ATOM 0 HB2 ALA A 547 3.487 -5.936 -1.793 1.00 0.00 H new ATOM 0 HB3 ALA A 547 2.362 -4.599 -2.131 1.00 0.00 H new ATOM 1520 N ASP A 548 0.702 -4.714 -4.701 1.00 0.00 N ATOM 1521 CA ASP A 548 -0.627 -4.307 -5.218 1.00 0.00 C ATOM 1522 C ASP A 548 -1.031 -5.107 -6.477 1.00 0.00 C ATOM 1523 O ASP A 548 -2.207 -5.464 -6.656 1.00 0.00 O ATOM 1524 CB ASP A 548 -0.595 -2.799 -5.530 1.00 0.00 C ATOM 1525 CG ASP A 548 -1.915 -2.240 -6.105 1.00 0.00 C ATOM 1526 OD1 ASP A 548 -2.796 -1.819 -5.314 1.00 0.00 O ATOM 1527 OD2 ASP A 548 -2.075 -2.202 -7.348 1.00 0.00 O ATOM 0 H ASP A 548 1.414 -3.989 -4.792 1.00 0.00 H new ATOM 0 HA ASP A 548 -1.375 -4.520 -4.455 1.00 0.00 H new ATOM 0 HB2 ASP A 548 -0.352 -2.256 -4.617 1.00 0.00 H new ATOM 0 HB3 ASP A 548 0.208 -2.604 -6.240 1.00 0.00 H new ATOM 1532 N GLY A 549 -0.037 -5.383 -7.340 1.00 0.00 N ATOM 1533 CA GLY A 549 -0.268 -6.015 -8.649 1.00 0.00 C ATOM 1534 C GLY A 549 -0.012 -5.049 -9.807 1.00 0.00 C ATOM 1535 O GLY A 549 0.126 -5.479 -10.960 1.00 0.00 O ATOM 0 H GLY A 549 0.943 -5.175 -7.150 1.00 0.00 H new ATOM 0 HA2 GLY A 549 0.382 -6.884 -8.752 1.00 0.00 H new ATOM 0 HA3 GLY A 549 -1.295 -6.378 -8.700 1.00 0.00 H new ATOM 1539 N GLU A 550 0.045 -3.741 -9.489 1.00 0.00 N ATOM 1540 CA GLU A 550 0.438 -2.679 -10.447 1.00 0.00 C ATOM 1541 C GLU A 550 1.895 -2.893 -10.918 1.00 0.00 C ATOM 1542 O GLU A 550 2.785 -3.229 -10.114 1.00 0.00 O ATOM 1543 CB GLU A 550 0.285 -1.269 -9.792 1.00 0.00 C ATOM 1544 CG GLU A 550 1.043 -1.141 -8.468 1.00 0.00 C ATOM 1545 CD GLU A 550 0.985 0.246 -7.812 1.00 0.00 C ATOM 1546 OE1 GLU A 550 -0.056 0.592 -7.212 1.00 0.00 O ATOM 1547 OE2 GLU A 550 1.990 0.990 -7.863 1.00 0.00 O ATOM 0 H GLU A 550 -0.180 -3.386 -8.559 1.00 0.00 H new ATOM 0 HA GLU A 550 -0.222 -2.734 -11.313 1.00 0.00 H new ATOM 0 HB2 GLU A 550 0.646 -0.510 -10.486 1.00 0.00 H new ATOM 0 HB3 GLU A 550 -0.772 -1.067 -9.621 1.00 0.00 H new ATOM 0 HG2 GLU A 550 0.643 -1.874 -7.767 1.00 0.00 H new ATOM 0 HG3 GLU A 550 2.088 -1.401 -8.639 1.00 0.00 H new ATOM 1554 N GLU A 551 2.118 -2.704 -12.226 1.00 0.00 N ATOM 1555 CA GLU A 551 3.441 -2.820 -12.855 1.00 0.00 C ATOM 1556 C GLU A 551 4.230 -1.512 -12.642 1.00 0.00 C ATOM 1557 O GLU A 551 4.164 -0.577 -13.455 1.00 0.00 O ATOM 1558 CB GLU A 551 3.266 -3.173 -14.355 1.00 0.00 C ATOM 1559 CG GLU A 551 2.486 -4.489 -14.600 1.00 0.00 C ATOM 1560 CD GLU A 551 2.378 -4.889 -16.083 1.00 0.00 C ATOM 1561 OE1 GLU A 551 1.654 -4.205 -16.837 1.00 0.00 O ATOM 1562 OE2 GLU A 551 3.001 -5.898 -16.494 1.00 0.00 O ATOM 0 H GLU A 551 1.377 -2.464 -12.884 1.00 0.00 H new ATOM 0 HA GLU A 551 4.017 -3.623 -12.395 1.00 0.00 H new ATOM 0 HB2 GLU A 551 2.746 -2.355 -14.853 1.00 0.00 H new ATOM 0 HB3 GLU A 551 4.250 -3.253 -14.817 1.00 0.00 H new ATOM 0 HG2 GLU A 551 2.974 -5.295 -14.052 1.00 0.00 H new ATOM 0 HG3 GLU A 551 1.482 -4.386 -14.189 1.00 0.00 H new ATOM 1569 N VAL A 552 4.939 -1.462 -11.493 1.00 0.00 N ATOM 1570 CA VAL A 552 5.604 -0.246 -10.973 1.00 0.00 C ATOM 1571 C VAL A 552 6.732 0.260 -11.901 1.00 0.00 C ATOM 1572 O VAL A 552 6.929 1.474 -12.046 1.00 0.00 O ATOM 1573 CB VAL A 552 6.149 -0.484 -9.507 1.00 0.00 C ATOM 1574 CG1 VAL A 552 7.125 -1.684 -9.429 1.00 0.00 C ATOM 1575 CG2 VAL A 552 6.793 0.786 -8.904 1.00 0.00 C ATOM 0 H VAL A 552 5.067 -2.276 -10.892 1.00 0.00 H new ATOM 0 HA VAL A 552 4.846 0.536 -10.943 1.00 0.00 H new ATOM 0 HB VAL A 552 5.276 -0.729 -8.902 1.00 0.00 H new ATOM 0 HG11 VAL A 552 7.471 -1.806 -8.402 1.00 0.00 H new ATOM 0 HG12 VAL A 552 6.613 -2.591 -9.749 1.00 0.00 H new ATOM 0 HG13 VAL A 552 7.980 -1.501 -10.080 1.00 0.00 H new ATOM 0 HG21 VAL A 552 7.151 0.570 -7.897 1.00 0.00 H new ATOM 0 HG22 VAL A 552 7.630 1.100 -9.527 1.00 0.00 H new ATOM 0 HG23 VAL A 552 6.052 1.585 -8.862 1.00 0.00 H new ATOM 1585 N ALA A 553 7.451 -0.673 -12.528 1.00 0.00 N ATOM 1586 CA ALA A 553 8.515 -0.364 -13.499 1.00 0.00 C ATOM 1587 C ALA A 553 8.337 -1.251 -14.735 1.00 0.00 C ATOM 1588 O ALA A 553 7.812 -2.361 -14.632 1.00 0.00 O ATOM 1589 CB ALA A 553 9.906 -0.548 -12.861 1.00 0.00 C ATOM 0 H ALA A 553 7.314 -1.673 -12.379 1.00 0.00 H new ATOM 0 HA ALA A 553 8.441 0.680 -13.805 1.00 0.00 H new ATOM 0 HB1 ALA A 553 10.677 -0.315 -13.595 1.00 0.00 H new ATOM 0 HB2 ALA A 553 10.005 0.120 -12.006 1.00 0.00 H new ATOM 0 HB3 ALA A 553 10.021 -1.580 -12.530 1.00 0.00 H new ATOM 1595 N MET A 554 8.769 -0.741 -15.893 1.00 0.00 N ATOM 1596 CA MET A 554 8.603 -1.416 -17.188 1.00 0.00 C ATOM 1597 C MET A 554 9.579 -0.820 -18.208 1.00 0.00 C ATOM 1598 O MET A 554 9.548 0.386 -18.470 1.00 0.00 O ATOM 1599 CB MET A 554 7.140 -1.259 -17.689 1.00 0.00 C ATOM 1600 CG MET A 554 6.843 -1.916 -19.047 1.00 0.00 C ATOM 1601 SD MET A 554 5.123 -1.697 -19.571 1.00 0.00 S ATOM 1602 CE MET A 554 4.228 -2.534 -18.259 1.00 0.00 C ATOM 0 H MET A 554 9.247 0.158 -15.960 1.00 0.00 H new ATOM 0 HA MET A 554 8.817 -2.478 -17.068 1.00 0.00 H new ATOM 0 HB2 MET A 554 6.469 -1.684 -16.943 1.00 0.00 H new ATOM 0 HB3 MET A 554 6.908 -0.196 -17.758 1.00 0.00 H new ATOM 0 HG2 MET A 554 7.505 -1.493 -19.803 1.00 0.00 H new ATOM 0 HG3 MET A 554 7.067 -2.981 -18.987 1.00 0.00 H new ATOM 0 HE1 MET A 554 3.366 -3.052 -18.679 1.00 0.00 H new ATOM 0 HE2 MET A 554 4.884 -3.257 -17.775 1.00 0.00 H new ATOM 0 HE3 MET A 554 3.890 -1.802 -17.525 1.00 0.00 H new ATOM 1612 N ARG A 555 10.441 -1.675 -18.773 1.00 0.00 N ATOM 1613 CA ARG A 555 11.379 -1.290 -19.830 1.00 0.00 C ATOM 1614 C ARG A 555 11.431 -2.402 -20.895 1.00 0.00 C ATOM 1615 O ARG A 555 11.783 -3.554 -20.601 1.00 0.00 O ATOM 1616 CB ARG A 555 12.784 -0.972 -19.224 1.00 0.00 C ATOM 1617 CG ARG A 555 13.774 -0.260 -20.192 1.00 0.00 C ATOM 1618 CD ARG A 555 14.627 -1.218 -21.044 1.00 0.00 C ATOM 1619 NE ARG A 555 15.187 -0.543 -22.224 1.00 0.00 N ATOM 1620 CZ ARG A 555 16.438 -0.661 -22.690 1.00 0.00 C ATOM 1621 NH1 ARG A 555 17.374 -1.334 -22.016 1.00 0.00 N ATOM 1622 NH2 ARG A 555 16.748 -0.074 -23.831 1.00 0.00 N ATOM 0 H ARG A 555 10.506 -2.658 -18.507 1.00 0.00 H new ATOM 0 HA ARG A 555 11.037 -0.377 -20.318 1.00 0.00 H new ATOM 0 HB2 ARG A 555 12.649 -0.346 -18.342 1.00 0.00 H new ATOM 0 HB3 ARG A 555 13.237 -1.904 -18.887 1.00 0.00 H new ATOM 0 HG2 ARG A 555 13.208 0.392 -20.857 1.00 0.00 H new ATOM 0 HG3 ARG A 555 14.438 0.378 -19.609 1.00 0.00 H new ATOM 0 HD2 ARG A 555 15.437 -1.622 -20.437 1.00 0.00 H new ATOM 0 HD3 ARG A 555 14.017 -2.063 -21.363 1.00 0.00 H new ATOM 0 HE ARG A 555 14.561 0.076 -22.739 1.00 0.00 H new ATOM 0 HH11 ARG A 555 17.144 -1.773 -21.125 1.00 0.00 H new ATOM 0 HH12 ARG A 555 18.319 -1.409 -22.393 1.00 0.00 H new ATOM 0 HH21 ARG A 555 16.041 0.457 -24.340 1.00 0.00 H new ATOM 0 HH22 ARG A 555 17.694 -0.151 -24.204 1.00 0.00 H new ATOM 1636 N THR A 556 11.048 -2.038 -22.129 1.00 0.00 N ATOM 1637 CA THR A 556 11.133 -2.909 -23.302 1.00 0.00 C ATOM 1638 C THR A 556 12.538 -2.788 -23.925 1.00 0.00 C ATOM 1639 O THR A 556 13.104 -1.690 -23.976 1.00 0.00 O ATOM 1640 CB THR A 556 10.040 -2.529 -24.362 1.00 0.00 C ATOM 1641 OG1 THR A 556 8.742 -2.491 -23.737 1.00 0.00 O ATOM 1642 CG2 THR A 556 10.008 -3.519 -25.547 1.00 0.00 C ATOM 0 H THR A 556 10.666 -1.116 -22.338 1.00 0.00 H new ATOM 0 HA THR A 556 10.957 -3.938 -22.989 1.00 0.00 H new ATOM 0 HB THR A 556 10.298 -1.545 -24.754 1.00 0.00 H new ATOM 0 HG1 THR A 556 8.065 -2.252 -24.404 1.00 0.00 H new ATOM 0 HG21 THR A 556 9.236 -3.215 -26.254 1.00 0.00 H new ATOM 0 HG22 THR A 556 10.977 -3.521 -26.046 1.00 0.00 H new ATOM 0 HG23 THR A 556 9.788 -4.521 -25.178 1.00 0.00 H new ATOM 1650 N VAL A 557 13.090 -3.916 -24.377 1.00 0.00 N ATOM 1651 CA VAL A 557 14.427 -3.983 -24.980 1.00 0.00 C ATOM 1652 C VAL A 557 14.440 -5.082 -26.056 1.00 0.00 C ATOM 1653 O VAL A 557 13.955 -6.195 -25.827 1.00 0.00 O ATOM 1654 CB VAL A 557 15.538 -4.235 -23.882 1.00 0.00 C ATOM 1655 CG1 VAL A 557 15.172 -5.427 -22.974 1.00 0.00 C ATOM 1656 CG2 VAL A 557 16.949 -4.415 -24.509 1.00 0.00 C ATOM 0 H VAL A 557 12.618 -4.819 -24.335 1.00 0.00 H new ATOM 0 HA VAL A 557 14.658 -3.026 -25.448 1.00 0.00 H new ATOM 0 HB VAL A 557 15.577 -3.342 -23.259 1.00 0.00 H new ATOM 0 HG11 VAL A 557 15.956 -5.573 -22.231 1.00 0.00 H new ATOM 0 HG12 VAL A 557 14.227 -5.224 -22.469 1.00 0.00 H new ATOM 0 HG13 VAL A 557 15.073 -6.328 -23.579 1.00 0.00 H new ATOM 0 HG21 VAL A 557 17.680 -4.585 -23.718 1.00 0.00 H new ATOM 0 HG22 VAL A 557 16.940 -5.270 -25.185 1.00 0.00 H new ATOM 0 HG23 VAL A 557 17.218 -3.516 -25.064 1.00 0.00 H new ATOM 1666 N LYS A 558 14.956 -4.737 -27.244 1.00 0.00 N ATOM 1667 CA LYS A 558 15.144 -5.681 -28.356 1.00 0.00 C ATOM 1668 C LYS A 558 16.627 -5.696 -28.755 1.00 0.00 C ATOM 1669 O LYS A 558 17.221 -4.647 -29.038 1.00 0.00 O ATOM 1670 CB LYS A 558 14.213 -5.380 -29.586 1.00 0.00 C ATOM 1671 CG LYS A 558 13.930 -3.892 -29.912 1.00 0.00 C ATOM 1672 CD LYS A 558 12.807 -3.285 -29.036 1.00 0.00 C ATOM 1673 CE LYS A 558 12.399 -1.875 -29.482 1.00 0.00 C ATOM 1674 NZ LYS A 558 13.531 -0.906 -29.410 1.00 0.00 N ATOM 0 H LYS A 558 15.257 -3.787 -27.463 1.00 0.00 H new ATOM 0 HA LYS A 558 14.849 -6.672 -28.011 1.00 0.00 H new ATOM 0 HB2 LYS A 558 14.659 -5.840 -30.468 1.00 0.00 H new ATOM 0 HB3 LYS A 558 13.258 -5.876 -29.416 1.00 0.00 H new ATOM 0 HG2 LYS A 558 14.844 -3.315 -29.773 1.00 0.00 H new ATOM 0 HG3 LYS A 558 13.653 -3.802 -30.962 1.00 0.00 H new ATOM 0 HD2 LYS A 558 11.935 -3.938 -29.069 1.00 0.00 H new ATOM 0 HD3 LYS A 558 13.141 -3.250 -27.999 1.00 0.00 H new ATOM 0 HE2 LYS A 558 12.023 -1.915 -30.504 1.00 0.00 H new ATOM 0 HE3 LYS A 558 11.581 -1.521 -28.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 558 13.206 0.032 -29.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 558 13.875 -0.846 -28.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 558 14.303 -1.227 -30.028 1.00 0.00 H new ATOM 1688 N LYS A 559 17.199 -6.907 -28.756 1.00 0.00 N ATOM 1689 CA LYS A 559 18.615 -7.163 -29.037 1.00 0.00 C ATOM 1690 C LYS A 559 18.892 -7.000 -30.541 1.00 0.00 C ATOM 1691 O LYS A 559 18.493 -7.855 -31.349 1.00 0.00 O ATOM 1692 CB LYS A 559 18.967 -8.602 -28.562 1.00 0.00 C ATOM 1693 CG LYS A 559 20.441 -9.021 -28.747 1.00 0.00 C ATOM 1694 CD LYS A 559 20.680 -10.490 -28.336 1.00 0.00 C ATOM 1695 CE LYS A 559 22.154 -10.897 -28.394 1.00 0.00 C ATOM 1696 NZ LYS A 559 22.346 -12.312 -27.997 1.00 0.00 N ATOM 0 H LYS A 559 16.674 -7.758 -28.556 1.00 0.00 H new ATOM 0 HA LYS A 559 19.238 -6.446 -28.502 1.00 0.00 H new ATOM 0 HB2 LYS A 559 18.712 -8.690 -27.506 1.00 0.00 H new ATOM 0 HB3 LYS A 559 18.336 -9.308 -29.102 1.00 0.00 H new ATOM 0 HG2 LYS A 559 20.729 -8.885 -29.789 1.00 0.00 H new ATOM 0 HG3 LYS A 559 21.081 -8.369 -28.152 1.00 0.00 H new ATOM 0 HD2 LYS A 559 20.306 -10.643 -27.324 1.00 0.00 H new ATOM 0 HD3 LYS A 559 20.103 -11.143 -28.991 1.00 0.00 H new ATOM 0 HE2 LYS A 559 22.534 -10.748 -29.405 1.00 0.00 H new ATOM 0 HE3 LYS A 559 22.736 -10.252 -27.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 23.110 -12.375 -27.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 21.465 -12.679 -27.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 22.598 -12.876 -28.834 1.00 0.00 H new