USER MOD reduce.3.24.130724 H: found=0, std=0, add=679, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 679 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 479 HIS : no HE2:sc= 0.279 K(o=1,f=-3) USER MOD Set 1.2: A 483 LYS NZ :NH3+ -121:sc= 0.509 (180deg=0) USER MOD Set 1.3: A 522 THR OG1 : rot 135:sc= 0.24 USER MOD Single : A 470 SER OG : rot 80:sc= 0.87 USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 476 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 477 LYS NZ :NH3+ 168:sc= 1.23 (180deg=0.941) USER MOD Single : A 480 SER OG : rot 97:sc= 1.29 USER MOD Single : A 487 LYS NZ :NH3+ 143:sc= 0.844 (180deg=-1.29!) USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 496 CYS SG : rot 170:sc= -0.476 USER MOD Single : A 498 ASN : amide:sc= -1.27 K(o=-1.3,f=-0.1) USER MOD Single : A 505 THR OG1 : rot -38:sc= 0.0441 USER MOD Single : A 507 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 509 THR OG1 : rot 180:sc= -0.0173 USER MOD Single : A 510 SER OG : rot 180:sc= 0.0428 USER MOD Single : A 511 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 514 GLN : amide:sc= 0 X(o=0,f=0.078) USER MOD Single : A 515 LYS NZ :NH3+ 140:sc= 0.543 (180deg=-0.257!) USER MOD Single : A 516 ASN : amide:sc= 0.0394 X(o=0.039,f=-0.021) USER MOD Single : A 517 THR OG1 : rot 180:sc= 0.0206 USER MOD Single : A 524 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 525 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 529 TYR OH : rot 180:sc= 0 USER MOD Single : A 530 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 532 ASN : amide:sc= -0.194 K(o=-0.19,f=-1.2) USER MOD Single : A 533 LYS NZ :NH3+ -178:sc= 0.24 (180deg=0.159) USER MOD Single : A 536 MET CE :methyl 149:sc= -0.458 (180deg=-0.845) USER MOD Single : A 538 LYS NZ :NH3+ -160:sc= 0.488 (180deg=-0.0247) USER MOD Single : A 543 TYR OH : rot 180:sc= 0 USER MOD Single : A 544 THR OG1 : rot 94:sc= 1.31 USER MOD Single : A 547 LYS NZ :NH3+ -139:sc= -0.392 (180deg=-1.98!) USER MOD Single : A 548 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 470 6.817 -8.030 -3.941 1.00 0.00 N ATOM 49 CA SER A 470 8.121 -8.416 -4.476 1.00 0.00 C ATOM 50 C SER A 470 8.033 -9.679 -5.326 1.00 0.00 C ATOM 51 O SER A 470 7.059 -10.416 -5.259 1.00 0.00 O ATOM 52 CB SER A 470 9.084 -8.673 -3.318 1.00 0.00 C ATOM 53 OG SER A 470 9.060 -7.593 -2.404 1.00 0.00 O ATOM 0 HA SER A 470 8.477 -7.601 -5.106 1.00 0.00 H new ATOM 0 HB2 SER A 470 8.809 -9.596 -2.807 1.00 0.00 H new ATOM 0 HB3 SER A 470 10.095 -8.810 -3.702 1.00 0.00 H new ATOM 0 HG SER A 470 8.273 -7.672 -1.825 1.00 0.00 H new ATOM 59 N VAL A 471 9.066 -9.949 -6.112 1.00 0.00 N ATOM 60 CA VAL A 471 9.095 -11.143 -6.967 1.00 0.00 C ATOM 61 C VAL A 471 8.837 -12.411 -6.183 1.00 0.00 C ATOM 62 O VAL A 471 8.067 -13.246 -6.603 1.00 0.00 O ATOM 63 CB VAL A 471 10.483 -11.298 -7.650 1.00 0.00 C ATOM 64 CG1 VAL A 471 10.663 -12.685 -8.284 1.00 0.00 C ATOM 65 CG2 VAL A 471 10.657 -10.257 -8.698 1.00 0.00 C ATOM 0 H VAL A 471 9.898 -9.362 -6.180 1.00 0.00 H new ATOM 0 HA VAL A 471 8.308 -11.003 -7.708 1.00 0.00 H new ATOM 0 HB VAL A 471 11.238 -11.179 -6.873 1.00 0.00 H new ATOM 0 HG11 VAL A 471 11.647 -12.748 -8.749 1.00 0.00 H new ATOM 0 HG12 VAL A 471 10.577 -13.451 -7.514 1.00 0.00 H new ATOM 0 HG13 VAL A 471 9.894 -12.842 -9.040 1.00 0.00 H new ATOM 0 HG21 VAL A 471 11.633 -10.375 -9.170 1.00 0.00 H new ATOM 0 HG22 VAL A 471 9.875 -10.363 -9.450 1.00 0.00 H new ATOM 0 HG23 VAL A 471 10.591 -9.269 -8.243 1.00 0.00 H new ATOM 75 N GLU A 472 9.491 -12.555 -5.050 1.00 0.00 N ATOM 76 CA GLU A 472 9.339 -13.750 -4.223 1.00 0.00 C ATOM 77 C GLU A 472 7.924 -13.893 -3.659 1.00 0.00 C ATOM 78 O GLU A 472 7.427 -15.000 -3.521 1.00 0.00 O ATOM 79 CB GLU A 472 10.350 -13.733 -3.088 1.00 0.00 C ATOM 80 CG GLU A 472 10.857 -12.348 -2.759 1.00 0.00 C ATOM 81 CD GLU A 472 11.795 -12.387 -1.575 1.00 0.00 C ATOM 82 OE1 GLU A 472 12.998 -12.111 -1.767 1.00 0.00 O ATOM 83 OE2 GLU A 472 11.359 -12.725 -0.461 1.00 0.00 O ATOM 0 H GLU A 472 10.137 -11.861 -4.673 1.00 0.00 H new ATOM 0 HA GLU A 472 9.521 -14.611 -4.866 1.00 0.00 H new ATOM 0 HB2 GLU A 472 9.894 -14.166 -2.198 1.00 0.00 H new ATOM 0 HB3 GLU A 472 11.195 -14.368 -3.354 1.00 0.00 H new ATOM 0 HG2 GLU A 472 11.373 -11.930 -3.623 1.00 0.00 H new ATOM 0 HG3 GLU A 472 10.016 -11.690 -2.541 1.00 0.00 H new ATOM 90 N GLU A 473 7.273 -12.782 -3.348 1.00 0.00 N ATOM 91 CA GLU A 473 5.902 -12.826 -2.838 1.00 0.00 C ATOM 92 C GLU A 473 5.004 -13.316 -3.963 1.00 0.00 C ATOM 93 O GLU A 473 4.087 -14.109 -3.775 1.00 0.00 O ATOM 94 CB GLU A 473 5.439 -11.425 -2.436 1.00 0.00 C ATOM 95 CG GLU A 473 6.198 -10.821 -1.269 1.00 0.00 C ATOM 96 CD GLU A 473 5.818 -9.366 -1.054 1.00 0.00 C ATOM 97 OE1 GLU A 473 4.633 -9.078 -0.812 1.00 0.00 O ATOM 98 OE2 GLU A 473 6.717 -8.500 -1.155 1.00 0.00 O ATOM 0 H GLU A 473 7.664 -11.844 -3.437 1.00 0.00 H new ATOM 0 HA GLU A 473 5.856 -13.483 -1.969 1.00 0.00 H new ATOM 0 HB2 GLU A 473 5.535 -10.763 -3.297 1.00 0.00 H new ATOM 0 HB3 GLU A 473 4.380 -11.465 -2.182 1.00 0.00 H new ATOM 0 HG2 GLU A 473 5.989 -11.391 -0.363 1.00 0.00 H new ATOM 0 HG3 GLU A 473 7.270 -10.895 -1.453 1.00 0.00 H new ATOM 105 N LYS A 474 5.291 -12.832 -5.160 1.00 0.00 N ATOM 106 CA LYS A 474 4.485 -13.174 -6.327 1.00 0.00 C ATOM 107 C LYS A 474 4.754 -14.600 -6.748 1.00 0.00 C ATOM 108 O LYS A 474 3.873 -15.304 -7.239 1.00 0.00 O ATOM 109 CB LYS A 474 4.797 -12.214 -7.459 1.00 0.00 C ATOM 110 CG LYS A 474 4.388 -10.788 -7.121 1.00 0.00 C ATOM 111 CD LYS A 474 4.952 -9.779 -8.082 1.00 0.00 C ATOM 112 CE LYS A 474 4.283 -9.909 -9.437 1.00 0.00 C ATOM 113 NZ LYS A 474 4.706 -8.877 -10.424 1.00 0.00 N ATOM 0 H LYS A 474 6.071 -12.204 -5.352 1.00 0.00 H new ATOM 0 HA LYS A 474 3.429 -13.088 -6.073 1.00 0.00 H new ATOM 0 HB2 LYS A 474 5.865 -12.244 -7.677 1.00 0.00 H new ATOM 0 HB3 LYS A 474 4.278 -12.536 -8.362 1.00 0.00 H new ATOM 0 HG2 LYS A 474 3.300 -10.716 -7.122 1.00 0.00 H new ATOM 0 HG3 LYS A 474 4.722 -10.548 -6.111 1.00 0.00 H new ATOM 0 HD2 LYS A 474 4.804 -8.772 -7.691 1.00 0.00 H new ATOM 0 HD3 LYS A 474 6.027 -9.926 -8.184 1.00 0.00 H new ATOM 0 HE2 LYS A 474 4.500 -10.897 -9.844 1.00 0.00 H new ATOM 0 HE3 LYS A 474 3.203 -9.849 -9.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 4.207 -9.031 -11.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 4.475 -7.931 -10.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 5.732 -8.947 -10.581 1.00 0.00 H new ATOM 127 N LEU A 475 5.988 -15.022 -6.537 1.00 0.00 N ATOM 128 CA LEU A 475 6.423 -16.367 -6.854 1.00 0.00 C ATOM 129 C LEU A 475 5.552 -17.356 -6.111 1.00 0.00 C ATOM 130 O LEU A 475 5.193 -18.383 -6.670 1.00 0.00 O ATOM 131 CB LEU A 475 7.908 -16.541 -6.468 1.00 0.00 C ATOM 132 CG LEU A 475 8.584 -17.924 -6.531 1.00 0.00 C ATOM 133 CD1 LEU A 475 8.177 -18.831 -5.350 1.00 0.00 C ATOM 134 CD2 LEU A 475 8.316 -18.591 -7.852 1.00 0.00 C ATOM 0 H LEU A 475 6.721 -14.435 -6.138 1.00 0.00 H new ATOM 0 HA LEU A 475 6.327 -16.548 -7.925 1.00 0.00 H new ATOM 0 HB2 LEU A 475 8.485 -15.873 -7.108 1.00 0.00 H new ATOM 0 HB3 LEU A 475 8.018 -16.177 -5.446 1.00 0.00 H new ATOM 0 HG LEU A 475 9.658 -17.761 -6.443 1.00 0.00 H new ATOM 0 HD11 LEU A 475 8.680 -19.794 -5.440 1.00 0.00 H new ATOM 0 HD12 LEU A 475 8.465 -18.358 -4.411 1.00 0.00 H new ATOM 0 HD13 LEU A 475 7.098 -18.983 -5.363 1.00 0.00 H new ATOM 0 HD21 LEU A 475 8.803 -19.566 -7.873 1.00 0.00 H new ATOM 0 HD22 LEU A 475 7.242 -18.720 -7.983 1.00 0.00 H new ATOM 0 HD23 LEU A 475 8.709 -17.972 -8.659 1.00 0.00 H new ATOM 146 N GLN A 476 5.197 -17.058 -4.866 1.00 0.00 N ATOM 147 CA GLN A 476 4.374 -17.974 -4.077 1.00 0.00 C ATOM 148 C GLN A 476 3.110 -18.339 -4.842 1.00 0.00 C ATOM 149 O GLN A 476 2.690 -19.498 -4.836 1.00 0.00 O ATOM 150 CB GLN A 476 4.007 -17.352 -2.731 1.00 0.00 C ATOM 151 CG GLN A 476 5.211 -17.119 -1.842 1.00 0.00 C ATOM 152 CD GLN A 476 4.840 -16.487 -0.518 1.00 0.00 C ATOM 153 OE1 GLN A 476 4.332 -15.385 -0.468 1.00 0.00 O ATOM 154 NE2 GLN A 476 5.083 -17.191 0.558 1.00 0.00 N ATOM 0 H GLN A 476 5.462 -16.199 -4.383 1.00 0.00 H new ATOM 0 HA GLN A 476 4.953 -18.879 -3.893 1.00 0.00 H new ATOM 0 HB2 GLN A 476 3.498 -16.403 -2.901 1.00 0.00 H new ATOM 0 HB3 GLN A 476 3.302 -18.004 -2.215 1.00 0.00 H new ATOM 0 HG2 GLN A 476 5.713 -18.069 -1.659 1.00 0.00 H new ATOM 0 HG3 GLN A 476 5.923 -16.477 -2.361 1.00 0.00 H new ATOM 0 HE21 GLN A 476 5.511 -18.113 0.478 1.00 0.00 H new ATOM 0 HE22 GLN A 476 4.844 -16.817 1.477 1.00 0.00 H new ATOM 163 N LYS A 477 2.516 -17.369 -5.525 1.00 0.00 N ATOM 164 CA LYS A 477 1.335 -17.652 -6.334 1.00 0.00 C ATOM 165 C LYS A 477 1.707 -18.450 -7.576 1.00 0.00 C ATOM 166 O LYS A 477 1.185 -19.536 -7.768 1.00 0.00 O ATOM 167 CB LYS A 477 0.641 -16.356 -6.757 1.00 0.00 C ATOM 168 CG LYS A 477 -0.585 -16.588 -7.642 1.00 0.00 C ATOM 169 CD LYS A 477 -1.233 -15.274 -8.051 1.00 0.00 C ATOM 170 CE LYS A 477 -2.283 -15.494 -9.144 1.00 0.00 C ATOM 171 NZ LYS A 477 -3.380 -16.425 -8.707 1.00 0.00 N ATOM 0 H LYS A 477 2.824 -16.397 -5.537 1.00 0.00 H new ATOM 0 HA LYS A 477 0.652 -18.241 -5.722 1.00 0.00 H new ATOM 0 HB2 LYS A 477 0.338 -15.806 -5.866 1.00 0.00 H new ATOM 0 HB3 LYS A 477 1.353 -15.728 -7.292 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -0.292 -17.143 -8.533 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -1.310 -17.202 -7.108 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -1.700 -14.809 -7.182 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -0.469 -14.584 -8.410 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -2.716 -14.534 -9.426 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -1.799 -15.899 -10.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 -4.162 -16.385 -9.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 -3.012 -17.396 -8.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -3.726 -16.138 -7.769 1.00 0.00 H new ATOM 185 N LEU A 478 2.608 -17.940 -8.412 1.00 0.00 N ATOM 186 CA LEU A 478 2.964 -18.610 -9.650 1.00 0.00 C ATOM 187 C LEU A 478 3.442 -20.031 -9.468 1.00 0.00 C ATOM 188 O LEU A 478 3.013 -20.921 -10.183 1.00 0.00 O ATOM 189 CB LEU A 478 4.074 -17.818 -10.323 1.00 0.00 C ATOM 190 CG LEU A 478 3.727 -16.543 -11.096 1.00 0.00 C ATOM 191 CD1 LEU A 478 2.255 -16.152 -11.151 1.00 0.00 C ATOM 192 CD2 LEU A 478 4.557 -15.375 -10.609 1.00 0.00 C ATOM 0 H LEU A 478 3.103 -17.063 -8.250 1.00 0.00 H new ATOM 0 HA LEU A 478 2.056 -18.657 -10.251 1.00 0.00 H new ATOM 0 HB2 LEU A 478 4.795 -17.547 -9.552 1.00 0.00 H new ATOM 0 HB3 LEU A 478 4.583 -18.491 -11.014 1.00 0.00 H new ATOM 0 HG LEU A 478 3.976 -16.798 -12.126 1.00 0.00 H new ATOM 0 HD11 LEU A 478 2.144 -15.233 -11.727 1.00 0.00 H new ATOM 0 HD12 LEU A 478 1.684 -16.949 -11.627 1.00 0.00 H new ATOM 0 HD13 LEU A 478 1.883 -15.993 -10.139 1.00 0.00 H new ATOM 0 HD21 LEU A 478 4.293 -14.481 -11.173 1.00 0.00 H new ATOM 0 HD22 LEU A 478 4.362 -15.207 -9.550 1.00 0.00 H new ATOM 0 HD23 LEU A 478 5.615 -15.595 -10.753 1.00 0.00 H new ATOM 204 N HIS A 479 4.322 -20.254 -8.509 1.00 0.00 N ATOM 205 CA HIS A 479 4.842 -21.585 -8.265 1.00 0.00 C ATOM 206 C HIS A 479 3.690 -22.506 -7.936 1.00 0.00 C ATOM 207 O HIS A 479 3.659 -23.622 -8.425 1.00 0.00 O ATOM 208 CB HIS A 479 5.841 -21.556 -7.107 1.00 0.00 C ATOM 209 CG HIS A 479 6.620 -22.824 -6.940 1.00 0.00 C ATOM 210 ND1 HIS A 479 7.239 -23.197 -5.775 1.00 0.00 N ATOM 211 CD2 HIS A 479 6.905 -23.820 -7.826 1.00 0.00 C ATOM 212 CE1 HIS A 479 7.864 -24.348 -5.982 1.00 0.00 C ATOM 213 NE2 HIS A 479 7.688 -24.783 -7.215 1.00 0.00 N ATOM 0 H HIS A 479 4.690 -19.533 -7.889 1.00 0.00 H new ATOM 0 HA HIS A 479 5.358 -21.946 -9.154 1.00 0.00 H new ATOM 0 HB2 HIS A 479 6.537 -20.732 -7.263 1.00 0.00 H new ATOM 0 HB3 HIS A 479 5.303 -21.348 -6.182 1.00 0.00 H new ATOM 0 HD1 HIS A 479 7.222 -22.677 -4.898 1.00 0.00 H new ATOM 0 HD2 HIS A 479 6.570 -23.852 -8.852 1.00 0.00 H new ATOM 0 HE1 HIS A 479 8.445 -24.866 -5.233 1.00 0.00 H new ATOM 221 N SER A 480 2.744 -22.041 -7.128 1.00 0.00 N ATOM 222 CA SER A 480 1.598 -22.865 -6.750 1.00 0.00 C ATOM 223 C SER A 480 0.721 -23.187 -7.954 1.00 0.00 C ATOM 224 O SER A 480 0.216 -24.298 -8.064 1.00 0.00 O ATOM 225 CB SER A 480 0.763 -22.169 -5.677 1.00 0.00 C ATOM 226 OG SER A 480 1.549 -21.941 -4.519 1.00 0.00 O ATOM 0 H SER A 480 2.746 -21.105 -6.724 1.00 0.00 H new ATOM 0 HA SER A 480 1.989 -23.800 -6.349 1.00 0.00 H new ATOM 0 HB2 SER A 480 0.382 -21.222 -6.059 1.00 0.00 H new ATOM 0 HB3 SER A 480 -0.102 -22.782 -5.424 1.00 0.00 H new ATOM 0 HG SER A 480 1.895 -21.024 -4.534 1.00 0.00 H new ATOM 232 N GLU A 481 0.547 -22.243 -8.869 1.00 0.00 N ATOM 233 CA GLU A 481 -0.264 -22.516 -10.055 1.00 0.00 C ATOM 234 C GLU A 481 0.390 -23.587 -10.903 1.00 0.00 C ATOM 235 O GLU A 481 -0.304 -24.424 -11.469 1.00 0.00 O ATOM 236 CB GLU A 481 -0.442 -21.300 -10.954 1.00 0.00 C ATOM 237 CG GLU A 481 -0.908 -20.017 -10.324 1.00 0.00 C ATOM 238 CD GLU A 481 -2.254 -20.098 -9.596 1.00 0.00 C ATOM 239 OE1 GLU A 481 -2.597 -19.117 -8.900 1.00 0.00 O ATOM 240 OE2 GLU A 481 -2.974 -21.115 -9.714 1.00 0.00 O ATOM 0 H GLU A 481 0.943 -21.304 -8.820 1.00 0.00 H new ATOM 0 HA GLU A 481 -1.237 -22.827 -9.675 1.00 0.00 H new ATOM 0 HB2 GLU A 481 0.512 -21.104 -11.443 1.00 0.00 H new ATOM 0 HB3 GLU A 481 -1.153 -21.565 -11.737 1.00 0.00 H new ATOM 0 HG2 GLU A 481 -0.150 -19.682 -9.616 1.00 0.00 H new ATOM 0 HG3 GLU A 481 -0.978 -19.255 -11.100 1.00 0.00 H new ATOM 247 N ILE A 482 1.721 -23.583 -10.989 1.00 0.00 N ATOM 248 CA ILE A 482 2.418 -24.596 -11.764 1.00 0.00 C ATOM 249 C ILE A 482 2.045 -25.949 -11.170 1.00 0.00 C ATOM 250 O ILE A 482 1.773 -26.888 -11.881 1.00 0.00 O ATOM 251 CB ILE A 482 3.979 -24.432 -11.726 1.00 0.00 C ATOM 252 CG1 ILE A 482 4.407 -23.089 -12.337 1.00 0.00 C ATOM 253 CG2 ILE A 482 4.676 -25.560 -12.488 1.00 0.00 C ATOM 254 CD1 ILE A 482 5.888 -22.738 -12.107 1.00 0.00 C ATOM 0 H ILE A 482 2.326 -22.898 -10.537 1.00 0.00 H new ATOM 0 HA ILE A 482 2.120 -24.501 -12.808 1.00 0.00 H new ATOM 0 HB ILE A 482 4.275 -24.469 -10.678 1.00 0.00 H new ATOM 0 HG12 ILE A 482 4.212 -23.111 -13.409 1.00 0.00 H new ATOM 0 HG13 ILE A 482 3.787 -22.297 -11.917 1.00 0.00 H new ATOM 0 HG21 ILE A 482 5.756 -25.417 -12.443 1.00 0.00 H new ATOM 0 HG22 ILE A 482 4.418 -26.518 -12.037 1.00 0.00 H new ATOM 0 HG23 ILE A 482 4.352 -25.550 -13.529 1.00 0.00 H new ATOM 0 HD11 ILE A 482 6.110 -21.776 -12.569 1.00 0.00 H new ATOM 0 HD12 ILE A 482 6.086 -22.681 -11.037 1.00 0.00 H new ATOM 0 HD13 ILE A 482 6.518 -23.508 -12.552 1.00 0.00 H new ATOM 266 N LYS A 483 2.020 -26.035 -9.850 1.00 0.00 N ATOM 267 CA LYS A 483 1.677 -27.301 -9.169 1.00 0.00 C ATOM 268 C LYS A 483 0.256 -27.753 -9.487 1.00 0.00 C ATOM 269 O LYS A 483 0.023 -28.917 -9.795 1.00 0.00 O ATOM 270 CB LYS A 483 1.777 -27.180 -7.647 1.00 0.00 C ATOM 271 CG LYS A 483 3.002 -26.553 -7.135 1.00 0.00 C ATOM 272 CD LYS A 483 4.248 -27.316 -7.405 1.00 0.00 C ATOM 273 CE LYS A 483 5.216 -26.905 -6.339 1.00 0.00 C ATOM 274 NZ LYS A 483 6.564 -27.542 -6.466 1.00 0.00 N ATOM 0 H LYS A 483 2.229 -25.259 -9.222 1.00 0.00 H new ATOM 0 HA LYS A 483 2.399 -28.029 -9.539 1.00 0.00 H new ATOM 0 HB2 LYS A 483 0.921 -26.607 -7.290 1.00 0.00 H new ATOM 0 HB3 LYS A 483 1.694 -28.178 -7.216 1.00 0.00 H new ATOM 0 HG2 LYS A 483 3.097 -25.560 -7.575 1.00 0.00 H new ATOM 0 HG3 LYS A 483 2.902 -26.416 -6.058 1.00 0.00 H new ATOM 0 HD2 LYS A 483 4.064 -28.390 -7.373 1.00 0.00 H new ATOM 0 HD3 LYS A 483 4.639 -27.089 -8.397 1.00 0.00 H new ATOM 0 HE2 LYS A 483 5.333 -25.822 -6.366 1.00 0.00 H new ATOM 0 HE3 LYS A 483 4.797 -27.156 -5.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 483 6.775 -28.083 -5.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 483 6.570 -28.182 -7.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 483 7.285 -26.805 -6.597 1.00 0.00 H new ATOM 288 N PHE A 484 -0.690 -26.829 -9.400 1.00 0.00 N ATOM 289 CA PHE A 484 -2.099 -27.141 -9.638 1.00 0.00 C ATOM 290 C PHE A 484 -2.335 -27.549 -11.079 1.00 0.00 C ATOM 291 O PHE A 484 -3.180 -28.383 -11.364 1.00 0.00 O ATOM 292 CB PHE A 484 -2.961 -25.919 -9.325 1.00 0.00 C ATOM 293 CG PHE A 484 -3.041 -25.585 -7.858 1.00 0.00 C ATOM 294 CD1 PHE A 484 -2.757 -24.281 -7.408 1.00 0.00 C ATOM 295 CD2 PHE A 484 -3.412 -26.565 -6.916 1.00 0.00 C ATOM 296 CE1 PHE A 484 -2.827 -23.956 -6.033 1.00 0.00 C ATOM 297 CE2 PHE A 484 -3.487 -26.252 -5.536 1.00 0.00 C ATOM 298 CZ PHE A 484 -3.188 -24.945 -5.095 1.00 0.00 C ATOM 0 H PHE A 484 -0.510 -25.853 -9.166 1.00 0.00 H new ATOM 0 HA PHE A 484 -2.371 -27.972 -8.987 1.00 0.00 H new ATOM 0 HB2 PHE A 484 -2.562 -25.058 -9.862 1.00 0.00 H new ATOM 0 HB3 PHE A 484 -3.969 -26.091 -9.703 1.00 0.00 H new ATOM 0 HD1 PHE A 484 -2.482 -23.519 -8.122 1.00 0.00 H new ATOM 0 HD2 PHE A 484 -3.642 -27.566 -7.250 1.00 0.00 H new ATOM 0 HE1 PHE A 484 -2.604 -22.952 -5.702 1.00 0.00 H new ATOM 0 HE2 PHE A 484 -3.772 -27.012 -4.823 1.00 0.00 H new ATOM 0 HZ PHE A 484 -3.236 -24.703 -4.043 1.00 0.00 H new ATOM 308 N ALA A 485 -1.570 -26.963 -11.981 1.00 0.00 N ATOM 309 CA ALA A 485 -1.671 -27.259 -13.400 1.00 0.00 C ATOM 310 C ALA A 485 -1.258 -28.689 -13.738 1.00 0.00 C ATOM 311 O ALA A 485 -1.562 -29.183 -14.815 1.00 0.00 O ATOM 312 CB ALA A 485 -0.795 -26.303 -14.147 1.00 0.00 C ATOM 0 H ALA A 485 -0.860 -26.268 -11.751 1.00 0.00 H new ATOM 0 HA ALA A 485 -2.717 -27.152 -13.689 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -0.858 -26.510 -15.215 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -1.125 -25.282 -13.955 1.00 0.00 H new ATOM 0 HB3 ALA A 485 0.237 -26.420 -13.815 1.00 0.00 H new ATOM 318 N LEU A 486 -0.551 -29.337 -12.826 1.00 0.00 N ATOM 319 CA LEU A 486 -0.033 -30.685 -13.053 1.00 0.00 C ATOM 320 C LEU A 486 -0.737 -31.717 -12.197 1.00 0.00 C ATOM 321 O LEU A 486 -0.274 -32.853 -12.082 1.00 0.00 O ATOM 322 CB LEU A 486 1.463 -30.724 -12.777 1.00 0.00 C ATOM 323 CG LEU A 486 2.257 -29.632 -13.499 1.00 0.00 C ATOM 324 CD1 LEU A 486 3.685 -29.657 -12.961 1.00 0.00 C ATOM 325 CD2 LEU A 486 2.222 -29.735 -15.025 1.00 0.00 C ATOM 0 H LEU A 486 -0.319 -28.950 -11.911 1.00 0.00 H new ATOM 0 HA LEU A 486 -0.223 -30.934 -14.097 1.00 0.00 H new ATOM 0 HB2 LEU A 486 1.627 -30.629 -11.704 1.00 0.00 H new ATOM 0 HB3 LEU A 486 1.852 -31.698 -13.074 1.00 0.00 H new ATOM 0 HG LEU A 486 1.783 -28.673 -13.290 1.00 0.00 H new ATOM 0 HD11 LEU A 486 4.275 -28.887 -13.459 1.00 0.00 H new ATOM 0 HD12 LEU A 486 3.673 -29.467 -11.888 1.00 0.00 H new ATOM 0 HD13 LEU A 486 4.129 -30.634 -13.152 1.00 0.00 H new ATOM 0 HD21 LEU A 486 2.809 -28.925 -15.458 1.00 0.00 H new ATOM 0 HD22 LEU A 486 2.641 -30.692 -15.335 1.00 0.00 H new ATOM 0 HD23 LEU A 486 1.191 -29.662 -15.371 1.00 0.00 H new ATOM 337 N LYS A 487 -1.842 -31.315 -11.582 1.00 0.00 N ATOM 338 CA LYS A 487 -2.637 -32.229 -10.773 1.00 0.00 C ATOM 339 C LYS A 487 -2.992 -33.410 -11.651 1.00 0.00 C ATOM 340 O LYS A 487 -3.477 -33.237 -12.744 1.00 0.00 O ATOM 341 CB LYS A 487 -3.935 -31.555 -10.336 1.00 0.00 C ATOM 342 CG LYS A 487 -3.866 -30.790 -9.028 1.00 0.00 C ATOM 343 CD LYS A 487 -5.189 -30.043 -8.786 1.00 0.00 C ATOM 344 CE LYS A 487 -6.317 -31.007 -8.387 1.00 0.00 C ATOM 345 NZ LYS A 487 -7.689 -30.498 -8.730 1.00 0.00 N ATOM 0 H LYS A 487 -2.207 -30.364 -11.628 1.00 0.00 H new ATOM 0 HA LYS A 487 -2.075 -32.530 -9.889 1.00 0.00 H new ATOM 0 HB2 LYS A 487 -4.250 -30.869 -11.122 1.00 0.00 H new ATOM 0 HB3 LYS A 487 -4.709 -32.318 -10.250 1.00 0.00 H new ATOM 0 HG2 LYS A 487 -3.671 -31.477 -8.205 1.00 0.00 H new ATOM 0 HG3 LYS A 487 -3.038 -30.081 -9.055 1.00 0.00 H new ATOM 0 HD2 LYS A 487 -5.050 -29.300 -8.001 1.00 0.00 H new ATOM 0 HD3 LYS A 487 -5.473 -29.503 -9.689 1.00 0.00 H new ATOM 0 HE2 LYS A 487 -6.159 -31.964 -8.883 1.00 0.00 H new ATOM 0 HE3 LYS A 487 -6.264 -31.192 -7.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 487 -8.287 -31.291 -9.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 487 -8.113 -30.050 -7.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 487 -7.618 -29.799 -9.497 1.00 0.00 H new ATOM 359 N VAL A 488 -2.756 -34.608 -11.153 1.00 0.00 N ATOM 360 CA VAL A 488 -3.095 -35.827 -11.890 1.00 0.00 C ATOM 361 C VAL A 488 -4.604 -35.879 -12.089 1.00 0.00 C ATOM 362 O VAL A 488 -5.111 -36.242 -13.139 1.00 0.00 O ATOM 363 CB VAL A 488 -2.645 -37.068 -11.074 1.00 0.00 C ATOM 364 CG1 VAL A 488 -3.215 -38.347 -11.659 1.00 0.00 C ATOM 365 CG2 VAL A 488 -1.116 -37.124 -11.007 1.00 0.00 C ATOM 0 H VAL A 488 -2.331 -34.772 -10.241 1.00 0.00 H new ATOM 0 HA VAL A 488 -2.590 -35.826 -12.856 1.00 0.00 H new ATOM 0 HB VAL A 488 -3.034 -36.975 -10.060 1.00 0.00 H new ATOM 0 HG11 VAL A 488 -2.882 -39.199 -11.066 1.00 0.00 H new ATOM 0 HG12 VAL A 488 -4.304 -38.299 -11.646 1.00 0.00 H new ATOM 0 HG13 VAL A 488 -2.869 -38.463 -12.686 1.00 0.00 H new ATOM 0 HG21 VAL A 488 -0.809 -37.998 -10.433 1.00 0.00 H new ATOM 0 HG22 VAL A 488 -0.710 -37.192 -12.016 1.00 0.00 H new ATOM 0 HG23 VAL A 488 -0.740 -36.222 -10.524 1.00 0.00 H new ATOM 375 N ASP A 489 -5.293 -35.488 -11.034 1.00 0.00 N ATOM 376 CA ASP A 489 -6.750 -35.474 -10.972 1.00 0.00 C ATOM 377 C ASP A 489 -7.378 -34.446 -11.912 1.00 0.00 C ATOM 378 O ASP A 489 -8.481 -34.637 -12.406 1.00 0.00 O ATOM 379 CB ASP A 489 -7.112 -35.161 -9.520 1.00 0.00 C ATOM 380 CG ASP A 489 -8.429 -34.419 -9.371 1.00 0.00 C ATOM 381 OD1 ASP A 489 -9.485 -35.060 -9.286 1.00 0.00 O ATOM 382 OD2 ASP A 489 -8.385 -33.165 -9.308 1.00 0.00 O ATOM 0 H ASP A 489 -4.850 -35.163 -10.175 1.00 0.00 H new ATOM 0 HA ASP A 489 -7.140 -36.439 -11.297 1.00 0.00 H new ATOM 0 HB2 ASP A 489 -7.164 -36.093 -8.958 1.00 0.00 H new ATOM 0 HB3 ASP A 489 -6.315 -34.564 -9.076 1.00 0.00 H new ATOM 387 N SER A 490 -6.663 -33.359 -12.164 1.00 0.00 N ATOM 388 CA SER A 490 -7.193 -32.280 -13.000 1.00 0.00 C ATOM 389 C SER A 490 -6.087 -31.360 -13.533 1.00 0.00 C ATOM 390 O SER A 490 -5.861 -30.271 -12.991 1.00 0.00 O ATOM 391 CB SER A 490 -8.201 -31.452 -12.194 1.00 0.00 C ATOM 392 OG SER A 490 -8.894 -30.529 -13.016 1.00 0.00 O ATOM 0 H SER A 490 -5.721 -33.197 -11.807 1.00 0.00 H new ATOM 0 HA SER A 490 -7.681 -32.742 -13.859 1.00 0.00 H new ATOM 0 HB2 SER A 490 -8.916 -32.118 -11.711 1.00 0.00 H new ATOM 0 HB3 SER A 490 -7.680 -30.915 -11.402 1.00 0.00 H new ATOM 0 HG SER A 490 -9.529 -30.019 -12.471 1.00 0.00 H new ATOM 398 N PRO A 491 -5.372 -31.788 -14.585 1.00 0.00 N ATOM 399 CA PRO A 491 -4.333 -30.901 -15.122 1.00 0.00 C ATOM 400 C PRO A 491 -4.910 -29.729 -15.924 1.00 0.00 C ATOM 401 O PRO A 491 -5.937 -29.858 -16.587 1.00 0.00 O ATOM 402 CB PRO A 491 -3.514 -31.836 -16.013 1.00 0.00 C ATOM 403 CG PRO A 491 -4.504 -32.841 -16.492 1.00 0.00 C ATOM 404 CD PRO A 491 -5.441 -33.064 -15.325 1.00 0.00 C ATOM 0 HA PRO A 491 -3.750 -30.422 -14.336 1.00 0.00 H new ATOM 0 HB2 PRO A 491 -3.059 -31.297 -16.844 1.00 0.00 H new ATOM 0 HB3 PRO A 491 -2.704 -32.308 -15.457 1.00 0.00 H new ATOM 0 HG2 PRO A 491 -5.044 -32.476 -17.366 1.00 0.00 H new ATOM 0 HG3 PRO A 491 -4.013 -33.769 -16.785 1.00 0.00 H new ATOM 0 HD2 PRO A 491 -6.456 -33.281 -15.659 1.00 0.00 H new ATOM 0 HD3 PRO A 491 -5.122 -33.904 -14.708 1.00 0.00 H new ATOM 412 N ASP A 492 -4.244 -28.585 -15.855 1.00 0.00 N ATOM 413 CA ASP A 492 -4.684 -27.376 -16.562 1.00 0.00 C ATOM 414 C ASP A 492 -3.499 -26.665 -17.209 1.00 0.00 C ATOM 415 O ASP A 492 -2.741 -25.949 -16.557 1.00 0.00 O ATOM 416 CB ASP A 492 -5.411 -26.424 -15.613 1.00 0.00 C ATOM 417 CG ASP A 492 -5.994 -25.205 -16.336 1.00 0.00 C ATOM 418 OD1 ASP A 492 -5.638 -24.953 -17.518 1.00 0.00 O ATOM 419 OD2 ASP A 492 -6.801 -24.491 -15.714 1.00 0.00 O ATOM 0 H ASP A 492 -3.389 -28.462 -15.313 1.00 0.00 H new ATOM 0 HA ASP A 492 -5.377 -27.682 -17.345 1.00 0.00 H new ATOM 0 HB2 ASP A 492 -6.214 -26.962 -15.109 1.00 0.00 H new ATOM 0 HB3 ASP A 492 -4.719 -26.088 -14.841 1.00 0.00 H new ATOM 424 N VAL A 493 -3.341 -26.853 -18.504 1.00 0.00 N ATOM 425 CA VAL A 493 -2.235 -26.241 -19.229 1.00 0.00 C ATOM 426 C VAL A 493 -2.233 -24.734 -19.167 1.00 0.00 C ATOM 427 O VAL A 493 -1.195 -24.135 -18.926 1.00 0.00 O ATOM 428 CB VAL A 493 -2.232 -26.700 -20.696 1.00 0.00 C ATOM 429 CG1 VAL A 493 -3.661 -26.827 -21.276 1.00 0.00 C ATOM 430 CG2 VAL A 493 -1.360 -25.794 -21.602 1.00 0.00 C ATOM 0 H VAL A 493 -3.961 -27.423 -19.079 1.00 0.00 H new ATOM 0 HA VAL A 493 -1.327 -26.578 -18.729 1.00 0.00 H new ATOM 0 HB VAL A 493 -1.782 -27.693 -20.690 1.00 0.00 H new ATOM 0 HG11 VAL A 493 -3.605 -27.154 -22.314 1.00 0.00 H new ATOM 0 HG12 VAL A 493 -4.226 -27.557 -20.696 1.00 0.00 H new ATOM 0 HG13 VAL A 493 -4.161 -25.860 -21.227 1.00 0.00 H new ATOM 0 HG21 VAL A 493 -1.394 -26.164 -22.627 1.00 0.00 H new ATOM 0 HG22 VAL A 493 -1.742 -24.774 -21.572 1.00 0.00 H new ATOM 0 HG23 VAL A 493 -0.330 -25.807 -21.246 1.00 0.00 H new ATOM 440 N LYS A 494 -3.384 -24.115 -19.368 1.00 0.00 N ATOM 441 CA LYS A 494 -3.474 -22.658 -19.372 1.00 0.00 C ATOM 442 C LYS A 494 -3.065 -22.132 -18.023 1.00 0.00 C ATOM 443 O LYS A 494 -2.514 -21.045 -17.916 1.00 0.00 O ATOM 444 CB LYS A 494 -4.886 -22.187 -19.707 1.00 0.00 C ATOM 445 CG LYS A 494 -5.195 -22.278 -21.186 1.00 0.00 C ATOM 446 CD LYS A 494 -6.538 -21.644 -21.505 1.00 0.00 C ATOM 447 CE LYS A 494 -6.820 -21.700 -23.002 1.00 0.00 C ATOM 448 NZ LYS A 494 -8.096 -20.982 -23.345 1.00 0.00 N ATOM 0 H LYS A 494 -4.270 -24.594 -19.531 1.00 0.00 H new ATOM 0 HA LYS A 494 -2.804 -22.274 -20.141 1.00 0.00 H new ATOM 0 HB2 LYS A 494 -5.607 -22.787 -19.152 1.00 0.00 H new ATOM 0 HB3 LYS A 494 -5.009 -21.155 -19.377 1.00 0.00 H new ATOM 0 HG2 LYS A 494 -4.410 -21.780 -21.756 1.00 0.00 H new ATOM 0 HG3 LYS A 494 -5.200 -23.323 -21.496 1.00 0.00 H new ATOM 0 HD2 LYS A 494 -7.328 -22.162 -20.962 1.00 0.00 H new ATOM 0 HD3 LYS A 494 -6.546 -20.608 -21.167 1.00 0.00 H new ATOM 0 HE2 LYS A 494 -5.990 -21.251 -23.548 1.00 0.00 H new ATOM 0 HE3 LYS A 494 -6.888 -22.740 -23.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 494 -8.261 -21.038 -24.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 494 -8.890 -21.427 -22.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 494 -8.021 -19.985 -23.060 1.00 0.00 H new ATOM 462 N ARG A 495 -3.323 -22.910 -16.988 1.00 0.00 N ATOM 463 CA ARG A 495 -2.997 -22.459 -15.631 1.00 0.00 C ATOM 464 C ARG A 495 -1.489 -22.420 -15.474 1.00 0.00 C ATOM 465 O ARG A 495 -0.935 -21.481 -14.904 1.00 0.00 O ATOM 466 CB ARG A 495 -3.639 -23.367 -14.592 1.00 0.00 C ATOM 467 CG ARG A 495 -3.548 -22.855 -13.184 1.00 0.00 C ATOM 468 CD ARG A 495 -4.482 -23.640 -12.290 1.00 0.00 C ATOM 469 NE ARG A 495 -4.551 -23.027 -10.959 1.00 0.00 N ATOM 470 CZ ARG A 495 -5.429 -23.321 -10.014 1.00 0.00 C ATOM 471 NH1 ARG A 495 -6.366 -24.224 -10.177 1.00 0.00 N ATOM 472 NH2 ARG A 495 -5.360 -22.673 -8.887 1.00 0.00 N ATOM 0 H ARG A 495 -3.747 -23.836 -17.047 1.00 0.00 H new ATOM 0 HA ARG A 495 -3.396 -21.457 -15.472 1.00 0.00 H new ATOM 0 HB2 ARG A 495 -4.689 -23.507 -14.848 1.00 0.00 H new ATOM 0 HB3 ARG A 495 -3.165 -24.348 -14.641 1.00 0.00 H new ATOM 0 HG2 ARG A 495 -2.524 -22.943 -12.821 1.00 0.00 H new ATOM 0 HG3 ARG A 495 -3.807 -21.797 -13.155 1.00 0.00 H new ATOM 0 HD2 ARG A 495 -5.477 -23.674 -12.734 1.00 0.00 H new ATOM 0 HD3 ARG A 495 -4.135 -24.670 -12.206 1.00 0.00 H new ATOM 0 HE ARG A 495 -3.859 -22.309 -10.743 1.00 0.00 H new ATOM 0 HH11 ARG A 495 -6.438 -24.731 -11.059 1.00 0.00 H new ATOM 0 HH12 ARG A 495 -7.023 -24.420 -9.421 1.00 0.00 H new ATOM 0 HH21 ARG A 495 -4.643 -21.961 -8.751 1.00 0.00 H new ATOM 0 HH22 ARG A 495 -6.023 -22.878 -8.140 1.00 0.00 H new ATOM 486 N CYS A 496 -0.822 -23.432 -16.007 1.00 0.00 N ATOM 487 CA CYS A 496 0.631 -23.460 -15.995 1.00 0.00 C ATOM 488 C CYS A 496 1.150 -22.312 -16.853 1.00 0.00 C ATOM 489 O CYS A 496 2.011 -21.575 -16.416 1.00 0.00 O ATOM 490 CB CYS A 496 1.148 -24.798 -16.541 1.00 0.00 C ATOM 491 SG CYS A 496 2.539 -25.481 -15.605 1.00 0.00 S ATOM 0 H CYS A 496 -1.261 -24.239 -16.450 1.00 0.00 H new ATOM 0 HA CYS A 496 0.987 -23.350 -14.971 1.00 0.00 H new ATOM 0 HB2 CYS A 496 0.332 -25.520 -16.539 1.00 0.00 H new ATOM 0 HB3 CYS A 496 1.452 -24.663 -17.579 1.00 0.00 H new ATOM 0 HG CYS A 496 2.770 -26.699 -15.997 1.00 0.00 H new ATOM 497 N LEU A 497 0.617 -22.159 -18.061 1.00 0.00 N ATOM 498 CA LEU A 497 1.087 -21.130 -18.997 1.00 0.00 C ATOM 499 C LEU A 497 1.011 -19.734 -18.406 1.00 0.00 C ATOM 500 O LEU A 497 1.954 -18.967 -18.528 1.00 0.00 O ATOM 501 CB LEU A 497 0.264 -21.150 -20.297 1.00 0.00 C ATOM 502 CG LEU A 497 0.409 -22.370 -21.221 1.00 0.00 C ATOM 503 CD1 LEU A 497 -0.459 -22.218 -22.453 1.00 0.00 C ATOM 504 CD2 LEU A 497 1.818 -22.551 -21.652 1.00 0.00 C ATOM 0 H LEU A 497 -0.144 -22.735 -18.421 1.00 0.00 H new ATOM 0 HA LEU A 497 2.130 -21.367 -19.207 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -0.788 -21.057 -20.028 1.00 0.00 H new ATOM 0 HB3 LEU A 497 0.526 -20.262 -20.872 1.00 0.00 H new ATOM 0 HG LEU A 497 0.090 -23.244 -20.652 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -0.340 -23.093 -23.092 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -1.503 -22.127 -22.153 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -0.159 -21.325 -23.001 1.00 0.00 H new ATOM 0 HD21 LEU A 497 1.890 -23.421 -22.304 1.00 0.00 H new ATOM 0 HD22 LEU A 497 2.150 -21.664 -22.192 1.00 0.00 H new ATOM 0 HD23 LEU A 497 2.450 -22.701 -20.777 1.00 0.00 H new ATOM 516 N ASN A 498 -0.101 -19.419 -17.761 1.00 0.00 N ATOM 517 CA ASN A 498 -0.291 -18.102 -17.148 1.00 0.00 C ATOM 518 C ASN A 498 0.755 -17.876 -16.057 1.00 0.00 C ATOM 519 O ASN A 498 1.307 -16.792 -15.906 1.00 0.00 O ATOM 520 CB ASN A 498 -1.709 -18.033 -16.560 1.00 0.00 C ATOM 521 CG ASN A 498 -2.111 -16.632 -16.120 1.00 0.00 C ATOM 522 OD1 ASN A 498 -3.009 -16.044 -16.685 1.00 0.00 O ATOM 523 ND2 ASN A 498 -1.468 -16.109 -15.108 1.00 0.00 N ATOM 0 H ASN A 498 -0.890 -20.054 -17.645 1.00 0.00 H new ATOM 0 HA ASN A 498 -0.171 -17.321 -17.898 1.00 0.00 H new ATOM 0 HB2 ASN A 498 -2.421 -18.391 -17.304 1.00 0.00 H new ATOM 0 HB3 ASN A 498 -1.774 -18.707 -15.706 1.00 0.00 H new ATOM 0 HD21 ASN A 498 -1.717 -15.179 -14.771 1.00 0.00 H new ATOM 0 HD22 ASN A 498 -0.718 -16.631 -14.656 1.00 0.00 H new ATOM 530 N ALA A 499 1.024 -18.910 -15.278 1.00 0.00 N ATOM 531 CA ALA A 499 2.002 -18.799 -14.209 1.00 0.00 C ATOM 532 C ALA A 499 3.389 -18.607 -14.797 1.00 0.00 C ATOM 533 O ALA A 499 4.141 -17.729 -14.385 1.00 0.00 O ATOM 534 CB ALA A 499 1.970 -20.033 -13.372 1.00 0.00 C ATOM 0 H ALA A 499 0.584 -19.826 -15.364 1.00 0.00 H new ATOM 0 HA ALA A 499 1.760 -17.938 -13.587 1.00 0.00 H new ATOM 0 HB1 ALA A 499 2.704 -19.948 -12.571 1.00 0.00 H new ATOM 0 HB2 ALA A 499 0.976 -20.155 -12.942 1.00 0.00 H new ATOM 0 HB3 ALA A 499 2.207 -20.899 -13.991 1.00 0.00 H new ATOM 540 N LEU A 500 3.714 -19.446 -15.765 1.00 0.00 N ATOM 541 CA LEU A 500 4.975 -19.388 -16.442 1.00 0.00 C ATOM 542 C LEU A 500 5.201 -18.024 -17.078 1.00 0.00 C ATOM 543 O LEU A 500 6.279 -17.472 -16.947 1.00 0.00 O ATOM 544 CB LEU A 500 4.987 -20.488 -17.515 1.00 0.00 C ATOM 545 CG LEU A 500 5.441 -21.917 -17.157 1.00 0.00 C ATOM 546 CD1 LEU A 500 5.875 -22.160 -15.789 1.00 0.00 C ATOM 547 CD2 LEU A 500 4.494 -23.011 -17.641 1.00 0.00 C ATOM 0 H LEU A 500 3.098 -20.188 -16.098 1.00 0.00 H new ATOM 0 HA LEU A 500 5.781 -19.544 -15.725 1.00 0.00 H new ATOM 0 HB2 LEU A 500 3.975 -20.561 -17.914 1.00 0.00 H new ATOM 0 HB3 LEU A 500 5.626 -20.140 -18.327 1.00 0.00 H new ATOM 0 HG LEU A 500 6.361 -21.981 -17.739 1.00 0.00 H new ATOM 0 HD11 LEU A 500 6.165 -23.205 -15.680 1.00 0.00 H new ATOM 0 HD12 LEU A 500 6.727 -21.521 -15.559 1.00 0.00 H new ATOM 0 HD13 LEU A 500 5.058 -21.937 -15.103 1.00 0.00 H new ATOM 0 HD21 LEU A 500 4.885 -23.986 -17.349 1.00 0.00 H new ATOM 0 HD22 LEU A 500 3.511 -22.865 -17.193 1.00 0.00 H new ATOM 0 HD23 LEU A 500 4.409 -22.964 -18.727 1.00 0.00 H new ATOM 559 N GLU A 501 4.220 -17.467 -17.764 1.00 0.00 N ATOM 560 CA GLU A 501 4.440 -16.198 -18.448 1.00 0.00 C ATOM 561 C GLU A 501 4.759 -15.057 -17.477 1.00 0.00 C ATOM 562 O GLU A 501 5.587 -14.198 -17.796 1.00 0.00 O ATOM 563 CB GLU A 501 3.275 -15.870 -19.395 1.00 0.00 C ATOM 564 CG GLU A 501 2.149 -15.032 -18.833 1.00 0.00 C ATOM 565 CD GLU A 501 0.970 -14.994 -19.791 1.00 0.00 C ATOM 566 OE1 GLU A 501 0.362 -16.061 -20.032 1.00 0.00 O ATOM 567 OE2 GLU A 501 0.662 -13.904 -20.314 1.00 0.00 O ATOM 0 H GLU A 501 3.283 -17.858 -17.864 1.00 0.00 H new ATOM 0 HA GLU A 501 5.331 -16.310 -19.067 1.00 0.00 H new ATOM 0 HB2 GLU A 501 3.681 -15.353 -20.265 1.00 0.00 H new ATOM 0 HB3 GLU A 501 2.853 -16.810 -19.751 1.00 0.00 H new ATOM 0 HG2 GLU A 501 1.830 -15.440 -17.874 1.00 0.00 H new ATOM 0 HG3 GLU A 501 2.503 -14.018 -18.646 1.00 0.00 H new ATOM 574 N GLU A 502 4.159 -15.044 -16.289 1.00 0.00 N ATOM 575 CA GLU A 502 4.489 -14.001 -15.328 1.00 0.00 C ATOM 576 C GLU A 502 5.891 -14.270 -14.792 1.00 0.00 C ATOM 577 O GLU A 502 6.718 -13.370 -14.691 1.00 0.00 O ATOM 578 CB GLU A 502 3.490 -13.958 -14.179 1.00 0.00 C ATOM 579 CG GLU A 502 3.269 -12.546 -13.660 1.00 0.00 C ATOM 580 CD GLU A 502 2.577 -12.514 -12.309 1.00 0.00 C ATOM 581 OE1 GLU A 502 3.211 -12.028 -11.347 1.00 0.00 O ATOM 582 OE2 GLU A 502 1.416 -12.952 -12.195 1.00 0.00 O ATOM 0 H GLU A 502 3.464 -15.722 -15.977 1.00 0.00 H new ATOM 0 HA GLU A 502 4.448 -13.033 -15.827 1.00 0.00 H new ATOM 0 HB2 GLU A 502 2.539 -14.374 -14.512 1.00 0.00 H new ATOM 0 HB3 GLU A 502 3.847 -14.590 -13.366 1.00 0.00 H new ATOM 0 HG2 GLU A 502 4.230 -12.038 -13.582 1.00 0.00 H new ATOM 0 HG3 GLU A 502 2.672 -11.989 -14.382 1.00 0.00 H new ATOM 589 N LEU A 503 6.171 -15.527 -14.476 1.00 0.00 N ATOM 590 CA LEU A 503 7.497 -15.930 -13.996 1.00 0.00 C ATOM 591 C LEU A 503 8.584 -15.528 -15.005 1.00 0.00 C ATOM 592 O LEU A 503 9.703 -15.171 -14.637 1.00 0.00 O ATOM 593 CB LEU A 503 7.507 -17.455 -13.799 1.00 0.00 C ATOM 594 CG LEU A 503 8.324 -18.089 -12.667 1.00 0.00 C ATOM 595 CD1 LEU A 503 9.809 -17.855 -12.816 1.00 0.00 C ATOM 596 CD2 LEU A 503 7.858 -17.581 -11.332 1.00 0.00 C ATOM 0 H LEU A 503 5.499 -16.292 -14.542 1.00 0.00 H new ATOM 0 HA LEU A 503 7.707 -15.428 -13.052 1.00 0.00 H new ATOM 0 HB2 LEU A 503 6.472 -17.768 -13.663 1.00 0.00 H new ATOM 0 HB3 LEU A 503 7.854 -17.898 -14.733 1.00 0.00 H new ATOM 0 HG LEU A 503 8.158 -19.165 -12.728 1.00 0.00 H new ATOM 0 HD11 LEU A 503 10.337 -18.326 -11.987 1.00 0.00 H new ATOM 0 HD12 LEU A 503 10.153 -18.286 -13.756 1.00 0.00 H new ATOM 0 HD13 LEU A 503 10.011 -16.784 -12.813 1.00 0.00 H new ATOM 0 HD21 LEU A 503 8.449 -18.042 -10.541 1.00 0.00 H new ATOM 0 HD22 LEU A 503 7.979 -16.499 -11.292 1.00 0.00 H new ATOM 0 HD23 LEU A 503 6.807 -17.834 -11.193 1.00 0.00 H new ATOM 608 N GLY A 504 8.237 -15.573 -16.282 1.00 0.00 N ATOM 609 CA GLY A 504 9.163 -15.218 -17.341 1.00 0.00 C ATOM 610 C GLY A 504 9.553 -13.754 -17.371 1.00 0.00 C ATOM 611 O GLY A 504 10.557 -13.409 -18.009 1.00 0.00 O ATOM 0 H GLY A 504 7.313 -15.854 -16.610 1.00 0.00 H new ATOM 0 HA2 GLY A 504 10.066 -15.819 -17.233 1.00 0.00 H new ATOM 0 HA3 GLY A 504 8.717 -15.482 -18.300 1.00 0.00 H new ATOM 615 N THR A 505 8.803 -12.895 -16.694 1.00 0.00 N ATOM 616 CA THR A 505 9.099 -11.460 -16.673 1.00 0.00 C ATOM 617 C THR A 505 9.507 -11.006 -15.265 1.00 0.00 C ATOM 618 O THR A 505 10.064 -9.924 -15.087 1.00 0.00 O ATOM 619 CB THR A 505 7.902 -10.628 -17.248 1.00 0.00 C ATOM 620 OG1 THR A 505 8.302 -9.270 -17.435 1.00 0.00 O ATOM 621 CG2 THR A 505 6.672 -10.657 -16.358 1.00 0.00 C ATOM 0 H THR A 505 7.983 -13.163 -16.150 1.00 0.00 H new ATOM 0 HA THR A 505 9.952 -11.274 -17.326 1.00 0.00 H new ATOM 0 HB THR A 505 7.632 -11.091 -18.197 1.00 0.00 H new ATOM 0 HG1 THR A 505 8.892 -8.999 -16.701 1.00 0.00 H new ATOM 0 HG21 THR A 505 5.880 -10.062 -16.813 1.00 0.00 H new ATOM 0 HG22 THR A 505 6.332 -11.686 -16.241 1.00 0.00 H new ATOM 0 HG23 THR A 505 6.920 -10.244 -15.380 1.00 0.00 H new ATOM 629 N LEU A 506 9.258 -11.840 -14.262 1.00 0.00 N ATOM 630 CA LEU A 506 9.635 -11.511 -12.887 1.00 0.00 C ATOM 631 C LEU A 506 11.164 -11.466 -12.763 1.00 0.00 C ATOM 632 O LEU A 506 11.872 -12.238 -13.420 1.00 0.00 O ATOM 633 CB LEU A 506 9.080 -12.558 -11.903 1.00 0.00 C ATOM 634 CG LEU A 506 7.562 -12.697 -11.636 1.00 0.00 C ATOM 635 CD1 LEU A 506 7.314 -13.030 -10.157 1.00 0.00 C ATOM 636 CD2 LEU A 506 6.755 -11.462 -12.006 1.00 0.00 C ATOM 0 H LEU A 506 8.799 -12.745 -14.371 1.00 0.00 H new ATOM 0 HA LEU A 506 9.214 -10.536 -12.642 1.00 0.00 H new ATOM 0 HB2 LEU A 506 9.431 -13.531 -12.246 1.00 0.00 H new ATOM 0 HB3 LEU A 506 9.554 -12.369 -10.940 1.00 0.00 H new ATOM 0 HG LEU A 506 7.221 -13.506 -12.282 1.00 0.00 H new ATOM 0 HD11 LEU A 506 6.243 -13.126 -9.980 1.00 0.00 H new ATOM 0 HD12 LEU A 506 7.808 -13.969 -9.908 1.00 0.00 H new ATOM 0 HD13 LEU A 506 7.715 -12.232 -9.532 1.00 0.00 H new ATOM 0 HD21 LEU A 506 5.701 -11.638 -11.790 1.00 0.00 H new ATOM 0 HD22 LEU A 506 7.107 -10.610 -11.425 1.00 0.00 H new ATOM 0 HD23 LEU A 506 6.877 -11.252 -13.069 1.00 0.00 H new ATOM 648 N GLN A 507 11.684 -10.581 -11.916 1.00 0.00 N ATOM 649 CA GLN A 507 13.133 -10.503 -11.706 1.00 0.00 C ATOM 650 C GLN A 507 13.573 -11.618 -10.766 1.00 0.00 C ATOM 651 O GLN A 507 13.734 -11.449 -9.571 1.00 0.00 O ATOM 652 CB GLN A 507 13.512 -9.157 -11.085 1.00 0.00 C ATOM 653 CG GLN A 507 14.940 -8.717 -11.403 1.00 0.00 C ATOM 654 CD GLN A 507 15.242 -7.325 -10.880 1.00 0.00 C ATOM 655 OE1 GLN A 507 14.414 -6.700 -10.248 1.00 0.00 O ATOM 656 NE2 GLN A 507 16.424 -6.839 -11.152 1.00 0.00 N ATOM 0 H GLN A 507 11.136 -9.916 -11.370 1.00 0.00 H new ATOM 0 HA GLN A 507 13.629 -10.607 -12.671 1.00 0.00 H new ATOM 0 HB2 GLN A 507 12.818 -8.395 -11.440 1.00 0.00 H new ATOM 0 HB3 GLN A 507 13.392 -9.219 -10.003 1.00 0.00 H new ATOM 0 HG2 GLN A 507 15.643 -9.427 -10.967 1.00 0.00 H new ATOM 0 HG3 GLN A 507 15.093 -8.739 -12.482 1.00 0.00 H new ATOM 0 HE21 GLN A 507 17.093 -7.394 -11.686 1.00 0.00 H new ATOM 0 HE22 GLN A 507 16.678 -5.905 -10.831 1.00 0.00 H new ATOM 665 N VAL A 508 13.798 -12.773 -11.332 1.00 0.00 N ATOM 666 CA VAL A 508 14.202 -13.942 -10.573 1.00 0.00 C ATOM 667 C VAL A 508 15.724 -14.052 -10.650 1.00 0.00 C ATOM 668 O VAL A 508 16.307 -15.086 -10.953 1.00 0.00 O ATOM 669 CB VAL A 508 13.505 -15.145 -11.140 1.00 0.00 C ATOM 670 CG1 VAL A 508 11.984 -15.027 -10.971 1.00 0.00 C ATOM 671 CG2 VAL A 508 13.883 -15.307 -12.611 1.00 0.00 C ATOM 0 H VAL A 508 13.708 -12.938 -12.335 1.00 0.00 H new ATOM 0 HA VAL A 508 13.922 -13.867 -9.522 1.00 0.00 H new ATOM 0 HB VAL A 508 13.826 -16.032 -10.594 1.00 0.00 H new ATOM 0 HG11 VAL A 508 11.502 -15.910 -11.390 1.00 0.00 H new ATOM 0 HG12 VAL A 508 11.741 -14.948 -9.911 1.00 0.00 H new ATOM 0 HG13 VAL A 508 11.628 -14.138 -11.492 1.00 0.00 H new ATOM 0 HG21 VAL A 508 13.377 -16.180 -13.023 1.00 0.00 H new ATOM 0 HG22 VAL A 508 13.581 -14.418 -13.164 1.00 0.00 H new ATOM 0 HG23 VAL A 508 14.962 -15.438 -12.697 1.00 0.00 H new ATOM 681 N THR A 509 16.357 -12.929 -10.382 1.00 0.00 N ATOM 682 CA THR A 509 17.808 -12.816 -10.440 1.00 0.00 C ATOM 683 C THR A 509 18.365 -13.683 -9.323 1.00 0.00 C ATOM 684 O THR A 509 17.592 -14.189 -8.514 1.00 0.00 O ATOM 685 CB THR A 509 18.267 -11.336 -10.335 1.00 0.00 C ATOM 686 OG1 THR A 509 19.685 -11.255 -10.494 1.00 0.00 O ATOM 687 CG2 THR A 509 17.888 -10.714 -8.993 1.00 0.00 C ATOM 0 H THR A 509 15.884 -12.065 -10.117 1.00 0.00 H new ATOM 0 HA THR A 509 18.189 -13.164 -11.400 1.00 0.00 H new ATOM 0 HB THR A 509 17.760 -10.783 -11.126 1.00 0.00 H new ATOM 0 HG1 THR A 509 19.969 -10.319 -10.429 1.00 0.00 H new ATOM 0 HG21 THR A 509 18.228 -9.679 -8.963 1.00 0.00 H new ATOM 0 HG22 THR A 509 16.805 -10.744 -8.871 1.00 0.00 H new ATOM 0 HG23 THR A 509 18.360 -11.275 -8.186 1.00 0.00 H new ATOM 695 N SER A 510 19.677 -13.869 -9.268 1.00 0.00 N ATOM 696 CA SER A 510 20.297 -14.791 -8.315 1.00 0.00 C ATOM 697 C SER A 510 19.815 -14.603 -6.884 1.00 0.00 C ATOM 698 O SER A 510 19.651 -15.571 -6.165 1.00 0.00 O ATOM 699 CB SER A 510 21.808 -14.625 -8.386 1.00 0.00 C ATOM 700 OG SER A 510 22.183 -14.499 -9.744 1.00 0.00 O ATOM 0 H SER A 510 20.341 -13.390 -9.877 1.00 0.00 H new ATOM 0 HA SER A 510 20.001 -15.801 -8.599 1.00 0.00 H new ATOM 0 HB2 SER A 510 22.119 -13.744 -7.824 1.00 0.00 H new ATOM 0 HB3 SER A 510 22.305 -15.483 -7.934 1.00 0.00 H new ATOM 0 HG SER A 510 23.155 -14.389 -9.806 1.00 0.00 H new ATOM 706 N GLN A 511 19.537 -13.369 -6.494 1.00 0.00 N ATOM 707 CA GLN A 511 19.026 -13.081 -5.156 1.00 0.00 C ATOM 708 C GLN A 511 17.762 -13.893 -4.841 1.00 0.00 C ATOM 709 O GLN A 511 17.632 -14.437 -3.757 1.00 0.00 O ATOM 710 CB GLN A 511 18.686 -11.592 -5.078 1.00 0.00 C ATOM 711 CG GLN A 511 18.248 -11.106 -3.700 1.00 0.00 C ATOM 712 CD GLN A 511 17.837 -9.647 -3.723 1.00 0.00 C ATOM 713 OE1 GLN A 511 17.200 -9.191 -4.657 1.00 0.00 O ATOM 714 NE2 GLN A 511 18.207 -8.915 -2.707 1.00 0.00 N ATOM 0 H GLN A 511 19.656 -12.546 -7.085 1.00 0.00 H new ATOM 0 HA GLN A 511 19.792 -13.353 -4.430 1.00 0.00 H new ATOM 0 HB2 GLN A 511 19.559 -11.018 -5.390 1.00 0.00 H new ATOM 0 HB3 GLN A 511 17.891 -11.377 -5.793 1.00 0.00 H new ATOM 0 HG2 GLN A 511 17.414 -11.713 -3.348 1.00 0.00 H new ATOM 0 HG3 GLN A 511 19.064 -11.243 -2.990 1.00 0.00 H new ATOM 0 HE21 GLN A 511 18.739 -9.333 -1.944 1.00 0.00 H new ATOM 0 HE22 GLN A 511 17.964 -7.925 -2.676 1.00 0.00 H new ATOM 723 N ILE A 512 16.833 -13.960 -5.788 1.00 0.00 N ATOM 724 CA ILE A 512 15.587 -14.699 -5.613 1.00 0.00 C ATOM 725 C ILE A 512 15.817 -16.148 -5.992 1.00 0.00 C ATOM 726 O ILE A 512 15.333 -17.059 -5.337 1.00 0.00 O ATOM 727 CB ILE A 512 14.403 -14.109 -6.457 1.00 0.00 C ATOM 728 CG1 ILE A 512 14.021 -12.729 -5.912 1.00 0.00 C ATOM 729 CG2 ILE A 512 13.161 -15.026 -6.371 1.00 0.00 C ATOM 730 CD1 ILE A 512 14.806 -11.605 -6.544 1.00 0.00 C ATOM 0 H ILE A 512 16.921 -13.505 -6.697 1.00 0.00 H new ATOM 0 HA ILE A 512 15.297 -14.614 -4.566 1.00 0.00 H new ATOM 0 HB ILE A 512 14.729 -14.034 -7.495 1.00 0.00 H new ATOM 0 HG12 ILE A 512 12.957 -12.560 -6.080 1.00 0.00 H new ATOM 0 HG13 ILE A 512 14.180 -12.714 -4.834 1.00 0.00 H new ATOM 0 HG21 ILE A 512 12.352 -14.599 -6.963 1.00 0.00 H new ATOM 0 HG22 ILE A 512 13.411 -16.014 -6.757 1.00 0.00 H new ATOM 0 HG23 ILE A 512 12.844 -15.112 -5.332 1.00 0.00 H new ATOM 0 HD11 ILE A 512 14.489 -10.654 -6.116 1.00 0.00 H new ATOM 0 HD12 ILE A 512 15.869 -11.752 -6.354 1.00 0.00 H new ATOM 0 HD13 ILE A 512 14.627 -11.596 -7.619 1.00 0.00 H new ATOM 742 N LEU A 513 16.549 -16.365 -7.069 1.00 0.00 N ATOM 743 CA LEU A 513 16.751 -17.705 -7.583 1.00 0.00 C ATOM 744 C LEU A 513 17.414 -18.639 -6.594 1.00 0.00 C ATOM 745 O LEU A 513 17.064 -19.812 -6.509 1.00 0.00 O ATOM 746 CB LEU A 513 17.619 -17.663 -8.849 1.00 0.00 C ATOM 747 CG LEU A 513 17.045 -18.118 -10.210 1.00 0.00 C ATOM 748 CD1 LEU A 513 17.723 -19.418 -10.627 1.00 0.00 C ATOM 749 CD2 LEU A 513 15.525 -18.286 -10.226 1.00 0.00 C ATOM 0 H LEU A 513 17.013 -15.631 -7.604 1.00 0.00 H new ATOM 0 HA LEU A 513 15.754 -18.091 -7.795 1.00 0.00 H new ATOM 0 HB2 LEU A 513 17.960 -16.635 -8.971 1.00 0.00 H new ATOM 0 HB3 LEU A 513 18.503 -18.271 -8.653 1.00 0.00 H new ATOM 0 HG LEU A 513 17.257 -17.320 -10.922 1.00 0.00 H new ATOM 0 HD11 LEU A 513 17.323 -19.745 -11.587 1.00 0.00 H new ATOM 0 HD12 LEU A 513 18.797 -19.255 -10.718 1.00 0.00 H new ATOM 0 HD13 LEU A 513 17.534 -20.184 -9.875 1.00 0.00 H new ATOM 0 HD21 LEU A 513 15.205 -18.607 -11.217 1.00 0.00 H new ATOM 0 HD22 LEU A 513 15.234 -19.036 -9.490 1.00 0.00 H new ATOM 0 HD23 LEU A 513 15.051 -17.335 -9.982 1.00 0.00 H new ATOM 761 N GLN A 514 18.375 -18.119 -5.849 1.00 0.00 N ATOM 762 CA GLN A 514 19.118 -18.935 -4.892 1.00 0.00 C ATOM 763 C GLN A 514 18.227 -19.345 -3.721 1.00 0.00 C ATOM 764 O GLN A 514 18.387 -20.425 -3.168 1.00 0.00 O ATOM 765 CB GLN A 514 20.338 -18.167 -4.393 1.00 0.00 C ATOM 766 CG GLN A 514 21.473 -18.110 -5.422 1.00 0.00 C ATOM 767 CD GLN A 514 22.600 -17.190 -4.995 1.00 0.00 C ATOM 768 OE1 GLN A 514 22.397 -16.013 -4.761 1.00 0.00 O ATOM 769 NE2 GLN A 514 23.790 -17.721 -4.904 1.00 0.00 N ATOM 0 H GLN A 514 18.661 -17.141 -5.885 1.00 0.00 H new ATOM 0 HA GLN A 514 19.452 -19.843 -5.394 1.00 0.00 H new ATOM 0 HB2 GLN A 514 20.040 -17.151 -4.133 1.00 0.00 H new ATOM 0 HB3 GLN A 514 20.706 -18.635 -3.480 1.00 0.00 H new ATOM 0 HG2 GLN A 514 21.868 -19.114 -5.578 1.00 0.00 H new ATOM 0 HG3 GLN A 514 21.075 -17.771 -6.379 1.00 0.00 H new ATOM 0 HE21 GLN A 514 23.923 -18.712 -5.108 1.00 0.00 H new ATOM 0 HE22 GLN A 514 24.586 -17.145 -4.629 1.00 0.00 H new ATOM 778 N LYS A 515 17.274 -18.495 -3.357 1.00 0.00 N ATOM 779 CA LYS A 515 16.335 -18.825 -2.274 1.00 0.00 C ATOM 780 C LYS A 515 15.111 -19.573 -2.810 1.00 0.00 C ATOM 781 O LYS A 515 14.261 -20.002 -2.044 1.00 0.00 O ATOM 782 CB LYS A 515 15.921 -17.564 -1.486 1.00 0.00 C ATOM 783 CG LYS A 515 15.424 -16.389 -2.338 1.00 0.00 C ATOM 784 CD LYS A 515 15.168 -15.107 -1.531 1.00 0.00 C ATOM 785 CE LYS A 515 14.038 -15.260 -0.505 1.00 0.00 C ATOM 786 NZ LYS A 515 13.820 -13.972 0.241 1.00 0.00 N ATOM 0 H LYS A 515 17.126 -17.581 -3.785 1.00 0.00 H new ATOM 0 HA LYS A 515 16.851 -19.490 -1.581 1.00 0.00 H new ATOM 0 HB2 LYS A 515 15.135 -17.838 -0.782 1.00 0.00 H new ATOM 0 HB3 LYS A 515 16.774 -17.228 -0.897 1.00 0.00 H new ATOM 0 HG2 LYS A 515 16.159 -16.178 -3.115 1.00 0.00 H new ATOM 0 HG3 LYS A 515 14.503 -16.681 -2.842 1.00 0.00 H new ATOM 0 HD2 LYS A 515 16.084 -14.821 -1.014 1.00 0.00 H new ATOM 0 HD3 LYS A 515 14.922 -14.296 -2.216 1.00 0.00 H new ATOM 0 HE2 LYS A 515 13.118 -15.553 -1.011 1.00 0.00 H new ATOM 0 HE3 LYS A 515 14.283 -16.056 0.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 515 12.800 -13.817 0.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 515 14.287 -14.025 1.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 515 14.222 -13.183 -0.304 1.00 0.00 H new ATOM 800 N ASN A 516 15.029 -19.738 -4.124 1.00 0.00 N ATOM 801 CA ASN A 516 13.915 -20.444 -4.761 1.00 0.00 C ATOM 802 C ASN A 516 14.389 -21.557 -5.704 1.00 0.00 C ATOM 803 O ASN A 516 13.898 -21.714 -6.824 1.00 0.00 O ATOM 804 CB ASN A 516 13.037 -19.431 -5.497 1.00 0.00 C ATOM 805 CG ASN A 516 12.098 -18.730 -4.568 1.00 0.00 C ATOM 806 OD1 ASN A 516 11.113 -19.296 -4.146 1.00 0.00 O ATOM 807 ND2 ASN A 516 12.396 -17.511 -4.237 1.00 0.00 N ATOM 0 H ASN A 516 15.728 -19.389 -4.780 1.00 0.00 H new ATOM 0 HA ASN A 516 13.332 -20.937 -3.983 1.00 0.00 H new ATOM 0 HB2 ASN A 516 13.670 -18.697 -5.996 1.00 0.00 H new ATOM 0 HB3 ASN A 516 12.467 -19.941 -6.273 1.00 0.00 H new ATOM 0 HD21 ASN A 516 11.791 -16.993 -3.599 1.00 0.00 H new ATOM 0 HD22 ASN A 516 13.235 -17.071 -4.615 1.00 0.00 H new ATOM 814 N THR A 517 15.343 -22.347 -5.248 1.00 0.00 N ATOM 815 CA THR A 517 15.881 -23.437 -6.059 1.00 0.00 C ATOM 816 C THR A 517 14.838 -24.522 -6.353 1.00 0.00 C ATOM 817 O THR A 517 14.900 -25.177 -7.393 1.00 0.00 O ATOM 818 CB THR A 517 17.078 -24.072 -5.349 1.00 0.00 C ATOM 819 OG1 THR A 517 16.727 -24.309 -3.983 1.00 0.00 O ATOM 820 CG2 THR A 517 18.278 -23.133 -5.377 1.00 0.00 C ATOM 0 H THR A 517 15.764 -22.259 -4.323 1.00 0.00 H new ATOM 0 HA THR A 517 16.187 -23.003 -7.011 1.00 0.00 H new ATOM 0 HB THR A 517 17.336 -25.001 -5.857 1.00 0.00 H new ATOM 0 HG1 THR A 517 17.486 -24.718 -3.516 1.00 0.00 H new ATOM 0 HG21 THR A 517 19.119 -23.602 -4.867 1.00 0.00 H new ATOM 0 HG22 THR A 517 18.552 -22.923 -6.411 1.00 0.00 H new ATOM 0 HG23 THR A 517 18.023 -22.201 -4.873 1.00 0.00 H new ATOM 828 N ASP A 518 13.867 -24.707 -5.468 1.00 0.00 N ATOM 829 CA ASP A 518 12.803 -25.704 -5.685 1.00 0.00 C ATOM 830 C ASP A 518 11.859 -25.299 -6.811 1.00 0.00 C ATOM 831 O ASP A 518 11.189 -26.140 -7.429 1.00 0.00 O ATOM 832 CB ASP A 518 11.981 -25.903 -4.412 1.00 0.00 C ATOM 833 CG ASP A 518 12.593 -26.932 -3.480 1.00 0.00 C ATOM 834 OD1 ASP A 518 13.489 -27.686 -3.919 1.00 0.00 O ATOM 835 OD2 ASP A 518 12.167 -26.993 -2.315 1.00 0.00 O ATOM 0 H ASP A 518 13.786 -24.187 -4.594 1.00 0.00 H new ATOM 0 HA ASP A 518 13.301 -26.633 -5.961 1.00 0.00 H new ATOM 0 HB2 ASP A 518 11.892 -24.951 -3.889 1.00 0.00 H new ATOM 0 HB3 ASP A 518 10.972 -26.215 -4.680 1.00 0.00 H new ATOM 840 N VAL A 519 11.809 -24.012 -7.100 1.00 0.00 N ATOM 841 CA VAL A 519 10.980 -23.517 -8.191 1.00 0.00 C ATOM 842 C VAL A 519 11.663 -23.961 -9.467 1.00 0.00 C ATOM 843 O VAL A 519 11.035 -24.487 -10.383 1.00 0.00 O ATOM 844 CB VAL A 519 10.874 -21.981 -8.151 1.00 0.00 C ATOM 845 CG1 VAL A 519 10.026 -21.450 -9.312 1.00 0.00 C ATOM 846 CG2 VAL A 519 10.281 -21.537 -6.818 1.00 0.00 C ATOM 0 H VAL A 519 12.329 -23.291 -6.599 1.00 0.00 H new ATOM 0 HA VAL A 519 9.964 -23.906 -8.118 1.00 0.00 H new ATOM 0 HB VAL A 519 11.877 -21.568 -8.255 1.00 0.00 H new ATOM 0 HG11 VAL A 519 9.971 -20.363 -9.255 1.00 0.00 H new ATOM 0 HG12 VAL A 519 10.482 -21.741 -10.258 1.00 0.00 H new ATOM 0 HG13 VAL A 519 9.021 -21.868 -9.250 1.00 0.00 H new ATOM 0 HG21 VAL A 519 10.209 -20.450 -6.796 1.00 0.00 H new ATOM 0 HG22 VAL A 519 9.287 -21.969 -6.700 1.00 0.00 H new ATOM 0 HG23 VAL A 519 10.923 -21.874 -6.004 1.00 0.00 H new ATOM 856 N VAL A 520 12.973 -23.776 -9.506 1.00 0.00 N ATOM 857 CA VAL A 520 13.778 -24.180 -10.653 1.00 0.00 C ATOM 858 C VAL A 520 13.675 -25.698 -10.790 1.00 0.00 C ATOM 859 O VAL A 520 13.614 -26.235 -11.899 1.00 0.00 O ATOM 860 CB VAL A 520 15.258 -23.722 -10.480 1.00 0.00 C ATOM 861 CG1 VAL A 520 16.100 -24.090 -11.707 1.00 0.00 C ATOM 862 CG2 VAL A 520 15.319 -22.200 -10.254 1.00 0.00 C ATOM 0 H VAL A 520 13.507 -23.345 -8.751 1.00 0.00 H new ATOM 0 HA VAL A 520 13.407 -23.705 -11.561 1.00 0.00 H new ATOM 0 HB VAL A 520 15.667 -24.238 -9.612 1.00 0.00 H new ATOM 0 HG11 VAL A 520 17.127 -23.758 -11.556 1.00 0.00 H new ATOM 0 HG12 VAL A 520 16.085 -25.171 -11.848 1.00 0.00 H new ATOM 0 HG13 VAL A 520 15.687 -23.604 -12.591 1.00 0.00 H new ATOM 0 HG21 VAL A 520 16.357 -21.891 -10.134 1.00 0.00 H new ATOM 0 HG22 VAL A 520 14.884 -21.687 -11.112 1.00 0.00 H new ATOM 0 HG23 VAL A 520 14.758 -21.943 -9.355 1.00 0.00 H new ATOM 872 N ALA A 521 13.628 -26.394 -9.662 1.00 0.00 N ATOM 873 CA ALA A 521 13.481 -27.839 -9.667 1.00 0.00 C ATOM 874 C ALA A 521 12.157 -28.264 -10.309 1.00 0.00 C ATOM 875 O ALA A 521 12.114 -29.286 -10.988 1.00 0.00 O ATOM 876 CB ALA A 521 13.597 -28.398 -8.243 1.00 0.00 C ATOM 0 H ALA A 521 13.690 -25.979 -8.732 1.00 0.00 H new ATOM 0 HA ALA A 521 14.289 -28.254 -10.269 1.00 0.00 H new ATOM 0 HB1 ALA A 521 13.484 -29.482 -8.267 1.00 0.00 H new ATOM 0 HB2 ALA A 521 14.574 -28.144 -7.831 1.00 0.00 H new ATOM 0 HB3 ALA A 521 12.816 -27.966 -7.618 1.00 0.00 H new ATOM 882 N THR A 522 11.087 -27.499 -10.120 1.00 0.00 N ATOM 883 CA THR A 522 9.809 -27.856 -10.715 1.00 0.00 C ATOM 884 C THR A 522 9.812 -27.494 -12.189 1.00 0.00 C ATOM 885 O THR A 522 9.306 -28.237 -13.013 1.00 0.00 O ATOM 886 CB THR A 522 8.639 -27.154 -10.016 1.00 0.00 C ATOM 887 OG1 THR A 522 8.638 -27.512 -8.630 1.00 0.00 O ATOM 888 CG2 THR A 522 7.321 -27.588 -10.638 1.00 0.00 C ATOM 0 H THR A 522 11.080 -26.641 -9.568 1.00 0.00 H new ATOM 0 HA THR A 522 9.675 -28.931 -10.594 1.00 0.00 H new ATOM 0 HB THR A 522 8.752 -26.076 -10.128 1.00 0.00 H new ATOM 0 HG1 THR A 522 8.502 -26.709 -8.085 1.00 0.00 H new ATOM 0 HG21 THR A 522 6.497 -27.083 -10.134 1.00 0.00 H new ATOM 0 HG22 THR A 522 7.314 -27.326 -11.696 1.00 0.00 H new ATOM 0 HG23 THR A 522 7.206 -28.667 -10.531 1.00 0.00 H new ATOM 896 N LEU A 523 10.401 -26.362 -12.531 1.00 0.00 N ATOM 897 CA LEU A 523 10.479 -25.926 -13.926 1.00 0.00 C ATOM 898 C LEU A 523 11.214 -26.954 -14.795 1.00 0.00 C ATOM 899 O LEU A 523 10.893 -27.139 -15.967 1.00 0.00 O ATOM 900 CB LEU A 523 11.151 -24.562 -14.004 1.00 0.00 C ATOM 901 CG LEU A 523 10.300 -23.422 -13.417 1.00 0.00 C ATOM 902 CD1 LEU A 523 11.169 -22.254 -13.153 1.00 0.00 C ATOM 903 CD2 LEU A 523 9.183 -23.005 -14.346 1.00 0.00 C ATOM 0 H LEU A 523 10.835 -25.723 -11.865 1.00 0.00 H new ATOM 0 HA LEU A 523 9.465 -25.841 -14.318 1.00 0.00 H new ATOM 0 HB2 LEU A 523 12.102 -24.604 -13.474 1.00 0.00 H new ATOM 0 HB3 LEU A 523 11.377 -24.336 -15.046 1.00 0.00 H new ATOM 0 HG LEU A 523 9.848 -23.788 -12.495 1.00 0.00 H new ATOM 0 HD11 LEU A 523 10.572 -21.443 -12.737 1.00 0.00 H new ATOM 0 HD12 LEU A 523 11.947 -22.533 -12.443 1.00 0.00 H new ATOM 0 HD13 LEU A 523 11.629 -21.925 -14.085 1.00 0.00 H new ATOM 0 HD21 LEU A 523 8.611 -22.198 -13.888 1.00 0.00 H new ATOM 0 HD22 LEU A 523 9.605 -22.660 -15.290 1.00 0.00 H new ATOM 0 HD23 LEU A 523 8.527 -23.856 -14.531 1.00 0.00 H new ATOM 915 N LYS A 524 12.177 -27.659 -14.215 1.00 0.00 N ATOM 916 CA LYS A 524 12.861 -28.740 -14.936 1.00 0.00 C ATOM 917 C LYS A 524 11.894 -29.885 -15.267 1.00 0.00 C ATOM 918 O LYS A 524 12.076 -30.580 -16.263 1.00 0.00 O ATOM 919 CB LYS A 524 14.048 -29.276 -14.123 1.00 0.00 C ATOM 920 CG LYS A 524 15.243 -28.310 -14.080 1.00 0.00 C ATOM 921 CD LYS A 524 16.483 -28.903 -13.381 1.00 0.00 C ATOM 922 CE LYS A 524 16.275 -29.094 -11.874 1.00 0.00 C ATOM 923 NZ LYS A 524 17.526 -29.583 -11.173 1.00 0.00 N ATOM 0 H LYS A 524 12.503 -27.510 -13.260 1.00 0.00 H new ATOM 0 HA LYS A 524 13.236 -28.323 -15.871 1.00 0.00 H new ATOM 0 HB2 LYS A 524 13.719 -29.481 -13.104 1.00 0.00 H new ATOM 0 HB3 LYS A 524 14.372 -30.225 -14.550 1.00 0.00 H new ATOM 0 HG2 LYS A 524 15.509 -28.027 -15.098 1.00 0.00 H new ATOM 0 HG3 LYS A 524 14.945 -27.398 -13.563 1.00 0.00 H new ATOM 0 HD2 LYS A 524 16.727 -29.863 -13.835 1.00 0.00 H new ATOM 0 HD3 LYS A 524 17.337 -28.246 -13.546 1.00 0.00 H new ATOM 0 HE2 LYS A 524 15.960 -28.149 -11.431 1.00 0.00 H new ATOM 0 HE3 LYS A 524 15.468 -29.808 -11.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 524 17.333 -29.696 -10.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 524 17.814 -30.498 -11.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 524 18.291 -28.891 -11.305 1.00 0.00 H new ATOM 937 N LYS A 525 10.872 -30.075 -14.442 1.00 0.00 N ATOM 938 CA LYS A 525 9.892 -31.152 -14.651 1.00 0.00 C ATOM 939 C LYS A 525 8.932 -30.842 -15.791 1.00 0.00 C ATOM 940 O LYS A 525 8.616 -31.709 -16.594 1.00 0.00 O ATOM 941 CB LYS A 525 9.073 -31.405 -13.379 1.00 0.00 C ATOM 942 CG LYS A 525 9.922 -31.702 -12.153 1.00 0.00 C ATOM 943 CD LYS A 525 9.064 -31.941 -10.915 1.00 0.00 C ATOM 944 CE LYS A 525 9.934 -31.933 -9.655 1.00 0.00 C ATOM 945 NZ LYS A 525 9.157 -32.327 -8.424 1.00 0.00 N ATOM 0 H LYS A 525 10.694 -29.500 -13.618 1.00 0.00 H new ATOM 0 HA LYS A 525 10.467 -32.042 -14.908 1.00 0.00 H new ATOM 0 HB2 LYS A 525 8.453 -30.532 -13.177 1.00 0.00 H new ATOM 0 HB3 LYS A 525 8.397 -32.242 -13.553 1.00 0.00 H new ATOM 0 HG2 LYS A 525 10.540 -32.580 -12.342 1.00 0.00 H new ATOM 0 HG3 LYS A 525 10.600 -30.869 -11.970 1.00 0.00 H new ATOM 0 HD2 LYS A 525 8.298 -31.169 -10.841 1.00 0.00 H new ATOM 0 HD3 LYS A 525 8.547 -32.896 -11.002 1.00 0.00 H new ATOM 0 HE2 LYS A 525 10.771 -32.618 -9.789 1.00 0.00 H new ATOM 0 HE3 LYS A 525 10.356 -30.938 -9.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 525 9.786 -32.308 -7.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 525 8.373 -31.659 -8.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 525 8.775 -33.287 -8.547 1.00 0.00 H new ATOM 959 N ILE A 526 8.458 -29.609 -15.857 1.00 0.00 N ATOM 960 CA ILE A 526 7.470 -29.238 -16.874 1.00 0.00 C ATOM 961 C ILE A 526 8.040 -28.988 -18.258 1.00 0.00 C ATOM 962 O ILE A 526 7.340 -29.107 -19.240 1.00 0.00 O ATOM 963 CB ILE A 526 6.642 -28.019 -16.459 1.00 0.00 C ATOM 964 CG1 ILE A 526 7.459 -27.088 -15.565 1.00 0.00 C ATOM 965 CG2 ILE A 526 5.424 -28.490 -15.722 1.00 0.00 C ATOM 966 CD1 ILE A 526 6.882 -25.721 -15.381 1.00 0.00 C ATOM 0 H ILE A 526 8.732 -28.852 -15.231 1.00 0.00 H new ATOM 0 HA ILE A 526 6.835 -30.121 -16.940 1.00 0.00 H new ATOM 0 HB ILE A 526 6.350 -27.464 -17.351 1.00 0.00 H new ATOM 0 HG12 ILE A 526 7.570 -27.554 -14.586 1.00 0.00 H new ATOM 0 HG13 ILE A 526 8.459 -26.990 -15.986 1.00 0.00 H new ATOM 0 HG21 ILE A 526 4.826 -27.630 -15.421 1.00 0.00 H new ATOM 0 HG22 ILE A 526 4.832 -29.134 -16.372 1.00 0.00 H new ATOM 0 HG23 ILE A 526 5.728 -29.048 -14.837 1.00 0.00 H new ATOM 0 HD11 ILE A 526 7.533 -25.136 -14.732 1.00 0.00 H new ATOM 0 HD12 ILE A 526 6.798 -25.228 -16.350 1.00 0.00 H new ATOM 0 HD13 ILE A 526 5.894 -25.801 -14.927 1.00 0.00 H new ATOM 978 N ARG A 527 9.320 -28.676 -18.339 1.00 0.00 N ATOM 979 CA ARG A 527 10.007 -28.492 -19.627 1.00 0.00 C ATOM 980 C ARG A 527 9.975 -29.766 -20.470 1.00 0.00 C ATOM 981 O ARG A 527 10.191 -29.728 -21.662 1.00 0.00 O ATOM 982 CB ARG A 527 11.470 -28.154 -19.343 1.00 0.00 C ATOM 983 CG ARG A 527 11.843 -26.736 -19.518 1.00 0.00 C ATOM 984 CD ARG A 527 13.130 -26.609 -20.331 1.00 0.00 C ATOM 985 NE ARG A 527 14.308 -27.208 -19.683 1.00 0.00 N ATOM 986 CZ ARG A 527 15.557 -27.083 -20.122 1.00 0.00 C ATOM 987 NH1 ARG A 527 15.858 -26.387 -21.193 1.00 0.00 N ATOM 988 NH2 ARG A 527 16.525 -27.668 -19.472 1.00 0.00 N ATOM 0 H ARG A 527 9.920 -28.541 -17.525 1.00 0.00 H new ATOM 0 HA ARG A 527 9.501 -27.698 -20.176 1.00 0.00 H new ATOM 0 HB2 ARG A 527 11.700 -28.448 -18.319 1.00 0.00 H new ATOM 0 HB3 ARG A 527 12.098 -28.760 -19.997 1.00 0.00 H new ATOM 0 HG2 ARG A 527 11.036 -26.203 -20.021 1.00 0.00 H new ATOM 0 HG3 ARG A 527 11.976 -26.267 -18.543 1.00 0.00 H new ATOM 0 HD2 ARG A 527 12.982 -27.082 -21.302 1.00 0.00 H new ATOM 0 HD3 ARG A 527 13.328 -25.553 -20.517 1.00 0.00 H new ATOM 0 HE ARG A 527 14.156 -27.758 -18.838 1.00 0.00 H new ATOM 0 HH11 ARG A 527 15.121 -25.918 -21.720 1.00 0.00 H new ATOM 0 HH12 ARG A 527 16.829 -26.315 -21.498 1.00 0.00 H new ATOM 0 HH21 ARG A 527 16.320 -28.215 -18.636 1.00 0.00 H new ATOM 0 HH22 ARG A 527 17.487 -27.579 -19.800 1.00 0.00 H new ATOM 1002 N ARG A 528 9.717 -30.892 -19.819 1.00 0.00 N ATOM 1003 CA ARG A 528 9.621 -32.201 -20.482 1.00 0.00 C ATOM 1004 C ARG A 528 8.226 -32.822 -20.304 1.00 0.00 C ATOM 1005 O ARG A 528 8.054 -34.036 -20.448 1.00 0.00 O ATOM 1006 CB ARG A 528 10.723 -33.130 -19.944 1.00 0.00 C ATOM 1007 CG ARG A 528 10.676 -33.357 -18.431 1.00 0.00 C ATOM 1008 CD ARG A 528 11.919 -34.071 -17.928 1.00 0.00 C ATOM 1009 NE ARG A 528 12.020 -35.451 -18.435 1.00 0.00 N ATOM 1010 CZ ARG A 528 13.031 -36.283 -18.196 1.00 0.00 C ATOM 1011 NH1 ARG A 528 14.069 -35.935 -17.475 1.00 0.00 N ATOM 1012 NH2 ARG A 528 12.997 -37.488 -18.692 1.00 0.00 N ATOM 0 H ARG A 528 9.566 -30.931 -18.811 1.00 0.00 H new ATOM 0 HA ARG A 528 9.768 -32.064 -21.553 1.00 0.00 H new ATOM 0 HB2 ARG A 528 10.646 -34.094 -20.446 1.00 0.00 H new ATOM 0 HB3 ARG A 528 11.694 -32.711 -20.206 1.00 0.00 H new ATOM 0 HG2 ARG A 528 10.577 -32.398 -17.923 1.00 0.00 H new ATOM 0 HG3 ARG A 528 9.793 -33.944 -18.179 1.00 0.00 H new ATOM 0 HD2 ARG A 528 12.804 -33.510 -18.230 1.00 0.00 H new ATOM 0 HD3 ARG A 528 11.909 -34.087 -16.838 1.00 0.00 H new ATOM 0 HE ARG A 528 11.255 -35.796 -19.015 1.00 0.00 H new ATOM 0 HH11 ARG A 528 14.121 -34.998 -17.075 1.00 0.00 H new ATOM 0 HH12 ARG A 528 14.824 -36.601 -17.314 1.00 0.00 H new ATOM 0 HH21 ARG A 528 12.201 -37.785 -19.257 1.00 0.00 H new ATOM 0 HH22 ARG A 528 13.766 -38.134 -18.515 1.00 0.00 H new ATOM 1026 N TYR A 529 7.243 -31.994 -19.975 1.00 0.00 N ATOM 1027 CA TYR A 529 5.872 -32.449 -19.742 1.00 0.00 C ATOM 1028 C TYR A 529 5.237 -32.971 -21.031 1.00 0.00 C ATOM 1029 O TYR A 529 5.098 -32.242 -22.002 1.00 0.00 O ATOM 1030 CB TYR A 529 5.057 -31.279 -19.189 1.00 0.00 C ATOM 1031 CG TYR A 529 3.757 -31.668 -18.533 1.00 0.00 C ATOM 1032 CD1 TYR A 529 2.538 -31.124 -18.977 1.00 0.00 C ATOM 1033 CD2 TYR A 529 3.736 -32.569 -17.450 1.00 0.00 C ATOM 1034 CE1 TYR A 529 1.316 -31.455 -18.336 1.00 0.00 C ATOM 1035 CE2 TYR A 529 2.509 -32.918 -16.814 1.00 0.00 C ATOM 1036 CZ TYR A 529 1.311 -32.349 -17.263 1.00 0.00 C ATOM 1037 OH TYR A 529 0.123 -32.663 -16.656 1.00 0.00 O ATOM 0 H TYR A 529 7.370 -30.988 -19.861 1.00 0.00 H new ATOM 0 HA TYR A 529 5.885 -33.270 -19.026 1.00 0.00 H new ATOM 0 HB2 TYR A 529 5.667 -30.741 -18.464 1.00 0.00 H new ATOM 0 HB3 TYR A 529 4.844 -30.586 -20.003 1.00 0.00 H new ATOM 0 HD1 TYR A 529 2.532 -30.445 -19.817 1.00 0.00 H new ATOM 0 HD2 TYR A 529 4.661 -33.001 -17.097 1.00 0.00 H new ATOM 0 HE1 TYR A 529 0.390 -31.016 -18.678 1.00 0.00 H new ATOM 0 HE2 TYR A 529 2.503 -33.617 -15.991 1.00 0.00 H new ATOM 0 HH TYR A 529 0.286 -33.298 -15.928 1.00 0.00 H new ATOM 1047 N LYS A 530 4.865 -34.245 -21.042 1.00 0.00 N ATOM 1048 CA LYS A 530 4.306 -34.869 -22.247 1.00 0.00 C ATOM 1049 C LYS A 530 2.819 -34.650 -22.483 1.00 0.00 C ATOM 1050 O LYS A 530 2.378 -34.715 -23.617 1.00 0.00 O ATOM 1051 CB LYS A 530 4.547 -36.380 -22.219 1.00 0.00 C ATOM 1052 CG LYS A 530 5.886 -36.793 -22.801 1.00 0.00 C ATOM 1053 CD LYS A 530 5.973 -38.315 -22.909 1.00 0.00 C ATOM 1054 CE LYS A 530 7.188 -38.756 -23.724 1.00 0.00 C ATOM 1055 NZ LYS A 530 8.482 -38.371 -23.073 1.00 0.00 N ATOM 0 H LYS A 530 4.937 -34.868 -20.238 1.00 0.00 H new ATOM 0 HA LYS A 530 4.829 -34.370 -23.063 1.00 0.00 H new ATOM 0 HB2 LYS A 530 4.485 -36.730 -21.189 1.00 0.00 H new ATOM 0 HB3 LYS A 530 3.751 -36.877 -22.773 1.00 0.00 H new ATOM 0 HG2 LYS A 530 6.016 -36.344 -23.786 1.00 0.00 H new ATOM 0 HG3 LYS A 530 6.694 -36.420 -22.172 1.00 0.00 H new ATOM 0 HD2 LYS A 530 6.028 -38.748 -21.910 1.00 0.00 H new ATOM 0 HD3 LYS A 530 5.065 -38.699 -23.373 1.00 0.00 H new ATOM 0 HE2 LYS A 530 7.159 -39.837 -23.858 1.00 0.00 H new ATOM 0 HE3 LYS A 530 7.137 -38.310 -24.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 530 9.276 -38.691 -23.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 530 8.524 -37.337 -22.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 530 8.545 -38.817 -22.136 1.00 0.00 H new ATOM 1069 N ALA A 531 2.048 -34.418 -21.430 1.00 0.00 N ATOM 1070 CA ALA A 531 0.597 -34.295 -21.581 1.00 0.00 C ATOM 1071 C ALA A 531 0.222 -33.086 -22.436 1.00 0.00 C ATOM 1072 O ALA A 531 -0.686 -33.150 -23.254 1.00 0.00 O ATOM 1073 CB ALA A 531 -0.071 -34.201 -20.210 1.00 0.00 C ATOM 0 H ALA A 531 2.391 -34.312 -20.475 1.00 0.00 H new ATOM 0 HA ALA A 531 0.239 -35.188 -22.093 1.00 0.00 H new ATOM 0 HB1 ALA A 531 -1.150 -34.110 -20.336 1.00 0.00 H new ATOM 0 HB2 ALA A 531 0.152 -35.099 -19.634 1.00 0.00 H new ATOM 0 HB3 ALA A 531 0.307 -33.327 -19.680 1.00 0.00 H new ATOM 1079 N ASN A 532 0.921 -31.980 -22.232 1.00 0.00 N ATOM 1080 CA ASN A 532 0.640 -30.756 -22.968 1.00 0.00 C ATOM 1081 C ASN A 532 1.934 -30.152 -23.497 1.00 0.00 C ATOM 1082 O ASN A 532 2.794 -29.740 -22.718 1.00 0.00 O ATOM 1083 CB ASN A 532 -0.053 -29.747 -22.049 1.00 0.00 C ATOM 1084 CG ASN A 532 -1.329 -30.282 -21.448 1.00 0.00 C ATOM 1085 OD1 ASN A 532 -1.422 -30.448 -20.248 1.00 0.00 O ATOM 1086 ND2 ASN A 532 -2.311 -30.540 -22.267 1.00 0.00 N ATOM 0 H ASN A 532 1.687 -31.904 -21.563 1.00 0.00 H new ATOM 0 HA ASN A 532 -0.013 -30.994 -23.808 1.00 0.00 H new ATOM 0 HB2 ASN A 532 0.630 -29.464 -21.248 1.00 0.00 H new ATOM 0 HB3 ASN A 532 -0.275 -28.841 -22.613 1.00 0.00 H new ATOM 0 HD21 ASN A 532 -3.197 -30.895 -21.906 1.00 0.00 H new ATOM 0 HD22 ASN A 532 -2.193 -30.387 -23.269 1.00 0.00 H new ATOM 1093 N LYS A 533 2.061 -30.088 -24.818 1.00 0.00 N ATOM 1094 CA LYS A 533 3.239 -29.491 -25.463 1.00 0.00 C ATOM 1095 C LYS A 533 3.407 -28.058 -25.000 1.00 0.00 C ATOM 1096 O LYS A 533 4.501 -27.640 -24.696 1.00 0.00 O ATOM 1097 CB LYS A 533 3.054 -29.517 -26.988 1.00 0.00 C ATOM 1098 CG LYS A 533 4.126 -28.804 -27.843 1.00 0.00 C ATOM 1099 CD LYS A 533 5.537 -29.362 -27.690 1.00 0.00 C ATOM 1100 CE LYS A 533 6.427 -28.834 -28.820 1.00 0.00 C ATOM 1101 NZ LYS A 533 7.895 -28.832 -28.474 1.00 0.00 N ATOM 0 H LYS A 533 1.362 -30.442 -25.471 1.00 0.00 H new ATOM 0 HA LYS A 533 4.126 -30.063 -25.191 1.00 0.00 H new ATOM 0 HB2 LYS A 533 3.008 -30.559 -27.305 1.00 0.00 H new ATOM 0 HB3 LYS A 533 2.087 -29.071 -27.218 1.00 0.00 H new ATOM 0 HG2 LYS A 533 3.836 -28.868 -28.892 1.00 0.00 H new ATOM 0 HG3 LYS A 533 4.137 -27.746 -27.579 1.00 0.00 H new ATOM 0 HD2 LYS A 533 5.950 -29.073 -26.724 1.00 0.00 H new ATOM 0 HD3 LYS A 533 5.512 -30.451 -27.713 1.00 0.00 H new ATOM 0 HE2 LYS A 533 6.272 -29.444 -29.710 1.00 0.00 H new ATOM 0 HE3 LYS A 533 6.119 -27.819 -29.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 533 8.438 -28.433 -29.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 533 8.050 -28.256 -27.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 533 8.211 -29.807 -28.295 1.00 0.00 H new ATOM 1115 N ASP A 534 2.306 -27.327 -24.942 1.00 0.00 N ATOM 1116 CA ASP A 534 2.315 -25.915 -24.553 1.00 0.00 C ATOM 1117 C ASP A 534 3.032 -25.667 -23.232 1.00 0.00 C ATOM 1118 O ASP A 534 3.846 -24.757 -23.115 1.00 0.00 O ATOM 1119 CB ASP A 534 0.875 -25.447 -24.413 1.00 0.00 C ATOM 1120 CG ASP A 534 0.417 -24.622 -25.582 1.00 0.00 C ATOM 1121 OD1 ASP A 534 1.076 -23.618 -25.903 1.00 0.00 O ATOM 1122 OD2 ASP A 534 -0.619 -24.980 -26.175 1.00 0.00 O ATOM 0 H ASP A 534 1.378 -27.690 -25.162 1.00 0.00 H new ATOM 0 HA ASP A 534 2.852 -25.365 -25.326 1.00 0.00 H new ATOM 0 HB2 ASP A 534 0.224 -26.315 -24.309 1.00 0.00 H new ATOM 0 HB3 ASP A 534 0.775 -24.862 -23.499 1.00 0.00 H new ATOM 1127 N VAL A 535 2.734 -26.490 -22.237 1.00 0.00 N ATOM 1128 CA VAL A 535 3.373 -26.365 -20.927 1.00 0.00 C ATOM 1129 C VAL A 535 4.882 -26.495 -21.074 1.00 0.00 C ATOM 1130 O VAL A 535 5.626 -25.725 -20.489 1.00 0.00 O ATOM 1131 CB VAL A 535 2.866 -27.455 -19.940 1.00 0.00 C ATOM 1132 CG1 VAL A 535 3.647 -27.424 -18.640 1.00 0.00 C ATOM 1133 CG2 VAL A 535 1.392 -27.258 -19.648 1.00 0.00 C ATOM 0 H VAL A 535 2.057 -27.250 -22.307 1.00 0.00 H new ATOM 0 HA VAL A 535 3.116 -25.385 -20.525 1.00 0.00 H new ATOM 0 HB VAL A 535 3.016 -28.425 -20.413 1.00 0.00 H new ATOM 0 HG11 VAL A 535 3.270 -28.197 -17.970 1.00 0.00 H new ATOM 0 HG12 VAL A 535 4.702 -27.605 -18.845 1.00 0.00 H new ATOM 0 HG13 VAL A 535 3.531 -26.448 -18.169 1.00 0.00 H new ATOM 0 HG21 VAL A 535 1.052 -28.028 -18.956 1.00 0.00 H new ATOM 0 HG22 VAL A 535 1.238 -26.276 -19.202 1.00 0.00 H new ATOM 0 HG23 VAL A 535 0.825 -27.328 -20.576 1.00 0.00 H new ATOM 1143 N MET A 536 5.328 -27.461 -21.862 1.00 0.00 N ATOM 1144 CA MET A 536 6.758 -27.689 -22.071 1.00 0.00 C ATOM 1145 C MET A 536 7.370 -26.493 -22.760 1.00 0.00 C ATOM 1146 O MET A 536 8.432 -26.040 -22.350 1.00 0.00 O ATOM 1147 CB MET A 536 6.963 -28.990 -22.864 1.00 0.00 C ATOM 1148 CG MET A 536 8.060 -28.967 -23.934 1.00 0.00 C ATOM 1149 SD MET A 536 8.519 -30.636 -24.527 1.00 0.00 S ATOM 1150 CE MET A 536 6.927 -31.416 -24.854 1.00 0.00 C ATOM 0 H MET A 536 4.722 -28.104 -22.371 1.00 0.00 H new ATOM 0 HA MET A 536 7.265 -27.806 -21.113 1.00 0.00 H new ATOM 0 HB2 MET A 536 7.190 -29.789 -22.158 1.00 0.00 H new ATOM 0 HB3 MET A 536 6.020 -29.249 -23.346 1.00 0.00 H new ATOM 0 HG2 MET A 536 7.722 -28.368 -24.779 1.00 0.00 H new ATOM 0 HG3 MET A 536 8.945 -28.476 -23.528 1.00 0.00 H new ATOM 0 HE1 MET A 536 7.032 -32.128 -25.673 1.00 0.00 H new ATOM 0 HE2 MET A 536 6.587 -31.939 -23.960 1.00 0.00 H new ATOM 0 HE3 MET A 536 6.198 -30.654 -25.128 1.00 0.00 H new ATOM 1160 N GLU A 537 6.709 -25.968 -23.778 1.00 0.00 N ATOM 1161 CA GLU A 537 7.243 -24.818 -24.501 1.00 0.00 C ATOM 1162 C GLU A 537 7.355 -23.592 -23.610 1.00 0.00 C ATOM 1163 O GLU A 537 8.401 -22.938 -23.580 1.00 0.00 O ATOM 1164 CB GLU A 537 6.364 -24.482 -25.702 1.00 0.00 C ATOM 1165 CG GLU A 537 6.177 -25.631 -26.664 1.00 0.00 C ATOM 1166 CD GLU A 537 7.389 -25.917 -27.527 1.00 0.00 C ATOM 1167 OE1 GLU A 537 7.341 -25.660 -28.743 1.00 0.00 O ATOM 1168 OE2 GLU A 537 8.389 -26.458 -26.997 1.00 0.00 O ATOM 0 H GLU A 537 5.812 -26.312 -24.122 1.00 0.00 H new ATOM 0 HA GLU A 537 8.242 -25.093 -24.840 1.00 0.00 H new ATOM 0 HB2 GLU A 537 5.387 -24.157 -25.345 1.00 0.00 H new ATOM 0 HB3 GLU A 537 6.804 -23.641 -26.237 1.00 0.00 H new ATOM 0 HG2 GLU A 537 5.927 -26.528 -26.098 1.00 0.00 H new ATOM 0 HG3 GLU A 537 5.326 -25.415 -27.311 1.00 0.00 H new ATOM 1175 N LYS A 538 6.308 -23.253 -22.867 1.00 0.00 N ATOM 1176 CA LYS A 538 6.406 -22.056 -22.038 1.00 0.00 C ATOM 1177 C LYS A 538 7.333 -22.260 -20.854 1.00 0.00 C ATOM 1178 O LYS A 538 8.088 -21.367 -20.504 1.00 0.00 O ATOM 1179 CB LYS A 538 5.032 -21.602 -21.581 1.00 0.00 C ATOM 1180 CG LYS A 538 4.959 -20.129 -21.197 1.00 0.00 C ATOM 1181 CD LYS A 538 5.013 -19.236 -22.433 1.00 0.00 C ATOM 1182 CE LYS A 538 5.046 -17.765 -22.067 1.00 0.00 C ATOM 1183 NZ LYS A 538 5.269 -16.928 -23.295 1.00 0.00 N ATOM 0 H LYS A 538 5.424 -23.759 -22.819 1.00 0.00 H new ATOM 0 HA LYS A 538 6.840 -21.269 -22.654 1.00 0.00 H new ATOM 0 HB2 LYS A 538 4.314 -21.795 -22.378 1.00 0.00 H new ATOM 0 HB3 LYS A 538 4.728 -22.205 -20.725 1.00 0.00 H new ATOM 0 HG2 LYS A 538 4.037 -19.939 -20.647 1.00 0.00 H new ATOM 0 HG3 LYS A 538 5.785 -19.882 -20.530 1.00 0.00 H new ATOM 0 HD2 LYS A 538 5.897 -19.484 -23.021 1.00 0.00 H new ATOM 0 HD3 LYS A 538 4.145 -19.434 -23.062 1.00 0.00 H new ATOM 0 HE2 LYS A 538 4.108 -17.481 -21.590 1.00 0.00 H new ATOM 0 HE3 LYS A 538 5.840 -17.581 -21.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 538 5.623 -15.991 -23.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 538 5.967 -17.393 -23.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 538 4.372 -16.820 -23.809 1.00 0.00 H new ATOM 1197 N ALA A 539 7.301 -23.438 -20.245 1.00 0.00 N ATOM 1198 CA ALA A 539 8.183 -23.737 -19.115 1.00 0.00 C ATOM 1199 C ALA A 539 9.614 -23.564 -19.553 1.00 0.00 C ATOM 1200 O ALA A 539 10.446 -23.066 -18.826 1.00 0.00 O ATOM 1201 CB ALA A 539 7.971 -25.157 -18.645 1.00 0.00 C ATOM 0 H ALA A 539 6.679 -24.201 -20.510 1.00 0.00 H new ATOM 0 HA ALA A 539 7.956 -23.058 -18.293 1.00 0.00 H new ATOM 0 HB1 ALA A 539 8.633 -25.365 -17.805 1.00 0.00 H new ATOM 0 HB2 ALA A 539 6.935 -25.285 -18.331 1.00 0.00 H new ATOM 0 HB3 ALA A 539 8.191 -25.847 -19.460 1.00 0.00 H new ATOM 1207 N ALA A 540 9.869 -24.006 -20.762 1.00 0.00 N ATOM 1208 CA ALA A 540 11.185 -23.897 -21.380 1.00 0.00 C ATOM 1209 C ALA A 540 11.653 -22.481 -21.583 1.00 0.00 C ATOM 1210 O ALA A 540 12.771 -22.142 -21.194 1.00 0.00 O ATOM 1211 CB ALA A 540 11.201 -24.623 -22.709 1.00 0.00 C ATOM 0 H ALA A 540 9.171 -24.455 -21.354 1.00 0.00 H new ATOM 0 HA ALA A 540 11.879 -24.359 -20.677 1.00 0.00 H new ATOM 0 HB1 ALA A 540 12.189 -24.534 -23.160 1.00 0.00 H new ATOM 0 HB2 ALA A 540 10.968 -25.676 -22.551 1.00 0.00 H new ATOM 0 HB3 ALA A 540 10.458 -24.182 -23.373 1.00 0.00 H new ATOM 1217 N GLU A 541 10.815 -21.664 -22.194 1.00 0.00 N ATOM 1218 CA GLU A 541 11.164 -20.280 -22.456 1.00 0.00 C ATOM 1219 C GLU A 541 11.472 -19.615 -21.113 1.00 0.00 C ATOM 1220 O GLU A 541 12.448 -18.882 -20.969 1.00 0.00 O ATOM 1221 CB GLU A 541 9.996 -19.596 -23.192 1.00 0.00 C ATOM 1222 CG GLU A 541 9.626 -18.230 -22.635 1.00 0.00 C ATOM 1223 CD GLU A 541 8.475 -17.551 -23.355 1.00 0.00 C ATOM 1224 OE1 GLU A 541 7.791 -18.184 -24.175 1.00 0.00 O ATOM 1225 OE2 GLU A 541 8.241 -16.355 -23.071 1.00 0.00 O ATOM 0 H GLU A 541 9.887 -21.935 -22.518 1.00 0.00 H new ATOM 0 HA GLU A 541 12.043 -20.197 -23.096 1.00 0.00 H new ATOM 0 HB2 GLU A 541 10.257 -19.489 -24.245 1.00 0.00 H new ATOM 0 HB3 GLU A 541 9.121 -20.245 -23.145 1.00 0.00 H new ATOM 0 HG2 GLU A 541 9.367 -18.338 -21.582 1.00 0.00 H new ATOM 0 HG3 GLU A 541 10.501 -17.582 -22.683 1.00 0.00 H new ATOM 1232 N VAL A 542 10.639 -19.892 -20.124 1.00 0.00 N ATOM 1233 CA VAL A 542 10.771 -19.292 -18.812 1.00 0.00 C ATOM 1234 C VAL A 542 12.011 -19.778 -18.113 1.00 0.00 C ATOM 1235 O VAL A 542 12.800 -18.984 -17.644 1.00 0.00 O ATOM 1236 CB VAL A 542 9.530 -19.613 -17.980 1.00 0.00 C ATOM 1237 CG1 VAL A 542 9.698 -19.199 -16.519 1.00 0.00 C ATOM 1238 CG2 VAL A 542 8.350 -18.901 -18.588 1.00 0.00 C ATOM 0 H VAL A 542 9.854 -20.538 -20.210 1.00 0.00 H new ATOM 0 HA VAL A 542 10.861 -18.212 -18.930 1.00 0.00 H new ATOM 0 HB VAL A 542 9.373 -20.692 -17.989 1.00 0.00 H new ATOM 0 HG11 VAL A 542 8.793 -19.446 -15.965 1.00 0.00 H new ATOM 0 HG12 VAL A 542 10.545 -19.730 -16.085 1.00 0.00 H new ATOM 0 HG13 VAL A 542 9.876 -18.125 -16.463 1.00 0.00 H new ATOM 0 HG21 VAL A 542 7.454 -19.119 -18.006 1.00 0.00 H new ATOM 0 HG22 VAL A 542 8.532 -17.826 -18.585 1.00 0.00 H new ATOM 0 HG23 VAL A 542 8.208 -19.242 -19.614 1.00 0.00 H new ATOM 1248 N TYR A 543 12.189 -21.085 -18.053 1.00 0.00 N ATOM 1249 CA TYR A 543 13.317 -21.682 -17.360 1.00 0.00 C ATOM 1250 C TYR A 543 14.630 -21.107 -17.886 1.00 0.00 C ATOM 1251 O TYR A 543 15.511 -20.746 -17.110 1.00 0.00 O ATOM 1252 CB TYR A 543 13.275 -23.198 -17.545 1.00 0.00 C ATOM 1253 CG TYR A 543 14.505 -23.886 -17.033 1.00 0.00 C ATOM 1254 CD1 TYR A 543 14.589 -24.315 -15.697 1.00 0.00 C ATOM 1255 CD2 TYR A 543 15.606 -24.103 -17.883 1.00 0.00 C ATOM 1256 CE1 TYR A 543 15.753 -24.947 -15.215 1.00 0.00 C ATOM 1257 CE2 TYR A 543 16.775 -24.719 -17.404 1.00 0.00 C ATOM 1258 CZ TYR A 543 16.842 -25.140 -16.071 1.00 0.00 C ATOM 1259 OH TYR A 543 17.980 -25.742 -15.602 1.00 0.00 O ATOM 0 H TYR A 543 11.558 -21.762 -18.482 1.00 0.00 H new ATOM 0 HA TYR A 543 13.254 -21.451 -16.297 1.00 0.00 H new ATOM 0 HB2 TYR A 543 12.401 -23.597 -17.030 1.00 0.00 H new ATOM 0 HB3 TYR A 543 13.152 -23.426 -18.604 1.00 0.00 H new ATOM 0 HD1 TYR A 543 13.752 -24.159 -15.032 1.00 0.00 H new ATOM 0 HD2 TYR A 543 15.552 -23.792 -18.916 1.00 0.00 H new ATOM 0 HE1 TYR A 543 15.804 -25.281 -14.189 1.00 0.00 H new ATOM 0 HE2 TYR A 543 17.618 -24.867 -18.062 1.00 0.00 H new ATOM 0 HH TYR A 543 18.640 -25.801 -16.324 1.00 0.00 H new ATOM 1269 N THR A 544 14.738 -21.006 -19.201 1.00 0.00 N ATOM 1270 CA THR A 544 15.910 -20.465 -19.875 1.00 0.00 C ATOM 1271 C THR A 544 16.119 -18.996 -19.529 1.00 0.00 C ATOM 1272 O THR A 544 17.237 -18.552 -19.326 1.00 0.00 O ATOM 1273 CB THR A 544 15.701 -20.596 -21.382 1.00 0.00 C ATOM 1274 OG1 THR A 544 15.403 -21.961 -21.689 1.00 0.00 O ATOM 1275 CG2 THR A 544 16.909 -20.200 -22.157 1.00 0.00 C ATOM 0 H THR A 544 14.002 -21.302 -19.842 1.00 0.00 H new ATOM 0 HA THR A 544 16.790 -21.020 -19.550 1.00 0.00 H new ATOM 0 HB THR A 544 14.884 -19.931 -21.660 1.00 0.00 H new ATOM 0 HG1 THR A 544 14.431 -22.088 -21.707 1.00 0.00 H new ATOM 0 HG21 THR A 544 16.710 -20.311 -23.223 1.00 0.00 H new ATOM 0 HG22 THR A 544 17.156 -19.161 -21.940 1.00 0.00 H new ATOM 0 HG23 THR A 544 17.747 -20.838 -21.876 1.00 0.00 H new ATOM 1283 N ARG A 545 15.044 -18.238 -19.424 1.00 0.00 N ATOM 1284 CA ARG A 545 15.151 -16.840 -19.017 1.00 0.00 C ATOM 1285 C ARG A 545 15.738 -16.721 -17.616 1.00 0.00 C ATOM 1286 O ARG A 545 16.362 -15.721 -17.294 1.00 0.00 O ATOM 1287 CB ARG A 545 13.815 -16.151 -19.088 1.00 0.00 C ATOM 1288 CG ARG A 545 13.427 -15.817 -20.504 1.00 0.00 C ATOM 1289 CD ARG A 545 12.048 -15.348 -20.454 1.00 0.00 C ATOM 1290 NE ARG A 545 11.485 -15.016 -21.773 1.00 0.00 N ATOM 1291 CZ ARG A 545 10.547 -14.098 -21.997 1.00 0.00 C ATOM 1292 NH1 ARG A 545 10.036 -13.363 -21.036 1.00 0.00 N ATOM 1293 NH2 ARG A 545 10.124 -13.907 -23.213 1.00 0.00 N ATOM 0 H ARG A 545 14.094 -18.557 -19.612 1.00 0.00 H new ATOM 0 HA ARG A 545 15.827 -16.345 -19.714 1.00 0.00 H new ATOM 0 HB2 ARG A 545 13.053 -16.792 -18.645 1.00 0.00 H new ATOM 0 HB3 ARG A 545 13.847 -15.237 -18.496 1.00 0.00 H new ATOM 0 HG2 ARG A 545 14.083 -15.050 -20.916 1.00 0.00 H new ATOM 0 HG3 ARG A 545 13.516 -16.692 -21.148 1.00 0.00 H new ATOM 0 HD2 ARG A 545 11.430 -16.115 -19.988 1.00 0.00 H new ATOM 0 HD3 ARG A 545 11.997 -14.466 -19.815 1.00 0.00 H new ATOM 0 HE ARG A 545 11.842 -15.530 -22.579 1.00 0.00 H new ATOM 0 HH11 ARG A 545 10.357 -13.485 -20.075 1.00 0.00 H new ATOM 0 HH12 ARG A 545 9.319 -12.670 -21.250 1.00 0.00 H new ATOM 0 HH21 ARG A 545 10.511 -14.457 -23.980 1.00 0.00 H new ATOM 0 HH22 ARG A 545 9.406 -13.207 -23.399 1.00 0.00 H new ATOM 1307 N LEU A 546 15.534 -17.723 -16.766 1.00 0.00 N ATOM 1308 CA LEU A 546 16.017 -17.621 -15.389 1.00 0.00 C ATOM 1309 C LEU A 546 17.500 -17.857 -15.411 1.00 0.00 C ATOM 1310 O LEU A 546 18.248 -17.325 -14.613 1.00 0.00 O ATOM 1311 CB LEU A 546 15.354 -18.621 -14.456 1.00 0.00 C ATOM 1312 CG LEU A 546 13.872 -18.930 -14.673 1.00 0.00 C ATOM 1313 CD1 LEU A 546 13.443 -19.824 -13.573 1.00 0.00 C ATOM 1314 CD2 LEU A 546 12.907 -17.739 -14.775 1.00 0.00 C ATOM 0 H LEU A 546 15.052 -18.592 -16.995 1.00 0.00 H new ATOM 0 HA LEU A 546 15.770 -16.631 -15.006 1.00 0.00 H new ATOM 0 HB2 LEU A 546 15.905 -19.559 -14.526 1.00 0.00 H new ATOM 0 HB3 LEU A 546 15.473 -18.256 -13.436 1.00 0.00 H new ATOM 0 HG LEU A 546 13.810 -19.382 -15.663 1.00 0.00 H new ATOM 0 HD11 LEU A 546 12.387 -20.068 -13.693 1.00 0.00 H new ATOM 0 HD12 LEU A 546 14.032 -20.741 -13.598 1.00 0.00 H new ATOM 0 HD13 LEU A 546 13.593 -19.322 -12.617 1.00 0.00 H new ATOM 0 HD21 LEU A 546 11.892 -18.105 -14.928 1.00 0.00 H new ATOM 0 HD22 LEU A 546 12.948 -17.158 -13.854 1.00 0.00 H new ATOM 0 HD23 LEU A 546 13.196 -17.108 -15.616 1.00 0.00 H new ATOM 1326 N LYS A 547 17.916 -18.691 -16.352 1.00 0.00 N ATOM 1327 CA LYS A 547 19.331 -18.980 -16.547 1.00 0.00 C ATOM 1328 C LYS A 547 20.080 -17.713 -16.907 1.00 0.00 C ATOM 1329 O LYS A 547 21.182 -17.503 -16.441 1.00 0.00 O ATOM 1330 CB LYS A 547 19.504 -20.052 -17.633 1.00 0.00 C ATOM 1331 CG LYS A 547 18.780 -21.375 -17.353 1.00 0.00 C ATOM 1332 CD LYS A 547 19.165 -22.016 -16.037 1.00 0.00 C ATOM 1333 CE LYS A 547 18.253 -21.668 -14.849 1.00 0.00 C ATOM 1334 NZ LYS A 547 19.039 -20.963 -13.756 1.00 0.00 N ATOM 0 H LYS A 547 17.293 -19.181 -16.994 1.00 0.00 H new ATOM 0 HA LYS A 547 19.748 -19.366 -15.617 1.00 0.00 H new ATOM 0 HB2 LYS A 547 19.144 -19.651 -18.580 1.00 0.00 H new ATOM 0 HB3 LYS A 547 20.568 -20.255 -17.757 1.00 0.00 H new ATOM 0 HG2 LYS A 547 17.704 -21.198 -17.359 1.00 0.00 H new ATOM 0 HG3 LYS A 547 18.993 -22.073 -18.162 1.00 0.00 H new ATOM 0 HD2 LYS A 547 19.170 -23.098 -16.166 1.00 0.00 H new ATOM 0 HD3 LYS A 547 20.185 -21.719 -15.791 1.00 0.00 H new ATOM 0 HE2 LYS A 547 17.436 -21.029 -15.186 1.00 0.00 H new ATOM 0 HE3 LYS A 547 17.803 -22.578 -14.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 547 18.739 -21.321 -12.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 547 20.055 -21.145 -13.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 547 18.862 -19.939 -13.806 1.00 0.00 H new ATOM 1348 N SER A 548 19.459 -16.869 -17.711 1.00 0.00 N ATOM 1349 CA SER A 548 20.056 -15.596 -18.104 1.00 0.00 C ATOM 1350 C SER A 548 20.048 -14.535 -16.995 1.00 0.00 C ATOM 1351 O SER A 548 20.794 -13.572 -17.061 1.00 0.00 O ATOM 1352 CB SER A 548 19.291 -15.059 -19.304 1.00 0.00 C ATOM 1353 OG SER A 548 19.209 -16.046 -20.318 1.00 0.00 O ATOM 0 H SER A 548 18.536 -17.040 -18.109 1.00 0.00 H new ATOM 0 HA SER A 548 21.103 -15.793 -18.336 1.00 0.00 H new ATOM 0 HB2 SER A 548 18.289 -14.757 -18.999 1.00 0.00 H new ATOM 0 HB3 SER A 548 19.788 -14.170 -19.692 1.00 0.00 H new ATOM 0 HG SER A 548 18.713 -15.688 -21.084 1.00 0.00 H new