USER MOD reduce.3.24.130724 H: found=0, std=0, add=794, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 797 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 501 LYS NZ :NH3+ 159:sc= 1.27 (180deg=0) USER MOD Set 1.2: A 525 SER OG : rot -170:sc= 1.02 USER MOD Single : A 477 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 480 GLN : amide:sc= -1.77 X(o=-1.8,f=-1.5!) USER MOD Single : A 483 THR OG1 : rot -73:sc= 1.24 USER MOD Single : A 497 LYS NZ :NH3+ 148:sc= 1.3 (180deg=1.07) USER MOD Single : A 510 LYS NZ :NH3+ 169:sc= -0.0516 (180deg=-0.243) USER MOD Single : A 511 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 513 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 515 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 516 TYR OH : rot 42:sc= 1.42 USER MOD Single : A 517 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 519 ASN : amide:sc= -0.263 K(o=-0.26,f=-1.2) USER MOD Single : A 538 GLN : amide:sc= -2.5! K(o=-2.5!,f=-0.036) USER MOD Single : A 540 MET CE :methyl 162:sc= -0.739 (180deg=-1.07) USER MOD Single : A 543 SER OG : rot 82:sc= 0.746 USER MOD Single : A 545 TYR OH : rot 180:sc= 0 USER MOD Single : A 547 CYS SG : rot -168:sc= 1.19 USER MOD Single : A 551 HIS : no HD1:sc= 0.572 K(o=0.57,f=-5.7!) USER MOD Single : A 552 LYS NZ :NH3+ 171:sc= 1.15 (180deg=1.06) USER MOD Single : A 553 THR OG1 : rot 180:sc= 0 USER MOD Single : A 554 MET CE :methyl 178:sc= -1.59 (180deg=-1.6) USER MOD Single : A 556 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0447) USER MOD Single : A 559 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 563 SER OG : rot 180:sc= 0 USER MOD Single : A 566 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 568 LYS NZ :NH3+ -168:sc= -0.0177 (180deg=-0.199) USER MOD Single : A 571 GLN : amide:sc= -1.11 K(o=-1.1,f=-5.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 475 1.558 14.264 10.485 1.00 9.50 N ATOM 2 CA GLY A 475 2.967 14.092 10.064 1.00 8.97 C ATOM 3 C GLY A 475 3.253 14.783 8.750 1.00 8.18 C ATOM 4 O GLY A 475 2.694 15.848 8.475 1.00 8.54 O ATOM 0 HA2 GLY A 475 3.627 14.491 10.835 1.00 8.97 H new ATOM 0 HA3 GLY A 475 3.191 13.029 9.971 1.00 8.97 H new ATOM 10 N ALA A 476 4.116 14.168 7.941 1.00 7.34 N ATOM 11 CA ALA A 476 4.506 14.709 6.642 1.00 6.74 C ATOM 12 C ALA A 476 5.027 16.137 6.773 1.00 7.12 C ATOM 13 O ALA A 476 4.590 17.040 6.059 1.00 7.28 O ATOM 14 CB ALA A 476 3.348 14.644 5.656 1.00 5.93 C ATOM 0 H ALA A 476 4.564 13.280 8.169 1.00 7.34 H new ATOM 0 HA ALA A 476 5.317 14.092 6.255 1.00 6.74 H new ATOM 0 HB1 ALA A 476 3.664 15.053 4.696 1.00 5.93 H new ATOM 0 HB2 ALA A 476 3.040 13.607 5.525 1.00 5.93 H new ATOM 0 HB3 ALA A 476 2.510 15.226 6.040 1.00 5.93 H new ATOM 20 N MET A 477 5.954 16.332 7.698 1.00 7.56 N ATOM 21 CA MET A 477 6.549 17.642 7.918 1.00 8.10 C ATOM 22 C MET A 477 7.404 18.041 6.723 1.00 7.49 C ATOM 23 O MET A 477 7.333 19.169 6.242 1.00 7.91 O ATOM 24 CB MET A 477 7.395 17.632 9.196 1.00 8.92 C ATOM 25 CG MET A 477 8.156 18.926 9.440 1.00 9.65 C ATOM 26 SD MET A 477 7.070 20.354 9.590 1.00 10.43 S ATOM 27 CE MET A 477 8.267 21.662 9.827 1.00 10.95 C ATOM 0 H MET A 477 6.312 15.598 8.310 1.00 7.56 H new ATOM 0 HA MET A 477 5.749 18.373 8.034 1.00 8.10 H new ATOM 0 HB2 MET A 477 6.745 17.438 10.049 1.00 8.92 H new ATOM 0 HB3 MET A 477 8.106 16.808 9.143 1.00 8.92 H new ATOM 0 HG2 MET A 477 8.748 18.828 10.350 1.00 9.65 H new ATOM 0 HG3 MET A 477 8.855 19.091 8.621 1.00 9.65 H new ATOM 0 HE1 MET A 477 7.748 22.614 9.936 1.00 10.95 H new ATOM 0 HE2 MET A 477 8.852 21.462 10.725 1.00 10.95 H new ATOM 0 HE3 MET A 477 8.932 21.708 8.964 1.00 10.95 H new ATOM 37 N ASP A 478 8.201 17.101 6.245 1.00 6.78 N ATOM 38 CA ASP A 478 9.069 17.333 5.101 1.00 6.45 C ATOM 39 C ASP A 478 8.506 16.649 3.866 1.00 5.85 C ATOM 40 O ASP A 478 7.815 15.632 3.966 1.00 5.45 O ATOM 41 CB ASP A 478 10.489 16.830 5.392 1.00 6.52 C ATOM 42 CG ASP A 478 10.566 15.331 5.607 1.00 6.15 C ATOM 43 OD1 ASP A 478 9.937 14.835 6.563 1.00 6.19 O ATOM 44 OD2 ASP A 478 11.226 14.641 4.797 1.00 6.08 O ATOM 0 H ASP A 478 8.266 16.161 6.635 1.00 6.78 H new ATOM 0 HA ASP A 478 9.117 18.406 4.914 1.00 6.45 H new ATOM 0 HB2 ASP A 478 11.140 17.104 4.562 1.00 6.52 H new ATOM 0 HB3 ASP A 478 10.871 17.337 6.278 1.00 6.52 H new ATOM 49 N PRO A 479 8.744 17.245 2.689 1.00 6.15 N ATOM 50 CA PRO A 479 8.354 16.668 1.399 1.00 6.09 C ATOM 51 C PRO A 479 8.775 15.205 1.262 1.00 5.56 C ATOM 52 O PRO A 479 9.868 14.829 1.691 1.00 5.93 O ATOM 53 CB PRO A 479 9.113 17.542 0.399 1.00 7.00 C ATOM 54 CG PRO A 479 9.214 18.863 1.069 1.00 7.45 C ATOM 55 CD PRO A 479 9.400 18.557 2.527 1.00 6.96 C ATOM 0 HA PRO A 479 7.273 16.660 1.257 1.00 6.09 H new ATOM 0 HB2 PRO A 479 10.098 17.131 0.179 1.00 7.00 H new ATOM 0 HB3 PRO A 479 8.580 17.616 -0.549 1.00 7.00 H new ATOM 0 HG2 PRO A 479 10.053 19.439 0.678 1.00 7.45 H new ATOM 0 HG3 PRO A 479 8.315 19.457 0.904 1.00 7.45 H new ATOM 0 HD2 PRO A 479 10.455 18.514 2.797 1.00 6.96 H new ATOM 0 HD3 PRO A 479 8.940 19.317 3.159 1.00 6.96 H new ATOM 63 N GLN A 480 7.886 14.399 0.675 1.00 5.08 N ATOM 64 CA GLN A 480 8.098 12.960 0.468 1.00 4.93 C ATOM 65 C GLN A 480 7.862 12.178 1.767 1.00 4.26 C ATOM 66 O GLN A 480 8.043 10.957 1.813 1.00 4.58 O ATOM 67 CB GLN A 480 9.499 12.679 -0.101 1.00 5.47 C ATOM 68 CG GLN A 480 9.694 11.258 -0.609 1.00 5.99 C ATOM 69 CD GLN A 480 11.105 10.993 -1.096 1.00 6.80 C ATOM 70 OE1 GLN A 480 11.314 10.201 -2.015 1.00 7.23 O ATOM 71 NE2 GLN A 480 12.083 11.640 -0.481 1.00 7.34 N ATOM 0 H GLN A 480 6.987 14.730 0.325 1.00 5.08 H new ATOM 0 HA GLN A 480 7.369 12.618 -0.267 1.00 4.93 H new ATOM 0 HB2 GLN A 480 9.693 13.374 -0.918 1.00 5.47 H new ATOM 0 HB3 GLN A 480 10.240 12.881 0.672 1.00 5.47 H new ATOM 0 HG2 GLN A 480 9.453 10.556 0.189 1.00 5.99 H new ATOM 0 HG3 GLN A 480 8.993 11.069 -1.422 1.00 5.99 H new ATOM 0 HE21 GLN A 480 11.868 12.288 0.277 1.00 7.34 H new ATOM 0 HE22 GLN A 480 13.051 11.490 -0.765 1.00 7.34 H new ATOM 80 N GLU A 481 7.428 12.893 2.810 1.00 3.73 N ATOM 81 CA GLU A 481 7.109 12.293 4.107 1.00 3.42 C ATOM 82 C GLU A 481 8.314 11.562 4.696 1.00 2.91 C ATOM 83 O GLU A 481 9.432 11.652 4.186 1.00 3.35 O ATOM 84 CB GLU A 481 5.928 11.311 3.993 1.00 4.12 C ATOM 85 CG GLU A 481 4.594 11.950 3.633 1.00 4.77 C ATOM 86 CD GLU A 481 4.514 12.393 2.187 1.00 5.51 C ATOM 87 OE1 GLU A 481 4.296 11.532 1.307 1.00 5.86 O ATOM 88 OE2 GLU A 481 4.664 13.600 1.921 1.00 6.03 O ATOM 0 H GLU A 481 7.288 13.903 2.778 1.00 3.73 H new ATOM 0 HA GLU A 481 6.831 13.111 4.772 1.00 3.42 H new ATOM 0 HB2 GLU A 481 6.170 10.561 3.240 1.00 4.12 H new ATOM 0 HB3 GLU A 481 5.818 10.786 4.942 1.00 4.12 H new ATOM 0 HG2 GLU A 481 3.792 11.239 3.833 1.00 4.77 H new ATOM 0 HG3 GLU A 481 4.425 12.811 4.280 1.00 4.77 H new ATOM 95 N GLU A 482 8.082 10.852 5.789 1.00 2.67 N ATOM 96 CA GLU A 482 9.090 9.964 6.347 1.00 2.85 C ATOM 97 C GLU A 482 8.862 8.550 5.831 1.00 2.19 C ATOM 98 O GLU A 482 9.634 7.635 6.104 1.00 2.63 O ATOM 99 CB GLU A 482 9.090 10.017 7.886 1.00 3.76 C ATOM 100 CG GLU A 482 7.739 9.763 8.546 1.00 4.21 C ATOM 101 CD GLU A 482 7.421 8.293 8.731 1.00 5.22 C ATOM 102 OE1 GLU A 482 7.867 7.705 9.736 1.00 5.55 O ATOM 103 OE2 GLU A 482 6.697 7.726 7.890 1.00 5.92 O ATOM 0 H GLU A 482 7.204 10.873 6.308 1.00 2.67 H new ATOM 0 HA GLU A 482 10.076 10.296 6.023 1.00 2.85 H new ATOM 0 HB2 GLU A 482 9.802 9.281 8.259 1.00 3.76 H new ATOM 0 HB3 GLU A 482 9.451 10.997 8.200 1.00 3.76 H new ATOM 0 HG2 GLU A 482 7.721 10.255 9.518 1.00 4.21 H new ATOM 0 HG3 GLU A 482 6.957 10.222 7.942 1.00 4.21 H new ATOM 110 N THR A 483 7.791 8.396 5.067 1.00 1.57 N ATOM 111 CA THR A 483 7.438 7.125 4.471 1.00 0.95 C ATOM 112 C THR A 483 7.796 7.129 2.988 1.00 0.88 C ATOM 113 O THR A 483 7.139 7.795 2.185 1.00 1.70 O ATOM 114 CB THR A 483 5.930 6.853 4.628 1.00 0.84 C ATOM 115 OG1 THR A 483 5.390 7.695 5.655 1.00 1.40 O ATOM 116 CG2 THR A 483 5.678 5.399 4.986 1.00 1.04 C ATOM 0 H THR A 483 7.144 9.153 4.845 1.00 1.57 H new ATOM 0 HA THR A 483 7.996 6.340 4.982 1.00 0.95 H new ATOM 0 HB THR A 483 5.442 7.069 3.678 1.00 0.84 H new ATOM 0 HG1 THR A 483 5.685 7.371 6.532 1.00 1.40 H new ATOM 0 HG21 THR A 483 4.606 5.231 5.092 1.00 1.04 H new ATOM 0 HG22 THR A 483 6.070 4.757 4.197 1.00 1.04 H new ATOM 0 HG23 THR A 483 6.177 5.164 5.926 1.00 1.04 H new ATOM 124 N GLY A 484 8.841 6.393 2.628 1.00 0.58 N ATOM 125 CA GLY A 484 9.291 6.360 1.245 1.00 0.41 C ATOM 126 C GLY A 484 8.461 5.433 0.381 1.00 0.35 C ATOM 127 O GLY A 484 9.005 4.644 -0.391 1.00 0.36 O ATOM 0 H GLY A 484 9.387 5.817 3.269 1.00 0.58 H new ATOM 0 HA2 GLY A 484 9.252 7.367 0.831 1.00 0.41 H new ATOM 0 HA3 GLY A 484 10.333 6.042 1.214 1.00 0.41 H new ATOM 131 N VAL A 485 7.145 5.547 0.499 1.00 0.31 N ATOM 132 CA VAL A 485 6.210 4.713 -0.238 1.00 0.27 C ATOM 133 C VAL A 485 4.876 5.424 -0.399 1.00 0.26 C ATOM 134 O VAL A 485 4.607 6.419 0.278 1.00 0.31 O ATOM 135 CB VAL A 485 5.944 3.375 0.472 1.00 0.26 C ATOM 136 CG1 VAL A 485 6.900 2.295 0.010 1.00 0.36 C ATOM 137 CG2 VAL A 485 6.033 3.558 1.973 1.00 0.29 C ATOM 0 H VAL A 485 6.695 6.226 1.113 1.00 0.31 H new ATOM 0 HA VAL A 485 6.668 4.520 -1.208 1.00 0.27 H new ATOM 0 HB VAL A 485 4.937 3.051 0.210 1.00 0.26 H new ATOM 0 HG11 VAL A 485 6.680 1.365 0.535 1.00 0.36 H new ATOM 0 HG12 VAL A 485 6.785 2.142 -1.063 1.00 0.36 H new ATOM 0 HG13 VAL A 485 7.924 2.599 0.225 1.00 0.36 H new ATOM 0 HG21 VAL A 485 5.843 2.605 2.468 1.00 0.29 H new ATOM 0 HG22 VAL A 485 7.029 3.912 2.238 1.00 0.29 H new ATOM 0 HG23 VAL A 485 5.291 4.288 2.295 1.00 0.29 H new ATOM 147 N ARG A 486 4.052 4.899 -1.292 1.00 0.24 N ATOM 148 CA ARG A 486 2.706 5.410 -1.511 1.00 0.26 C ATOM 149 C ARG A 486 1.934 4.446 -2.398 1.00 0.20 C ATOM 150 O ARG A 486 2.472 3.910 -3.355 1.00 0.28 O ATOM 151 CB ARG A 486 2.761 6.812 -2.132 1.00 0.37 C ATOM 152 CG ARG A 486 1.407 7.398 -2.525 1.00 0.38 C ATOM 153 CD ARG A 486 0.401 7.348 -1.381 1.00 0.73 C ATOM 154 NE ARG A 486 0.929 7.905 -0.138 1.00 1.51 N ATOM 155 CZ ARG A 486 0.258 7.909 1.014 1.00 2.01 C ATOM 156 NH1 ARG A 486 -1.002 7.505 1.059 1.00 2.01 N ATOM 157 NH2 ARG A 486 0.832 8.353 2.120 1.00 2.96 N ATOM 0 H ARG A 486 4.296 4.107 -1.886 1.00 0.24 H new ATOM 0 HA ARG A 486 2.189 5.491 -0.555 1.00 0.26 H new ATOM 0 HB2 ARG A 486 3.241 7.488 -1.424 1.00 0.37 H new ATOM 0 HB3 ARG A 486 3.395 6.776 -3.018 1.00 0.37 H new ATOM 0 HG2 ARG A 486 1.540 8.432 -2.844 1.00 0.38 H new ATOM 0 HG3 ARG A 486 1.010 6.849 -3.379 1.00 0.38 H new ATOM 0 HD2 ARG A 486 -0.496 7.897 -1.668 1.00 0.73 H new ATOM 0 HD3 ARG A 486 0.101 6.314 -1.212 1.00 0.73 H new ATOM 0 HE ARG A 486 1.863 8.314 -0.152 1.00 1.51 H new ATOM 0 HH11 ARG A 486 -1.466 7.188 0.208 1.00 2.01 H new ATOM 0 HH12 ARG A 486 -1.508 7.511 1.944 1.00 2.01 H new ATOM 0 HH21 ARG A 486 1.793 8.695 2.094 1.00 2.96 H new ATOM 0 HH22 ARG A 486 0.314 8.354 2.999 1.00 2.96 H new ATOM 171 N VAL A 487 0.683 4.208 -2.062 1.00 0.19 N ATOM 172 CA VAL A 487 -0.122 3.248 -2.796 1.00 0.16 C ATOM 173 C VAL A 487 -1.176 3.941 -3.649 1.00 0.19 C ATOM 174 O VAL A 487 -1.788 4.924 -3.229 1.00 0.23 O ATOM 175 CB VAL A 487 -0.798 2.253 -1.836 1.00 0.18 C ATOM 176 CG1 VAL A 487 -1.566 1.187 -2.596 1.00 0.22 C ATOM 177 CG2 VAL A 487 0.241 1.617 -0.940 1.00 0.21 C ATOM 0 H VAL A 487 0.201 4.664 -1.287 1.00 0.19 H new ATOM 0 HA VAL A 487 0.549 2.701 -3.458 1.00 0.16 H new ATOM 0 HB VAL A 487 -1.513 2.802 -1.223 1.00 0.18 H new ATOM 0 HG11 VAL A 487 -2.031 0.500 -1.889 1.00 0.22 H new ATOM 0 HG12 VAL A 487 -2.337 1.659 -3.205 1.00 0.22 H new ATOM 0 HG13 VAL A 487 -0.882 0.635 -3.241 1.00 0.22 H new ATOM 0 HG21 VAL A 487 -0.244 0.914 -0.263 1.00 0.21 H new ATOM 0 HG22 VAL A 487 0.973 1.087 -1.550 1.00 0.21 H new ATOM 0 HG23 VAL A 487 0.744 2.391 -0.360 1.00 0.21 H new ATOM 187 N GLU A 488 -1.371 3.420 -4.850 1.00 0.20 N ATOM 188 CA GLU A 488 -2.350 3.961 -5.787 1.00 0.24 C ATOM 189 C GLU A 488 -3.318 2.877 -6.225 1.00 0.19 C ATOM 190 O GLU A 488 -2.996 1.687 -6.184 1.00 0.18 O ATOM 191 CB GLU A 488 -1.655 4.539 -7.023 1.00 0.32 C ATOM 192 CG GLU A 488 -0.736 5.713 -6.737 1.00 0.42 C ATOM 193 CD GLU A 488 -0.233 6.368 -8.008 1.00 1.13 C ATOM 194 OE1 GLU A 488 -0.938 7.240 -8.560 1.00 1.19 O ATOM 195 OE2 GLU A 488 0.875 6.013 -8.462 1.00 2.01 O ATOM 0 H GLU A 488 -0.858 2.613 -5.204 1.00 0.20 H new ATOM 0 HA GLU A 488 -2.897 4.755 -5.278 1.00 0.24 H new ATOM 0 HB2 GLU A 488 -1.076 3.749 -7.502 1.00 0.32 H new ATOM 0 HB3 GLU A 488 -2.415 4.855 -7.737 1.00 0.32 H new ATOM 0 HG2 GLU A 488 -1.268 6.451 -6.136 1.00 0.42 H new ATOM 0 HG3 GLU A 488 0.113 5.372 -6.145 1.00 0.42 H new ATOM 202 N LEU A 489 -4.505 3.298 -6.631 1.00 0.22 N ATOM 203 CA LEU A 489 -5.505 2.390 -7.161 1.00 0.20 C ATOM 204 C LEU A 489 -5.186 2.051 -8.603 1.00 0.21 C ATOM 205 O LEU A 489 -4.989 2.944 -9.429 1.00 0.30 O ATOM 206 CB LEU A 489 -6.896 3.019 -7.105 1.00 0.24 C ATOM 207 CG LEU A 489 -7.385 3.432 -5.719 1.00 0.26 C ATOM 208 CD1 LEU A 489 -8.693 4.199 -5.838 1.00 0.37 C ATOM 209 CD2 LEU A 489 -7.586 2.213 -4.836 1.00 0.22 C ATOM 0 H LEU A 489 -4.800 4.274 -6.602 1.00 0.22 H new ATOM 0 HA LEU A 489 -5.493 1.487 -6.551 1.00 0.20 H new ATOM 0 HB2 LEU A 489 -6.902 3.899 -7.748 1.00 0.24 H new ATOM 0 HB3 LEU A 489 -7.611 2.312 -7.526 1.00 0.24 H new ATOM 0 HG LEU A 489 -6.629 4.072 -5.264 1.00 0.26 H new ATOM 0 HD11 LEU A 489 -9.036 4.490 -4.845 1.00 0.37 H new ATOM 0 HD12 LEU A 489 -8.538 5.091 -6.445 1.00 0.37 H new ATOM 0 HD13 LEU A 489 -9.444 3.566 -6.310 1.00 0.37 H new ATOM 0 HD21 LEU A 489 -7.935 2.529 -3.853 1.00 0.22 H new ATOM 0 HD22 LEU A 489 -8.327 1.554 -5.289 1.00 0.22 H new ATOM 0 HD23 LEU A 489 -6.641 1.680 -4.732 1.00 0.22 H new ATOM 221 N ALA A 490 -5.132 0.764 -8.901 1.00 0.19 N ATOM 222 CA ALA A 490 -4.990 0.312 -10.275 1.00 0.21 C ATOM 223 C ALA A 490 -6.299 0.545 -11.005 1.00 0.28 C ATOM 224 O ALA A 490 -6.344 0.658 -12.229 1.00 0.43 O ATOM 225 CB ALA A 490 -4.619 -1.158 -10.327 1.00 0.20 C ATOM 0 H ALA A 490 -5.184 0.014 -8.211 1.00 0.19 H new ATOM 0 HA ALA A 490 -4.190 0.875 -10.755 1.00 0.21 H new ATOM 0 HB1 ALA A 490 -4.519 -1.471 -11.366 1.00 0.20 H new ATOM 0 HB2 ALA A 490 -3.673 -1.313 -9.808 1.00 0.20 H new ATOM 0 HB3 ALA A 490 -5.398 -1.747 -9.844 1.00 0.20 H new ATOM 231 N GLU A 491 -7.355 0.622 -10.212 1.00 0.28 N ATOM 232 CA GLU A 491 -8.690 0.892 -10.695 1.00 0.37 C ATOM 233 C GLU A 491 -9.372 1.820 -9.702 1.00 0.45 C ATOM 234 O GLU A 491 -9.211 1.671 -8.491 1.00 0.69 O ATOM 235 CB GLU A 491 -9.474 -0.413 -10.852 1.00 0.46 C ATOM 236 CG GLU A 491 -9.599 -1.189 -9.560 1.00 0.64 C ATOM 237 CD GLU A 491 -9.948 -2.649 -9.775 1.00 1.35 C ATOM 238 OE1 GLU A 491 -9.603 -3.195 -10.841 1.00 2.02 O ATOM 239 OE2 GLU A 491 -10.573 -3.256 -8.880 1.00 1.60 O ATOM 0 H GLU A 491 -7.303 0.496 -9.201 1.00 0.28 H new ATOM 0 HA GLU A 491 -8.649 1.367 -11.675 1.00 0.37 H new ATOM 0 HB2 GLU A 491 -10.471 -0.188 -11.231 1.00 0.46 H new ATOM 0 HB3 GLU A 491 -8.983 -1.038 -11.598 1.00 0.46 H new ATOM 0 HG2 GLU A 491 -8.660 -1.123 -9.011 1.00 0.64 H new ATOM 0 HG3 GLU A 491 -10.365 -0.726 -8.938 1.00 0.64 H new ATOM 246 N GLU A 492 -10.108 2.775 -10.218 1.00 0.49 N ATOM 247 CA GLU A 492 -10.681 3.828 -9.398 1.00 0.59 C ATOM 248 C GLU A 492 -11.834 3.309 -8.551 1.00 0.57 C ATOM 249 O GLU A 492 -12.735 2.631 -9.046 1.00 0.83 O ATOM 250 CB GLU A 492 -11.137 4.995 -10.274 1.00 0.82 C ATOM 251 CG GLU A 492 -12.043 4.582 -11.416 1.00 1.23 C ATOM 252 CD GLU A 492 -12.508 5.760 -12.241 1.00 1.71 C ATOM 253 OE1 GLU A 492 -13.462 6.440 -11.818 1.00 2.06 O ATOM 254 OE2 GLU A 492 -11.919 6.018 -13.312 1.00 2.36 O ATOM 0 H GLU A 492 -10.329 2.849 -11.211 1.00 0.49 H new ATOM 0 HA GLU A 492 -9.907 4.182 -8.718 1.00 0.59 H new ATOM 0 HB2 GLU A 492 -11.659 5.722 -9.652 1.00 0.82 H new ATOM 0 HB3 GLU A 492 -10.259 5.496 -10.681 1.00 0.82 H new ATOM 0 HG2 GLU A 492 -11.514 3.878 -12.059 1.00 1.23 H new ATOM 0 HG3 GLU A 492 -12.911 4.058 -11.016 1.00 1.23 H new ATOM 261 N ASP A 493 -11.784 3.618 -7.268 1.00 0.49 N ATOM 262 CA ASP A 493 -12.848 3.242 -6.349 1.00 0.52 C ATOM 263 C ASP A 493 -13.604 4.466 -5.858 1.00 0.71 C ATOM 264 O ASP A 493 -13.078 5.266 -5.082 1.00 0.97 O ATOM 265 CB ASP A 493 -12.316 2.453 -5.149 1.00 0.69 C ATOM 266 CG ASP A 493 -13.354 2.327 -4.040 1.00 1.00 C ATOM 267 OD1 ASP A 493 -14.530 2.058 -4.354 1.00 1.37 O ATOM 268 OD2 ASP A 493 -12.989 2.475 -2.847 1.00 1.13 O ATOM 0 H ASP A 493 -11.015 4.130 -6.835 1.00 0.49 H new ATOM 0 HA ASP A 493 -13.529 2.599 -6.906 1.00 0.52 H new ATOM 0 HB2 ASP A 493 -12.012 1.458 -5.475 1.00 0.69 H new ATOM 0 HB3 ASP A 493 -11.426 2.946 -4.758 1.00 0.69 H new ATOM 273 N ASP A 494 -14.834 4.614 -6.324 1.00 0.91 N ATOM 274 CA ASP A 494 -15.699 5.695 -5.869 1.00 1.30 C ATOM 275 C ASP A 494 -17.113 5.173 -5.665 1.00 1.49 C ATOM 276 O ASP A 494 -18.080 5.932 -5.730 1.00 2.20 O ATOM 277 CB ASP A 494 -15.728 6.857 -6.873 1.00 1.80 C ATOM 278 CG ASP A 494 -14.383 7.532 -7.066 1.00 2.52 C ATOM 279 OD1 ASP A 494 -13.604 7.082 -7.935 1.00 3.38 O ATOM 280 OD2 ASP A 494 -14.101 8.532 -6.365 1.00 2.75 O ATOM 0 H ASP A 494 -15.258 3.999 -7.018 1.00 0.91 H new ATOM 0 HA ASP A 494 -15.297 6.067 -4.927 1.00 1.30 H new ATOM 0 HB2 ASP A 494 -16.079 6.485 -7.836 1.00 1.80 H new ATOM 0 HB3 ASP A 494 -16.451 7.599 -6.535 1.00 1.80 H new ATOM 285 N GLY A 495 -17.236 3.876 -5.414 1.00 1.42 N ATOM 286 CA GLY A 495 -18.550 3.277 -5.289 1.00 1.85 C ATOM 287 C GLY A 495 -18.663 2.316 -4.134 1.00 1.67 C ATOM 288 O GLY A 495 -18.730 2.721 -2.972 1.00 2.45 O ATOM 0 H GLY A 495 -16.454 3.232 -5.295 1.00 1.42 H new ATOM 0 HA2 GLY A 495 -19.291 4.067 -5.168 1.00 1.85 H new ATOM 0 HA3 GLY A 495 -18.791 2.752 -6.213 1.00 1.85 H new ATOM 292 N GLU A 496 -18.677 1.034 -4.459 1.00 1.21 N ATOM 293 CA GLU A 496 -18.958 -0.002 -3.484 1.00 1.33 C ATOM 294 C GLU A 496 -17.911 -1.110 -3.519 1.00 1.13 C ATOM 295 O GLU A 496 -18.175 -2.245 -3.116 1.00 1.17 O ATOM 296 CB GLU A 496 -20.366 -0.558 -3.728 1.00 1.72 C ATOM 297 CG GLU A 496 -20.735 -0.769 -5.198 1.00 2.44 C ATOM 298 CD GLU A 496 -19.704 -1.552 -5.987 1.00 2.90 C ATOM 299 OE1 GLU A 496 -19.754 -2.801 -5.952 1.00 3.22 O ATOM 300 OE2 GLU A 496 -18.837 -0.930 -6.634 1.00 3.35 O ATOM 0 H GLU A 496 -18.495 0.685 -5.400 1.00 1.21 H new ATOM 0 HA GLU A 496 -18.914 0.436 -2.487 1.00 1.33 H new ATOM 0 HB2 GLU A 496 -20.459 -1.510 -3.206 1.00 1.72 H new ATOM 0 HB3 GLU A 496 -21.091 0.123 -3.282 1.00 1.72 H new ATOM 0 HG2 GLU A 496 -21.691 -1.291 -5.251 1.00 2.44 H new ATOM 0 HG3 GLU A 496 -20.876 0.203 -5.670 1.00 2.44 H new ATOM 307 N LYS A 497 -16.723 -0.764 -3.994 1.00 1.03 N ATOM 308 CA LYS A 497 -15.638 -1.710 -4.130 1.00 0.93 C ATOM 309 C LYS A 497 -15.180 -2.218 -2.774 1.00 0.74 C ATOM 310 O LYS A 497 -14.757 -1.450 -1.914 1.00 0.84 O ATOM 311 CB LYS A 497 -14.478 -1.044 -4.853 1.00 1.08 C ATOM 312 CG LYS A 497 -14.775 -0.697 -6.303 1.00 0.89 C ATOM 313 CD LYS A 497 -14.677 -1.917 -7.207 1.00 1.02 C ATOM 314 CE LYS A 497 -13.243 -2.409 -7.329 1.00 1.22 C ATOM 315 NZ LYS A 497 -13.124 -3.568 -8.250 1.00 1.75 N ATOM 0 H LYS A 497 -16.490 0.182 -4.295 1.00 1.03 H new ATOM 0 HA LYS A 497 -15.992 -2.564 -4.707 1.00 0.93 H new ATOM 0 HB2 LYS A 497 -14.205 -0.133 -4.320 1.00 1.08 H new ATOM 0 HB3 LYS A 497 -13.612 -1.706 -4.818 1.00 1.08 H new ATOM 0 HG2 LYS A 497 -15.775 -0.269 -6.377 1.00 0.89 H new ATOM 0 HG3 LYS A 497 -14.076 0.066 -6.645 1.00 0.89 H new ATOM 0 HD2 LYS A 497 -15.304 -2.716 -6.811 1.00 1.02 H new ATOM 0 HD3 LYS A 497 -15.063 -1.670 -8.196 1.00 1.02 H new ATOM 0 HE2 LYS A 497 -12.611 -1.596 -7.687 1.00 1.22 H new ATOM 0 HE3 LYS A 497 -12.872 -2.691 -6.343 1.00 1.22 H new ATOM 0 HZ1 LYS A 497 -12.199 -3.540 -8.725 1.00 1.75 H new ATOM 0 HZ2 LYS A 497 -13.209 -4.452 -7.708 1.00 1.75 H new ATOM 0 HZ3 LYS A 497 -13.881 -3.525 -8.962 1.00 1.75 H new ATOM 329 N ILE A 498 -15.282 -3.517 -2.596 1.00 0.62 N ATOM 330 CA ILE A 498 -14.809 -4.163 -1.392 1.00 0.52 C ATOM 331 C ILE A 498 -13.395 -4.632 -1.606 1.00 0.45 C ATOM 332 O ILE A 498 -12.503 -4.367 -0.810 1.00 0.50 O ATOM 333 CB ILE A 498 -15.698 -5.356 -1.016 1.00 0.61 C ATOM 334 CG1 ILE A 498 -17.070 -4.854 -0.599 1.00 0.68 C ATOM 335 CG2 ILE A 498 -15.067 -6.179 0.098 1.00 0.65 C ATOM 336 CD1 ILE A 498 -17.059 -4.072 0.695 1.00 0.65 C ATOM 0 H ILE A 498 -15.694 -4.153 -3.279 1.00 0.62 H new ATOM 0 HA ILE A 498 -14.846 -3.443 -0.574 1.00 0.52 H new ATOM 0 HB ILE A 498 -15.802 -6.004 -1.886 1.00 0.61 H new ATOM 0 HG12 ILE A 498 -17.474 -4.224 -1.392 1.00 0.68 H new ATOM 0 HG13 ILE A 498 -17.743 -5.705 -0.494 1.00 0.68 H new ATOM 0 HG21 ILE A 498 -15.718 -7.018 0.344 1.00 0.65 H new ATOM 0 HG22 ILE A 498 -14.099 -6.556 -0.232 1.00 0.65 H new ATOM 0 HG23 ILE A 498 -14.931 -5.554 0.980 1.00 0.65 H new ATOM 0 HD11 ILE A 498 -18.072 -3.745 0.931 1.00 0.65 H new ATOM 0 HD12 ILE A 498 -16.685 -4.705 1.500 1.00 0.65 H new ATOM 0 HD13 ILE A 498 -16.412 -3.201 0.588 1.00 0.65 H new ATOM 348 N ALA A 499 -13.200 -5.310 -2.709 1.00 0.45 N ATOM 349 CA ALA A 499 -11.897 -5.812 -3.065 1.00 0.40 C ATOM 350 C ALA A 499 -11.340 -5.032 -4.238 1.00 0.36 C ATOM 351 O ALA A 499 -11.941 -4.985 -5.313 1.00 0.43 O ATOM 352 CB ALA A 499 -11.995 -7.281 -3.374 1.00 0.45 C ATOM 0 H ALA A 499 -13.935 -5.528 -3.382 1.00 0.45 H new ATOM 0 HA ALA A 499 -11.210 -5.683 -2.229 1.00 0.40 H new ATOM 0 HB1 ALA A 499 -11.010 -7.663 -3.644 1.00 0.45 H new ATOM 0 HB2 ALA A 499 -12.363 -7.814 -2.497 1.00 0.45 H new ATOM 0 HB3 ALA A 499 -12.683 -7.433 -4.206 1.00 0.45 H new ATOM 358 N ILE A 500 -10.201 -4.407 -4.013 1.00 0.28 N ATOM 359 CA ILE A 500 -9.638 -3.482 -4.974 1.00 0.25 C ATOM 360 C ILE A 500 -8.263 -3.924 -5.438 1.00 0.21 C ATOM 361 O ILE A 500 -7.714 -4.917 -4.956 1.00 0.24 O ATOM 362 CB ILE A 500 -9.525 -2.078 -4.360 1.00 0.25 C ATOM 363 CG1 ILE A 500 -8.457 -2.046 -3.262 1.00 0.22 C ATOM 364 CG2 ILE A 500 -10.866 -1.661 -3.799 1.00 0.31 C ATOM 365 CD1 ILE A 500 -8.386 -0.729 -2.527 1.00 0.26 C ATOM 0 H ILE A 500 -9.645 -4.525 -3.166 1.00 0.28 H new ATOM 0 HA ILE A 500 -10.308 -3.463 -5.833 1.00 0.25 H new ATOM 0 HB ILE A 500 -9.226 -1.378 -5.140 1.00 0.25 H new ATOM 0 HG12 ILE A 500 -8.660 -2.842 -2.546 1.00 0.22 H new ATOM 0 HG13 ILE A 500 -7.484 -2.258 -3.706 1.00 0.22 H new ATOM 0 HG21 ILE A 500 -10.785 -0.665 -3.364 1.00 0.31 H new ATOM 0 HG22 ILE A 500 -11.607 -1.648 -4.598 1.00 0.31 H new ATOM 0 HG23 ILE A 500 -11.175 -2.369 -3.030 1.00 0.31 H new ATOM 0 HD11 ILE A 500 -7.609 -0.779 -1.765 1.00 0.26 H new ATOM 0 HD12 ILE A 500 -8.152 0.069 -3.232 1.00 0.26 H new ATOM 0 HD13 ILE A 500 -9.346 -0.525 -2.053 1.00 0.26 H new ATOM 377 N LYS A 501 -7.714 -3.164 -6.366 1.00 0.21 N ATOM 378 CA LYS A 501 -6.392 -3.428 -6.895 1.00 0.20 C ATOM 379 C LYS A 501 -5.485 -2.235 -6.614 1.00 0.15 C ATOM 380 O LYS A 501 -5.739 -1.128 -7.090 1.00 0.16 O ATOM 381 CB LYS A 501 -6.475 -3.688 -8.399 1.00 0.27 C ATOM 382 CG LYS A 501 -5.207 -4.285 -8.991 1.00 0.33 C ATOM 383 CD LYS A 501 -5.019 -5.734 -8.573 1.00 1.08 C ATOM 384 CE LYS A 501 -6.142 -6.613 -9.096 1.00 1.52 C ATOM 385 NZ LYS A 501 -5.961 -8.035 -8.713 1.00 1.81 N ATOM 0 H LYS A 501 -8.172 -2.348 -6.773 1.00 0.21 H new ATOM 0 HA LYS A 501 -5.978 -4.313 -6.411 1.00 0.20 H new ATOM 0 HB2 LYS A 501 -7.309 -4.362 -8.596 1.00 0.27 H new ATOM 0 HB3 LYS A 501 -6.696 -2.750 -8.909 1.00 0.27 H new ATOM 0 HG2 LYS A 501 -5.249 -4.223 -10.078 1.00 0.33 H new ATOM 0 HG3 LYS A 501 -4.345 -3.699 -8.671 1.00 0.33 H new ATOM 0 HD2 LYS A 501 -4.063 -6.101 -8.948 1.00 1.08 H new ATOM 0 HD3 LYS A 501 -4.981 -5.798 -7.486 1.00 1.08 H new ATOM 0 HE2 LYS A 501 -7.095 -6.252 -8.709 1.00 1.52 H new ATOM 0 HE3 LYS A 501 -6.188 -6.533 -10.182 1.00 1.52 H new ATOM 0 HZ1 LYS A 501 -6.876 -8.527 -8.764 1.00 1.81 H new ATOM 0 HZ2 LYS A 501 -5.288 -8.487 -9.364 1.00 1.81 H new ATOM 0 HZ3 LYS A 501 -5.592 -8.089 -7.742 1.00 1.81 H new ATOM 399 N LEU A 502 -4.450 -2.456 -5.825 1.00 0.16 N ATOM 400 CA LEU A 502 -3.529 -1.397 -5.446 1.00 0.13 C ATOM 401 C LEU A 502 -2.128 -1.687 -5.965 1.00 0.14 C ATOM 402 O LEU A 502 -1.770 -2.840 -6.174 1.00 0.20 O ATOM 403 CB LEU A 502 -3.478 -1.285 -3.925 1.00 0.18 C ATOM 404 CG LEU A 502 -4.781 -0.879 -3.243 1.00 0.21 C ATOM 405 CD1 LEU A 502 -4.726 -1.226 -1.768 1.00 0.60 C ATOM 406 CD2 LEU A 502 -5.035 0.606 -3.417 1.00 0.55 C ATOM 0 H LEU A 502 -4.224 -3.369 -5.430 1.00 0.16 H new ATOM 0 HA LEU A 502 -3.883 -0.463 -5.882 1.00 0.13 H new ATOM 0 HB2 LEU A 502 -3.162 -2.246 -3.520 1.00 0.18 H new ATOM 0 HB3 LEU A 502 -2.710 -0.559 -3.659 1.00 0.18 H new ATOM 0 HG LEU A 502 -5.600 -1.428 -3.709 1.00 0.21 H new ATOM 0 HD11 LEU A 502 -5.661 -0.932 -1.290 1.00 0.60 H new ATOM 0 HD12 LEU A 502 -4.581 -2.300 -1.652 1.00 0.60 H new ATOM 0 HD13 LEU A 502 -3.897 -0.695 -1.300 1.00 0.60 H new ATOM 0 HD21 LEU A 502 -5.969 0.876 -2.924 1.00 0.55 H new ATOM 0 HD22 LEU A 502 -4.214 1.170 -2.974 1.00 0.55 H new ATOM 0 HD23 LEU A 502 -5.105 0.841 -4.479 1.00 0.55 H new ATOM 418 N TRP A 503 -1.347 -0.642 -6.189 1.00 0.12 N ATOM 419 CA TRP A 503 0.072 -0.806 -6.466 1.00 0.14 C ATOM 420 C TRP A 503 0.887 -0.095 -5.399 1.00 0.15 C ATOM 421 O TRP A 503 0.706 1.102 -5.158 1.00 0.17 O ATOM 422 CB TRP A 503 0.466 -0.260 -7.840 1.00 0.19 C ATOM 423 CG TRP A 503 -0.069 -1.040 -9.005 1.00 0.20 C ATOM 424 CD1 TRP A 503 -1.370 -1.170 -9.362 1.00 0.20 C ATOM 425 CD2 TRP A 503 0.685 -1.790 -9.970 1.00 0.25 C ATOM 426 NE1 TRP A 503 -1.480 -1.917 -10.509 1.00 0.25 N ATOM 427 CE2 TRP A 503 -0.233 -2.312 -10.900 1.00 0.27 C ATOM 428 CE3 TRP A 503 2.040 -2.066 -10.148 1.00 0.28 C ATOM 429 CZ2 TRP A 503 0.164 -3.086 -11.987 1.00 0.32 C ATOM 430 CZ3 TRP A 503 2.430 -2.838 -11.223 1.00 0.33 C ATOM 431 CH2 TRP A 503 1.495 -3.337 -12.132 1.00 0.34 C ATOM 0 H TRP A 503 -1.670 0.326 -6.185 1.00 0.12 H new ATOM 0 HA TRP A 503 0.279 -1.876 -6.460 1.00 0.14 H new ATOM 0 HB2 TRP A 503 0.117 0.770 -7.920 1.00 0.19 H new ATOM 0 HB3 TRP A 503 1.554 -0.234 -7.907 1.00 0.19 H new ATOM 0 HD1 TRP A 503 -2.203 -0.746 -8.821 1.00 0.20 H new ATOM 0 HE1 TRP A 503 -2.351 -2.140 -10.990 1.00 0.25 H new ATOM 0 HE3 TRP A 503 2.773 -1.681 -9.455 1.00 0.28 H new ATOM 0 HZ2 TRP A 503 -0.558 -3.474 -12.691 1.00 0.32 H new ATOM 0 HZ3 TRP A 503 3.477 -3.060 -11.364 1.00 0.33 H new ATOM 0 HH2 TRP A 503 1.834 -3.934 -12.966 1.00 0.34 H new ATOM 442 N LEU A 504 1.758 -0.839 -4.744 1.00 0.17 N ATOM 443 CA LEU A 504 2.668 -0.270 -3.767 1.00 0.18 C ATOM 444 C LEU A 504 3.820 0.421 -4.474 1.00 0.18 C ATOM 445 O LEU A 504 4.734 -0.233 -4.974 1.00 0.21 O ATOM 446 CB LEU A 504 3.201 -1.358 -2.841 1.00 0.20 C ATOM 447 CG LEU A 504 4.241 -0.904 -1.817 1.00 0.21 C ATOM 448 CD1 LEU A 504 3.616 0.021 -0.788 1.00 0.29 C ATOM 449 CD2 LEU A 504 4.868 -2.111 -1.147 1.00 0.26 C ATOM 0 H LEU A 504 1.855 -1.846 -4.872 1.00 0.17 H new ATOM 0 HA LEU A 504 2.126 0.462 -3.168 1.00 0.18 H new ATOM 0 HB2 LEU A 504 2.360 -1.799 -2.306 1.00 0.20 H new ATOM 0 HB3 LEU A 504 3.639 -2.147 -3.452 1.00 0.20 H new ATOM 0 HG LEU A 504 5.022 -0.347 -2.335 1.00 0.21 H new ATOM 0 HD11 LEU A 504 4.375 0.331 -0.069 1.00 0.29 H new ATOM 0 HD12 LEU A 504 3.209 0.900 -1.288 1.00 0.29 H new ATOM 0 HD13 LEU A 504 2.815 -0.503 -0.266 1.00 0.29 H new ATOM 0 HD21 LEU A 504 5.608 -1.779 -0.419 1.00 0.26 H new ATOM 0 HD22 LEU A 504 4.095 -2.689 -0.641 1.00 0.26 H new ATOM 0 HD23 LEU A 504 5.353 -2.734 -1.899 1.00 0.26 H new ATOM 461 N ARG A 505 3.758 1.735 -4.528 1.00 0.21 N ATOM 462 CA ARG A 505 4.780 2.520 -5.193 1.00 0.23 C ATOM 463 C ARG A 505 5.906 2.844 -4.226 1.00 0.22 C ATOM 464 O ARG A 505 5.670 3.370 -3.135 1.00 0.30 O ATOM 465 CB ARG A 505 4.185 3.801 -5.745 1.00 0.33 C ATOM 466 CG ARG A 505 4.489 4.014 -7.210 1.00 0.64 C ATOM 467 CD ARG A 505 3.900 5.316 -7.697 1.00 0.72 C ATOM 468 NE ARG A 505 4.392 6.464 -6.930 1.00 1.68 N ATOM 469 CZ ARG A 505 3.808 7.661 -6.921 1.00 2.25 C ATOM 470 NH1 ARG A 505 2.679 7.862 -7.585 1.00 2.19 N ATOM 471 NH2 ARG A 505 4.343 8.652 -6.222 1.00 3.33 N ATOM 0 H ARG A 505 3.005 2.286 -4.116 1.00 0.21 H new ATOM 0 HA ARG A 505 5.183 1.935 -6.020 1.00 0.23 H new ATOM 0 HB2 ARG A 505 3.104 3.783 -5.603 1.00 0.33 H new ATOM 0 HB3 ARG A 505 4.567 4.647 -5.174 1.00 0.33 H new ATOM 0 HG2 ARG A 505 5.568 4.017 -7.365 1.00 0.64 H new ATOM 0 HG3 ARG A 505 4.086 3.187 -7.794 1.00 0.64 H new ATOM 0 HD2 ARG A 505 4.144 5.453 -8.750 1.00 0.72 H new ATOM 0 HD3 ARG A 505 2.813 5.271 -7.625 1.00 0.72 H new ATOM 0 HE ARG A 505 5.234 6.338 -6.368 1.00 1.68 H new ATOM 0 HH11 ARG A 505 2.252 7.097 -8.107 1.00 2.19 H new ATOM 0 HH12 ARG A 505 2.237 8.781 -7.574 1.00 2.19 H new ATOM 0 HH21 ARG A 505 5.201 8.497 -5.692 1.00 3.33 H new ATOM 0 HH22 ARG A 505 3.897 9.569 -6.214 1.00 3.33 H new ATOM 485 N ILE A 506 7.122 2.515 -4.620 1.00 0.27 N ATOM 486 CA ILE A 506 8.289 2.780 -3.799 1.00 0.33 C ATOM 487 C ILE A 506 8.857 4.152 -4.137 1.00 0.39 C ATOM 488 O ILE A 506 9.316 4.390 -5.257 1.00 0.45 O ATOM 489 CB ILE A 506 9.382 1.710 -4.001 1.00 0.42 C ATOM 490 CG1 ILE A 506 8.788 0.296 -3.927 1.00 0.40 C ATOM 491 CG2 ILE A 506 10.481 1.879 -2.966 1.00 0.51 C ATOM 492 CD1 ILE A 506 8.116 -0.028 -2.611 1.00 0.35 C ATOM 0 H ILE A 506 7.328 2.061 -5.510 1.00 0.27 H new ATOM 0 HA ILE A 506 7.974 2.752 -2.756 1.00 0.33 H new ATOM 0 HB ILE A 506 9.811 1.844 -4.994 1.00 0.42 H new ATOM 0 HG12 ILE A 506 8.062 0.177 -4.731 1.00 0.40 H new ATOM 0 HG13 ILE A 506 9.582 -0.429 -4.104 1.00 0.40 H new ATOM 0 HG21 ILE A 506 11.246 1.118 -3.120 1.00 0.51 H new ATOM 0 HG22 ILE A 506 10.928 2.868 -3.068 1.00 0.51 H new ATOM 0 HG23 ILE A 506 10.059 1.773 -1.967 1.00 0.51 H new ATOM 0 HD11 ILE A 506 7.724 -1.045 -2.643 1.00 0.35 H new ATOM 0 HD12 ILE A 506 8.841 0.056 -1.802 1.00 0.35 H new ATOM 0 HD13 ILE A 506 7.298 0.671 -2.439 1.00 0.35 H new ATOM 504 N GLU A 507 8.813 5.048 -3.167 1.00 0.40 N ATOM 505 CA GLU A 507 9.191 6.431 -3.374 1.00 0.46 C ATOM 506 C GLU A 507 10.679 6.648 -3.132 1.00 0.48 C ATOM 507 O GLU A 507 11.376 7.227 -3.966 1.00 0.61 O ATOM 508 CB GLU A 507 8.376 7.306 -2.432 1.00 0.47 C ATOM 509 CG GLU A 507 6.881 7.226 -2.679 1.00 0.73 C ATOM 510 CD GLU A 507 6.486 7.778 -4.032 1.00 1.05 C ATOM 511 OE1 GLU A 507 6.271 9.001 -4.146 1.00 1.42 O ATOM 512 OE2 GLU A 507 6.392 6.987 -4.994 1.00 1.52 O ATOM 0 H GLU A 507 8.514 4.836 -2.215 1.00 0.40 H new ATOM 0 HA GLU A 507 8.988 6.698 -4.411 1.00 0.46 H new ATOM 0 HB2 GLU A 507 8.583 7.011 -1.403 1.00 0.47 H new ATOM 0 HB3 GLU A 507 8.700 8.341 -2.538 1.00 0.47 H new ATOM 0 HG2 GLU A 507 6.559 6.187 -2.606 1.00 0.73 H new ATOM 0 HG3 GLU A 507 6.357 7.777 -1.898 1.00 0.73 H new ATOM 519 N ASP A 508 11.159 6.177 -1.990 1.00 0.40 N ATOM 520 CA ASP A 508 12.545 6.396 -1.596 1.00 0.41 C ATOM 521 C ASP A 508 13.141 5.102 -1.067 1.00 0.39 C ATOM 522 O ASP A 508 12.880 4.704 0.070 1.00 0.40 O ATOM 523 CB ASP A 508 12.629 7.488 -0.525 1.00 0.44 C ATOM 524 CG ASP A 508 14.054 7.925 -0.235 1.00 0.47 C ATOM 525 OD1 ASP A 508 14.828 7.125 0.326 1.00 0.57 O ATOM 526 OD2 ASP A 508 14.404 9.084 -0.556 1.00 0.71 O ATOM 0 H ASP A 508 10.609 5.640 -1.319 1.00 0.40 H new ATOM 0 HA ASP A 508 13.111 6.721 -2.469 1.00 0.41 H new ATOM 0 HB2 ASP A 508 12.048 8.352 -0.848 1.00 0.44 H new ATOM 0 HB3 ASP A 508 12.172 7.123 0.395 1.00 0.44 H new ATOM 531 N ILE A 509 13.919 4.434 -1.902 1.00 0.40 N ATOM 532 CA ILE A 509 14.489 3.148 -1.543 1.00 0.44 C ATOM 533 C ILE A 509 15.650 3.293 -0.563 1.00 0.48 C ATOM 534 O ILE A 509 16.105 2.310 0.019 1.00 0.56 O ATOM 535 CB ILE A 509 14.934 2.369 -2.799 1.00 0.51 C ATOM 536 CG1 ILE A 509 16.142 3.015 -3.476 1.00 0.59 C ATOM 537 CG2 ILE A 509 13.785 2.286 -3.784 1.00 0.53 C ATOM 538 CD1 ILE A 509 17.473 2.430 -3.051 1.00 0.71 C ATOM 0 H ILE A 509 14.170 4.762 -2.834 1.00 0.40 H new ATOM 0 HA ILE A 509 13.705 2.579 -1.043 1.00 0.44 H new ATOM 0 HB ILE A 509 15.227 1.369 -2.479 1.00 0.51 H new ATOM 0 HG12 ILE A 509 16.039 2.910 -4.556 1.00 0.59 H new ATOM 0 HG13 ILE A 509 16.140 4.083 -3.258 1.00 0.59 H new ATOM 0 HG21 ILE A 509 14.104 1.735 -4.669 1.00 0.53 H new ATOM 0 HG22 ILE A 509 12.944 1.771 -3.319 1.00 0.53 H new ATOM 0 HG23 ILE A 509 13.480 3.292 -4.073 1.00 0.53 H new ATOM 0 HD11 ILE A 509 18.280 2.942 -3.576 1.00 0.71 H new ATOM 0 HD12 ILE A 509 17.600 2.559 -1.976 1.00 0.71 H new ATOM 0 HD13 ILE A 509 17.498 1.368 -3.295 1.00 0.71 H new ATOM 550 N LYS A 510 16.113 4.521 -0.369 1.00 0.47 N ATOM 551 CA LYS A 510 17.212 4.790 0.542 1.00 0.55 C ATOM 552 C LYS A 510 16.703 4.838 1.977 1.00 0.57 C ATOM 553 O LYS A 510 17.476 4.891 2.930 1.00 0.70 O ATOM 554 CB LYS A 510 17.883 6.112 0.170 1.00 0.62 C ATOM 555 CG LYS A 510 18.521 6.109 -1.212 1.00 0.77 C ATOM 556 CD LYS A 510 19.702 5.154 -1.287 1.00 1.51 C ATOM 557 CE LYS A 510 20.299 5.105 -2.686 1.00 2.36 C ATOM 558 NZ LYS A 510 20.666 6.456 -3.190 1.00 3.15 N ATOM 0 H LYS A 510 15.741 5.349 -0.834 1.00 0.47 H new ATOM 0 HA LYS A 510 17.946 3.989 0.461 1.00 0.55 H new ATOM 0 HB2 LYS A 510 17.142 6.910 0.216 1.00 0.62 H new ATOM 0 HB3 LYS A 510 18.647 6.343 0.912 1.00 0.62 H new ATOM 0 HG2 LYS A 510 17.776 5.825 -1.955 1.00 0.77 H new ATOM 0 HG3 LYS A 510 18.852 7.117 -1.462 1.00 0.77 H new ATOM 0 HD2 LYS A 510 20.467 5.465 -0.576 1.00 1.51 H new ATOM 0 HD3 LYS A 510 19.381 4.155 -0.993 1.00 1.51 H new ATOM 0 HE2 LYS A 510 21.184 4.469 -2.679 1.00 2.36 H new ATOM 0 HE3 LYS A 510 19.583 4.647 -3.368 1.00 2.36 H new ATOM 0 HZ1 LYS A 510 21.233 6.361 -4.056 1.00 3.15 H new ATOM 0 HZ2 LYS A 510 19.802 6.995 -3.399 1.00 3.15 H new ATOM 0 HZ3 LYS A 510 21.220 6.958 -2.467 1.00 3.15 H new ATOM 572 N LYS A 511 15.389 4.827 2.113 1.00 0.53 N ATOM 573 CA LYS A 511 14.744 4.780 3.388 1.00 0.61 C ATOM 574 C LYS A 511 14.525 3.321 3.787 1.00 0.57 C ATOM 575 O LYS A 511 14.271 2.999 4.947 1.00 0.69 O ATOM 576 CB LYS A 511 13.419 5.530 3.266 1.00 0.69 C ATOM 577 CG LYS A 511 12.509 5.317 4.436 1.00 1.41 C ATOM 578 CD LYS A 511 13.035 6.012 5.676 1.00 1.84 C ATOM 579 CE LYS A 511 12.087 5.873 6.855 1.00 2.59 C ATOM 580 NZ LYS A 511 12.615 6.544 8.073 1.00 3.19 N ATOM 0 H LYS A 511 14.743 4.851 1.324 1.00 0.53 H new ATOM 0 HA LYS A 511 15.353 5.249 4.161 1.00 0.61 H new ATOM 0 HB2 LYS A 511 13.621 6.596 3.161 1.00 0.69 H new ATOM 0 HB3 LYS A 511 12.911 5.211 2.356 1.00 0.69 H new ATOM 0 HG2 LYS A 511 11.514 5.694 4.199 1.00 1.41 H new ATOM 0 HG3 LYS A 511 12.407 4.249 4.630 1.00 1.41 H new ATOM 0 HD2 LYS A 511 14.006 5.594 5.941 1.00 1.84 H new ATOM 0 HD3 LYS A 511 13.191 7.069 5.460 1.00 1.84 H new ATOM 0 HE2 LYS A 511 11.119 6.302 6.595 1.00 2.59 H new ATOM 0 HE3 LYS A 511 11.922 4.816 7.065 1.00 2.59 H new ATOM 0 HZ1 LYS A 511 11.939 6.426 8.855 1.00 3.19 H new ATOM 0 HZ2 LYS A 511 13.527 6.118 8.336 1.00 3.19 H new ATOM 0 HZ3 LYS A 511 12.749 7.557 7.881 1.00 3.19 H new ATOM 594 N LEU A 512 14.655 2.439 2.808 1.00 0.44 N ATOM 595 CA LEU A 512 14.371 1.028 2.998 1.00 0.42 C ATOM 596 C LEU A 512 15.657 0.231 3.201 1.00 0.49 C ATOM 597 O LEU A 512 16.755 0.728 2.934 1.00 0.58 O ATOM 598 CB LEU A 512 13.605 0.516 1.785 1.00 0.35 C ATOM 599 CG LEU A 512 12.418 1.389 1.371 1.00 0.32 C ATOM 600 CD1 LEU A 512 11.787 0.851 0.107 1.00 0.31 C ATOM 601 CD2 LEU A 512 11.388 1.474 2.490 1.00 0.38 C ATOM 0 H LEU A 512 14.959 2.681 1.865 1.00 0.44 H new ATOM 0 HA LEU A 512 13.766 0.900 3.896 1.00 0.42 H new ATOM 0 HB2 LEU A 512 14.293 0.437 0.943 1.00 0.35 H new ATOM 0 HB3 LEU A 512 13.244 -0.490 1.997 1.00 0.35 H new ATOM 0 HG LEU A 512 12.786 2.396 1.175 1.00 0.32 H new ATOM 0 HD11 LEU A 512 10.944 1.482 -0.176 1.00 0.31 H new ATOM 0 HD12 LEU A 512 12.524 0.850 -0.696 1.00 0.31 H new ATOM 0 HD13 LEU A 512 11.437 -0.167 0.280 1.00 0.31 H new ATOM 0 HD21 LEU A 512 10.555 2.100 2.171 1.00 0.38 H new ATOM 0 HD22 LEU A 512 11.022 0.474 2.724 1.00 0.38 H new ATOM 0 HD23 LEU A 512 11.849 1.909 3.377 1.00 0.38 H new ATOM 613 N LYS A 513 15.517 -1.003 3.665 1.00 0.51 N ATOM 614 CA LYS A 513 16.666 -1.850 3.973 1.00 0.61 C ATOM 615 C LYS A 513 16.711 -3.059 3.046 1.00 0.64 C ATOM 616 O LYS A 513 16.874 -4.199 3.495 1.00 1.21 O ATOM 617 CB LYS A 513 16.612 -2.310 5.432 1.00 0.71 C ATOM 618 CG LYS A 513 16.624 -1.169 6.434 1.00 1.54 C ATOM 619 CD LYS A 513 17.840 -0.277 6.244 1.00 1.77 C ATOM 620 CE LYS A 513 17.860 0.861 7.251 1.00 2.87 C ATOM 621 NZ LYS A 513 19.024 1.764 7.055 1.00 3.30 N ATOM 0 H LYS A 513 14.614 -1.444 3.838 1.00 0.51 H new ATOM 0 HA LYS A 513 17.572 -1.263 3.820 1.00 0.61 H new ATOM 0 HB2 LYS A 513 15.711 -2.904 5.583 1.00 0.71 H new ATOM 0 HB3 LYS A 513 17.462 -2.964 5.629 1.00 0.71 H new ATOM 0 HG2 LYS A 513 15.716 -0.577 6.324 1.00 1.54 H new ATOM 0 HG3 LYS A 513 16.621 -1.572 7.447 1.00 1.54 H new ATOM 0 HD2 LYS A 513 18.748 -0.871 6.347 1.00 1.77 H new ATOM 0 HD3 LYS A 513 17.839 0.131 5.233 1.00 1.77 H new ATOM 0 HE2 LYS A 513 16.938 1.436 7.165 1.00 2.87 H new ATOM 0 HE3 LYS A 513 17.887 0.450 8.260 1.00 2.87 H new ATOM 0 HZ1 LYS A 513 18.996 2.525 7.764 1.00 3.30 H new ATOM 0 HZ2 LYS A 513 19.905 1.223 7.162 1.00 3.30 H new ATOM 0 HZ3 LYS A 513 18.986 2.178 6.102 1.00 3.30 H new ATOM 635 N GLY A 514 16.578 -2.804 1.759 1.00 0.67 N ATOM 636 CA GLY A 514 16.588 -3.876 0.785 1.00 0.63 C ATOM 637 C GLY A 514 16.891 -3.369 -0.607 1.00 0.73 C ATOM 638 O GLY A 514 17.268 -2.210 -0.783 1.00 0.96 O ATOM 0 H GLY A 514 16.462 -1.870 1.366 1.00 0.67 H new ATOM 0 HA2 GLY A 514 17.332 -4.619 1.071 1.00 0.63 H new ATOM 0 HA3 GLY A 514 15.620 -4.377 0.786 1.00 0.63 H new ATOM 642 N LYS A 515 16.710 -4.228 -1.598 1.00 0.73 N ATOM 643 CA LYS A 515 16.950 -3.858 -2.984 1.00 0.86 C ATOM 644 C LYS A 515 15.640 -3.482 -3.665 1.00 0.71 C ATOM 645 O LYS A 515 14.777 -4.334 -3.902 1.00 0.77 O ATOM 646 CB LYS A 515 17.627 -5.005 -3.736 1.00 1.10 C ATOM 647 CG LYS A 515 17.936 -4.687 -5.189 1.00 1.71 C ATOM 648 CD LYS A 515 18.569 -5.874 -5.895 1.00 2.22 C ATOM 649 CE LYS A 515 18.885 -5.553 -7.347 1.00 3.03 C ATOM 650 NZ LYS A 515 19.462 -6.721 -8.059 1.00 3.53 N ATOM 0 H LYS A 515 16.396 -5.190 -1.467 1.00 0.73 H new ATOM 0 HA LYS A 515 17.614 -2.994 -3.000 1.00 0.86 H new ATOM 0 HB2 LYS A 515 18.554 -5.265 -3.225 1.00 1.10 H new ATOM 0 HB3 LYS A 515 16.984 -5.884 -3.695 1.00 1.10 H new ATOM 0 HG2 LYS A 515 17.018 -4.403 -5.704 1.00 1.71 H new ATOM 0 HG3 LYS A 515 18.608 -3.831 -5.240 1.00 1.71 H new ATOM 0 HD2 LYS A 515 19.484 -6.161 -5.377 1.00 2.22 H new ATOM 0 HD3 LYS A 515 17.894 -6.729 -5.848 1.00 2.22 H new ATOM 0 HE2 LYS A 515 17.975 -5.232 -7.854 1.00 3.03 H new ATOM 0 HE3 LYS A 515 19.585 -4.719 -7.390 1.00 3.03 H new ATOM 0 HZ1 LYS A 515 19.663 -6.461 -9.046 1.00 3.53 H new ATOM 0 HZ2 LYS A 515 20.344 -7.012 -7.591 1.00 3.53 H new ATOM 0 HZ3 LYS A 515 18.783 -7.509 -8.040 1.00 3.53 H new ATOM 664 N TYR A 516 15.495 -2.202 -3.961 1.00 0.62 N ATOM 665 CA TYR A 516 14.301 -1.688 -4.614 1.00 0.52 C ATOM 666 C TYR A 516 14.698 -0.667 -5.673 1.00 0.55 C ATOM 667 O TYR A 516 15.844 -0.214 -5.713 1.00 0.73 O ATOM 668 CB TYR A 516 13.367 -1.002 -3.608 1.00 0.48 C ATOM 669 CG TYR A 516 13.045 -1.804 -2.373 1.00 0.46 C ATOM 670 CD1 TYR A 516 13.872 -1.776 -1.262 1.00 0.51 C ATOM 671 CD2 TYR A 516 11.920 -2.612 -2.335 1.00 0.50 C ATOM 672 CE1 TYR A 516 13.581 -2.527 -0.142 1.00 0.51 C ATOM 673 CE2 TYR A 516 11.624 -3.366 -1.224 1.00 0.55 C ATOM 674 CZ TYR A 516 12.451 -3.235 -0.075 1.00 0.51 C ATOM 675 OH TYR A 516 12.158 -4.082 0.974 1.00 0.57 O ATOM 0 H TYR A 516 16.198 -1.491 -3.757 1.00 0.62 H new ATOM 0 HA TYR A 516 13.779 -2.531 -5.066 1.00 0.52 H new ATOM 0 HB2 TYR A 516 13.821 -0.060 -3.301 1.00 0.48 H new ATOM 0 HB3 TYR A 516 12.434 -0.756 -4.114 1.00 0.48 H new ATOM 0 HD1 TYR A 516 14.757 -1.157 -1.273 1.00 0.51 H new ATOM 0 HD2 TYR A 516 11.265 -2.650 -3.193 1.00 0.50 H new ATOM 0 HE1 TYR A 516 14.273 -2.542 0.687 1.00 0.51 H new ATOM 0 HE2 TYR A 516 10.782 -4.043 -1.224 1.00 0.55 H new ATOM 0 HH TYR A 516 12.414 -3.657 1.819 1.00 0.57 H new ATOM 685 N LYS A 517 13.751 -0.308 -6.522 1.00 0.51 N ATOM 686 CA LYS A 517 13.953 0.752 -7.498 1.00 0.55 C ATOM 687 C LYS A 517 13.075 1.943 -7.139 1.00 0.51 C ATOM 688 O LYS A 517 11.947 1.762 -6.674 1.00 0.47 O ATOM 689 CB LYS A 517 13.626 0.247 -8.905 1.00 0.64 C ATOM 690 CG LYS A 517 14.507 -0.911 -9.352 1.00 1.06 C ATOM 691 CD LYS A 517 14.125 -1.417 -10.735 1.00 1.18 C ATOM 692 CE LYS A 517 12.759 -2.082 -10.730 1.00 1.33 C ATOM 693 NZ LYS A 517 12.375 -2.571 -12.079 1.00 1.98 N ATOM 0 H LYS A 517 12.827 -0.738 -6.556 1.00 0.51 H new ATOM 0 HA LYS A 517 14.998 1.063 -7.484 1.00 0.55 H new ATOM 0 HB2 LYS A 517 12.583 -0.067 -8.937 1.00 0.64 H new ATOM 0 HB3 LYS A 517 13.733 1.069 -9.612 1.00 0.64 H new ATOM 0 HG2 LYS A 517 15.549 -0.592 -9.358 1.00 1.06 H new ATOM 0 HG3 LYS A 517 14.427 -1.726 -8.633 1.00 1.06 H new ATOM 0 HD2 LYS A 517 14.123 -0.585 -11.439 1.00 1.18 H new ATOM 0 HD3 LYS A 517 14.875 -2.127 -11.083 1.00 1.18 H new ATOM 0 HE2 LYS A 517 12.765 -2.917 -10.029 1.00 1.33 H new ATOM 0 HE3 LYS A 517 12.011 -1.373 -10.375 1.00 1.33 H new ATOM 0 HZ1 LYS A 517 11.437 -3.018 -12.032 1.00 1.98 H new ATOM 0 HZ2 LYS A 517 12.345 -1.771 -12.743 1.00 1.98 H new ATOM 0 HZ3 LYS A 517 13.074 -3.267 -12.408 1.00 1.98 H new ATOM 707 N ASP A 518 13.577 3.158 -7.363 1.00 0.60 N ATOM 708 CA ASP A 518 12.872 4.381 -6.948 1.00 0.67 C ATOM 709 C ASP A 518 11.747 4.736 -7.912 1.00 0.71 C ATOM 710 O ASP A 518 11.492 5.907 -8.192 1.00 0.87 O ATOM 711 CB ASP A 518 13.839 5.568 -6.824 1.00 0.83 C ATOM 712 CG ASP A 518 14.855 5.399 -5.711 1.00 1.48 C ATOM 713 OD1 ASP A 518 14.480 5.576 -4.530 1.00 2.29 O ATOM 714 OD2 ASP A 518 16.026 5.072 -6.005 1.00 1.91 O ATOM 0 H ASP A 518 14.469 3.326 -7.829 1.00 0.60 H new ATOM 0 HA ASP A 518 12.438 4.176 -5.969 1.00 0.67 H new ATOM 0 HB2 ASP A 518 14.365 5.700 -7.770 1.00 0.83 H new ATOM 0 HB3 ASP A 518 13.266 6.478 -6.648 1.00 0.83 H new ATOM 719 N ASN A 519 11.093 3.708 -8.414 1.00 0.62 N ATOM 720 CA ASN A 519 9.946 3.850 -9.295 1.00 0.75 C ATOM 721 C ASN A 519 9.256 2.495 -9.420 1.00 0.68 C ATOM 722 O ASN A 519 8.629 2.177 -10.432 1.00 0.89 O ATOM 723 CB ASN A 519 10.369 4.367 -10.676 1.00 0.96 C ATOM 724 CG ASN A 519 9.188 4.810 -11.523 1.00 1.85 C ATOM 725 OD1 ASN A 519 8.176 5.285 -11.006 1.00 2.56 O ATOM 726 ND2 ASN A 519 9.308 4.656 -12.834 1.00 2.48 N ATOM 0 H ASN A 519 11.344 2.738 -8.221 1.00 0.62 H new ATOM 0 HA ASN A 519 9.256 4.580 -8.872 1.00 0.75 H new ATOM 0 HB2 ASN A 519 11.056 5.204 -10.551 1.00 0.96 H new ATOM 0 HB3 ASN A 519 10.914 3.583 -11.202 1.00 0.96 H new ATOM 0 HD21 ASN A 519 8.546 4.935 -13.452 1.00 2.48 H new ATOM 0 HD22 ASN A 519 10.162 4.259 -13.225 1.00 2.48 H new ATOM 733 N GLU A 520 9.392 1.693 -8.373 1.00 0.50 N ATOM 734 CA GLU A 520 8.840 0.356 -8.351 1.00 0.52 C ATOM 735 C GLU A 520 7.409 0.405 -7.849 1.00 0.38 C ATOM 736 O GLU A 520 7.066 1.242 -7.016 1.00 0.40 O ATOM 737 CB GLU A 520 9.685 -0.547 -7.444 1.00 0.74 C ATOM 738 CG GLU A 520 9.228 -1.996 -7.413 1.00 0.81 C ATOM 739 CD GLU A 520 9.386 -2.683 -8.751 1.00 0.99 C ATOM 740 OE1 GLU A 520 10.483 -3.210 -9.036 1.00 1.37 O ATOM 741 OE2 GLU A 520 8.413 -2.702 -9.526 1.00 1.52 O ATOM 0 H GLU A 520 9.887 1.955 -7.520 1.00 0.50 H new ATOM 0 HA GLU A 520 8.852 -0.053 -9.361 1.00 0.52 H new ATOM 0 HB2 GLU A 520 10.722 -0.511 -7.778 1.00 0.74 H new ATOM 0 HB3 GLU A 520 9.663 -0.148 -6.430 1.00 0.74 H new ATOM 0 HG2 GLU A 520 9.801 -2.538 -6.660 1.00 0.81 H new ATOM 0 HG3 GLU A 520 8.182 -2.037 -7.109 1.00 0.81 H new ATOM 748 N ALA A 521 6.586 -0.480 -8.364 1.00 0.38 N ATOM 749 CA ALA A 521 5.203 -0.573 -7.941 1.00 0.32 C ATOM 750 C ALA A 521 4.767 -2.021 -7.883 1.00 0.31 C ATOM 751 O ALA A 521 4.846 -2.754 -8.870 1.00 0.43 O ATOM 752 CB ALA A 521 4.299 0.235 -8.857 1.00 0.39 C ATOM 0 H ALA A 521 6.852 -1.153 -9.083 1.00 0.38 H new ATOM 0 HA ALA A 521 5.120 -0.151 -6.940 1.00 0.32 H new ATOM 0 HB1 ALA A 521 3.267 0.149 -8.518 1.00 0.39 H new ATOM 0 HB2 ALA A 521 4.602 1.282 -8.836 1.00 0.39 H new ATOM 0 HB3 ALA A 521 4.379 -0.145 -9.875 1.00 0.39 H new ATOM 758 N ILE A 522 4.334 -2.424 -6.709 1.00 0.25 N ATOM 759 CA ILE A 522 3.920 -3.787 -6.463 1.00 0.25 C ATOM 760 C ILE A 522 2.398 -3.882 -6.430 1.00 0.21 C ATOM 761 O ILE A 522 1.758 -3.429 -5.483 1.00 0.19 O ATOM 762 CB ILE A 522 4.513 -4.287 -5.132 1.00 0.28 C ATOM 763 CG1 ILE A 522 6.039 -4.303 -5.210 1.00 0.33 C ATOM 764 CG2 ILE A 522 3.994 -5.672 -4.789 1.00 0.31 C ATOM 765 CD1 ILE A 522 6.717 -4.452 -3.866 1.00 0.39 C ATOM 0 H ILE A 522 4.259 -1.813 -5.895 1.00 0.25 H new ATOM 0 HA ILE A 522 4.290 -4.416 -7.273 1.00 0.25 H new ATOM 0 HB ILE A 522 4.202 -3.602 -4.343 1.00 0.28 H new ATOM 0 HG12 ILE A 522 6.352 -5.122 -5.857 1.00 0.33 H new ATOM 0 HG13 ILE A 522 6.379 -3.379 -5.678 1.00 0.33 H new ATOM 0 HG21 ILE A 522 4.429 -6.000 -3.845 1.00 0.31 H new ATOM 0 HG22 ILE A 522 2.908 -5.641 -4.697 1.00 0.31 H new ATOM 0 HG23 ILE A 522 4.272 -6.370 -5.578 1.00 0.31 H new ATOM 0 HD11 ILE A 522 7.798 -4.455 -4.002 1.00 0.39 H new ATOM 0 HD12 ILE A 522 6.435 -3.619 -3.222 1.00 0.39 H new ATOM 0 HD13 ILE A 522 6.407 -5.389 -3.404 1.00 0.39 H new ATOM 777 N GLU A 523 1.832 -4.444 -7.484 1.00 0.23 N ATOM 778 CA GLU A 523 0.388 -4.608 -7.597 1.00 0.21 C ATOM 779 C GLU A 523 -0.104 -5.704 -6.648 1.00 0.22 C ATOM 780 O GLU A 523 0.439 -6.810 -6.626 1.00 0.26 O ATOM 781 CB GLU A 523 0.029 -4.960 -9.040 1.00 0.25 C ATOM 782 CG GLU A 523 -1.434 -5.329 -9.239 1.00 0.27 C ATOM 783 CD GLU A 523 -1.687 -6.079 -10.533 1.00 0.36 C ATOM 784 OE1 GLU A 523 -1.544 -5.470 -11.613 1.00 0.50 O ATOM 785 OE2 GLU A 523 -2.036 -7.274 -10.484 1.00 0.60 O ATOM 0 H GLU A 523 2.356 -4.799 -8.284 1.00 0.23 H new ATOM 0 HA GLU A 523 -0.099 -3.673 -7.320 1.00 0.21 H new ATOM 0 HB2 GLU A 523 0.270 -4.112 -9.681 1.00 0.25 H new ATOM 0 HB3 GLU A 523 0.651 -5.793 -9.366 1.00 0.25 H new ATOM 0 HG2 GLU A 523 -1.766 -5.941 -8.400 1.00 0.27 H new ATOM 0 HG3 GLU A 523 -2.036 -4.421 -9.229 1.00 0.27 H new ATOM 792 N PHE A 524 -1.120 -5.385 -5.861 1.00 0.20 N ATOM 793 CA PHE A 524 -1.720 -6.340 -4.942 1.00 0.22 C ATOM 794 C PHE A 524 -3.214 -6.058 -4.794 1.00 0.20 C ATOM 795 O PHE A 524 -3.658 -4.919 -4.952 1.00 0.17 O ATOM 796 CB PHE A 524 -1.019 -6.291 -3.571 1.00 0.24 C ATOM 797 CG PHE A 524 -1.124 -4.971 -2.851 1.00 0.20 C ATOM 798 CD1 PHE A 524 -0.253 -3.937 -3.154 1.00 0.19 C ATOM 799 CD2 PHE A 524 -2.100 -4.757 -1.890 1.00 0.22 C ATOM 800 CE1 PHE A 524 -0.353 -2.719 -2.514 1.00 0.18 C ATOM 801 CE2 PHE A 524 -2.205 -3.539 -1.248 1.00 0.22 C ATOM 802 CZ PHE A 524 -1.305 -2.556 -1.489 1.00 0.18 C ATOM 0 H PHE A 524 -1.551 -4.461 -5.841 1.00 0.20 H new ATOM 0 HA PHE A 524 -1.593 -7.343 -5.350 1.00 0.22 H new ATOM 0 HB2 PHE A 524 -1.441 -7.069 -2.935 1.00 0.24 H new ATOM 0 HB3 PHE A 524 0.035 -6.530 -3.710 1.00 0.24 H new ATOM 0 HD1 PHE A 524 0.513 -4.086 -3.900 1.00 0.19 H new ATOM 0 HD2 PHE A 524 -2.786 -5.553 -1.640 1.00 0.22 H new ATOM 0 HE1 PHE A 524 0.292 -1.900 -2.796 1.00 0.18 H new ATOM 0 HE2 PHE A 524 -3.010 -3.369 -0.549 1.00 0.22 H new ATOM 0 HZ PHE A 524 -1.317 -1.652 -0.898 1.00 0.18 H new ATOM 812 N SER A 525 -3.985 -7.095 -4.511 1.00 0.25 N ATOM 813 CA SER A 525 -5.422 -6.949 -4.323 1.00 0.25 C ATOM 814 C SER A 525 -5.719 -6.726 -2.848 1.00 0.25 C ATOM 815 O SER A 525 -5.040 -7.294 -1.990 1.00 0.33 O ATOM 816 CB SER A 525 -6.144 -8.204 -4.815 1.00 0.32 C ATOM 817 OG SER A 525 -5.671 -8.597 -6.095 1.00 1.24 O ATOM 0 H SER A 525 -3.641 -8.049 -4.406 1.00 0.25 H new ATOM 0 HA SER A 525 -5.775 -6.092 -4.897 1.00 0.25 H new ATOM 0 HB2 SER A 525 -5.994 -9.016 -4.103 1.00 0.32 H new ATOM 0 HB3 SER A 525 -7.217 -8.015 -4.862 1.00 0.32 H new ATOM 0 HG SER A 525 -6.250 -9.300 -6.456 1.00 1.24 H new ATOM 823 N PHE A 526 -6.714 -5.906 -2.534 1.00 0.22 N ATOM 824 CA PHE A 526 -7.032 -5.651 -1.144 1.00 0.22 C ATOM 825 C PHE A 526 -8.526 -5.705 -0.909 1.00 0.26 C ATOM 826 O PHE A 526 -9.279 -4.894 -1.447 1.00 0.27 O ATOM 827 CB PHE A 526 -6.493 -4.289 -0.704 1.00 0.19 C ATOM 828 CG PHE A 526 -6.297 -4.180 0.777 1.00 0.19 C ATOM 829 CD1 PHE A 526 -7.344 -3.819 1.607 1.00 0.22 C ATOM 830 CD2 PHE A 526 -5.062 -4.448 1.340 1.00 0.20 C ATOM 831 CE1 PHE A 526 -7.161 -3.721 2.972 1.00 0.22 C ATOM 832 CE2 PHE A 526 -4.873 -4.352 2.702 1.00 0.22 C ATOM 833 CZ PHE A 526 -5.923 -3.990 3.519 1.00 0.21 C ATOM 0 H PHE A 526 -7.301 -5.418 -3.210 1.00 0.22 H new ATOM 0 HA PHE A 526 -6.555 -6.431 -0.550 1.00 0.22 H new ATOM 0 HB2 PHE A 526 -5.542 -4.103 -1.204 1.00 0.19 H new ATOM 0 HB3 PHE A 526 -7.182 -3.510 -1.031 1.00 0.19 H new ATOM 0 HD1 PHE A 526 -8.315 -3.612 1.182 1.00 0.22 H new ATOM 0 HD2 PHE A 526 -4.237 -4.736 0.705 1.00 0.20 H new ATOM 0 HE1 PHE A 526 -7.984 -3.435 3.610 1.00 0.22 H new ATOM 0 HE2 PHE A 526 -3.903 -4.560 3.129 1.00 0.22 H new ATOM 0 HZ PHE A 526 -5.777 -3.917 4.587 1.00 0.21 H new ATOM 843 N ASP A 527 -8.948 -6.674 -0.121 1.00 0.30 N ATOM 844 CA ASP A 527 -10.319 -6.734 0.341 1.00 0.35 C ATOM 845 C ASP A 527 -10.454 -5.855 1.568 1.00 0.35 C ATOM 846 O ASP A 527 -9.917 -6.167 2.630 1.00 0.36 O ATOM 847 CB ASP A 527 -10.710 -8.168 0.680 1.00 0.42 C ATOM 848 CG ASP A 527 -12.208 -8.335 0.856 1.00 0.49 C ATOM 849 OD1 ASP A 527 -12.756 -7.821 1.856 1.00 0.48 O ATOM 850 OD2 ASP A 527 -12.840 -8.996 0.005 1.00 0.58 O ATOM 0 H ASP A 527 -8.356 -7.434 0.214 1.00 0.30 H new ATOM 0 HA ASP A 527 -10.984 -6.381 -0.447 1.00 0.35 H new ATOM 0 HB2 ASP A 527 -10.364 -8.832 -0.112 1.00 0.42 H new ATOM 0 HB3 ASP A 527 -10.203 -8.473 1.596 1.00 0.42 H new ATOM 855 N LEU A 528 -11.167 -4.757 1.414 1.00 0.37 N ATOM 856 CA LEU A 528 -11.274 -3.742 2.451 1.00 0.39 C ATOM 857 C LEU A 528 -12.070 -4.228 3.660 1.00 0.43 C ATOM 858 O LEU A 528 -12.242 -3.494 4.635 1.00 0.51 O ATOM 859 CB LEU A 528 -11.920 -2.492 1.861 1.00 0.40 C ATOM 860 CG LEU A 528 -11.131 -1.825 0.731 1.00 0.37 C ATOM 861 CD1 LEU A 528 -11.971 -0.754 0.064 1.00 0.41 C ATOM 862 CD2 LEU A 528 -9.838 -1.226 1.259 1.00 0.32 C ATOM 0 H LEU A 528 -11.691 -4.540 0.566 1.00 0.37 H new ATOM 0 HA LEU A 528 -10.269 -3.515 2.806 1.00 0.39 H new ATOM 0 HB2 LEU A 528 -12.909 -2.755 1.486 1.00 0.40 H new ATOM 0 HB3 LEU A 528 -12.065 -1.765 2.660 1.00 0.40 H new ATOM 0 HG LEU A 528 -10.881 -2.586 -0.008 1.00 0.37 H new ATOM 0 HD11 LEU A 528 -11.397 -0.288 -0.737 1.00 0.41 H new ATOM 0 HD12 LEU A 528 -12.873 -1.204 -0.350 1.00 0.41 H new ATOM 0 HD13 LEU A 528 -12.247 0.002 0.799 1.00 0.41 H new ATOM 0 HD21 LEU A 528 -9.293 -0.757 0.440 1.00 0.32 H new ATOM 0 HD22 LEU A 528 -10.067 -0.478 2.018 1.00 0.32 H new ATOM 0 HD23 LEU A 528 -9.225 -2.013 1.699 1.00 0.32 H new ATOM 874 N GLU A 529 -12.567 -5.454 3.596 1.00 0.44 N ATOM 875 CA GLU A 529 -13.275 -6.040 4.720 1.00 0.50 C ATOM 876 C GLU A 529 -12.497 -7.214 5.315 1.00 0.50 C ATOM 877 O GLU A 529 -12.685 -7.557 6.480 1.00 0.59 O ATOM 878 CB GLU A 529 -14.665 -6.505 4.292 1.00 0.56 C ATOM 879 CG GLU A 529 -15.591 -5.387 3.860 1.00 0.81 C ATOM 880 CD GLU A 529 -16.990 -5.888 3.586 1.00 1.54 C ATOM 881 OE1 GLU A 529 -17.136 -6.894 2.859 1.00 2.09 O ATOM 882 OE2 GLU A 529 -17.955 -5.282 4.098 1.00 2.18 O ATOM 0 H GLU A 529 -12.493 -6.060 2.779 1.00 0.44 H new ATOM 0 HA GLU A 529 -13.374 -5.270 5.486 1.00 0.50 H new ATOM 0 HB2 GLU A 529 -14.561 -7.213 3.470 1.00 0.56 H new ATOM 0 HB3 GLU A 529 -15.126 -7.043 5.120 1.00 0.56 H new ATOM 0 HG2 GLU A 529 -15.625 -4.623 4.637 1.00 0.81 H new ATOM 0 HG3 GLU A 529 -15.193 -4.912 2.963 1.00 0.81 H new ATOM 889 N ARG A 530 -11.631 -7.832 4.519 1.00 0.46 N ATOM 890 CA ARG A 530 -10.943 -9.039 4.938 1.00 0.49 C ATOM 891 C ARG A 530 -9.431 -8.840 5.080 1.00 0.44 C ATOM 892 O ARG A 530 -8.848 -9.198 6.105 1.00 0.49 O ATOM 893 CB ARG A 530 -11.214 -10.142 3.923 1.00 0.53 C ATOM 894 CG ARG A 530 -12.690 -10.450 3.739 1.00 0.97 C ATOM 895 CD ARG A 530 -12.911 -11.518 2.681 1.00 1.44 C ATOM 896 NE ARG A 530 -14.319 -11.622 2.306 1.00 2.29 N ATOM 897 CZ ARG A 530 -14.888 -12.726 1.826 1.00 3.07 C ATOM 898 NH1 ARG A 530 -14.180 -13.841 1.695 1.00 3.22 N ATOM 899 NH2 ARG A 530 -16.172 -12.715 1.488 1.00 4.10 N ATOM 0 H ARG A 530 -11.391 -7.514 3.580 1.00 0.46 H new ATOM 0 HA ARG A 530 -11.325 -9.310 5.922 1.00 0.49 H new ATOM 0 HB2 ARG A 530 -10.789 -9.852 2.962 1.00 0.53 H new ATOM 0 HB3 ARG A 530 -10.699 -11.049 4.239 1.00 0.53 H new ATOM 0 HG2 ARG A 530 -13.114 -10.783 4.687 1.00 0.97 H new ATOM 0 HG3 ARG A 530 -13.219 -9.541 3.455 1.00 0.97 H new ATOM 0 HD2 ARG A 530 -12.315 -11.285 1.798 1.00 1.44 H new ATOM 0 HD3 ARG A 530 -12.562 -12.480 3.056 1.00 1.44 H new ATOM 0 HE ARG A 530 -14.905 -10.795 2.419 1.00 2.29 H new ATOM 0 HH11 ARG A 530 -13.196 -13.855 1.963 1.00 3.22 H new ATOM 0 HH12 ARG A 530 -14.620 -14.684 1.327 1.00 3.22 H new ATOM 0 HH21 ARG A 530 -16.721 -11.862 1.596 1.00 4.10 H new ATOM 0 HH22 ARG A 530 -16.610 -13.560 1.120 1.00 4.10 H new ATOM 913 N ASP A 531 -8.804 -8.268 4.055 1.00 0.36 N ATOM 914 CA ASP A 531 -7.341 -8.202 3.984 1.00 0.32 C ATOM 915 C ASP A 531 -6.744 -7.308 5.062 1.00 0.25 C ATOM 916 O ASP A 531 -7.374 -6.360 5.535 1.00 0.27 O ATOM 917 CB ASP A 531 -6.870 -7.725 2.606 1.00 0.34 C ATOM 918 CG ASP A 531 -6.787 -8.849 1.593 1.00 0.39 C ATOM 919 OD1 ASP A 531 -5.909 -9.727 1.739 1.00 0.61 O ATOM 920 OD2 ASP A 531 -7.585 -8.855 0.639 1.00 0.39 O ATOM 0 H ASP A 531 -9.283 -7.843 3.261 1.00 0.36 H new ATOM 0 HA ASP A 531 -6.986 -9.218 4.154 1.00 0.32 H new ATOM 0 HB2 ASP A 531 -7.554 -6.960 2.238 1.00 0.34 H new ATOM 0 HB3 ASP A 531 -5.891 -7.257 2.704 1.00 0.34 H new ATOM 925 N VAL A 532 -5.516 -7.633 5.437 1.00 0.23 N ATOM 926 CA VAL A 532 -4.764 -6.878 6.425 1.00 0.19 C ATOM 927 C VAL A 532 -3.465 -6.390 5.799 1.00 0.17 C ATOM 928 O VAL A 532 -2.710 -7.170 5.225 1.00 0.19 O ATOM 929 CB VAL A 532 -4.444 -7.746 7.663 1.00 0.25 C ATOM 930 CG1 VAL A 532 -3.579 -6.991 8.661 1.00 0.28 C ATOM 931 CG2 VAL A 532 -5.729 -8.209 8.322 1.00 0.28 C ATOM 0 H VAL A 532 -5.010 -8.435 5.060 1.00 0.23 H new ATOM 0 HA VAL A 532 -5.369 -6.031 6.748 1.00 0.19 H new ATOM 0 HB VAL A 532 -3.882 -8.617 7.328 1.00 0.25 H new ATOM 0 HG11 VAL A 532 -3.372 -7.630 9.520 1.00 0.28 H new ATOM 0 HG12 VAL A 532 -2.640 -6.706 8.186 1.00 0.28 H new ATOM 0 HG13 VAL A 532 -4.104 -6.095 8.993 1.00 0.28 H new ATOM 0 HG21 VAL A 532 -5.492 -8.820 9.193 1.00 0.28 H new ATOM 0 HG22 VAL A 532 -6.311 -7.342 8.634 1.00 0.28 H new ATOM 0 HG23 VAL A 532 -6.310 -8.799 7.613 1.00 0.28 H new ATOM 941 N PRO A 533 -3.211 -5.075 5.891 1.00 0.17 N ATOM 942 CA PRO A 533 -2.043 -4.428 5.275 1.00 0.18 C ATOM 943 C PRO A 533 -0.707 -5.066 5.661 1.00 0.14 C ATOM 944 O PRO A 533 0.173 -5.215 4.815 1.00 0.18 O ATOM 945 CB PRO A 533 -2.124 -2.989 5.784 1.00 0.23 C ATOM 946 CG PRO A 533 -3.568 -2.780 6.069 1.00 0.24 C ATOM 947 CD PRO A 533 -4.067 -4.095 6.589 1.00 0.18 C ATOM 0 HA PRO A 533 -2.071 -4.519 4.189 1.00 0.18 H new ATOM 0 HB2 PRO A 533 -1.518 -2.849 6.679 1.00 0.23 H new ATOM 0 HB3 PRO A 533 -1.759 -2.282 5.038 1.00 0.23 H new ATOM 0 HG2 PRO A 533 -3.713 -1.987 6.803 1.00 0.24 H new ATOM 0 HG3 PRO A 533 -4.107 -2.484 5.169 1.00 0.24 H new ATOM 0 HD2 PRO A 533 -3.962 -4.167 7.672 1.00 0.18 H new ATOM 0 HD3 PRO A 533 -5.122 -4.245 6.360 1.00 0.18 H new ATOM 955 N GLU A 534 -0.542 -5.433 6.931 1.00 0.17 N ATOM 956 CA GLU A 534 0.685 -6.094 7.364 1.00 0.17 C ATOM 957 C GLU A 534 0.747 -7.532 6.860 1.00 0.16 C ATOM 958 O GLU A 534 1.830 -8.083 6.668 1.00 0.20 O ATOM 959 CB GLU A 534 0.839 -6.045 8.887 1.00 0.22 C ATOM 960 CG GLU A 534 1.323 -4.697 9.398 1.00 0.37 C ATOM 961 CD GLU A 534 1.727 -4.710 10.856 1.00 1.23 C ATOM 962 OE1 GLU A 534 0.836 -4.777 11.729 1.00 1.11 O ATOM 963 OE2 GLU A 534 2.943 -4.637 11.139 1.00 2.34 O ATOM 0 H GLU A 534 -1.232 -5.286 7.668 1.00 0.17 H new ATOM 0 HA GLU A 534 1.520 -5.547 6.926 1.00 0.17 H new ATOM 0 HB2 GLU A 534 -0.120 -6.279 9.350 1.00 0.22 H new ATOM 0 HB3 GLU A 534 1.541 -6.818 9.200 1.00 0.22 H new ATOM 0 HG2 GLU A 534 2.173 -4.374 8.797 1.00 0.37 H new ATOM 0 HG3 GLU A 534 0.533 -3.959 9.255 1.00 0.37 H new ATOM 970 N ASP A 535 -0.410 -8.129 6.622 1.00 0.19 N ATOM 971 CA ASP A 535 -0.466 -9.475 6.061 1.00 0.21 C ATOM 972 C ASP A 535 -0.053 -9.435 4.597 1.00 0.19 C ATOM 973 O ASP A 535 0.698 -10.285 4.121 1.00 0.21 O ATOM 974 CB ASP A 535 -1.874 -10.053 6.189 1.00 0.26 C ATOM 975 CG ASP A 535 -1.985 -11.454 5.618 1.00 0.70 C ATOM 976 OD1 ASP A 535 -1.736 -12.426 6.363 1.00 1.00 O ATOM 977 OD2 ASP A 535 -2.304 -11.593 4.419 1.00 1.09 O ATOM 0 H ASP A 535 -1.320 -7.708 6.806 1.00 0.19 H new ATOM 0 HA ASP A 535 0.221 -10.115 6.615 1.00 0.21 H new ATOM 0 HB2 ASP A 535 -2.161 -10.070 7.240 1.00 0.26 H new ATOM 0 HB3 ASP A 535 -2.579 -9.399 5.676 1.00 0.26 H new ATOM 982 N VAL A 536 -0.539 -8.425 3.894 1.00 0.18 N ATOM 983 CA VAL A 536 -0.171 -8.213 2.501 1.00 0.18 C ATOM 984 C VAL A 536 1.315 -7.896 2.383 1.00 0.15 C ATOM 985 O VAL A 536 1.999 -8.401 1.497 1.00 0.17 O ATOM 986 CB VAL A 536 -0.987 -7.070 1.863 1.00 0.21 C ATOM 987 CG1 VAL A 536 -0.537 -6.820 0.431 1.00 0.26 C ATOM 988 CG2 VAL A 536 -2.472 -7.388 1.903 1.00 0.28 C ATOM 0 H VAL A 536 -1.192 -7.736 4.266 1.00 0.18 H new ATOM 0 HA VAL A 536 -0.393 -9.136 1.966 1.00 0.18 H new ATOM 0 HB VAL A 536 -0.811 -6.163 2.441 1.00 0.21 H new ATOM 0 HG11 VAL A 536 -1.126 -6.010 0.001 1.00 0.26 H new ATOM 0 HG12 VAL A 536 0.518 -6.545 0.424 1.00 0.26 H new ATOM 0 HG13 VAL A 536 -0.680 -7.725 -0.159 1.00 0.26 H new ATOM 0 HG21 VAL A 536 -3.032 -6.570 1.449 1.00 0.28 H new ATOM 0 HG22 VAL A 536 -2.662 -8.309 1.351 1.00 0.28 H new ATOM 0 HG23 VAL A 536 -2.789 -7.514 2.938 1.00 0.28 H new ATOM 998 N ALA A 537 1.827 -7.073 3.287 1.00 0.14 N ATOM 999 CA ALA A 537 3.249 -6.760 3.287 1.00 0.12 C ATOM 1000 C ALA A 537 4.073 -8.004 3.608 1.00 0.12 C ATOM 1001 O ALA A 537 5.261 -8.066 3.312 1.00 0.17 O ATOM 1002 CB ALA A 537 3.563 -5.641 4.263 1.00 0.13 C ATOM 0 H ALA A 537 1.287 -6.615 4.021 1.00 0.14 H new ATOM 0 HA ALA A 537 3.518 -6.417 2.288 1.00 0.12 H new ATOM 0 HB1 ALA A 537 4.632 -5.429 4.242 1.00 0.13 H new ATOM 0 HB2 ALA A 537 3.010 -4.746 3.980 1.00 0.13 H new ATOM 0 HB3 ALA A 537 3.273 -5.944 5.269 1.00 0.13 H new ATOM 1008 N GLN A 538 3.431 -8.997 4.211 1.00 0.13 N ATOM 1009 CA GLN A 538 4.078 -10.270 4.480 1.00 0.16 C ATOM 1010 C GLN A 538 4.237 -11.068 3.196 1.00 0.15 C ATOM 1011 O GLN A 538 5.320 -11.576 2.915 1.00 0.17 O ATOM 1012 CB GLN A 538 3.291 -11.083 5.509 1.00 0.22 C ATOM 1013 CG GLN A 538 3.941 -11.135 6.881 1.00 0.48 C ATOM 1014 CD GLN A 538 5.097 -12.126 6.969 1.00 0.59 C ATOM 1015 OE1 GLN A 538 5.340 -12.707 8.023 1.00 1.08 O ATOM 1016 NE2 GLN A 538 5.817 -12.328 5.872 1.00 0.47 N ATOM 0 H GLN A 538 2.461 -8.943 4.523 1.00 0.13 H new ATOM 0 HA GLN A 538 5.065 -10.062 4.892 1.00 0.16 H new ATOM 0 HB2 GLN A 538 2.292 -10.657 5.607 1.00 0.22 H new ATOM 0 HB3 GLN A 538 3.169 -12.100 5.137 1.00 0.22 H new ATOM 0 HG2 GLN A 538 4.305 -10.141 7.140 1.00 0.48 H new ATOM 0 HG3 GLN A 538 3.187 -11.402 7.622 1.00 0.48 H new ATOM 0 HE21 GLN A 538 5.588 -11.829 5.013 1.00 0.47 H new ATOM 0 HE22 GLN A 538 6.599 -12.983 5.889 1.00 0.47 H new ATOM 1025 N GLU A 539 3.166 -11.165 2.410 1.00 0.16 N ATOM 1026 CA GLU A 539 3.230 -11.879 1.139 1.00 0.20 C ATOM 1027 C GLU A 539 4.151 -11.141 0.176 1.00 0.19 C ATOM 1028 O GLU A 539 4.751 -11.742 -0.716 1.00 0.25 O ATOM 1029 CB GLU A 539 1.837 -12.080 0.524 1.00 0.29 C ATOM 1030 CG GLU A 539 1.113 -10.802 0.145 1.00 0.65 C ATOM 1031 CD GLU A 539 -0.187 -11.077 -0.575 1.00 1.45 C ATOM 1032 OE1 GLU A 539 -1.100 -11.661 0.042 1.00 2.07 O ATOM 1033 OE2 GLU A 539 -0.296 -10.734 -1.770 1.00 1.88 O ATOM 0 H GLU A 539 2.254 -10.763 2.628 1.00 0.16 H new ATOM 0 HA GLU A 539 3.638 -12.872 1.329 1.00 0.20 H new ATOM 0 HB2 GLU A 539 1.936 -12.702 -0.366 1.00 0.29 H new ATOM 0 HB3 GLU A 539 1.220 -12.633 1.232 1.00 0.29 H new ATOM 0 HG2 GLU A 539 0.913 -10.219 1.044 1.00 0.65 H new ATOM 0 HG3 GLU A 539 1.758 -10.196 -0.491 1.00 0.65 H new ATOM 1040 N MET A 540 4.253 -9.832 0.375 1.00 0.16 N ATOM 1041 CA MET A 540 5.226 -9.016 -0.337 1.00 0.16 C ATOM 1042 C MET A 540 6.636 -9.526 -0.080 1.00 0.16 C ATOM 1043 O MET A 540 7.443 -9.655 -1.000 1.00 0.19 O ATOM 1044 CB MET A 540 5.107 -7.563 0.095 1.00 0.14 C ATOM 1045 CG MET A 540 3.892 -6.887 -0.489 1.00 0.18 C ATOM 1046 SD MET A 540 3.704 -5.186 0.037 1.00 0.19 S ATOM 1047 CE MET A 540 2.387 -4.714 -1.068 1.00 0.25 C ATOM 0 H MET A 540 3.669 -9.311 1.029 1.00 0.16 H new ATOM 0 HA MET A 540 5.022 -9.084 -1.406 1.00 0.16 H new ATOM 0 HB2 MET A 540 5.059 -7.513 1.183 1.00 0.14 H new ATOM 0 HB3 MET A 540 6.002 -7.022 -0.210 1.00 0.14 H new ATOM 0 HG2 MET A 540 3.955 -6.918 -1.577 1.00 0.18 H new ATOM 0 HG3 MET A 540 3.002 -7.448 -0.205 1.00 0.18 H new ATOM 0 HE1 MET A 540 1.908 -3.808 -0.697 1.00 0.25 H new ATOM 0 HE2 MET A 540 2.795 -4.528 -2.062 1.00 0.25 H new ATOM 0 HE3 MET A 540 1.652 -5.517 -1.122 1.00 0.25 H new ATOM 1057 N VAL A 541 6.919 -9.829 1.180 1.00 0.14 N ATOM 1058 CA VAL A 541 8.214 -10.363 1.577 1.00 0.16 C ATOM 1059 C VAL A 541 8.390 -11.788 1.063 1.00 0.20 C ATOM 1060 O VAL A 541 9.431 -12.132 0.502 1.00 0.24 O ATOM 1061 CB VAL A 541 8.377 -10.351 3.113 1.00 0.18 C ATOM 1062 CG1 VAL A 541 9.726 -10.922 3.528 1.00 0.23 C ATOM 1063 CG2 VAL A 541 8.208 -8.941 3.651 1.00 0.16 C ATOM 0 H VAL A 541 6.262 -9.712 1.951 1.00 0.14 H new ATOM 0 HA VAL A 541 8.979 -9.723 1.137 1.00 0.16 H new ATOM 0 HB VAL A 541 7.600 -10.985 3.540 1.00 0.18 H new ATOM 0 HG11 VAL A 541 9.812 -10.900 4.614 1.00 0.23 H new ATOM 0 HG12 VAL A 541 9.809 -11.951 3.178 1.00 0.23 H new ATOM 0 HG13 VAL A 541 10.525 -10.324 3.089 1.00 0.23 H new ATOM 0 HG21 VAL A 541 8.326 -8.949 4.735 1.00 0.16 H new ATOM 0 HG22 VAL A 541 8.962 -8.290 3.209 1.00 0.16 H new ATOM 0 HG23 VAL A 541 7.215 -8.571 3.396 1.00 0.16 H new ATOM 1073 N GLU A 542 7.353 -12.602 1.238 1.00 0.20 N ATOM 1074 CA GLU A 542 7.387 -14.005 0.831 1.00 0.26 C ATOM 1075 C GLU A 542 7.638 -14.141 -0.664 1.00 0.28 C ATOM 1076 O GLU A 542 8.335 -15.052 -1.105 1.00 0.36 O ATOM 1077 CB GLU A 542 6.071 -14.696 1.189 1.00 0.31 C ATOM 1078 CG GLU A 542 5.722 -14.603 2.666 1.00 0.34 C ATOM 1079 CD GLU A 542 4.404 -15.267 3.012 1.00 0.51 C ATOM 1080 OE1 GLU A 542 3.389 -14.983 2.341 1.00 0.77 O ATOM 1081 OE2 GLU A 542 4.370 -16.058 3.978 1.00 0.77 O ATOM 0 H GLU A 542 6.472 -12.312 1.662 1.00 0.20 H new ATOM 0 HA GLU A 542 8.207 -14.483 1.367 1.00 0.26 H new ATOM 0 HB2 GLU A 542 5.265 -14.252 0.604 1.00 0.31 H new ATOM 0 HB3 GLU A 542 6.131 -15.746 0.903 1.00 0.31 H new ATOM 0 HG2 GLU A 542 6.518 -15.064 3.250 1.00 0.34 H new ATOM 0 HG3 GLU A 542 5.680 -13.553 2.957 1.00 0.34 H new ATOM 1088 N SER A 543 7.076 -13.225 -1.442 1.00 0.27 N ATOM 1089 CA SER A 543 7.211 -13.277 -2.887 1.00 0.32 C ATOM 1090 C SER A 543 8.505 -12.606 -3.354 1.00 0.32 C ATOM 1091 O SER A 543 8.775 -12.522 -4.552 1.00 0.43 O ATOM 1092 CB SER A 543 6.005 -12.620 -3.553 1.00 0.37 C ATOM 1093 OG SER A 543 4.799 -13.233 -3.129 1.00 1.22 O ATOM 0 H SER A 543 6.524 -12.440 -1.095 1.00 0.27 H new ATOM 0 HA SER A 543 7.255 -14.326 -3.181 1.00 0.32 H new ATOM 0 HB2 SER A 543 5.983 -11.558 -3.309 1.00 0.37 H new ATOM 0 HB3 SER A 543 6.096 -12.697 -4.637 1.00 0.37 H new ATOM 0 HG SER A 543 4.530 -12.862 -2.263 1.00 1.22 H new ATOM 1099 N GLY A 544 9.294 -12.115 -2.405 1.00 0.27 N ATOM 1100 CA GLY A 544 10.589 -11.550 -2.737 1.00 0.30 C ATOM 1101 C GLY A 544 10.530 -10.079 -3.095 1.00 0.32 C ATOM 1102 O GLY A 544 11.567 -9.446 -3.294 1.00 0.54 O ATOM 0 H GLY A 544 9.060 -12.098 -1.412 1.00 0.27 H new ATOM 0 HA2 GLY A 544 11.263 -11.684 -1.891 1.00 0.30 H new ATOM 0 HA3 GLY A 544 11.015 -12.103 -3.574 1.00 0.30 H new ATOM 1106 N TYR A 545 9.324 -9.528 -3.175 1.00 0.21 N ATOM 1107 CA TYR A 545 9.149 -8.123 -3.526 1.00 0.21 C ATOM 1108 C TYR A 545 9.779 -7.221 -2.475 1.00 0.19 C ATOM 1109 O TYR A 545 10.640 -6.394 -2.781 1.00 0.27 O ATOM 1110 CB TYR A 545 7.666 -7.774 -3.657 1.00 0.23 C ATOM 1111 CG TYR A 545 6.963 -8.432 -4.820 1.00 0.29 C ATOM 1112 CD1 TYR A 545 7.374 -8.194 -6.124 1.00 0.35 C ATOM 1113 CD2 TYR A 545 5.906 -9.308 -4.613 1.00 0.36 C ATOM 1114 CE1 TYR A 545 6.748 -8.806 -7.191 1.00 0.43 C ATOM 1115 CE2 TYR A 545 5.279 -9.927 -5.675 1.00 0.44 C ATOM 1116 CZ TYR A 545 5.637 -9.609 -6.957 1.00 0.47 C ATOM 1117 OH TYR A 545 5.084 -10.289 -8.023 1.00 0.56 O ATOM 0 H TYR A 545 8.454 -10.032 -3.002 1.00 0.21 H new ATOM 0 HA TYR A 545 9.643 -7.962 -4.484 1.00 0.21 H new ATOM 0 HB2 TYR A 545 7.157 -8.057 -2.735 1.00 0.23 H new ATOM 0 HB3 TYR A 545 7.569 -6.693 -3.756 1.00 0.23 H new ATOM 0 HD1 TYR A 545 8.197 -7.519 -6.307 1.00 0.35 H new ATOM 0 HD2 TYR A 545 5.570 -9.508 -3.606 1.00 0.36 H new ATOM 0 HE1 TYR A 545 7.117 -8.663 -8.196 1.00 0.43 H new ATOM 0 HE2 TYR A 545 4.507 -10.661 -5.495 1.00 0.44 H new ATOM 0 HH TYR A 545 4.315 -10.812 -7.714 1.00 0.56 H new ATOM 1127 N VAL A 546 9.349 -7.401 -1.236 1.00 0.17 N ATOM 1128 CA VAL A 546 9.804 -6.564 -0.138 1.00 0.15 C ATOM 1129 C VAL A 546 10.759 -7.330 0.765 1.00 0.16 C ATOM 1130 O VAL A 546 10.613 -8.537 0.969 1.00 0.17 O ATOM 1131 CB VAL A 546 8.609 -6.038 0.695 1.00 0.14 C ATOM 1132 CG1 VAL A 546 9.082 -5.201 1.871 1.00 0.16 C ATOM 1133 CG2 VAL A 546 7.670 -5.226 -0.183 1.00 0.14 C ATOM 0 H VAL A 546 8.682 -8.123 -0.965 1.00 0.17 H new ATOM 0 HA VAL A 546 10.330 -5.713 -0.571 1.00 0.15 H new ATOM 0 HB VAL A 546 8.071 -6.900 1.089 1.00 0.14 H new ATOM 0 HG11 VAL A 546 8.220 -4.847 2.436 1.00 0.16 H new ATOM 0 HG12 VAL A 546 9.715 -5.808 2.518 1.00 0.16 H new ATOM 0 HG13 VAL A 546 9.651 -4.347 1.504 1.00 0.16 H new ATOM 0 HG21 VAL A 546 6.835 -4.863 0.416 1.00 0.14 H new ATOM 0 HG22 VAL A 546 8.209 -4.378 -0.606 1.00 0.14 H new ATOM 0 HG23 VAL A 546 7.292 -5.854 -0.990 1.00 0.14 H new ATOM 1143 N CYS A 547 11.745 -6.620 1.282 1.00 0.19 N ATOM 1144 CA CYS A 547 12.673 -7.168 2.249 1.00 0.22 C ATOM 1145 C CYS A 547 11.996 -7.241 3.610 1.00 0.20 C ATOM 1146 O CYS A 547 11.208 -6.367 3.971 1.00 0.21 O ATOM 1147 CB CYS A 547 13.927 -6.289 2.318 1.00 0.30 C ATOM 1148 SG CYS A 547 15.100 -6.754 3.610 1.00 0.43 S ATOM 0 H CYS A 547 11.924 -5.645 1.041 1.00 0.19 H new ATOM 0 HA CYS A 547 12.970 -8.172 1.947 1.00 0.22 H new ATOM 0 HB2 CYS A 547 14.435 -6.326 1.354 1.00 0.30 H new ATOM 0 HB3 CYS A 547 13.622 -5.255 2.478 1.00 0.30 H new ATOM 0 HG CYS A 547 15.981 -5.809 3.757 1.00 0.43 H new ATOM 1154 N GLU A 548 12.311 -8.287 4.364 1.00 0.22 N ATOM 1155 CA GLU A 548 11.672 -8.537 5.654 1.00 0.24 C ATOM 1156 C GLU A 548 11.980 -7.447 6.682 1.00 0.26 C ATOM 1157 O GLU A 548 11.412 -7.439 7.776 1.00 0.37 O ATOM 1158 CB GLU A 548 12.061 -9.927 6.189 1.00 0.31 C ATOM 1159 CG GLU A 548 13.554 -10.253 6.150 1.00 1.43 C ATOM 1160 CD GLU A 548 14.386 -9.445 7.124 1.00 2.08 C ATOM 1161 OE1 GLU A 548 14.383 -9.775 8.331 1.00 2.72 O ATOM 1162 OE2 GLU A 548 15.058 -8.491 6.689 1.00 2.51 O ATOM 0 H GLU A 548 13.011 -8.982 4.103 1.00 0.22 H new ATOM 0 HA GLU A 548 10.595 -8.514 5.489 1.00 0.24 H new ATOM 0 HB2 GLU A 548 11.716 -10.010 7.219 1.00 0.31 H new ATOM 0 HB3 GLU A 548 11.527 -10.682 5.612 1.00 0.31 H new ATOM 0 HG2 GLU A 548 13.690 -11.313 6.364 1.00 1.43 H new ATOM 0 HG3 GLU A 548 13.927 -10.082 5.140 1.00 1.43 H new ATOM 1169 N GLY A 549 12.868 -6.531 6.325 1.00 0.23 N ATOM 1170 CA GLY A 549 13.200 -5.432 7.205 1.00 0.27 C ATOM 1171 C GLY A 549 12.330 -4.211 6.971 1.00 0.23 C ATOM 1172 O GLY A 549 12.339 -3.277 7.771 1.00 0.32 O ATOM 0 H GLY A 549 13.367 -6.531 5.435 1.00 0.23 H new ATOM 0 HA2 GLY A 549 13.093 -5.756 8.240 1.00 0.27 H new ATOM 0 HA3 GLY A 549 14.246 -5.161 7.062 1.00 0.27 H new ATOM 1176 N ASP A 550 11.571 -4.214 5.878 1.00 0.17 N ATOM 1177 CA ASP A 550 10.719 -3.078 5.537 1.00 0.22 C ATOM 1178 C ASP A 550 9.251 -3.472 5.578 1.00 0.16 C ATOM 1179 O ASP A 550 8.397 -2.790 5.009 1.00 0.20 O ATOM 1180 CB ASP A 550 11.057 -2.548 4.143 1.00 0.35 C ATOM 1181 CG ASP A 550 12.479 -2.049 4.026 1.00 0.77 C ATOM 1182 OD1 ASP A 550 12.827 -1.080 4.730 1.00 0.79 O ATOM 1183 OD2 ASP A 550 13.256 -2.623 3.235 1.00 1.23 O ATOM 0 H ASP A 550 11.528 -4.988 5.215 1.00 0.17 H new ATOM 0 HA ASP A 550 10.901 -2.296 6.274 1.00 0.22 H new ATOM 0 HB2 ASP A 550 10.895 -3.339 3.411 1.00 0.35 H new ATOM 0 HB3 ASP A 550 10.372 -1.737 3.893 1.00 0.35 H new ATOM 1188 N HIS A 551 8.966 -4.571 6.266 1.00 0.15 N ATOM 1189 CA HIS A 551 7.617 -5.132 6.323 1.00 0.16 C ATOM 1190 C HIS A 551 6.586 -4.098 6.797 1.00 0.17 C ATOM 1191 O HIS A 551 5.583 -3.863 6.121 1.00 0.21 O ATOM 1192 CB HIS A 551 7.600 -6.364 7.245 1.00 0.17 C ATOM 1193 CG HIS A 551 6.225 -6.827 7.626 1.00 0.18 C ATOM 1194 ND1 HIS A 551 5.599 -6.438 8.793 1.00 0.22 N ATOM 1195 CD2 HIS A 551 5.343 -7.622 6.980 1.00 0.21 C ATOM 1196 CE1 HIS A 551 4.391 -6.965 8.842 1.00 0.24 C ATOM 1197 NE2 HIS A 551 4.214 -7.690 7.757 1.00 0.23 N ATOM 0 H HIS A 551 9.658 -5.098 6.799 1.00 0.15 H new ATOM 0 HA HIS A 551 7.338 -5.430 5.313 1.00 0.16 H new ATOM 0 HB2 HIS A 551 8.123 -7.182 6.749 1.00 0.17 H new ATOM 0 HB3 HIS A 551 8.158 -6.133 8.152 1.00 0.17 H new ATOM 0 HD2 HIS A 551 5.498 -8.112 6.030 1.00 0.21 H new ATOM 0 HE1 HIS A 551 3.671 -6.826 9.635 1.00 0.24 H new ATOM 0 HE2 HIS A 551 3.371 -8.218 7.530 1.00 0.23 H new ATOM 1206 N LYS A 552 6.831 -3.483 7.947 1.00 0.20 N ATOM 1207 CA LYS A 552 5.859 -2.565 8.533 1.00 0.27 C ATOM 1208 C LYS A 552 5.807 -1.249 7.764 1.00 0.22 C ATOM 1209 O LYS A 552 4.764 -0.603 7.702 1.00 0.23 O ATOM 1210 CB LYS A 552 6.173 -2.308 10.008 1.00 0.41 C ATOM 1211 CG LYS A 552 6.076 -3.557 10.874 1.00 1.40 C ATOM 1212 CD LYS A 552 6.398 -3.261 12.331 1.00 1.75 C ATOM 1213 CE LYS A 552 5.307 -2.433 12.992 1.00 2.03 C ATOM 1214 NZ LYS A 552 4.043 -3.202 13.157 1.00 2.90 N ATOM 0 H LYS A 552 7.687 -3.601 8.490 1.00 0.20 H new ATOM 0 HA LYS A 552 4.878 -3.036 8.464 1.00 0.27 H new ATOM 0 HB2 LYS A 552 7.178 -1.895 10.091 1.00 0.41 H new ATOM 0 HB3 LYS A 552 5.486 -1.554 10.392 1.00 0.41 H new ATOM 0 HG2 LYS A 552 5.071 -3.973 10.801 1.00 1.40 H new ATOM 0 HG3 LYS A 552 6.763 -4.315 10.497 1.00 1.40 H new ATOM 0 HD2 LYS A 552 6.523 -4.198 12.874 1.00 1.75 H new ATOM 0 HD3 LYS A 552 7.347 -2.728 12.393 1.00 1.75 H new ATOM 0 HE2 LYS A 552 5.653 -2.091 13.967 1.00 2.03 H new ATOM 0 HE3 LYS A 552 5.114 -1.543 12.392 1.00 2.03 H new ATOM 0 HZ1 LYS A 552 3.379 -2.657 13.744 1.00 2.90 H new ATOM 0 HZ2 LYS A 552 3.618 -3.375 12.224 1.00 2.90 H new ATOM 0 HZ3 LYS A 552 4.248 -4.111 13.619 1.00 2.90 H new ATOM 1228 N THR A 553 6.930 -0.869 7.170 1.00 0.21 N ATOM 1229 CA THR A 553 6.996 0.336 6.355 1.00 0.21 C ATOM 1230 C THR A 553 6.053 0.229 5.157 1.00 0.16 C ATOM 1231 O THR A 553 5.304 1.161 4.856 1.00 0.17 O ATOM 1232 CB THR A 553 8.440 0.587 5.873 1.00 0.26 C ATOM 1233 OG1 THR A 553 9.293 0.775 7.010 1.00 0.35 O ATOM 1234 CG2 THR A 553 8.522 1.803 4.958 1.00 0.26 C ATOM 0 H THR A 553 7.810 -1.380 7.238 1.00 0.21 H new ATOM 0 HA THR A 553 6.682 1.179 6.971 1.00 0.21 H new ATOM 0 HB THR A 553 8.766 -0.282 5.301 1.00 0.26 H new ATOM 0 HG1 THR A 553 10.212 0.933 6.707 1.00 0.35 H new ATOM 0 HG21 THR A 553 9.554 1.949 4.638 1.00 0.26 H new ATOM 0 HG22 THR A 553 7.890 1.644 4.084 1.00 0.26 H new ATOM 0 HG23 THR A 553 8.181 2.687 5.496 1.00 0.26 H new ATOM 1242 N MET A 554 6.075 -0.921 4.495 1.00 0.12 N ATOM 1243 CA MET A 554 5.207 -1.159 3.350 1.00 0.12 C ATOM 1244 C MET A 554 3.760 -1.241 3.790 1.00 0.12 C ATOM 1245 O MET A 554 2.870 -0.677 3.158 1.00 0.14 O ATOM 1246 CB MET A 554 5.589 -2.455 2.651 1.00 0.13 C ATOM 1247 CG MET A 554 7.016 -2.474 2.161 1.00 0.12 C ATOM 1248 SD MET A 554 7.378 -1.116 1.037 1.00 0.13 S ATOM 1249 CE MET A 554 9.128 -1.369 0.786 1.00 0.14 C ATOM 0 H MET A 554 6.685 -1.703 4.732 1.00 0.12 H new ATOM 0 HA MET A 554 5.328 -0.326 2.658 1.00 0.12 H new ATOM 0 HB2 MET A 554 5.437 -3.288 3.338 1.00 0.13 H new ATOM 0 HB3 MET A 554 4.920 -2.614 1.805 1.00 0.13 H new ATOM 0 HG2 MET A 554 7.691 -2.423 3.016 1.00 0.12 H new ATOM 0 HG3 MET A 554 7.211 -3.420 1.657 1.00 0.12 H new ATOM 0 HE1 MET A 554 9.505 -0.628 0.081 1.00 0.14 H new ATOM 0 HE2 MET A 554 9.651 -1.265 1.737 1.00 0.14 H new ATOM 0 HE3 MET A 554 9.297 -2.369 0.387 1.00 0.14 H new ATOM 1259 N ALA A 555 3.540 -1.947 4.887 1.00 0.12 N ATOM 1260 CA ALA A 555 2.207 -2.134 5.425 1.00 0.14 C ATOM 1261 C ALA A 555 1.586 -0.808 5.825 1.00 0.13 C ATOM 1262 O ALA A 555 0.382 -0.612 5.687 1.00 0.15 O ATOM 1263 CB ALA A 555 2.259 -3.066 6.617 1.00 0.17 C ATOM 0 H ALA A 555 4.277 -2.403 5.425 1.00 0.12 H new ATOM 0 HA ALA A 555 1.584 -2.577 4.648 1.00 0.14 H new ATOM 0 HB1 ALA A 555 1.254 -3.202 7.016 1.00 0.17 H new ATOM 0 HB2 ALA A 555 2.660 -4.031 6.307 1.00 0.17 H new ATOM 0 HB3 ALA A 555 2.900 -2.637 7.387 1.00 0.17 H new ATOM 1269 N LYS A 556 2.414 0.100 6.321 1.00 0.13 N ATOM 1270 CA LYS A 556 1.947 1.420 6.701 1.00 0.15 C ATOM 1271 C LYS A 556 1.478 2.158 5.454 1.00 0.16 C ATOM 1272 O LYS A 556 0.443 2.819 5.470 1.00 0.20 O ATOM 1273 CB LYS A 556 3.065 2.192 7.413 1.00 0.20 C ATOM 1274 CG LYS A 556 2.576 3.319 8.322 1.00 0.40 C ATOM 1275 CD LYS A 556 1.917 4.447 7.540 1.00 0.87 C ATOM 1276 CE LYS A 556 1.332 5.509 8.458 1.00 1.31 C ATOM 1277 NZ LYS A 556 2.376 6.201 9.254 1.00 1.83 N ATOM 0 H LYS A 556 3.411 -0.055 6.469 1.00 0.13 H new ATOM 0 HA LYS A 556 1.111 1.332 7.395 1.00 0.15 H new ATOM 0 HB2 LYS A 556 3.652 1.491 8.007 1.00 0.20 H new ATOM 0 HB3 LYS A 556 3.734 2.612 6.662 1.00 0.20 H new ATOM 0 HG2 LYS A 556 1.866 2.918 9.045 1.00 0.40 H new ATOM 0 HG3 LYS A 556 3.418 3.716 8.889 1.00 0.40 H new ATOM 0 HD2 LYS A 556 2.650 4.905 6.876 1.00 0.87 H new ATOM 0 HD3 LYS A 556 1.128 4.038 6.909 1.00 0.87 H new ATOM 0 HE2 LYS A 556 0.787 6.241 7.862 1.00 1.31 H new ATOM 0 HE3 LYS A 556 0.611 5.047 9.132 1.00 1.31 H new ATOM 0 HZ1 LYS A 556 1.945 6.982 9.788 1.00 1.83 H new ATOM 0 HZ2 LYS A 556 2.811 5.527 9.917 1.00 1.83 H new ATOM 0 HZ3 LYS A 556 3.105 6.579 8.616 1.00 1.83 H new ATOM 1291 N ALA A 557 2.236 2.019 4.370 1.00 0.15 N ATOM 1292 CA ALA A 557 1.863 2.614 3.093 1.00 0.16 C ATOM 1293 C ALA A 557 0.508 2.093 2.646 1.00 0.15 C ATOM 1294 O ALA A 557 -0.347 2.851 2.178 1.00 0.17 O ATOM 1295 CB ALA A 557 2.914 2.306 2.036 1.00 0.18 C ATOM 0 H ALA A 557 3.113 1.499 4.352 1.00 0.15 H new ATOM 0 HA ALA A 557 1.801 3.695 3.220 1.00 0.16 H new ATOM 0 HB1 ALA A 557 2.620 2.757 1.088 1.00 0.18 H new ATOM 0 HB2 ALA A 557 3.875 2.713 2.349 1.00 0.18 H new ATOM 0 HB3 ALA A 557 3.000 1.226 1.912 1.00 0.18 H new ATOM 1301 N ILE A 558 0.323 0.790 2.806 1.00 0.14 N ATOM 1302 CA ILE A 558 -0.932 0.143 2.483 1.00 0.14 C ATOM 1303 C ILE A 558 -2.038 0.673 3.385 1.00 0.14 C ATOM 1304 O ILE A 558 -3.079 1.121 2.912 1.00 0.16 O ATOM 1305 CB ILE A 558 -0.810 -1.385 2.654 1.00 0.14 C ATOM 1306 CG1 ILE A 558 0.359 -1.916 1.829 1.00 0.17 C ATOM 1307 CG2 ILE A 558 -2.099 -2.075 2.252 1.00 0.18 C ATOM 1308 CD1 ILE A 558 0.655 -3.381 2.051 1.00 0.18 C ATOM 0 H ILE A 558 1.039 0.157 3.163 1.00 0.14 H new ATOM 0 HA ILE A 558 -1.178 0.363 1.444 1.00 0.14 H new ATOM 0 HB ILE A 558 -0.623 -1.600 3.706 1.00 0.14 H new ATOM 0 HG12 ILE A 558 0.147 -1.755 0.772 1.00 0.17 H new ATOM 0 HG13 ILE A 558 1.251 -1.336 2.067 1.00 0.17 H new ATOM 0 HG21 ILE A 558 -1.991 -3.152 2.380 1.00 0.18 H new ATOM 0 HG22 ILE A 558 -2.915 -1.715 2.879 1.00 0.18 H new ATOM 0 HG23 ILE A 558 -2.319 -1.855 1.207 1.00 0.18 H new ATOM 0 HD11 ILE A 558 1.498 -3.680 1.429 1.00 0.18 H new ATOM 0 HD12 ILE A 558 0.901 -3.548 3.100 1.00 0.18 H new ATOM 0 HD13 ILE A 558 -0.220 -3.973 1.785 1.00 0.18 H new ATOM 1320 N LYS A 559 -1.772 0.663 4.685 1.00 0.14 N ATOM 1321 CA LYS A 559 -2.747 1.071 5.686 1.00 0.17 C ATOM 1322 C LYS A 559 -3.154 2.524 5.485 1.00 0.18 C ATOM 1323 O LYS A 559 -4.327 2.874 5.624 1.00 0.23 O ATOM 1324 CB LYS A 559 -2.160 0.889 7.086 1.00 0.21 C ATOM 1325 CG LYS A 559 -3.182 1.019 8.207 1.00 0.34 C ATOM 1326 CD LYS A 559 -2.532 0.901 9.579 1.00 0.93 C ATOM 1327 CE LYS A 559 -1.758 -0.400 9.723 1.00 1.61 C ATOM 1328 NZ LYS A 559 -1.168 -0.550 11.078 1.00 2.20 N ATOM 0 H LYS A 559 -0.875 0.372 5.074 1.00 0.14 H new ATOM 0 HA LYS A 559 -3.633 0.445 5.578 1.00 0.17 H new ATOM 0 HB2 LYS A 559 -1.691 -0.093 7.148 1.00 0.21 H new ATOM 0 HB3 LYS A 559 -1.373 1.628 7.238 1.00 0.21 H new ATOM 0 HG2 LYS A 559 -3.690 1.980 8.127 1.00 0.34 H new ATOM 0 HG3 LYS A 559 -3.943 0.246 8.097 1.00 0.34 H new ATOM 0 HD2 LYS A 559 -1.860 1.744 9.737 1.00 0.93 H new ATOM 0 HD3 LYS A 559 -3.299 0.956 10.351 1.00 0.93 H new ATOM 0 HE2 LYS A 559 -2.422 -1.241 9.522 1.00 1.61 H new ATOM 0 HE3 LYS A 559 -0.965 -0.434 8.976 1.00 1.61 H new ATOM 0 HZ1 LYS A 559 -0.649 -1.450 11.133 1.00 2.20 H new ATOM 0 HZ2 LYS A 559 -0.515 0.238 11.261 1.00 2.20 H new ATOM 0 HZ3 LYS A 559 -1.926 -0.543 11.790 1.00 2.20 H new ATOM 1342 N ASP A 560 -2.180 3.363 5.153 1.00 0.20 N ATOM 1343 CA ASP A 560 -2.430 4.783 4.952 1.00 0.25 C ATOM 1344 C ASP A 560 -3.371 4.992 3.774 1.00 0.20 C ATOM 1345 O ASP A 560 -4.318 5.776 3.853 1.00 0.22 O ATOM 1346 CB ASP A 560 -1.120 5.531 4.720 1.00 0.34 C ATOM 1347 CG ASP A 560 -1.295 7.033 4.791 1.00 0.60 C ATOM 1348 OD1 ASP A 560 -1.431 7.573 5.907 1.00 0.75 O ATOM 1349 OD2 ASP A 560 -1.309 7.682 3.724 1.00 1.03 O ATOM 0 H ASP A 560 -1.209 3.083 5.017 1.00 0.20 H new ATOM 0 HA ASP A 560 -2.900 5.180 5.852 1.00 0.25 H new ATOM 0 HB2 ASP A 560 -0.388 5.217 5.465 1.00 0.34 H new ATOM 0 HB3 ASP A 560 -0.718 5.260 3.744 1.00 0.34 H new ATOM 1354 N ARG A 561 -3.122 4.264 2.689 1.00 0.20 N ATOM 1355 CA ARG A 561 -3.972 4.341 1.515 1.00 0.19 C ATOM 1356 C ARG A 561 -5.356 3.791 1.823 1.00 0.18 C ATOM 1357 O ARG A 561 -6.365 4.422 1.517 1.00 0.20 O ATOM 1358 CB ARG A 561 -3.361 3.570 0.339 1.00 0.19 C ATOM 1359 CG ARG A 561 -4.220 3.609 -0.919 1.00 0.21 C ATOM 1360 CD ARG A 561 -4.512 5.040 -1.344 1.00 0.25 C ATOM 1361 NE ARG A 561 -5.488 5.134 -2.431 1.00 0.64 N ATOM 1362 CZ ARG A 561 -6.264 6.204 -2.627 1.00 0.85 C ATOM 1363 NH1 ARG A 561 -6.149 7.259 -1.830 1.00 1.57 N ATOM 1364 NH2 ARG A 561 -7.139 6.228 -3.626 1.00 1.32 N ATOM 0 H ARG A 561 -2.339 3.616 2.603 1.00 0.20 H new ATOM 0 HA ARG A 561 -4.057 5.391 1.235 1.00 0.19 H new ATOM 0 HB2 ARG A 561 -2.379 3.985 0.113 1.00 0.19 H new ATOM 0 HB3 ARG A 561 -3.208 2.532 0.634 1.00 0.19 H new ATOM 0 HG2 ARG A 561 -3.710 3.084 -1.727 1.00 0.21 H new ATOM 0 HG3 ARG A 561 -5.157 3.082 -0.739 1.00 0.21 H new ATOM 0 HD2 ARG A 561 -4.881 5.599 -0.484 1.00 0.25 H new ATOM 0 HD3 ARG A 561 -3.583 5.515 -1.658 1.00 0.25 H new ATOM 0 HE ARG A 561 -5.580 4.344 -3.070 1.00 0.64 H new ATOM 0 HH11 ARG A 561 -5.469 7.252 -1.070 1.00 1.57 H new ATOM 0 HH12 ARG A 561 -6.740 8.077 -1.978 1.00 1.57 H new ATOM 0 HH21 ARG A 561 -7.222 5.426 -4.250 1.00 1.32 H new ATOM 0 HH22 ARG A 561 -7.728 7.049 -3.769 1.00 1.32 H new ATOM 1378 N VAL A 562 -5.390 2.614 2.435 1.00 0.16 N ATOM 1379 CA VAL A 562 -6.639 1.947 2.757 1.00 0.18 C ATOM 1380 C VAL A 562 -7.502 2.804 3.680 1.00 0.21 C ATOM 1381 O VAL A 562 -8.721 2.840 3.535 1.00 0.24 O ATOM 1382 CB VAL A 562 -6.377 0.572 3.404 1.00 0.18 C ATOM 1383 CG1 VAL A 562 -7.675 -0.074 3.840 1.00 0.22 C ATOM 1384 CG2 VAL A 562 -5.636 -0.336 2.436 1.00 0.18 C ATOM 0 H VAL A 562 -4.556 2.100 2.720 1.00 0.16 H new ATOM 0 HA VAL A 562 -7.180 1.797 1.823 1.00 0.18 H new ATOM 0 HB VAL A 562 -5.757 0.724 4.287 1.00 0.18 H new ATOM 0 HG11 VAL A 562 -7.465 -1.043 4.293 1.00 0.22 H new ATOM 0 HG12 VAL A 562 -8.174 0.567 4.567 1.00 0.22 H new ATOM 0 HG13 VAL A 562 -8.322 -0.212 2.974 1.00 0.22 H new ATOM 0 HG21 VAL A 562 -5.458 -1.303 2.907 1.00 0.18 H new ATOM 0 HG22 VAL A 562 -6.236 -0.475 1.537 1.00 0.18 H new ATOM 0 HG23 VAL A 562 -4.682 0.118 2.169 1.00 0.18 H new ATOM 1394 N SER A 563 -6.868 3.500 4.615 1.00 0.23 N ATOM 1395 CA SER A 563 -7.586 4.398 5.507 1.00 0.28 C ATOM 1396 C SER A 563 -8.303 5.477 4.697 1.00 0.32 C ATOM 1397 O SER A 563 -9.503 5.696 4.865 1.00 0.35 O ATOM 1398 CB SER A 563 -6.623 5.035 6.512 1.00 0.34 C ATOM 1399 OG SER A 563 -7.322 5.787 7.490 1.00 0.84 O ATOM 0 H SER A 563 -5.861 3.460 4.774 1.00 0.23 H new ATOM 0 HA SER A 563 -8.329 3.823 6.060 1.00 0.28 H new ATOM 0 HB2 SER A 563 -6.036 4.257 7.000 1.00 0.34 H new ATOM 0 HB3 SER A 563 -5.921 5.682 5.986 1.00 0.34 H new ATOM 0 HG SER A 563 -6.682 6.181 8.119 1.00 0.84 H new ATOM 1405 N LEU A 564 -7.565 6.123 3.798 1.00 0.35 N ATOM 1406 CA LEU A 564 -8.129 7.156 2.935 1.00 0.42 C ATOM 1407 C LEU A 564 -9.236 6.578 2.059 1.00 0.43 C ATOM 1408 O LEU A 564 -10.292 7.187 1.887 1.00 0.51 O ATOM 1409 CB LEU A 564 -7.030 7.766 2.062 1.00 0.53 C ATOM 1410 CG LEU A 564 -5.903 8.460 2.827 1.00 0.98 C ATOM 1411 CD1 LEU A 564 -4.820 8.927 1.869 1.00 1.65 C ATOM 1412 CD2 LEU A 564 -6.445 9.631 3.631 1.00 1.70 C ATOM 0 H LEU A 564 -6.571 5.948 3.648 1.00 0.35 H new ATOM 0 HA LEU A 564 -8.559 7.937 3.563 1.00 0.42 H new ATOM 0 HB2 LEU A 564 -6.598 6.978 1.446 1.00 0.53 H new ATOM 0 HB3 LEU A 564 -7.485 8.487 1.383 1.00 0.53 H new ATOM 0 HG LEU A 564 -5.464 7.742 3.520 1.00 0.98 H new ATOM 0 HD11 LEU A 564 -4.025 9.419 2.430 1.00 1.65 H new ATOM 0 HD12 LEU A 564 -4.410 8.069 1.336 1.00 1.65 H new ATOM 0 HD13 LEU A 564 -5.246 9.629 1.152 1.00 1.65 H new ATOM 0 HD21 LEU A 564 -5.628 10.112 4.169 1.00 1.70 H new ATOM 0 HD22 LEU A 564 -6.910 10.351 2.957 1.00 1.70 H new ATOM 0 HD23 LEU A 564 -7.186 9.271 4.344 1.00 1.70 H new ATOM 1424 N ILE A 565 -8.978 5.392 1.516 1.00 0.39 N ATOM 1425 CA ILE A 565 -9.958 4.665 0.721 1.00 0.41 C ATOM 1426 C ILE A 565 -11.242 4.437 1.508 1.00 0.47 C ATOM 1427 O ILE A 565 -12.321 4.819 1.068 1.00 0.58 O ATOM 1428 CB ILE A 565 -9.379 3.314 0.265 1.00 0.35 C ATOM 1429 CG1 ILE A 565 -8.298 3.556 -0.777 1.00 0.30 C ATOM 1430 CG2 ILE A 565 -10.464 2.401 -0.285 1.00 0.38 C ATOM 1431 CD1 ILE A 565 -7.531 2.319 -1.150 1.00 0.24 C ATOM 0 H ILE A 565 -8.085 4.910 1.615 1.00 0.39 H new ATOM 0 HA ILE A 565 -10.194 5.269 -0.155 1.00 0.41 H new ATOM 0 HB ILE A 565 -8.943 2.812 1.129 1.00 0.35 H new ATOM 0 HG12 ILE A 565 -8.757 3.973 -1.674 1.00 0.30 H new ATOM 0 HG13 ILE A 565 -7.602 4.304 -0.398 1.00 0.30 H new ATOM 0 HG21 ILE A 565 -10.020 1.456 -0.598 1.00 0.38 H new ATOM 0 HG22 ILE A 565 -11.209 2.214 0.489 1.00 0.38 H new ATOM 0 HG23 ILE A 565 -10.942 2.878 -1.141 1.00 0.38 H new ATOM 0 HD11 ILE A 565 -6.778 2.569 -1.897 1.00 0.24 H new ATOM 0 HD12 ILE A 565 -7.042 1.913 -0.264 1.00 0.24 H new ATOM 0 HD13 ILE A 565 -8.215 1.576 -1.560 1.00 0.24 H new ATOM 1443 N LYS A 566 -11.111 3.840 2.687 1.00 0.42 N ATOM 1444 CA LYS A 566 -12.268 3.524 3.523 1.00 0.49 C ATOM 1445 C LYS A 566 -13.051 4.783 3.899 1.00 0.56 C ATOM 1446 O LYS A 566 -14.271 4.738 4.030 1.00 0.68 O ATOM 1447 CB LYS A 566 -11.846 2.773 4.788 1.00 0.45 C ATOM 1448 CG LYS A 566 -11.410 1.343 4.524 1.00 0.46 C ATOM 1449 CD LYS A 566 -11.115 0.604 5.820 1.00 0.49 C ATOM 1450 CE LYS A 566 -10.775 -0.857 5.565 1.00 0.54 C ATOM 1451 NZ LYS A 566 -10.498 -1.599 6.824 1.00 0.88 N ATOM 0 H LYS A 566 -10.215 3.564 3.088 1.00 0.42 H new ATOM 0 HA LYS A 566 -12.921 2.879 2.935 1.00 0.49 H new ATOM 0 HB2 LYS A 566 -11.028 3.312 5.265 1.00 0.45 H new ATOM 0 HB3 LYS A 566 -12.678 2.767 5.492 1.00 0.45 H new ATOM 0 HG2 LYS A 566 -12.191 0.818 3.974 1.00 0.46 H new ATOM 0 HG3 LYS A 566 -10.521 1.343 3.893 1.00 0.46 H new ATOM 0 HD2 LYS A 566 -10.284 1.087 6.334 1.00 0.49 H new ATOM 0 HD3 LYS A 566 -11.980 0.667 6.481 1.00 0.49 H new ATOM 0 HE2 LYS A 566 -11.602 -1.334 5.039 1.00 0.54 H new ATOM 0 HE3 LYS A 566 -9.905 -0.917 4.911 1.00 0.54 H new ATOM 0 HZ1 LYS A 566 -10.271 -2.589 6.601 1.00 0.88 H new ATOM 0 HZ2 LYS A 566 -9.692 -1.162 7.315 1.00 0.88 H new ATOM 0 HZ3 LYS A 566 -11.337 -1.566 7.438 1.00 0.88 H new ATOM 1465 N ARG A 567 -12.352 5.903 4.061 1.00 0.55 N ATOM 1466 CA ARG A 567 -12.998 7.170 4.346 1.00 0.68 C ATOM 1467 C ARG A 567 -13.904 7.584 3.190 1.00 0.85 C ATOM 1468 O ARG A 567 -15.041 8.014 3.398 1.00 0.96 O ATOM 1469 CB ARG A 567 -11.939 8.242 4.596 1.00 0.73 C ATOM 1470 CG ARG A 567 -11.144 8.044 5.875 1.00 1.10 C ATOM 1471 CD ARG A 567 -12.007 8.221 7.113 1.00 1.32 C ATOM 1472 NE ARG A 567 -12.550 9.577 7.223 1.00 1.82 N ATOM 1473 CZ ARG A 567 -13.198 10.032 8.296 1.00 2.40 C ATOM 1474 NH1 ARG A 567 -13.371 9.244 9.348 1.00 2.76 N ATOM 1475 NH2 ARG A 567 -13.667 11.274 8.319 1.00 3.00 N ATOM 0 H ARG A 567 -11.335 5.953 3.999 1.00 0.55 H new ATOM 0 HA ARG A 567 -13.613 7.058 5.239 1.00 0.68 H new ATOM 0 HB2 ARG A 567 -11.250 8.260 3.752 1.00 0.73 H new ATOM 0 HB3 ARG A 567 -12.426 9.217 4.631 1.00 0.73 H new ATOM 0 HG2 ARG A 567 -10.705 7.046 5.878 1.00 1.10 H new ATOM 0 HG3 ARG A 567 -10.319 8.756 5.903 1.00 1.10 H new ATOM 0 HD2 ARG A 567 -12.828 7.504 7.086 1.00 1.32 H new ATOM 0 HD3 ARG A 567 -11.416 7.996 8.001 1.00 1.32 H new ATOM 0 HE ARG A 567 -12.425 10.210 6.433 1.00 1.82 H new ATOM 0 HH11 ARG A 567 -13.009 8.291 9.336 1.00 2.76 H new ATOM 0 HH12 ARG A 567 -13.866 9.591 10.169 1.00 2.76 H new ATOM 0 HH21 ARG A 567 -13.532 11.885 7.513 1.00 3.00 H new ATOM 0 HH22 ARG A 567 -14.162 11.617 9.142 1.00 3.00 H new ATOM 1489 N LYS A 568 -13.395 7.433 1.972 1.00 0.95 N ATOM 1490 CA LYS A 568 -14.160 7.752 0.770 1.00 1.18 C ATOM 1491 C LYS A 568 -15.233 6.696 0.531 1.00 1.27 C ATOM 1492 O LYS A 568 -16.260 6.961 -0.092 1.00 1.48 O ATOM 1493 CB LYS A 568 -13.231 7.837 -0.442 1.00 1.28 C ATOM 1494 CG LYS A 568 -12.137 8.880 -0.301 1.00 1.84 C ATOM 1495 CD LYS A 568 -11.198 8.862 -1.496 1.00 2.17 C ATOM 1496 CE LYS A 568 -10.089 9.888 -1.349 1.00 2.77 C ATOM 1497 NZ LYS A 568 -10.620 11.272 -1.252 1.00 3.47 N ATOM 0 H LYS A 568 -12.452 7.090 1.790 1.00 0.95 H new ATOM 0 HA LYS A 568 -14.643 8.719 0.912 1.00 1.18 H new ATOM 0 HB2 LYS A 568 -12.772 6.862 -0.606 1.00 1.28 H new ATOM 0 HB3 LYS A 568 -13.824 8.063 -1.328 1.00 1.28 H new ATOM 0 HG2 LYS A 568 -12.585 9.869 -0.203 1.00 1.84 H new ATOM 0 HG3 LYS A 568 -11.571 8.695 0.612 1.00 1.84 H new ATOM 0 HD2 LYS A 568 -10.763 7.868 -1.603 1.00 2.17 H new ATOM 0 HD3 LYS A 568 -11.763 9.063 -2.406 1.00 2.17 H new ATOM 0 HE2 LYS A 568 -9.502 9.662 -0.459 1.00 2.77 H new ATOM 0 HE3 LYS A 568 -9.415 9.818 -2.202 1.00 2.77 H new ATOM 0 HZ1 LYS A 568 -9.840 11.951 -1.357 1.00 3.47 H new ATOM 0 HZ2 LYS A 568 -11.320 11.429 -2.005 1.00 3.47 H new ATOM 0 HZ3 LYS A 568 -11.073 11.406 -0.325 1.00 3.47 H new ATOM 1511 N ARG A 569 -14.972 5.494 1.019 1.00 1.16 N ATOM 1512 CA ARG A 569 -15.930 4.402 0.953 1.00 1.30 C ATOM 1513 C ARG A 569 -17.137 4.683 1.835 1.00 1.33 C ATOM 1514 O ARG A 569 -18.274 4.381 1.473 1.00 1.49 O ATOM 1515 CB ARG A 569 -15.259 3.104 1.379 1.00 1.22 C ATOM 1516 CG ARG A 569 -14.348 2.536 0.321 1.00 1.34 C ATOM 1517 CD ARG A 569 -14.956 1.303 -0.296 1.00 1.18 C ATOM 1518 NE ARG A 569 -16.323 1.547 -0.758 1.00 1.70 N ATOM 1519 CZ ARG A 569 -17.406 1.008 -0.199 1.00 2.26 C ATOM 1520 NH1 ARG A 569 -17.285 0.136 0.793 1.00 2.66 N ATOM 1521 NH2 ARG A 569 -18.612 1.340 -0.638 1.00 3.05 N ATOM 0 H ARG A 569 -14.092 5.248 1.471 1.00 1.16 H new ATOM 0 HA ARG A 569 -16.278 4.308 -0.076 1.00 1.30 H new ATOM 0 HB2 ARG A 569 -14.685 3.280 2.289 1.00 1.22 H new ATOM 0 HB3 ARG A 569 -16.026 2.369 1.623 1.00 1.22 H new ATOM 0 HG2 ARG A 569 -14.167 3.284 -0.451 1.00 1.34 H new ATOM 0 HG3 ARG A 569 -13.381 2.291 0.760 1.00 1.34 H new ATOM 0 HD2 ARG A 569 -14.342 0.975 -1.134 1.00 1.18 H new ATOM 0 HD3 ARG A 569 -14.958 0.494 0.434 1.00 1.18 H new ATOM 0 HE ARG A 569 -16.455 2.168 -1.557 1.00 1.70 H new ATOM 0 HH11 ARG A 569 -16.359 -0.125 1.132 1.00 2.66 H new ATOM 0 HH12 ARG A 569 -18.118 -0.273 1.217 1.00 2.66 H new ATOM 0 HH21 ARG A 569 -18.710 2.007 -1.403 1.00 3.05 H new ATOM 0 HH22 ARG A 569 -19.442 0.928 -0.211 1.00 3.05 H new ATOM 1535 N GLU A 570 -16.874 5.265 2.994 1.00 1.25 N ATOM 1536 CA GLU A 570 -17.920 5.611 3.941 1.00 1.34 C ATOM 1537 C GLU A 570 -18.860 6.672 3.385 1.00 1.54 C ATOM 1538 O GLU A 570 -20.068 6.441 3.289 1.00 1.74 O ATOM 1539 CB GLU A 570 -17.297 6.111 5.237 1.00 1.23 C ATOM 1540 CG GLU A 570 -16.706 5.004 6.084 1.00 1.17 C ATOM 1541 CD GLU A 570 -17.756 4.039 6.579 1.00 1.69 C ATOM 1542 OE1 GLU A 570 -18.558 4.432 7.453 1.00 2.16 O ATOM 1543 OE2 GLU A 570 -17.784 2.885 6.105 1.00 2.15 O ATOM 0 H GLU A 570 -15.933 5.510 3.303 1.00 1.25 H new ATOM 0 HA GLU A 570 -18.505 4.711 4.130 1.00 1.34 H new ATOM 0 HB2 GLU A 570 -16.517 6.835 5.001 1.00 1.23 H new ATOM 0 HB3 GLU A 570 -18.055 6.637 5.817 1.00 1.23 H new ATOM 0 HG2 GLU A 570 -15.962 4.461 5.501 1.00 1.17 H new ATOM 0 HG3 GLU A 570 -16.186 5.440 6.937 1.00 1.17 H new ATOM 1550 N GLN A 571 -18.306 7.822 3.009 1.00 1.83 N ATOM 1551 CA GLN A 571 -19.112 8.972 2.597 1.00 2.15 C ATOM 1552 C GLN A 571 -20.061 9.364 3.724 1.00 2.64 C ATOM 1553 O GLN A 571 -21.282 9.364 3.553 1.00 3.40 O ATOM 1554 CB GLN A 571 -19.905 8.669 1.316 1.00 3.00 C ATOM 1555 CG GLN A 571 -19.038 8.370 0.101 1.00 3.64 C ATOM 1556 CD GLN A 571 -18.281 9.583 -0.414 1.00 4.52 C ATOM 1557 OE1 GLN A 571 -17.934 10.495 0.342 1.00 4.82 O ATOM 1558 NE2 GLN A 571 -18.017 9.599 -1.712 1.00 5.28 N ATOM 0 H GLN A 571 -17.299 7.984 2.981 1.00 1.83 H new ATOM 0 HA GLN A 571 -18.439 9.803 2.383 1.00 2.15 H new ATOM 0 HB2 GLN A 571 -20.559 7.817 1.500 1.00 3.00 H new ATOM 0 HB3 GLN A 571 -20.547 9.520 1.090 1.00 3.00 H new ATOM 0 HG2 GLN A 571 -18.324 7.587 0.357 1.00 3.64 H new ATOM 0 HG3 GLN A 571 -19.668 7.978 -0.698 1.00 3.64 H new ATOM 0 HE21 GLN A 571 -18.321 8.826 -2.304 1.00 5.28 H new ATOM 0 HE22 GLN A 571 -17.510 10.385 -2.120 1.00 5.28 H new ATOM 1567 N ARG A 572 -19.474 9.681 4.881 1.00 2.88 N ATOM 1568 CA ARG A 572 -20.226 10.018 6.088 1.00 3.87 C ATOM 1569 C ARG A 572 -21.029 8.815 6.575 1.00 4.61 C ATOM 1570 O ARG A 572 -20.418 7.874 7.128 1.00 5.14 O ATOM 1571 CB ARG A 572 -21.156 11.214 5.847 1.00 4.32 C ATOM 1572 CG ARG A 572 -20.429 12.496 5.477 1.00 4.96 C ATOM 1573 CD ARG A 572 -21.409 13.597 5.106 1.00 5.75 C ATOM 1574 NE ARG A 572 -22.230 13.224 3.954 1.00 6.35 N ATOM 1575 CZ ARG A 572 -23.438 13.720 3.701 1.00 7.28 C ATOM 1576 NH1 ARG A 572 -23.980 14.619 4.514 1.00 7.72 N ATOM 1577 NH2 ARG A 572 -24.106 13.317 2.628 1.00 8.03 N ATOM 1578 OXT ARG A 572 -22.264 8.809 6.404 1.00 5.05 O ATOM 0 H ARG A 572 -18.462 9.711 5.005 1.00 2.88 H new ATOM 0 HA ARG A 572 -19.508 10.296 6.860 1.00 3.87 H new ATOM 0 HB2 ARG A 572 -21.856 10.962 5.050 1.00 4.32 H new ATOM 0 HB3 ARG A 572 -21.746 11.389 6.746 1.00 4.32 H new ATOM 0 HG2 ARG A 572 -19.812 12.822 6.314 1.00 4.96 H new ATOM 0 HG3 ARG A 572 -19.757 12.307 4.640 1.00 4.96 H new ATOM 0 HD2 ARG A 572 -22.054 13.813 5.958 1.00 5.75 H new ATOM 0 HD3 ARG A 572 -20.861 14.512 4.881 1.00 5.75 H new ATOM 0 HE ARG A 572 -21.851 12.538 3.301 1.00 6.35 H new ATOM 0 HH11 ARG A 572 -23.470 14.934 5.339 1.00 7.72 H new ATOM 0 HH12 ARG A 572 -24.907 14.995 4.313 1.00 7.72 H new ATOM 0 HH21 ARG A 572 -23.693 12.628 1.999 1.00 8.03 H new ATOM 0 HH22 ARG A 572 -25.032 13.696 2.432 1.00 8.03 H new TER 1592 ARG A 572