USER MOD reduce.3.24.130724 H: found=0, std=0, add=912, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 912 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 ALA N :NH3+ -119:sc= 0.0848 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 42:sc= 0.671 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 92:sc= 0.0647 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.4 K(o=-0.4,f=-1.2) USER MOD Single : A 9 LYS NZ :NH3+ 155:sc= -0.325 (180deg=-1.27!) USER MOD Single : A 13 THR OG1 : rot 56:sc= 1.99 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.0387 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -109:sc= 0.828 (180deg=-0.255) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 MET CE :methyl -152:sc= -0.473 (180deg=-2.03!) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0.0938 USER MOD Single : A 41 THR OG1 : rot -100:sc= -1.61 USER MOD Single : A 44 THR OG1 : rot 36:sc= 0.656 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 HIS : no HD1:sc= -1.85 K(o=-1.9,f=-2.8!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00599) USER MOD Single : A 53 LYS NZ :NH3+ -145:sc= -1.74 (180deg=-4.85!) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 8:sc= 0.241 USER MOD Single : A 62 THR OG1 : rot 104:sc= 0.0852 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ -129:sc= -0.911 (180deg=-2.35!) USER MOD Single : A 65 MET CE :methyl -121:sc= -0.0772 (180deg=-1.45) USER MOD Single : A 68 ASN : amide:sc= -0.302 X(o=-0.3,f=-0.073) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 161:sc= -0.0478 (180deg=-0.518) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= -1.33 K(o=-1.3,f=-3!) USER MOD Single : A 82 THR OG1 : rot -139:sc= 0.00817 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 MET CE :methyl -143:sc= -0.206 (180deg=-1.75!) USER MOD Single : A 100 ASN : amide:sc= -1.06 K(o=-1.1,f=-3.5!) USER MOD Single : A 106 GLN : amide:sc= 0.0107 K(o=0.011,f=-2.8!) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 14.139 25.079 -9.712 1.00 0.00 N ATOM 2 CA ALA A 1 12.772 24.704 -10.158 1.00 0.00 C ATOM 3 C ALA A 1 12.209 23.572 -9.305 1.00 0.00 C ATOM 4 O ALA A 1 12.802 23.188 -8.297 1.00 0.00 O ATOM 5 CB ALA A 1 12.790 24.300 -11.624 1.00 0.00 C ATOM 0 H1 ALA A 1 14.144 26.073 -9.406 1.00 0.00 H new ATOM 0 H2 ALA A 1 14.424 24.471 -8.918 1.00 0.00 H new ATOM 0 H3 ALA A 1 14.807 24.956 -10.500 1.00 0.00 H new ATOM 0 HA ALA A 1 12.125 25.573 -10.038 1.00 0.00 H new ATOM 0 HB1 ALA A 1 11.783 24.028 -11.939 1.00 0.00 H new ATOM 0 HB2 ALA A 1 13.145 25.135 -12.227 1.00 0.00 H new ATOM 0 HB3 ALA A 1 13.455 23.447 -11.758 1.00 0.00 H new ATOM 13 N THR A 2 11.062 23.042 -9.717 1.00 0.00 N ATOM 14 CA THR A 2 10.419 21.953 -8.992 1.00 0.00 C ATOM 15 C THR A 2 10.650 20.620 -9.697 1.00 0.00 C ATOM 16 O THR A 2 9.964 20.292 -10.665 1.00 0.00 O ATOM 17 CB THR A 2 8.919 22.219 -8.857 1.00 0.00 C ATOM 18 OG1 THR A 2 8.327 22.415 -10.128 1.00 0.00 O ATOM 19 CG2 THR A 2 8.599 23.430 -8.009 1.00 0.00 C ATOM 0 H THR A 2 10.559 23.349 -10.549 1.00 0.00 H new ATOM 0 HA THR A 2 10.862 21.899 -7.998 1.00 0.00 H new ATOM 0 HB THR A 2 8.513 21.335 -8.365 1.00 0.00 H new ATOM 0 HG1 THR A 2 8.694 21.766 -10.764 1.00 0.00 H new ATOM 0 HG21 THR A 2 7.518 23.561 -7.955 1.00 0.00 H new ATOM 0 HG22 THR A 2 8.998 23.287 -7.005 1.00 0.00 H new ATOM 0 HG23 THR A 2 9.050 24.316 -8.455 1.00 0.00 H new ATOM 27 N SER A 3 11.619 19.855 -9.205 1.00 0.00 N ATOM 28 CA SER A 3 11.939 18.559 -9.787 1.00 0.00 C ATOM 29 C SER A 3 11.077 17.460 -9.176 1.00 0.00 C ATOM 30 O SER A 3 10.905 17.397 -7.959 1.00 0.00 O ATOM 31 CB SER A 3 13.420 18.234 -9.580 1.00 0.00 C ATOM 32 OG SER A 3 13.663 17.774 -8.263 1.00 0.00 O ATOM 0 H SER A 3 12.196 20.111 -8.404 1.00 0.00 H new ATOM 0 HA SER A 3 11.730 18.608 -10.856 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.732 17.475 -10.297 1.00 0.00 H new ATOM 0 HB3 SER A 3 14.021 19.122 -9.775 1.00 0.00 H new ATOM 0 HG SER A 3 14.616 17.572 -8.158 1.00 0.00 H new ATOM 38 N THR A 4 10.538 16.594 -10.028 1.00 0.00 N ATOM 39 CA THR A 4 9.695 15.496 -9.570 1.00 0.00 C ATOM 40 C THR A 4 10.489 14.525 -8.704 1.00 0.00 C ATOM 41 O THR A 4 11.350 13.798 -9.198 1.00 0.00 O ATOM 42 CB THR A 4 9.091 14.756 -10.764 1.00 0.00 C ATOM 43 OG1 THR A 4 8.940 15.629 -11.870 1.00 0.00 O ATOM 44 CG2 THR A 4 7.736 14.151 -10.469 1.00 0.00 C ATOM 0 H THR A 4 10.670 16.631 -11.039 1.00 0.00 H new ATOM 0 HA THR A 4 8.890 15.917 -8.968 1.00 0.00 H new ATOM 0 HB THR A 4 9.790 13.950 -10.989 1.00 0.00 H new ATOM 0 HG1 THR A 4 9.741 15.585 -12.433 1.00 0.00 H new ATOM 0 HG21 THR A 4 7.364 13.641 -11.358 1.00 0.00 H new ATOM 0 HG22 THR A 4 7.827 13.436 -9.651 1.00 0.00 H new ATOM 0 HG23 THR A 4 7.039 14.940 -10.185 1.00 0.00 H new ATOM 52 N LYS A 5 10.196 14.521 -7.408 1.00 0.00 N ATOM 53 CA LYS A 5 10.884 13.639 -6.472 1.00 0.00 C ATOM 54 C LYS A 5 10.309 12.228 -6.531 1.00 0.00 C ATOM 55 O LYS A 5 9.160 11.998 -6.155 1.00 0.00 O ATOM 56 CB LYS A 5 10.778 14.192 -5.048 1.00 0.00 C ATOM 57 CG LYS A 5 12.103 14.216 -4.305 1.00 0.00 C ATOM 58 CD LYS A 5 12.570 12.812 -3.956 1.00 0.00 C ATOM 59 CE LYS A 5 13.921 12.832 -3.259 1.00 0.00 C ATOM 60 NZ LYS A 5 14.059 11.718 -2.281 1.00 0.00 N ATOM 0 H LYS A 5 9.487 15.118 -6.982 1.00 0.00 H new ATOM 0 HA LYS A 5 11.935 13.593 -6.758 1.00 0.00 H new ATOM 0 HB2 LYS A 5 10.376 15.204 -5.089 1.00 0.00 H new ATOM 0 HB3 LYS A 5 10.066 13.589 -4.485 1.00 0.00 H new ATOM 0 HG2 LYS A 5 12.857 14.710 -4.918 1.00 0.00 H new ATOM 0 HG3 LYS A 5 12.000 14.804 -3.393 1.00 0.00 H new ATOM 0 HD2 LYS A 5 11.834 12.332 -3.311 1.00 0.00 H new ATOM 0 HD3 LYS A 5 12.637 12.213 -4.864 1.00 0.00 H new ATOM 0 HE2 LYS A 5 14.714 12.762 -4.003 1.00 0.00 H new ATOM 0 HE3 LYS A 5 14.050 13.784 -2.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 14.994 11.768 -1.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 13.318 11.799 -1.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 13.962 10.808 -2.775 1.00 0.00 H new ATOM 74 N LYS A 6 11.119 11.285 -7.004 1.00 0.00 N ATOM 75 CA LYS A 6 10.691 9.895 -7.111 1.00 0.00 C ATOM 76 C LYS A 6 10.811 9.186 -5.766 1.00 0.00 C ATOM 77 O LYS A 6 11.738 9.442 -4.998 1.00 0.00 O ATOM 78 CB LYS A 6 11.525 9.162 -8.164 1.00 0.00 C ATOM 79 CG LYS A 6 10.912 9.195 -9.555 1.00 0.00 C ATOM 80 CD LYS A 6 10.094 7.943 -9.836 1.00 0.00 C ATOM 81 CE LYS A 6 8.667 8.284 -10.236 1.00 0.00 C ATOM 82 NZ LYS A 6 8.472 8.223 -11.711 1.00 0.00 N ATOM 0 H LYS A 6 12.074 11.458 -7.319 1.00 0.00 H new ATOM 0 HA LYS A 6 9.645 9.884 -7.416 1.00 0.00 H new ATOM 0 HB2 LYS A 6 12.519 9.608 -8.203 1.00 0.00 H new ATOM 0 HB3 LYS A 6 11.653 8.124 -7.857 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.276 10.075 -9.652 1.00 0.00 H new ATOM 0 HG3 LYS A 6 11.703 9.289 -10.300 1.00 0.00 H new ATOM 0 HD2 LYS A 6 10.568 7.369 -10.632 1.00 0.00 H new ATOM 0 HD3 LYS A 6 10.082 7.309 -8.949 1.00 0.00 H new ATOM 0 HE2 LYS A 6 7.979 7.592 -9.750 1.00 0.00 H new ATOM 0 HE3 LYS A 6 8.419 9.283 -9.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 7.486 8.462 -11.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 9.110 8.902 -12.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 8.683 7.263 -12.050 1.00 0.00 H new ATOM 96 N LEU A 7 9.867 8.293 -5.488 1.00 0.00 N ATOM 97 CA LEU A 7 9.868 7.546 -4.235 1.00 0.00 C ATOM 98 C LEU A 7 10.832 6.365 -4.307 1.00 0.00 C ATOM 99 O LEU A 7 10.937 5.700 -5.338 1.00 0.00 O ATOM 100 CB LEU A 7 8.455 7.053 -3.912 1.00 0.00 C ATOM 101 CG LEU A 7 7.896 7.521 -2.567 1.00 0.00 C ATOM 102 CD1 LEU A 7 8.717 6.950 -1.421 1.00 0.00 C ATOM 103 CD2 LEU A 7 7.873 9.041 -2.502 1.00 0.00 C ATOM 0 H LEU A 7 9.092 8.069 -6.112 1.00 0.00 H new ATOM 0 HA LEU A 7 10.202 8.213 -3.440 1.00 0.00 H new ATOM 0 HB2 LEU A 7 7.782 7.384 -4.703 1.00 0.00 H new ATOM 0 HB3 LEU A 7 8.455 5.963 -3.929 1.00 0.00 H new ATOM 0 HG LEU A 7 6.873 7.156 -2.472 1.00 0.00 H new ATOM 0 HD11 LEU A 7 8.305 7.293 -0.472 1.00 0.00 H new ATOM 0 HD12 LEU A 7 8.685 5.861 -1.458 1.00 0.00 H new ATOM 0 HD13 LEU A 7 9.750 7.286 -1.511 1.00 0.00 H new ATOM 0 HD21 LEU A 7 7.473 9.358 -1.539 1.00 0.00 H new ATOM 0 HD22 LEU A 7 8.886 9.426 -2.618 1.00 0.00 H new ATOM 0 HD23 LEU A 7 7.243 9.430 -3.302 1.00 0.00 H new ATOM 115 N HIS A 8 11.530 6.111 -3.206 1.00 0.00 N ATOM 116 CA HIS A 8 12.482 5.008 -3.143 1.00 0.00 C ATOM 117 C HIS A 8 11.823 3.754 -2.579 1.00 0.00 C ATOM 118 O HIS A 8 10.797 3.832 -1.903 1.00 0.00 O ATOM 119 CB HIS A 8 13.689 5.395 -2.287 1.00 0.00 C ATOM 120 CG HIS A 8 14.831 4.432 -2.397 1.00 0.00 C ATOM 121 ND1 HIS A 8 14.996 3.360 -1.546 1.00 0.00 N ATOM 122 CD2 HIS A 8 15.866 4.383 -3.268 1.00 0.00 C ATOM 123 CE1 HIS A 8 16.084 2.693 -1.887 1.00 0.00 C ATOM 124 NE2 HIS A 8 16.628 3.292 -2.930 1.00 0.00 N ATOM 0 H HIS A 8 11.455 6.653 -2.345 1.00 0.00 H new ATOM 0 HA HIS A 8 12.820 4.794 -4.157 1.00 0.00 H new ATOM 0 HB2 HIS A 8 14.031 6.387 -2.582 1.00 0.00 H new ATOM 0 HB3 HIS A 8 13.379 5.461 -1.244 1.00 0.00 H new ATOM 0 HD2 HIS A 8 16.057 5.073 -4.077 1.00 0.00 H new ATOM 0 HE1 HIS A 8 16.464 1.809 -1.396 1.00 0.00 H new ATOM 0 HE2 HIS A 8 17.478 2.992 -3.408 1.00 0.00 H new ATOM 133 N LYS A 9 12.419 2.601 -2.861 1.00 0.00 N ATOM 134 CA LYS A 9 11.887 1.331 -2.382 1.00 0.00 C ATOM 135 C LYS A 9 12.188 1.136 -0.899 1.00 0.00 C ATOM 136 O LYS A 9 13.331 0.887 -0.515 1.00 0.00 O ATOM 137 CB LYS A 9 12.470 0.170 -3.190 1.00 0.00 C ATOM 138 CG LYS A 9 11.810 -0.022 -4.545 1.00 0.00 C ATOM 139 CD LYS A 9 12.030 -1.429 -5.077 1.00 0.00 C ATOM 140 CE LYS A 9 11.769 -1.507 -6.573 1.00 0.00 C ATOM 141 NZ LYS A 9 12.460 -0.417 -7.315 1.00 0.00 N ATOM 0 H LYS A 9 13.270 2.520 -3.418 1.00 0.00 H new ATOM 0 HA LYS A 9 10.805 1.349 -2.514 1.00 0.00 H new ATOM 0 HB2 LYS A 9 13.537 0.340 -3.336 1.00 0.00 H new ATOM 0 HB3 LYS A 9 12.370 -0.749 -2.613 1.00 0.00 H new ATOM 0 HG2 LYS A 9 10.741 0.173 -4.461 1.00 0.00 H new ATOM 0 HG3 LYS A 9 12.212 0.703 -5.253 1.00 0.00 H new ATOM 0 HD2 LYS A 9 13.053 -1.742 -4.868 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.372 -2.123 -4.555 1.00 0.00 H new ATOM 0 HE2 LYS A 9 12.105 -2.473 -6.950 1.00 0.00 H new ATOM 0 HE3 LYS A 9 10.696 -1.449 -6.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 12.624 -0.716 -8.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 11.868 0.438 -7.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 13.372 -0.211 -6.859 1.00 0.00 H new ATOM 155 N GLU A 10 11.155 1.247 -0.072 1.00 0.00 N ATOM 156 CA GLU A 10 11.303 1.079 1.369 1.00 0.00 C ATOM 157 C GLU A 10 10.131 0.286 1.938 1.00 0.00 C ATOM 158 O GLU A 10 8.996 0.429 1.482 1.00 0.00 O ATOM 159 CB GLU A 10 11.398 2.442 2.059 1.00 0.00 C ATOM 160 CG GLU A 10 12.479 3.341 1.482 1.00 0.00 C ATOM 161 CD GLU A 10 13.398 3.907 2.549 1.00 0.00 C ATOM 162 OE1 GLU A 10 13.843 3.132 3.419 1.00 0.00 O ATOM 163 OE2 GLU A 10 13.672 5.126 2.510 1.00 0.00 O ATOM 0 H GLU A 10 10.203 1.453 -0.376 1.00 0.00 H new ATOM 0 HA GLU A 10 12.223 0.526 1.556 1.00 0.00 H new ATOM 0 HB2 GLU A 10 10.436 2.948 1.980 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.592 2.290 3.121 1.00 0.00 H new ATOM 0 HG2 GLU A 10 13.070 2.776 0.761 1.00 0.00 H new ATOM 0 HG3 GLU A 10 12.012 4.162 0.938 1.00 0.00 H new ATOM 170 N PRO A 11 10.384 -0.573 2.941 1.00 0.00 N ATOM 171 CA PRO A 11 9.341 -1.388 3.557 1.00 0.00 C ATOM 172 C PRO A 11 8.573 -0.640 4.642 1.00 0.00 C ATOM 173 O PRO A 11 9.017 0.403 5.124 1.00 0.00 O ATOM 174 CB PRO A 11 10.136 -2.541 4.158 1.00 0.00 C ATOM 175 CG PRO A 11 11.433 -1.921 4.554 1.00 0.00 C ATOM 176 CD PRO A 11 11.705 -0.824 3.550 1.00 0.00 C ATOM 0 HA PRO A 11 8.576 -1.693 2.843 1.00 0.00 H new ATOM 0 HB2 PRO A 11 9.623 -2.974 5.016 1.00 0.00 H new ATOM 0 HB3 PRO A 11 10.282 -3.344 3.435 1.00 0.00 H new ATOM 0 HG2 PRO A 11 11.378 -1.517 5.565 1.00 0.00 H new ATOM 0 HG3 PRO A 11 12.234 -2.660 4.549 1.00 0.00 H new ATOM 0 HD2 PRO A 11 12.101 0.070 4.031 1.00 0.00 H new ATOM 0 HD3 PRO A 11 12.437 -1.135 2.805 1.00 0.00 H new ATOM 184 N ALA A 12 7.420 -1.181 5.022 1.00 0.00 N ATOM 185 CA ALA A 12 6.587 -0.569 6.049 1.00 0.00 C ATOM 186 C ALA A 12 6.405 -1.508 7.236 1.00 0.00 C ATOM 187 O ALA A 12 5.650 -2.479 7.163 1.00 0.00 O ATOM 188 CB ALA A 12 5.236 -0.178 5.469 1.00 0.00 C ATOM 0 H ALA A 12 7.041 -2.044 4.632 1.00 0.00 H new ATOM 0 HA ALA A 12 7.090 0.330 6.404 1.00 0.00 H new ATOM 0 HB1 ALA A 12 4.624 0.278 6.247 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.381 0.535 4.657 1.00 0.00 H new ATOM 0 HB3 ALA A 12 4.734 -1.066 5.086 1.00 0.00 H new ATOM 194 N THR A 13 7.104 -1.216 8.328 1.00 0.00 N ATOM 195 CA THR A 13 7.027 -2.037 9.531 1.00 0.00 C ATOM 196 C THR A 13 5.628 -1.996 10.141 1.00 0.00 C ATOM 197 O THR A 13 5.381 -1.264 11.098 1.00 0.00 O ATOM 198 CB THR A 13 8.057 -1.567 10.560 1.00 0.00 C ATOM 199 OG1 THR A 13 7.736 -0.272 11.036 1.00 0.00 O ATOM 200 CG2 THR A 13 9.468 -1.522 10.017 1.00 0.00 C ATOM 0 H THR A 13 7.731 -0.415 8.405 1.00 0.00 H new ATOM 0 HA THR A 13 7.245 -3.066 9.247 1.00 0.00 H new ATOM 0 HB THR A 13 8.019 -2.303 11.364 1.00 0.00 H new ATOM 0 HG1 THR A 13 6.828 -0.274 11.404 1.00 0.00 H new ATOM 0 HG21 THR A 13 10.148 -1.181 10.798 1.00 0.00 H new ATOM 0 HG22 THR A 13 9.764 -2.519 9.689 1.00 0.00 H new ATOM 0 HG23 THR A 13 9.511 -0.834 9.172 1.00 0.00 H new ATOM 208 N LEU A 14 4.720 -2.793 9.586 1.00 0.00 N ATOM 209 CA LEU A 14 3.350 -2.852 10.084 1.00 0.00 C ATOM 210 C LEU A 14 3.310 -3.520 11.454 1.00 0.00 C ATOM 211 O LEU A 14 3.729 -4.666 11.607 1.00 0.00 O ATOM 212 CB LEU A 14 2.461 -3.619 9.104 1.00 0.00 C ATOM 213 CG LEU A 14 0.983 -3.226 9.126 1.00 0.00 C ATOM 214 CD1 LEU A 14 0.289 -3.701 7.859 1.00 0.00 C ATOM 215 CD2 LEU A 14 0.295 -3.795 10.361 1.00 0.00 C ATOM 0 H LEU A 14 4.908 -3.406 8.793 1.00 0.00 H new ATOM 0 HA LEU A 14 2.974 -1.833 10.179 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.846 -3.470 8.095 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.541 -4.684 9.322 1.00 0.00 H new ATOM 0 HG LEU A 14 0.916 -2.139 9.169 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.762 -3.414 7.890 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.764 -3.245 6.991 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.366 -4.786 7.787 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.756 -3.505 10.359 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.371 -4.882 10.351 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.777 -3.406 11.258 1.00 0.00 H new ATOM 227 N ILE A 15 2.810 -2.797 12.453 1.00 0.00 N ATOM 228 CA ILE A 15 2.731 -3.329 13.808 1.00 0.00 C ATOM 229 C ILE A 15 1.314 -3.253 14.368 1.00 0.00 C ATOM 230 O ILE A 15 0.656 -4.277 14.556 1.00 0.00 O ATOM 231 CB ILE A 15 3.689 -2.584 14.757 1.00 0.00 C ATOM 232 CG1 ILE A 15 5.081 -2.482 14.130 1.00 0.00 C ATOM 233 CG2 ILE A 15 3.758 -3.290 16.104 1.00 0.00 C ATOM 234 CD1 ILE A 15 5.991 -1.500 14.832 1.00 0.00 C ATOM 0 H ILE A 15 2.456 -1.846 12.349 1.00 0.00 H new ATOM 0 HA ILE A 15 3.026 -4.377 13.745 1.00 0.00 H new ATOM 0 HB ILE A 15 3.308 -1.576 14.918 1.00 0.00 H new ATOM 0 HG12 ILE A 15 5.547 -3.467 14.139 1.00 0.00 H new ATOM 0 HG13 ILE A 15 4.979 -2.187 13.086 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.439 -2.751 16.763 1.00 0.00 H new ATOM 0 HG22 ILE A 15 2.765 -3.317 16.552 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.120 -4.308 15.963 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.960 -1.481 14.333 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.547 -0.505 14.800 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.124 -1.805 15.870 1.00 0.00 H new ATOM 246 N LYS A 16 0.849 -2.037 14.648 1.00 0.00 N ATOM 247 CA LYS A 16 -0.487 -1.842 15.203 1.00 0.00 C ATOM 248 C LYS A 16 -1.338 -0.945 14.307 1.00 0.00 C ATOM 249 O LYS A 16 -0.831 -0.017 13.676 1.00 0.00 O ATOM 250 CB LYS A 16 -0.390 -1.233 16.603 1.00 0.00 C ATOM 251 CG LYS A 16 0.445 0.036 16.655 1.00 0.00 C ATOM 252 CD LYS A 16 0.479 0.624 18.057 1.00 0.00 C ATOM 253 CE LYS A 16 1.842 1.215 18.382 1.00 0.00 C ATOM 254 NZ LYS A 16 1.728 2.500 19.124 1.00 0.00 N ATOM 0 H LYS A 16 1.376 -1.176 14.500 1.00 0.00 H new ATOM 0 HA LYS A 16 -0.969 -2.818 15.262 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -1.394 -1.013 16.965 1.00 0.00 H new ATOM 0 HB3 LYS A 16 0.040 -1.969 17.282 1.00 0.00 H new ATOM 0 HG2 LYS A 16 1.461 -0.182 16.326 1.00 0.00 H new ATOM 0 HG3 LYS A 16 0.036 0.770 15.961 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -0.284 1.397 18.147 1.00 0.00 H new ATOM 0 HD3 LYS A 16 0.235 -0.151 18.784 1.00 0.00 H new ATOM 0 HE2 LYS A 16 2.414 0.502 18.976 1.00 0.00 H new ATOM 0 HE3 LYS A 16 2.397 1.378 17.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 2.679 2.870 19.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 1.204 3.189 18.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 1.221 2.341 20.018 1.00 0.00 H new ATOM 268 N ALA A 17 -2.637 -1.228 14.265 1.00 0.00 N ATOM 269 CA ALA A 17 -3.568 -0.449 13.457 1.00 0.00 C ATOM 270 C ALA A 17 -4.703 0.100 14.314 1.00 0.00 C ATOM 271 O ALA A 17 -5.116 -0.527 15.290 1.00 0.00 O ATOM 272 CB ALA A 17 -4.124 -1.300 12.325 1.00 0.00 C ATOM 0 H ALA A 17 -3.069 -1.993 14.783 1.00 0.00 H new ATOM 0 HA ALA A 17 -3.026 0.394 13.029 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.818 -0.706 11.730 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.306 -1.644 11.692 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.648 -2.161 12.740 1.00 0.00 H new ATOM 278 N ILE A 18 -5.202 1.277 13.950 1.00 0.00 N ATOM 279 CA ILE A 18 -6.288 1.905 14.693 1.00 0.00 C ATOM 280 C ILE A 18 -7.645 1.620 14.044 1.00 0.00 C ATOM 281 O ILE A 18 -8.309 0.643 14.389 1.00 0.00 O ATOM 282 CB ILE A 18 -6.070 3.431 14.819 1.00 0.00 C ATOM 283 CG1 ILE A 18 -4.742 3.720 15.522 1.00 0.00 C ATOM 284 CG2 ILE A 18 -7.223 4.077 15.575 1.00 0.00 C ATOM 285 CD1 ILE A 18 -4.701 3.241 16.957 1.00 0.00 C ATOM 0 H ILE A 18 -4.873 1.814 13.147 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.287 1.471 15.693 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.035 3.859 13.817 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -3.935 3.244 14.965 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -4.555 4.794 15.500 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -7.051 5.150 15.653 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -8.155 3.897 15.040 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -7.289 3.647 16.574 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -3.731 3.479 17.392 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -5.486 3.736 17.528 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.856 2.163 16.985 1.00 0.00 H new ATOM 297 N ASP A 19 -8.059 2.474 13.108 1.00 0.00 N ATOM 298 CA ASP A 19 -9.339 2.298 12.427 1.00 0.00 C ATOM 299 C ASP A 19 -9.139 2.096 10.929 1.00 0.00 C ATOM 300 O ASP A 19 -8.811 3.035 10.205 1.00 0.00 O ATOM 301 CB ASP A 19 -10.243 3.507 12.675 1.00 0.00 C ATOM 302 CG ASP A 19 -9.530 4.822 12.433 1.00 0.00 C ATOM 303 OD1 ASP A 19 -8.922 5.352 13.387 1.00 0.00 O ATOM 304 OD2 ASP A 19 -9.577 5.322 11.290 1.00 0.00 O ATOM 0 H ASP A 19 -7.528 3.291 12.806 1.00 0.00 H new ATOM 0 HA ASP A 19 -9.816 1.406 12.833 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -11.115 3.445 12.024 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -10.609 3.479 13.701 1.00 0.00 H new ATOM 309 N GLY A 20 -9.344 0.866 10.469 1.00 0.00 N ATOM 310 CA GLY A 20 -9.184 0.568 9.057 1.00 0.00 C ATOM 311 C GLY A 20 -7.838 -0.055 8.746 1.00 0.00 C ATOM 312 O GLY A 20 -7.551 -1.173 9.176 1.00 0.00 O ATOM 0 H GLY A 20 -9.618 0.071 11.047 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -9.977 -0.109 8.740 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -9.299 1.485 8.480 1.00 0.00 H new ATOM 316 N ASP A 21 -7.012 0.665 7.996 1.00 0.00 N ATOM 317 CA ASP A 21 -5.689 0.173 7.630 1.00 0.00 C ATOM 318 C ASP A 21 -4.598 1.143 8.075 1.00 0.00 C ATOM 319 O ASP A 21 -3.460 1.063 7.610 1.00 0.00 O ATOM 320 CB ASP A 21 -5.606 -0.048 6.120 1.00 0.00 C ATOM 321 CG ASP A 21 -6.211 -1.372 5.695 1.00 0.00 C ATOM 322 OD1 ASP A 21 -5.986 -2.379 6.397 1.00 0.00 O ATOM 323 OD2 ASP A 21 -6.909 -1.400 4.659 1.00 0.00 O ATOM 0 H ASP A 21 -7.235 1.591 7.630 1.00 0.00 H new ATOM 0 HA ASP A 21 -5.531 -0.777 8.141 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -6.121 0.765 5.608 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -4.563 -0.011 5.807 1.00 0.00 H new ATOM 328 N THR A 22 -4.943 2.056 8.979 1.00 0.00 N ATOM 329 CA THR A 22 -3.982 3.032 9.479 1.00 0.00 C ATOM 330 C THR A 22 -3.009 2.380 10.455 1.00 0.00 C ATOM 331 O THR A 22 -3.369 2.061 11.588 1.00 0.00 O ATOM 332 CB THR A 22 -4.704 4.198 10.160 1.00 0.00 C ATOM 333 OG1 THR A 22 -3.786 5.002 10.881 1.00 0.00 O ATOM 334 CG2 THR A 22 -5.782 3.757 11.125 1.00 0.00 C ATOM 0 H THR A 22 -5.878 2.140 9.378 1.00 0.00 H new ATOM 0 HA THR A 22 -3.418 3.416 8.629 1.00 0.00 H new ATOM 0 HB THR A 22 -5.173 4.758 9.351 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.265 5.743 11.308 1.00 0.00 H new ATOM 0 HG21 THR A 22 -6.252 4.634 11.571 1.00 0.00 H new ATOM 0 HG22 THR A 22 -6.533 3.175 10.591 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.339 3.144 11.910 1.00 0.00 H new ATOM 342 N VAL A 23 -1.774 2.184 10.007 1.00 0.00 N ATOM 343 CA VAL A 23 -0.748 1.570 10.838 1.00 0.00 C ATOM 344 C VAL A 23 0.518 2.419 10.858 1.00 0.00 C ATOM 345 O VAL A 23 0.977 2.889 9.819 1.00 0.00 O ATOM 346 CB VAL A 23 -0.392 0.155 10.343 1.00 0.00 C ATOM 347 CG1 VAL A 23 0.493 -0.559 11.351 1.00 0.00 C ATOM 348 CG2 VAL A 23 -1.656 -0.648 10.069 1.00 0.00 C ATOM 0 H VAL A 23 -1.460 2.442 9.072 1.00 0.00 H new ATOM 0 HA VAL A 23 -1.157 1.501 11.846 1.00 0.00 H new ATOM 0 HB VAL A 23 0.164 0.247 9.410 1.00 0.00 H new ATOM 0 HG11 VAL A 23 0.733 -1.556 10.982 1.00 0.00 H new ATOM 0 HG12 VAL A 23 1.414 0.007 11.492 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -0.032 -0.640 12.303 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -1.385 -1.645 9.720 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -2.240 -0.730 10.985 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.248 -0.145 9.305 1.00 0.00 H new ATOM 358 N LYS A 24 1.077 2.610 12.048 1.00 0.00 N ATOM 359 CA LYS A 24 2.289 3.404 12.200 1.00 0.00 C ATOM 360 C LYS A 24 3.520 2.586 11.825 1.00 0.00 C ATOM 361 O LYS A 24 4.031 1.806 12.628 1.00 0.00 O ATOM 362 CB LYS A 24 2.413 3.910 13.638 1.00 0.00 C ATOM 363 CG LYS A 24 2.931 5.336 13.740 1.00 0.00 C ATOM 364 CD LYS A 24 1.798 6.327 13.955 1.00 0.00 C ATOM 365 CE LYS A 24 2.156 7.361 15.010 1.00 0.00 C ATOM 366 NZ LYS A 24 1.893 6.861 16.388 1.00 0.00 N ATOM 0 H LYS A 24 0.711 2.226 12.919 1.00 0.00 H new ATOM 0 HA LYS A 24 2.225 4.260 11.528 1.00 0.00 H new ATOM 0 HB2 LYS A 24 1.437 3.852 14.120 1.00 0.00 H new ATOM 0 HB3 LYS A 24 3.081 3.249 14.190 1.00 0.00 H new ATOM 0 HG2 LYS A 24 3.640 5.408 14.565 1.00 0.00 H new ATOM 0 HG3 LYS A 24 3.473 5.593 12.830 1.00 0.00 H new ATOM 0 HD2 LYS A 24 1.569 6.829 13.015 1.00 0.00 H new ATOM 0 HD3 LYS A 24 0.898 5.792 14.259 1.00 0.00 H new ATOM 0 HE2 LYS A 24 3.209 7.627 14.915 1.00 0.00 H new ATOM 0 HE3 LYS A 24 1.580 8.270 14.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 2.150 7.595 17.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 0.884 6.631 16.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 2.462 6.008 16.562 1.00 0.00 H new ATOM 380 N LEU A 25 3.986 2.768 10.594 1.00 0.00 N ATOM 381 CA LEU A 25 5.154 2.047 10.101 1.00 0.00 C ATOM 382 C LEU A 25 6.404 2.918 10.181 1.00 0.00 C ATOM 383 O LEU A 25 6.349 4.123 9.939 1.00 0.00 O ATOM 384 CB LEU A 25 4.929 1.591 8.655 1.00 0.00 C ATOM 385 CG LEU A 25 3.486 1.209 8.303 1.00 0.00 C ATOM 386 CD1 LEU A 25 3.015 1.961 7.065 1.00 0.00 C ATOM 387 CD2 LEU A 25 3.362 -0.295 8.095 1.00 0.00 C ATOM 0 H LEU A 25 3.572 3.410 9.918 1.00 0.00 H new ATOM 0 HA LEU A 25 5.300 1.171 10.732 1.00 0.00 H new ATOM 0 HB2 LEU A 25 5.249 2.390 7.986 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.572 0.733 8.458 1.00 0.00 H new ATOM 0 HG LEU A 25 2.847 1.493 9.139 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.989 1.675 6.834 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.059 3.034 7.252 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.660 1.713 6.222 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.330 -0.544 7.846 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.017 -0.605 7.280 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.650 -0.814 9.009 1.00 0.00 H new ATOM 399 N MET A 26 7.530 2.298 10.520 1.00 0.00 N ATOM 400 CA MET A 26 8.794 3.017 10.631 1.00 0.00 C ATOM 401 C MET A 26 9.341 3.373 9.252 1.00 0.00 C ATOM 402 O MET A 26 9.938 2.536 8.575 1.00 0.00 O ATOM 403 CB MET A 26 9.817 2.175 11.396 1.00 0.00 C ATOM 404 CG MET A 26 9.719 2.323 12.907 1.00 0.00 C ATOM 405 SD MET A 26 8.233 1.558 13.583 1.00 0.00 S ATOM 406 CE MET A 26 8.051 2.468 15.115 1.00 0.00 C ATOM 0 H MET A 26 7.593 1.300 10.722 1.00 0.00 H new ATOM 0 HA MET A 26 8.611 3.941 11.179 1.00 0.00 H new ATOM 0 HB2 MET A 26 9.682 1.126 11.132 1.00 0.00 H new ATOM 0 HB3 MET A 26 10.820 2.457 11.076 1.00 0.00 H new ATOM 0 HG2 MET A 26 10.597 1.874 13.370 1.00 0.00 H new ATOM 0 HG3 MET A 26 9.728 3.382 13.166 1.00 0.00 H new ATOM 0 HE1 MET A 26 7.172 2.108 15.649 1.00 0.00 H new ATOM 0 HE2 MET A 26 8.937 2.321 15.733 1.00 0.00 H new ATOM 0 HE3 MET A 26 7.934 3.529 14.896 1.00 0.00 H new ATOM 416 N TYR A 27 9.132 4.620 8.843 1.00 0.00 N ATOM 417 CA TYR A 27 9.605 5.088 7.545 1.00 0.00 C ATOM 418 C TYR A 27 10.941 5.812 7.682 1.00 0.00 C ATOM 419 O TYR A 27 10.990 6.980 8.068 1.00 0.00 O ATOM 420 CB TYR A 27 8.568 6.018 6.908 1.00 0.00 C ATOM 421 CG TYR A 27 9.008 6.603 5.583 1.00 0.00 C ATOM 422 CD1 TYR A 27 9.142 5.800 4.458 1.00 0.00 C ATOM 423 CD2 TYR A 27 9.289 7.957 5.461 1.00 0.00 C ATOM 424 CE1 TYR A 27 9.545 6.330 3.248 1.00 0.00 C ATOM 425 CE2 TYR A 27 9.692 8.495 4.254 1.00 0.00 C ATOM 426 CZ TYR A 27 9.818 7.679 3.150 1.00 0.00 C ATOM 427 OH TYR A 27 10.221 8.209 1.947 1.00 0.00 O ATOM 0 H TYR A 27 8.638 5.324 9.391 1.00 0.00 H new ATOM 0 HA TYR A 27 9.748 4.220 6.902 1.00 0.00 H new ATOM 0 HB2 TYR A 27 7.640 5.466 6.761 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.349 6.832 7.600 1.00 0.00 H new ATOM 0 HD1 TYR A 27 8.928 4.744 4.530 1.00 0.00 H new ATOM 0 HD2 TYR A 27 9.191 8.600 6.323 1.00 0.00 H new ATOM 0 HE1 TYR A 27 9.646 5.692 2.383 1.00 0.00 H new ATOM 0 HE2 TYR A 27 9.907 9.550 4.176 1.00 0.00 H new ATOM 0 HH TYR A 27 10.371 9.172 2.048 1.00 0.00 H new ATOM 437 N LYS A 28 12.026 5.110 7.362 1.00 0.00 N ATOM 438 CA LYS A 28 13.363 5.687 7.450 1.00 0.00 C ATOM 439 C LYS A 28 13.641 6.209 8.855 1.00 0.00 C ATOM 440 O LYS A 28 14.375 7.180 9.033 1.00 0.00 O ATOM 441 CB LYS A 28 13.520 6.820 6.433 1.00 0.00 C ATOM 442 CG LYS A 28 14.956 7.285 6.258 1.00 0.00 C ATOM 443 CD LYS A 28 15.042 8.796 6.124 1.00 0.00 C ATOM 444 CE LYS A 28 16.313 9.341 6.752 1.00 0.00 C ATOM 445 NZ LYS A 28 16.313 9.184 8.235 1.00 0.00 N ATOM 0 H LYS A 28 12.004 4.142 7.040 1.00 0.00 H new ATOM 0 HA LYS A 28 14.085 4.902 7.225 1.00 0.00 H new ATOM 0 HB2 LYS A 28 13.134 6.488 5.469 1.00 0.00 H new ATOM 0 HB3 LYS A 28 12.908 7.666 6.747 1.00 0.00 H new ATOM 0 HG2 LYS A 28 15.551 6.960 7.112 1.00 0.00 H new ATOM 0 HG3 LYS A 28 15.386 6.816 5.373 1.00 0.00 H new ATOM 0 HD2 LYS A 28 15.009 9.071 5.070 1.00 0.00 H new ATOM 0 HD3 LYS A 28 14.175 9.254 6.600 1.00 0.00 H new ATOM 0 HE2 LYS A 28 17.176 8.824 6.332 1.00 0.00 H new ATOM 0 HE3 LYS A 28 16.420 10.396 6.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 16.201 10.116 8.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 15.526 8.567 8.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 17.213 8.760 8.539 1.00 0.00 H new ATOM 459 N GLY A 29 13.048 5.558 9.849 1.00 0.00 N ATOM 460 CA GLY A 29 13.240 5.970 11.226 1.00 0.00 C ATOM 461 C GLY A 29 12.203 6.979 11.682 1.00 0.00 C ATOM 462 O GLY A 29 12.421 7.710 12.647 1.00 0.00 O ATOM 0 H GLY A 29 12.437 4.751 9.725 1.00 0.00 H new ATOM 0 HA2 GLY A 29 13.198 5.094 11.873 1.00 0.00 H new ATOM 0 HA3 GLY A 29 14.235 6.401 11.337 1.00 0.00 H new ATOM 466 N GLN A 30 11.071 7.021 10.985 1.00 0.00 N ATOM 467 CA GLN A 30 9.997 7.947 11.325 1.00 0.00 C ATOM 468 C GLN A 30 8.631 7.279 11.157 1.00 0.00 C ATOM 469 O GLN A 30 8.221 6.966 10.041 1.00 0.00 O ATOM 470 CB GLN A 30 10.079 9.197 10.445 1.00 0.00 C ATOM 471 CG GLN A 30 10.491 10.448 11.204 1.00 0.00 C ATOM 472 CD GLN A 30 9.321 11.369 11.487 1.00 0.00 C ATOM 473 OE1 GLN A 30 8.664 11.259 12.523 1.00 0.00 O ATOM 474 NE2 GLN A 30 9.053 12.286 10.564 1.00 0.00 N ATOM 0 H GLN A 30 10.874 6.424 10.181 1.00 0.00 H new ATOM 0 HA GLN A 30 10.114 8.237 12.369 1.00 0.00 H new ATOM 0 HB2 GLN A 30 10.792 9.019 9.640 1.00 0.00 H new ATOM 0 HB3 GLN A 30 9.109 9.368 9.979 1.00 0.00 H new ATOM 0 HG2 GLN A 30 10.958 10.160 12.146 1.00 0.00 H new ATOM 0 HG3 GLN A 30 11.242 10.988 10.627 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.623 12.342 9.720 1.00 0.00 H new ATOM 0 HE22 GLN A 30 8.277 12.934 10.699 1.00 0.00 H new ATOM 483 N PRO A 31 7.906 7.051 12.268 1.00 0.00 N ATOM 484 CA PRO A 31 6.583 6.418 12.226 1.00 0.00 C ATOM 485 C PRO A 31 5.546 7.287 11.521 1.00 0.00 C ATOM 486 O PRO A 31 5.395 8.468 11.834 1.00 0.00 O ATOM 487 CB PRO A 31 6.217 6.241 13.702 1.00 0.00 C ATOM 488 CG PRO A 31 7.033 7.258 14.422 1.00 0.00 C ATOM 489 CD PRO A 31 8.310 7.389 13.645 1.00 0.00 C ATOM 0 HA PRO A 31 6.601 5.483 11.666 1.00 0.00 H new ATOM 0 HB2 PRO A 31 5.151 6.400 13.867 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.446 5.233 14.048 1.00 0.00 H new ATOM 0 HG2 PRO A 31 6.509 8.212 14.475 1.00 0.00 H new ATOM 0 HG3 PRO A 31 7.230 6.945 15.447 1.00 0.00 H new ATOM 0 HD2 PRO A 31 8.718 8.398 13.708 1.00 0.00 H new ATOM 0 HD3 PRO A 31 9.078 6.711 14.017 1.00 0.00 H new ATOM 497 N MET A 32 4.834 6.694 10.567 1.00 0.00 N ATOM 498 CA MET A 32 3.811 7.414 9.816 1.00 0.00 C ATOM 499 C MET A 32 2.639 6.498 9.475 1.00 0.00 C ATOM 500 O MET A 32 2.804 5.499 8.776 1.00 0.00 O ATOM 501 CB MET A 32 4.407 7.999 8.535 1.00 0.00 C ATOM 502 CG MET A 32 5.299 9.206 8.773 1.00 0.00 C ATOM 503 SD MET A 32 4.371 10.751 8.845 1.00 0.00 S ATOM 504 CE MET A 32 3.559 10.732 7.248 1.00 0.00 C ATOM 0 H MET A 32 4.947 5.717 10.296 1.00 0.00 H new ATOM 0 HA MET A 32 3.442 8.227 10.441 1.00 0.00 H new ATOM 0 HB2 MET A 32 4.984 7.226 8.027 1.00 0.00 H new ATOM 0 HB3 MET A 32 3.596 8.284 7.864 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.845 9.071 9.706 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.040 9.268 7.976 1.00 0.00 H new ATOM 0 HE1 MET A 32 3.373 11.755 6.922 1.00 0.00 H new ATOM 0 HE2 MET A 32 4.198 10.231 6.521 1.00 0.00 H new ATOM 0 HE3 MET A 32 2.612 10.198 7.328 1.00 0.00 H new ATOM 514 N THR A 33 1.457 6.847 9.973 1.00 0.00 N ATOM 515 CA THR A 33 0.258 6.058 9.723 1.00 0.00 C ATOM 516 C THR A 33 -0.186 6.180 8.267 1.00 0.00 C ATOM 517 O THR A 33 -0.214 7.276 7.707 1.00 0.00 O ATOM 518 CB THR A 33 -0.874 6.503 10.651 1.00 0.00 C ATOM 519 OG1 THR A 33 -0.753 7.878 10.966 1.00 0.00 O ATOM 520 CG2 THR A 33 -0.917 5.734 11.954 1.00 0.00 C ATOM 0 H THR A 33 1.305 7.672 10.553 1.00 0.00 H new ATOM 0 HA THR A 33 0.496 5.013 9.924 1.00 0.00 H new ATOM 0 HB THR A 33 -1.794 6.304 10.101 1.00 0.00 H new ATOM 0 HG1 THR A 33 -1.487 8.144 11.559 1.00 0.00 H new ATOM 0 HG21 THR A 33 -1.742 6.099 12.565 1.00 0.00 H new ATOM 0 HG22 THR A 33 -1.061 4.674 11.746 1.00 0.00 H new ATOM 0 HG23 THR A 33 0.021 5.874 12.491 1.00 0.00 H new ATOM 528 N PHE A 34 -0.534 5.049 7.661 1.00 0.00 N ATOM 529 CA PHE A 34 -0.980 5.029 6.273 1.00 0.00 C ATOM 530 C PHE A 34 -2.130 4.045 6.085 1.00 0.00 C ATOM 531 O PHE A 34 -2.250 3.070 6.825 1.00 0.00 O ATOM 532 CB PHE A 34 0.179 4.656 5.347 1.00 0.00 C ATOM 533 CG PHE A 34 1.336 5.611 5.421 1.00 0.00 C ATOM 534 CD1 PHE A 34 1.130 6.978 5.338 1.00 0.00 C ATOM 535 CD2 PHE A 34 2.630 5.139 5.571 1.00 0.00 C ATOM 536 CE1 PHE A 34 2.193 7.859 5.404 1.00 0.00 C ATOM 537 CE2 PHE A 34 3.698 6.015 5.639 1.00 0.00 C ATOM 538 CZ PHE A 34 3.479 7.376 5.555 1.00 0.00 C ATOM 0 H PHE A 34 -0.515 4.134 8.110 1.00 0.00 H new ATOM 0 HA PHE A 34 -1.333 6.028 6.018 1.00 0.00 H new ATOM 0 HB2 PHE A 34 0.528 3.655 5.600 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -0.185 4.617 4.320 1.00 0.00 H new ATOM 0 HD1 PHE A 34 0.127 7.360 5.220 1.00 0.00 H new ATOM 0 HD2 PHE A 34 2.807 4.075 5.636 1.00 0.00 H new ATOM 0 HE1 PHE A 34 2.019 8.923 5.338 1.00 0.00 H new ATOM 0 HE2 PHE A 34 4.702 5.635 5.758 1.00 0.00 H new ATOM 0 HZ PHE A 34 4.312 8.062 5.607 1.00 0.00 H new ATOM 548 N ARG A 35 -2.973 4.307 5.093 1.00 0.00 N ATOM 549 CA ARG A 35 -4.116 3.444 4.812 1.00 0.00 C ATOM 550 C ARG A 35 -4.005 2.821 3.424 1.00 0.00 C ATOM 551 O ARG A 35 -3.458 3.424 2.501 1.00 0.00 O ATOM 552 CB ARG A 35 -5.418 4.238 4.927 1.00 0.00 C ATOM 553 CG ARG A 35 -6.237 3.887 6.159 1.00 0.00 C ATOM 554 CD ARG A 35 -7.215 4.996 6.511 1.00 0.00 C ATOM 555 NE ARG A 35 -8.302 4.519 7.363 1.00 0.00 N ATOM 556 CZ ARG A 35 -9.362 3.853 6.911 1.00 0.00 C ATOM 557 NH1 ARG A 35 -9.483 3.583 5.617 1.00 0.00 N ATOM 558 NH2 ARG A 35 -10.305 3.456 7.755 1.00 0.00 N ATOM 0 H ARG A 35 -2.887 5.110 4.469 1.00 0.00 H new ATOM 0 HA ARG A 35 -4.121 2.640 5.548 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -5.184 5.302 4.947 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -6.022 4.061 4.037 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -6.784 2.961 5.982 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -5.570 3.707 7.002 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -6.683 5.800 7.019 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -7.630 5.417 5.595 1.00 0.00 H new ATOM 0 HE ARG A 35 -8.245 4.708 8.364 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -8.761 3.886 4.963 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -10.298 3.072 5.277 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -10.218 3.661 8.750 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -11.117 2.946 7.409 1.00 0.00 H new ATOM 572 N LEU A 36 -4.529 1.608 3.285 1.00 0.00 N ATOM 573 CA LEU A 36 -4.494 0.896 2.013 1.00 0.00 C ATOM 574 C LEU A 36 -5.565 1.429 1.064 1.00 0.00 C ATOM 575 O LEU A 36 -6.694 1.696 1.475 1.00 0.00 O ATOM 576 CB LEU A 36 -4.694 -0.605 2.243 1.00 0.00 C ATOM 577 CG LEU A 36 -4.935 -1.437 0.980 1.00 0.00 C ATOM 578 CD1 LEU A 36 -3.754 -1.321 0.026 1.00 0.00 C ATOM 579 CD2 LEU A 36 -5.195 -2.890 1.344 1.00 0.00 C ATOM 0 H LEU A 36 -4.984 1.096 4.040 1.00 0.00 H new ATOM 0 HA LEU A 36 -3.518 1.059 1.556 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.815 -0.997 2.754 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -5.541 -0.743 2.915 1.00 0.00 H new ATOM 0 HG LEU A 36 -5.818 -1.047 0.473 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.946 -1.920 -0.865 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.618 -0.278 -0.260 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -2.851 -1.682 0.519 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.364 -3.468 0.436 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -4.332 -3.292 1.874 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -6.075 -2.953 1.983 1.00 0.00 H new ATOM 591 N LEU A 37 -5.202 1.581 -0.205 1.00 0.00 N ATOM 592 CA LEU A 37 -6.132 2.080 -1.212 1.00 0.00 C ATOM 593 C LEU A 37 -7.015 0.955 -1.738 1.00 0.00 C ATOM 594 O LEU A 37 -6.635 0.233 -2.660 1.00 0.00 O ATOM 595 CB LEU A 37 -5.367 2.727 -2.366 1.00 0.00 C ATOM 596 CG LEU A 37 -6.241 3.261 -3.504 1.00 0.00 C ATOM 597 CD1 LEU A 37 -5.623 4.511 -4.111 1.00 0.00 C ATOM 598 CD2 LEU A 37 -6.442 2.193 -4.566 1.00 0.00 C ATOM 0 H LEU A 37 -4.271 1.366 -0.561 1.00 0.00 H new ATOM 0 HA LEU A 37 -6.770 2.830 -0.744 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -4.770 3.549 -1.971 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.671 1.995 -2.776 1.00 0.00 H new ATOM 0 HG LEU A 37 -7.216 3.526 -3.095 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -6.258 4.876 -4.918 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -5.532 5.281 -3.345 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.635 4.274 -4.506 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.066 2.590 -5.367 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -5.475 1.897 -4.972 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.930 1.326 -4.122 1.00 0.00 H new ATOM 610 N LEU A 38 -8.196 0.808 -1.145 1.00 0.00 N ATOM 611 CA LEU A 38 -9.134 -0.231 -1.554 1.00 0.00 C ATOM 612 C LEU A 38 -10.489 0.369 -1.910 1.00 0.00 C ATOM 613 O LEU A 38 -10.788 1.510 -1.558 1.00 0.00 O ATOM 614 CB LEU A 38 -9.292 -1.269 -0.438 1.00 0.00 C ATOM 615 CG LEU A 38 -8.869 -2.690 -0.813 1.00 0.00 C ATOM 616 CD1 LEU A 38 -9.826 -3.278 -1.837 1.00 0.00 C ATOM 617 CD2 LEU A 38 -7.443 -2.698 -1.344 1.00 0.00 C ATOM 0 H LEU A 38 -8.526 1.396 -0.379 1.00 0.00 H new ATOM 0 HA LEU A 38 -8.734 -0.722 -2.441 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -8.706 -0.947 0.423 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -10.336 -1.287 -0.125 1.00 0.00 H new ATOM 0 HG LEU A 38 -8.905 -3.309 0.083 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -9.510 -4.289 -2.092 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -10.833 -3.307 -1.420 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -9.823 -2.660 -2.735 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -7.158 -3.717 -1.606 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.381 -2.065 -2.229 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -6.767 -2.318 -0.578 1.00 0.00 H new ATOM 629 N VAL A 39 -11.307 -0.408 -2.613 1.00 0.00 N ATOM 630 CA VAL A 39 -12.633 0.043 -3.020 1.00 0.00 C ATOM 631 C VAL A 39 -13.509 0.345 -1.810 1.00 0.00 C ATOM 632 O VAL A 39 -13.247 -0.130 -0.704 1.00 0.00 O ATOM 633 CB VAL A 39 -13.339 -1.005 -3.899 1.00 0.00 C ATOM 634 CG1 VAL A 39 -12.628 -1.148 -5.234 1.00 0.00 C ATOM 635 CG2 VAL A 39 -13.414 -2.343 -3.179 1.00 0.00 C ATOM 0 H VAL A 39 -11.074 -1.355 -2.913 1.00 0.00 H new ATOM 0 HA VAL A 39 -12.490 0.956 -3.598 1.00 0.00 H new ATOM 0 HB VAL A 39 -14.357 -0.665 -4.091 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -13.141 -1.893 -5.842 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -12.633 -0.190 -5.754 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -11.598 -1.464 -5.066 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -13.916 -3.071 -3.816 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -12.406 -2.692 -2.954 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -13.973 -2.226 -2.251 1.00 0.00 H new ATOM 645 N ASP A 40 -14.555 1.134 -2.030 1.00 0.00 N ATOM 646 CA ASP A 40 -15.476 1.499 -0.960 1.00 0.00 C ATOM 647 C ASP A 40 -16.917 1.216 -1.372 1.00 0.00 C ATOM 648 O ASP A 40 -17.343 1.582 -2.468 1.00 0.00 O ATOM 649 CB ASP A 40 -15.317 2.977 -0.600 1.00 0.00 C ATOM 650 CG ASP A 40 -15.527 3.886 -1.794 1.00 0.00 C ATOM 651 OD1 ASP A 40 -14.582 4.040 -2.597 1.00 0.00 O ATOM 652 OD2 ASP A 40 -16.635 4.447 -1.926 1.00 0.00 O ATOM 0 H ASP A 40 -14.786 1.533 -2.940 1.00 0.00 H new ATOM 0 HA ASP A 40 -15.238 0.895 -0.085 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -16.031 3.237 0.182 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -14.321 3.144 -0.190 1.00 0.00 H new ATOM 657 N THR A 41 -17.662 0.560 -0.489 1.00 0.00 N ATOM 658 CA THR A 41 -19.055 0.225 -0.760 1.00 0.00 C ATOM 659 C THR A 41 -19.958 1.449 -0.591 1.00 0.00 C ATOM 660 O THR A 41 -20.150 1.935 0.524 1.00 0.00 O ATOM 661 CB THR A 41 -19.522 -0.898 0.171 1.00 0.00 C ATOM 662 OG1 THR A 41 -20.927 -1.057 0.100 1.00 0.00 O ATOM 663 CG2 THR A 41 -19.161 -0.664 1.623 1.00 0.00 C ATOM 0 H THR A 41 -17.324 0.249 0.422 1.00 0.00 H new ATOM 0 HA THR A 41 -19.124 -0.114 -1.794 1.00 0.00 H new ATOM 0 HB THR A 41 -19.004 -1.792 -0.176 1.00 0.00 H new ATOM 0 HG1 THR A 41 -21.346 -0.612 0.866 1.00 0.00 H new ATOM 0 HG21 THR A 41 -19.521 -1.497 2.226 1.00 0.00 H new ATOM 0 HG22 THR A 41 -18.078 -0.587 1.721 1.00 0.00 H new ATOM 0 HG23 THR A 41 -19.623 0.261 1.968 1.00 0.00 H new ATOM 671 N PRO A 42 -20.528 1.968 -1.696 1.00 0.00 N ATOM 672 CA PRO A 42 -21.409 3.138 -1.653 1.00 0.00 C ATOM 673 C PRO A 42 -22.727 2.841 -0.945 1.00 0.00 C ATOM 674 O PRO A 42 -23.097 1.681 -0.763 1.00 0.00 O ATOM 675 CB PRO A 42 -21.665 3.467 -3.133 1.00 0.00 C ATOM 676 CG PRO A 42 -20.656 2.678 -3.899 1.00 0.00 C ATOM 677 CD PRO A 42 -20.362 1.464 -3.067 1.00 0.00 C ATOM 0 HA PRO A 42 -20.957 3.959 -1.097 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -22.679 3.195 -3.425 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -21.554 4.535 -3.322 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -21.043 2.396 -4.878 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -19.752 3.262 -4.070 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -21.050 0.647 -3.285 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -19.354 1.087 -3.241 1.00 0.00 H new ATOM 685 N GLU A 43 -23.432 3.894 -0.549 1.00 0.00 N ATOM 686 CA GLU A 43 -24.710 3.745 0.137 1.00 0.00 C ATOM 687 C GLU A 43 -25.871 3.913 -0.838 1.00 0.00 C ATOM 688 O GLU A 43 -26.899 4.497 -0.499 1.00 0.00 O ATOM 689 CB GLU A 43 -24.828 4.765 1.271 1.00 0.00 C ATOM 690 CG GLU A 43 -25.907 4.425 2.286 1.00 0.00 C ATOM 691 CD GLU A 43 -26.635 5.654 2.796 1.00 0.00 C ATOM 692 OE1 GLU A 43 -27.408 6.251 2.018 1.00 0.00 O ATOM 693 OE2 GLU A 43 -26.433 6.017 3.973 1.00 0.00 O ATOM 0 H GLU A 43 -23.140 4.861 -0.691 1.00 0.00 H new ATOM 0 HA GLU A 43 -24.754 2.741 0.558 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -23.869 4.838 1.784 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -25.038 5.746 0.845 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -26.626 3.743 1.832 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -25.456 3.899 3.127 1.00 0.00 H new ATOM 700 N THR A 44 -25.695 3.400 -2.052 1.00 0.00 N ATOM 701 CA THR A 44 -26.726 3.495 -3.078 1.00 0.00 C ATOM 702 C THR A 44 -27.452 2.164 -3.250 1.00 0.00 C ATOM 703 O THR A 44 -26.924 1.231 -3.853 1.00 0.00 O ATOM 704 CB THR A 44 -26.111 3.928 -4.411 1.00 0.00 C ATOM 705 OG1 THR A 44 -25.097 3.024 -4.813 1.00 0.00 O ATOM 706 CG2 THR A 44 -25.500 5.311 -4.365 1.00 0.00 C ATOM 0 H THR A 44 -24.848 2.915 -2.348 1.00 0.00 H new ATOM 0 HA THR A 44 -27.451 4.244 -2.758 1.00 0.00 H new ATOM 0 HB THR A 44 -26.937 3.936 -5.122 1.00 0.00 H new ATOM 0 HG1 THR A 44 -25.353 2.112 -4.560 1.00 0.00 H new ATOM 0 HG21 THR A 44 -25.082 5.557 -5.341 1.00 0.00 H new ATOM 0 HG22 THR A 44 -26.268 6.040 -4.105 1.00 0.00 H new ATOM 0 HG23 THR A 44 -24.709 5.335 -3.615 1.00 0.00 H new ATOM 714 N LYS A 45 -28.666 2.087 -2.714 1.00 0.00 N ATOM 715 CA LYS A 45 -29.469 0.873 -2.808 1.00 0.00 C ATOM 716 C LYS A 45 -28.779 -0.298 -2.109 1.00 0.00 C ATOM 717 O LYS A 45 -29.083 -0.612 -0.959 1.00 0.00 O ATOM 718 CB LYS A 45 -29.744 0.528 -4.274 1.00 0.00 C ATOM 719 CG LYS A 45 -30.958 1.239 -4.849 1.00 0.00 C ATOM 720 CD LYS A 45 -30.670 1.810 -6.227 1.00 0.00 C ATOM 721 CE LYS A 45 -31.065 0.839 -7.328 1.00 0.00 C ATOM 722 NZ LYS A 45 -29.990 -0.154 -7.604 1.00 0.00 N ATOM 0 H LYS A 45 -29.115 2.851 -2.210 1.00 0.00 H new ATOM 0 HA LYS A 45 -30.418 1.057 -2.305 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -28.868 0.784 -4.869 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -29.887 -0.549 -4.364 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -31.794 0.542 -4.911 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -31.262 2.042 -4.178 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -31.213 2.746 -6.354 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -29.609 2.043 -6.310 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -31.977 0.316 -7.041 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -31.289 1.394 -8.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -30.298 -0.798 -8.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -29.127 0.343 -7.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -29.794 -0.702 -6.742 1.00 0.00 H new ATOM 736 N HIS A 46 -27.852 -0.945 -2.813 1.00 0.00 N ATOM 737 CA HIS A 46 -27.124 -2.080 -2.257 1.00 0.00 C ATOM 738 C HIS A 46 -25.620 -1.815 -2.245 1.00 0.00 C ATOM 739 O HIS A 46 -25.093 -1.143 -3.132 1.00 0.00 O ATOM 740 CB HIS A 46 -27.427 -3.348 -3.060 1.00 0.00 C ATOM 741 CG HIS A 46 -27.858 -4.504 -2.212 1.00 0.00 C ATOM 742 ND1 HIS A 46 -27.036 -5.577 -1.930 1.00 0.00 N ATOM 743 CD2 HIS A 46 -29.031 -4.755 -1.585 1.00 0.00 C ATOM 744 CE1 HIS A 46 -27.686 -6.436 -1.165 1.00 0.00 C ATOM 745 NE2 HIS A 46 -28.896 -5.960 -0.941 1.00 0.00 N ATOM 0 H HIS A 46 -27.589 -0.702 -3.768 1.00 0.00 H new ATOM 0 HA HIS A 46 -27.454 -2.222 -1.228 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -28.209 -3.130 -3.787 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -26.538 -3.633 -3.623 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -29.909 -4.125 -1.590 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -27.294 -7.369 -0.787 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -29.616 -6.415 -0.379 1.00 0.00 H new ATOM 754 N PRO A 47 -24.905 -2.344 -1.236 1.00 0.00 N ATOM 755 CA PRO A 47 -23.455 -2.163 -1.115 1.00 0.00 C ATOM 756 C PRO A 47 -22.682 -3.012 -2.119 1.00 0.00 C ATOM 757 O PRO A 47 -22.863 -4.226 -2.188 1.00 0.00 O ATOM 758 CB PRO A 47 -23.163 -2.625 0.312 1.00 0.00 C ATOM 759 CG PRO A 47 -24.228 -3.622 0.609 1.00 0.00 C ATOM 760 CD PRO A 47 -25.454 -3.162 -0.134 1.00 0.00 C ATOM 0 HA PRO A 47 -23.151 -1.136 -1.317 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -22.171 -3.070 0.390 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -23.194 -1.791 1.013 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -23.929 -4.619 0.286 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -24.421 -3.678 1.680 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -26.034 -4.004 -0.510 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -26.116 -2.579 0.507 1.00 0.00 H new ATOM 768 N LYS A 48 -21.819 -2.363 -2.895 1.00 0.00 N ATOM 769 CA LYS A 48 -21.019 -3.062 -3.894 1.00 0.00 C ATOM 770 C LYS A 48 -19.532 -2.789 -3.692 1.00 0.00 C ATOM 771 O LYS A 48 -19.065 -1.665 -3.875 1.00 0.00 O ATOM 772 CB LYS A 48 -21.440 -2.634 -5.302 1.00 0.00 C ATOM 773 CG LYS A 48 -20.905 -3.545 -6.397 1.00 0.00 C ATOM 774 CD LYS A 48 -22.028 -4.122 -7.243 1.00 0.00 C ATOM 775 CE LYS A 48 -21.494 -4.790 -8.498 1.00 0.00 C ATOM 776 NZ LYS A 48 -20.824 -6.085 -8.196 1.00 0.00 N ATOM 0 H LYS A 48 -21.656 -1.357 -2.851 1.00 0.00 H new ATOM 0 HA LYS A 48 -21.192 -4.132 -3.777 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -22.528 -2.613 -5.357 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -21.092 -1.617 -5.484 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -20.220 -2.986 -7.034 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -20.333 -4.357 -5.948 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -22.592 -4.847 -6.656 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -22.721 -3.328 -7.519 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -22.314 -4.960 -9.196 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -20.788 -4.123 -8.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -20.474 -6.509 -9.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -20.026 -5.920 -7.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -21.504 -6.732 -7.748 1.00 0.00 H new ATOM 790 N LYS A 49 -18.792 -3.828 -3.314 1.00 0.00 N ATOM 791 CA LYS A 49 -17.355 -3.705 -3.088 1.00 0.00 C ATOM 792 C LYS A 49 -17.063 -2.716 -1.964 1.00 0.00 C ATOM 793 O LYS A 49 -17.390 -1.534 -2.063 1.00 0.00 O ATOM 794 CB LYS A 49 -16.651 -3.262 -4.371 1.00 0.00 C ATOM 795 CG LYS A 49 -16.376 -4.401 -5.339 1.00 0.00 C ATOM 796 CD LYS A 49 -17.323 -4.367 -6.529 1.00 0.00 C ATOM 797 CE LYS A 49 -16.747 -3.552 -7.676 1.00 0.00 C ATOM 798 NZ LYS A 49 -17.814 -2.943 -8.516 1.00 0.00 N ATOM 0 H LYS A 49 -19.164 -4.765 -3.158 1.00 0.00 H new ATOM 0 HA LYS A 49 -16.974 -4.683 -2.794 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -17.263 -2.511 -4.871 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -15.708 -2.782 -4.111 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -15.346 -4.339 -5.691 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -16.478 -5.354 -4.819 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -17.521 -5.384 -6.867 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -18.279 -3.942 -6.223 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -16.107 -2.766 -7.277 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -16.118 -4.191 -8.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -17.380 -2.424 -9.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -18.431 -3.692 -8.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -18.378 -2.287 -7.939 1.00 0.00 H new ATOM 812 N GLY A 50 -16.444 -3.208 -0.896 1.00 0.00 N ATOM 813 CA GLY A 50 -16.118 -2.353 0.230 1.00 0.00 C ATOM 814 C GLY A 50 -15.906 -3.136 1.511 1.00 0.00 C ATOM 815 O GLY A 50 -16.757 -3.932 1.907 1.00 0.00 O ATOM 0 H GLY A 50 -16.163 -4.183 -0.790 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -15.216 -1.785 0.002 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -16.921 -1.631 0.378 1.00 0.00 H new ATOM 819 N VAL A 51 -14.769 -2.908 2.161 1.00 0.00 N ATOM 820 CA VAL A 51 -14.449 -3.596 3.406 1.00 0.00 C ATOM 821 C VAL A 51 -14.493 -2.634 4.588 1.00 0.00 C ATOM 822 O VAL A 51 -13.598 -1.806 4.762 1.00 0.00 O ATOM 823 CB VAL A 51 -13.057 -4.254 3.343 1.00 0.00 C ATOM 824 CG1 VAL A 51 -12.805 -5.094 4.586 1.00 0.00 C ATOM 825 CG2 VAL A 51 -12.919 -5.098 2.085 1.00 0.00 C ATOM 0 H VAL A 51 -14.054 -2.252 1.846 1.00 0.00 H new ATOM 0 HA VAL A 51 -15.202 -4.372 3.543 1.00 0.00 H new ATOM 0 HB VAL A 51 -12.306 -3.465 3.307 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -11.817 -5.550 4.523 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -12.855 -4.459 5.471 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -13.562 -5.875 4.657 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -11.929 -5.554 2.059 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -13.679 -5.880 2.086 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -13.050 -4.466 1.207 1.00 0.00 H new ATOM 835 N GLU A 52 -15.539 -2.750 5.401 1.00 0.00 N ATOM 836 CA GLU A 52 -15.699 -1.892 6.568 1.00 0.00 C ATOM 837 C GLU A 52 -15.104 -2.544 7.810 1.00 0.00 C ATOM 838 O GLU A 52 -14.585 -3.659 7.750 1.00 0.00 O ATOM 839 CB GLU A 52 -17.179 -1.583 6.801 1.00 0.00 C ATOM 840 CG GLU A 52 -17.671 -0.357 6.049 1.00 0.00 C ATOM 841 CD GLU A 52 -18.830 0.328 6.744 1.00 0.00 C ATOM 842 OE1 GLU A 52 -19.564 -0.356 7.489 1.00 0.00 O ATOM 843 OE2 GLU A 52 -19.007 1.549 6.544 1.00 0.00 O ATOM 0 H GLU A 52 -16.288 -3.430 5.272 1.00 0.00 H new ATOM 0 HA GLU A 52 -15.165 -0.961 6.378 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -17.773 -2.446 6.500 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -17.347 -1.436 7.868 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -16.849 0.351 5.938 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -17.977 -0.650 5.045 1.00 0.00 H new ATOM 850 N LYS A 53 -15.180 -1.842 8.937 1.00 0.00 N ATOM 851 CA LYS A 53 -14.649 -2.356 10.194 1.00 0.00 C ATOM 852 C LYS A 53 -15.396 -3.614 10.623 1.00 0.00 C ATOM 853 O LYS A 53 -16.408 -3.540 11.320 1.00 0.00 O ATOM 854 CB LYS A 53 -14.746 -1.287 11.286 1.00 0.00 C ATOM 855 CG LYS A 53 -13.412 -0.969 11.945 1.00 0.00 C ATOM 856 CD LYS A 53 -13.182 0.531 12.045 1.00 0.00 C ATOM 857 CE LYS A 53 -13.083 1.173 10.671 1.00 0.00 C ATOM 858 NZ LYS A 53 -12.155 0.430 9.775 1.00 0.00 N ATOM 0 H LYS A 53 -15.604 -0.917 9.005 1.00 0.00 H new ATOM 0 HA LYS A 53 -13.601 -2.614 10.043 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -15.155 -0.374 10.854 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -15.449 -1.621 12.049 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -13.383 -1.410 12.942 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -12.604 -1.424 11.372 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -13.999 0.989 12.603 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -12.266 0.723 12.604 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -14.073 1.211 10.216 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -12.740 2.202 10.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -11.656 1.102 9.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -11.463 -0.093 10.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -12.697 -0.239 9.192 1.00 0.00 H new ATOM 872 N TYR A 54 -14.891 -4.769 10.201 1.00 0.00 N ATOM 873 CA TYR A 54 -15.511 -6.044 10.542 1.00 0.00 C ATOM 874 C TYR A 54 -14.945 -6.594 11.847 1.00 0.00 C ATOM 875 O TYR A 54 -15.652 -7.251 12.612 1.00 0.00 O ATOM 876 CB TYR A 54 -15.300 -7.055 9.414 1.00 0.00 C ATOM 877 CG TYR A 54 -16.140 -6.776 8.187 1.00 0.00 C ATOM 878 CD1 TYR A 54 -17.527 -6.739 8.266 1.00 0.00 C ATOM 879 CD2 TYR A 54 -15.546 -6.550 6.952 1.00 0.00 C ATOM 880 CE1 TYR A 54 -18.298 -6.483 7.147 1.00 0.00 C ATOM 881 CE2 TYR A 54 -16.311 -6.294 5.829 1.00 0.00 C ATOM 882 CZ TYR A 54 -17.686 -6.263 5.932 1.00 0.00 C ATOM 883 OH TYR A 54 -18.450 -6.009 4.816 1.00 0.00 O ATOM 0 H TYR A 54 -14.055 -4.848 9.623 1.00 0.00 H new ATOM 0 HA TYR A 54 -16.580 -5.875 10.674 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -14.247 -7.057 9.131 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -15.532 -8.054 9.784 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -18.010 -6.913 9.216 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -14.470 -6.575 6.868 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -19.375 -6.456 7.225 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -15.834 -6.119 4.876 1.00 0.00 H new ATOM 0 HH TYR A 54 -17.864 -5.875 4.042 1.00 0.00 H new ATOM 893 N GLY A 55 -13.669 -6.320 12.097 1.00 0.00 N ATOM 894 CA GLY A 55 -13.034 -6.796 13.312 1.00 0.00 C ATOM 895 C GLY A 55 -11.529 -6.923 13.172 1.00 0.00 C ATOM 896 O GLY A 55 -10.915 -6.208 12.380 1.00 0.00 O ATOM 0 H GLY A 55 -13.064 -5.777 11.481 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -13.263 -6.112 14.129 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -13.453 -7.765 13.581 1.00 0.00 H new ATOM 900 N PRO A 56 -10.901 -7.834 13.937 1.00 0.00 N ATOM 901 CA PRO A 56 -9.449 -8.046 13.889 1.00 0.00 C ATOM 902 C PRO A 56 -8.960 -8.465 12.504 1.00 0.00 C ATOM 903 O PRO A 56 -7.767 -8.396 12.212 1.00 0.00 O ATOM 904 CB PRO A 56 -9.211 -9.175 14.899 1.00 0.00 C ATOM 905 CG PRO A 56 -10.414 -9.171 15.777 1.00 0.00 C ATOM 906 CD PRO A 56 -11.554 -8.725 14.908 1.00 0.00 C ATOM 0 HA PRO A 56 -8.905 -7.129 14.117 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -9.093 -10.135 14.396 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -8.302 -9.003 15.475 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -10.601 -10.163 16.188 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -10.279 -8.496 16.622 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -12.042 -9.568 14.418 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -12.320 -8.204 15.483 1.00 0.00 H new ATOM 914 N GLU A 57 -9.888 -8.904 11.654 1.00 0.00 N ATOM 915 CA GLU A 57 -9.548 -9.338 10.301 1.00 0.00 C ATOM 916 C GLU A 57 -8.617 -8.342 9.613 1.00 0.00 C ATOM 917 O GLU A 57 -7.813 -8.718 8.760 1.00 0.00 O ATOM 918 CB GLU A 57 -10.820 -9.517 9.468 1.00 0.00 C ATOM 919 CG GLU A 57 -11.711 -10.648 9.955 1.00 0.00 C ATOM 920 CD GLU A 57 -13.153 -10.485 9.514 1.00 0.00 C ATOM 921 OE1 GLU A 57 -13.411 -10.544 8.294 1.00 0.00 O ATOM 922 OE2 GLU A 57 -14.023 -10.296 10.390 1.00 0.00 O ATOM 0 H GLU A 57 -10.881 -8.968 11.879 1.00 0.00 H new ATOM 0 HA GLU A 57 -9.027 -10.292 10.380 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -11.388 -8.587 9.482 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -10.542 -9.705 8.431 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -11.325 -11.596 9.581 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -11.671 -10.695 11.043 1.00 0.00 H new ATOM 929 N ALA A 58 -8.729 -7.073 9.990 1.00 0.00 N ATOM 930 CA ALA A 58 -7.897 -6.028 9.407 1.00 0.00 C ATOM 931 C ALA A 58 -6.489 -6.052 9.995 1.00 0.00 C ATOM 932 O ALA A 58 -5.501 -6.109 9.263 1.00 0.00 O ATOM 933 CB ALA A 58 -8.536 -4.664 9.622 1.00 0.00 C ATOM 0 H ALA A 58 -9.387 -6.744 10.696 1.00 0.00 H new ATOM 0 HA ALA A 58 -7.818 -6.217 8.336 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -7.904 -3.893 9.182 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -9.517 -4.643 9.148 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -8.645 -4.478 10.690 1.00 0.00 H new ATOM 939 N SER A 59 -6.406 -6.006 11.320 1.00 0.00 N ATOM 940 CA SER A 59 -5.120 -6.021 12.008 1.00 0.00 C ATOM 941 C SER A 59 -4.439 -7.383 11.879 1.00 0.00 C ATOM 942 O SER A 59 -3.217 -7.487 11.979 1.00 0.00 O ATOM 943 CB SER A 59 -5.305 -5.672 13.486 1.00 0.00 C ATOM 944 OG SER A 59 -6.326 -6.461 14.072 1.00 0.00 O ATOM 0 H SER A 59 -7.215 -5.958 11.940 1.00 0.00 H new ATOM 0 HA SER A 59 -4.482 -5.273 11.538 1.00 0.00 H new ATOM 0 HB2 SER A 59 -4.368 -5.829 14.020 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.555 -4.616 13.585 1.00 0.00 H new ATOM 0 HG SER A 59 -6.612 -7.150 13.437 1.00 0.00 H new ATOM 950 N ALA A 60 -5.236 -8.424 11.660 1.00 0.00 N ATOM 951 CA ALA A 60 -4.708 -9.778 11.522 1.00 0.00 C ATOM 952 C ALA A 60 -3.637 -9.856 10.437 1.00 0.00 C ATOM 953 O ALA A 60 -2.791 -10.750 10.451 1.00 0.00 O ATOM 954 CB ALA A 60 -5.836 -10.754 11.221 1.00 0.00 C ATOM 0 H ALA A 60 -6.250 -8.357 11.574 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.241 -10.051 12.468 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.429 -11.760 11.120 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -6.560 -10.735 12.035 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -6.327 -10.467 10.291 1.00 0.00 H new ATOM 960 N PHE A 61 -3.677 -8.915 9.495 1.00 0.00 N ATOM 961 CA PHE A 61 -2.709 -8.885 8.404 1.00 0.00 C ATOM 962 C PHE A 61 -1.278 -8.865 8.936 1.00 0.00 C ATOM 963 O PHE A 61 -0.363 -9.387 8.302 1.00 0.00 O ATOM 964 CB PHE A 61 -2.950 -7.663 7.515 1.00 0.00 C ATOM 965 CG PHE A 61 -4.050 -7.859 6.510 1.00 0.00 C ATOM 966 CD1 PHE A 61 -5.365 -8.002 6.922 1.00 0.00 C ATOM 967 CD2 PHE A 61 -3.768 -7.900 5.154 1.00 0.00 C ATOM 968 CE1 PHE A 61 -6.378 -8.182 6.001 1.00 0.00 C ATOM 969 CE2 PHE A 61 -4.777 -8.080 4.228 1.00 0.00 C ATOM 970 CZ PHE A 61 -6.085 -8.220 4.651 1.00 0.00 C ATOM 0 H PHE A 61 -4.368 -8.166 9.467 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.842 -9.791 7.813 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -3.193 -6.808 8.145 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.027 -7.419 6.989 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -5.601 -7.972 7.976 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.748 -7.790 4.817 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -7.399 -8.293 6.336 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -4.544 -8.111 3.174 1.00 0.00 H new ATOM 0 HZ PHE A 61 -6.876 -8.359 3.929 1.00 0.00 H new ATOM 980 N THR A 62 -1.094 -8.259 10.104 1.00 0.00 N ATOM 981 CA THR A 62 0.226 -8.170 10.718 1.00 0.00 C ATOM 982 C THR A 62 0.607 -9.480 11.406 1.00 0.00 C ATOM 983 O THR A 62 1.779 -9.715 11.704 1.00 0.00 O ATOM 984 CB THR A 62 0.264 -7.022 11.727 1.00 0.00 C ATOM 985 OG1 THR A 62 1.576 -6.837 12.228 1.00 0.00 O ATOM 986 CG2 THR A 62 -0.654 -7.233 12.912 1.00 0.00 C ATOM 0 H THR A 62 -1.841 -7.823 10.644 1.00 0.00 H new ATOM 0 HA THR A 62 0.950 -7.978 9.927 1.00 0.00 H new ATOM 0 HB THR A 62 -0.077 -6.145 11.177 1.00 0.00 H new ATOM 0 HG1 THR A 62 1.977 -6.046 11.811 1.00 0.00 H new ATOM 0 HG21 THR A 62 -0.577 -6.381 13.588 1.00 0.00 H new ATOM 0 HG22 THR A 62 -1.682 -7.328 12.563 1.00 0.00 H new ATOM 0 HG23 THR A 62 -0.364 -8.142 13.439 1.00 0.00 H new ATOM 994 N LYS A 63 -0.385 -10.326 11.663 1.00 0.00 N ATOM 995 CA LYS A 63 -0.147 -11.605 12.321 1.00 0.00 C ATOM 996 C LYS A 63 0.155 -12.707 11.307 1.00 0.00 C ATOM 997 O LYS A 63 1.194 -13.356 11.374 1.00 0.00 O ATOM 998 CB LYS A 63 -1.357 -11.994 13.172 1.00 0.00 C ATOM 999 CG LYS A 63 -0.993 -12.419 14.587 1.00 0.00 C ATOM 1000 CD LYS A 63 -0.356 -11.280 15.365 1.00 0.00 C ATOM 1001 CE LYS A 63 -0.884 -11.214 16.789 1.00 0.00 C ATOM 1002 NZ LYS A 63 -0.897 -9.819 17.312 1.00 0.00 N ATOM 0 H LYS A 63 -1.361 -10.149 11.426 1.00 0.00 H new ATOM 0 HA LYS A 63 0.725 -11.492 12.965 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -2.044 -11.149 13.220 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.889 -12.809 12.682 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -1.888 -12.760 15.107 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -0.305 -13.264 14.549 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.726 -11.411 15.383 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.555 -10.336 14.858 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -1.894 -11.623 16.821 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -0.266 -11.838 17.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -1.264 -9.817 18.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 0.070 -9.437 17.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -1.507 -9.229 16.711 1.00 0.00 H new ATOM 1016 N LYS A 64 -0.771 -12.918 10.377 1.00 0.00 N ATOM 1017 CA LYS A 64 -0.614 -13.950 9.355 1.00 0.00 C ATOM 1018 C LYS A 64 0.115 -13.408 8.132 1.00 0.00 C ATOM 1019 O LYS A 64 1.167 -13.918 7.745 1.00 0.00 O ATOM 1020 CB LYS A 64 -1.980 -14.501 8.943 1.00 0.00 C ATOM 1021 CG LYS A 64 -2.904 -14.783 10.116 1.00 0.00 C ATOM 1022 CD LYS A 64 -4.362 -14.796 9.683 1.00 0.00 C ATOM 1023 CE LYS A 64 -4.794 -13.444 9.142 1.00 0.00 C ATOM 1024 NZ LYS A 64 -4.739 -13.396 7.654 1.00 0.00 N ATOM 0 H LYS A 64 -1.640 -12.388 10.309 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.016 -14.755 9.782 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -2.463 -13.788 8.275 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -1.835 -15.421 8.377 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -2.646 -15.744 10.561 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -2.758 -14.026 10.886 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -4.509 -15.559 8.918 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -4.992 -15.068 10.530 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -5.809 -13.228 9.475 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.151 -12.666 9.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -4.204 -12.557 7.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -4.270 -14.252 7.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -5.705 -13.345 7.272 1.00 0.00 H new ATOM 1038 N MET A 65 -0.461 -12.380 7.520 1.00 0.00 N ATOM 1039 CA MET A 65 0.118 -11.771 6.331 1.00 0.00 C ATOM 1040 C MET A 65 1.555 -11.315 6.574 1.00 0.00 C ATOM 1041 O MET A 65 2.319 -11.118 5.628 1.00 0.00 O ATOM 1042 CB MET A 65 -0.735 -10.585 5.874 1.00 0.00 C ATOM 1043 CG MET A 65 -1.067 -10.612 4.392 1.00 0.00 C ATOM 1044 SD MET A 65 -2.456 -11.695 4.009 1.00 0.00 S ATOM 1045 CE MET A 65 -3.183 -10.834 2.616 1.00 0.00 C ATOM 0 H MET A 65 -1.332 -11.950 7.830 1.00 0.00 H new ATOM 0 HA MET A 65 0.134 -12.529 5.548 1.00 0.00 H new ATOM 0 HB2 MET A 65 -1.663 -10.573 6.446 1.00 0.00 H new ATOM 0 HB3 MET A 65 -0.208 -9.659 6.103 1.00 0.00 H new ATOM 0 HG2 MET A 65 -1.297 -9.601 4.057 1.00 0.00 H new ATOM 0 HG3 MET A 65 -0.191 -10.941 3.834 1.00 0.00 H new ATOM 0 HE1 MET A 65 -4.215 -10.572 2.849 1.00 0.00 H new ATOM 0 HE2 MET A 65 -2.615 -9.926 2.413 1.00 0.00 H new ATOM 0 HE3 MET A 65 -3.162 -11.480 1.738 1.00 0.00 H new ATOM 1055 N TRP A 66 1.922 -11.135 7.839 1.00 0.00 N ATOM 1056 CA TRP A 66 3.266 -10.688 8.178 1.00 0.00 C ATOM 1057 C TRP A 66 4.168 -11.850 8.598 1.00 0.00 C ATOM 1058 O TRP A 66 5.372 -11.829 8.340 1.00 0.00 O ATOM 1059 CB TRP A 66 3.212 -9.634 9.284 1.00 0.00 C ATOM 1060 CG TRP A 66 3.835 -8.329 8.889 1.00 0.00 C ATOM 1061 CD1 TRP A 66 3.463 -7.525 7.849 1.00 0.00 C ATOM 1062 CD2 TRP A 66 4.942 -7.678 9.524 1.00 0.00 C ATOM 1063 NE1 TRP A 66 4.270 -6.415 7.799 1.00 0.00 N ATOM 1064 CE2 TRP A 66 5.186 -6.485 8.817 1.00 0.00 C ATOM 1065 CE3 TRP A 66 5.749 -7.989 10.622 1.00 0.00 C ATOM 1066 CZ2 TRP A 66 6.203 -5.605 9.173 1.00 0.00 C ATOM 1067 CZ3 TRP A 66 6.759 -7.113 10.975 1.00 0.00 C ATOM 1068 CH2 TRP A 66 6.978 -5.933 10.253 1.00 0.00 C ATOM 0 H TRP A 66 1.311 -11.291 8.641 1.00 0.00 H new ATOM 0 HA TRP A 66 3.698 -10.246 7.280 1.00 0.00 H new ATOM 0 HB2 TRP A 66 2.172 -9.463 9.563 1.00 0.00 H new ATOM 0 HB3 TRP A 66 3.720 -10.019 10.168 1.00 0.00 H new ATOM 0 HD1 TRP A 66 2.653 -7.732 7.166 1.00 0.00 H new ATOM 0 HE1 TRP A 66 4.199 -5.661 7.116 1.00 0.00 H new ATOM 0 HE3 TRP A 66 5.587 -8.897 11.184 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 6.375 -4.695 8.617 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 7.389 -7.342 11.821 1.00 0.00 H new ATOM 0 HH2 TRP A 66 7.774 -5.268 10.554 1.00 0.00 H new ATOM 1079 N GLU A 67 3.593 -12.857 9.252 1.00 0.00 N ATOM 1080 CA GLU A 67 4.373 -14.008 9.704 1.00 0.00 C ATOM 1081 C GLU A 67 4.341 -15.147 8.690 1.00 0.00 C ATOM 1082 O GLU A 67 5.388 -15.613 8.238 1.00 0.00 O ATOM 1083 CB GLU A 67 3.861 -14.508 11.056 1.00 0.00 C ATOM 1084 CG GLU A 67 4.072 -13.520 12.192 1.00 0.00 C ATOM 1085 CD GLU A 67 4.549 -14.189 13.466 1.00 0.00 C ATOM 1086 OE1 GLU A 67 3.835 -15.083 13.969 1.00 0.00 O ATOM 1087 OE2 GLU A 67 5.633 -13.820 13.962 1.00 0.00 O ATOM 0 H GLU A 67 2.600 -12.900 9.479 1.00 0.00 H new ATOM 0 HA GLU A 67 5.406 -13.675 9.809 1.00 0.00 H new ATOM 0 HB2 GLU A 67 2.797 -14.730 10.972 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.364 -15.443 11.302 1.00 0.00 H new ATOM 0 HG2 GLU A 67 4.801 -12.770 11.885 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.138 -12.995 12.390 1.00 0.00 H new ATOM 1094 N ASN A 68 3.143 -15.603 8.339 1.00 0.00 N ATOM 1095 CA ASN A 68 2.999 -16.698 7.382 1.00 0.00 C ATOM 1096 C ASN A 68 3.143 -16.194 5.949 1.00 0.00 C ATOM 1097 O ASN A 68 3.583 -16.926 5.063 1.00 0.00 O ATOM 1098 CB ASN A 68 1.643 -17.383 7.561 1.00 0.00 C ATOM 1099 CG ASN A 68 1.734 -18.628 8.423 1.00 0.00 C ATOM 1100 OD1 ASN A 68 0.981 -18.788 9.383 1.00 0.00 O ATOM 1101 ND2 ASN A 68 2.659 -19.517 8.081 1.00 0.00 N ATOM 0 H ASN A 68 2.262 -15.235 8.699 1.00 0.00 H new ATOM 0 HA ASN A 68 3.792 -17.421 7.573 1.00 0.00 H new ATOM 0 HB2 ASN A 68 0.942 -16.682 8.013 1.00 0.00 H new ATOM 0 HB3 ASN A 68 1.242 -17.650 6.583 1.00 0.00 H new ATOM 0 HD21 ASN A 68 2.767 -20.375 8.622 1.00 0.00 H new ATOM 0 HD22 ASN A 68 3.262 -19.342 7.277 1.00 0.00 H new ATOM 1108 N ALA A 69 2.779 -14.937 5.735 1.00 0.00 N ATOM 1109 CA ALA A 69 2.873 -14.320 4.418 1.00 0.00 C ATOM 1110 C ALA A 69 3.994 -13.290 4.385 1.00 0.00 C ATOM 1111 O ALA A 69 4.341 -12.710 5.412 1.00 0.00 O ATOM 1112 CB ALA A 69 1.549 -13.686 4.023 1.00 0.00 C ATOM 0 H ALA A 69 2.414 -14.321 6.461 1.00 0.00 H new ATOM 0 HA ALA A 69 3.105 -15.100 3.693 1.00 0.00 H new ATOM 0 HB1 ALA A 69 1.643 -13.232 3.037 1.00 0.00 H new ATOM 0 HB2 ALA A 69 0.773 -14.451 3.998 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.281 -12.920 4.751 1.00 0.00 H new ATOM 1118 N LYS A 70 4.562 -13.069 3.205 1.00 0.00 N ATOM 1119 CA LYS A 70 5.650 -12.107 3.056 1.00 0.00 C ATOM 1120 C LYS A 70 5.252 -10.757 3.643 1.00 0.00 C ATOM 1121 O LYS A 70 4.074 -10.506 3.900 1.00 0.00 O ATOM 1122 CB LYS A 70 6.025 -11.950 1.580 1.00 0.00 C ATOM 1123 CG LYS A 70 7.212 -12.803 1.160 1.00 0.00 C ATOM 1124 CD LYS A 70 6.964 -14.278 1.427 1.00 0.00 C ATOM 1125 CE LYS A 70 8.243 -14.996 1.827 1.00 0.00 C ATOM 1126 NZ LYS A 70 8.843 -15.738 0.686 1.00 0.00 N ATOM 0 H LYS A 70 4.290 -13.539 2.342 1.00 0.00 H new ATOM 0 HA LYS A 70 6.517 -12.482 3.600 1.00 0.00 H new ATOM 0 HB2 LYS A 70 5.164 -12.212 0.965 1.00 0.00 H new ATOM 0 HB3 LYS A 70 6.252 -10.903 1.381 1.00 0.00 H new ATOM 0 HG2 LYS A 70 7.411 -12.653 0.099 1.00 0.00 H new ATOM 0 HG3 LYS A 70 8.102 -12.480 1.700 1.00 0.00 H new ATOM 0 HD2 LYS A 70 6.223 -14.386 2.219 1.00 0.00 H new ATOM 0 HD3 LYS A 70 6.547 -14.745 0.535 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.963 -14.271 2.207 1.00 0.00 H new ATOM 0 HE3 LYS A 70 8.030 -15.690 2.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.713 -16.214 1.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 8.166 -16.448 0.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 9.070 -15.072 -0.080 1.00 0.00 H new ATOM 1140 N LYS A 71 6.238 -9.900 3.878 1.00 0.00 N ATOM 1141 CA LYS A 71 5.982 -8.589 4.466 1.00 0.00 C ATOM 1142 C LYS A 71 5.594 -7.568 3.405 1.00 0.00 C ATOM 1143 O LYS A 71 5.820 -7.773 2.212 1.00 0.00 O ATOM 1144 CB LYS A 71 7.216 -8.106 5.229 1.00 0.00 C ATOM 1145 CG LYS A 71 6.904 -7.607 6.628 1.00 0.00 C ATOM 1146 CD LYS A 71 8.109 -7.743 7.546 1.00 0.00 C ATOM 1147 CE LYS A 71 8.101 -9.073 8.282 1.00 0.00 C ATOM 1148 NZ LYS A 71 8.763 -10.148 7.494 1.00 0.00 N ATOM 0 H LYS A 71 7.219 -10.087 3.672 1.00 0.00 H new ATOM 0 HA LYS A 71 5.145 -8.690 5.157 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.936 -8.922 5.295 1.00 0.00 H new ATOM 0 HB3 LYS A 71 7.693 -7.305 4.664 1.00 0.00 H new ATOM 0 HG2 LYS A 71 6.595 -6.563 6.583 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.066 -8.170 7.039 1.00 0.00 H new ATOM 0 HD2 LYS A 71 9.025 -7.655 6.962 1.00 0.00 H new ATOM 0 HD3 LYS A 71 8.112 -6.926 8.268 1.00 0.00 H new ATOM 0 HE2 LYS A 71 8.608 -8.961 9.240 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.072 -9.362 8.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 9.026 -10.930 8.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 8.109 -10.497 6.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 9.618 -9.769 7.039 1.00 0.00 H new ATOM 1162 N ILE A 72 4.991 -6.471 3.855 1.00 0.00 N ATOM 1163 CA ILE A 72 4.549 -5.417 2.954 1.00 0.00 C ATOM 1164 C ILE A 72 5.493 -4.221 2.974 1.00 0.00 C ATOM 1165 O ILE A 72 6.061 -3.875 4.010 1.00 0.00 O ATOM 1166 CB ILE A 72 3.129 -4.936 3.316 1.00 0.00 C ATOM 1167 CG1 ILE A 72 3.078 -4.468 4.773 1.00 0.00 C ATOM 1168 CG2 ILE A 72 2.118 -6.046 3.070 1.00 0.00 C ATOM 1169 CD1 ILE A 72 2.679 -3.016 4.927 1.00 0.00 C ATOM 0 H ILE A 72 4.798 -6.291 4.840 1.00 0.00 H new ATOM 0 HA ILE A 72 4.546 -5.847 1.953 1.00 0.00 H new ATOM 0 HB ILE A 72 2.873 -4.090 2.678 1.00 0.00 H new ATOM 0 HG12 ILE A 72 2.372 -5.091 5.322 1.00 0.00 H new ATOM 0 HG13 ILE A 72 4.057 -4.618 5.229 1.00 0.00 H new ATOM 0 HG21 ILE A 72 1.120 -5.693 3.330 1.00 0.00 H new ATOM 0 HG22 ILE A 72 2.140 -6.331 2.018 1.00 0.00 H new ATOM 0 HG23 ILE A 72 2.369 -6.910 3.686 1.00 0.00 H new ATOM 0 HD11 ILE A 72 2.664 -2.753 5.985 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.398 -2.384 4.406 1.00 0.00 H new ATOM 0 HD13 ILE A 72 1.687 -2.864 4.501 1.00 0.00 H new ATOM 1181 N GLU A 73 5.646 -3.593 1.814 1.00 0.00 N ATOM 1182 CA GLU A 73 6.510 -2.430 1.671 1.00 0.00 C ATOM 1183 C GLU A 73 5.754 -1.275 1.018 1.00 0.00 C ATOM 1184 O GLU A 73 4.580 -1.409 0.672 1.00 0.00 O ATOM 1185 CB GLU A 73 7.742 -2.789 0.836 1.00 0.00 C ATOM 1186 CG GLU A 73 8.574 -3.910 1.434 1.00 0.00 C ATOM 1187 CD GLU A 73 10.005 -3.909 0.931 1.00 0.00 C ATOM 1188 OE1 GLU A 73 10.257 -3.315 -0.138 1.00 0.00 O ATOM 1189 OE2 GLU A 73 10.871 -4.501 1.606 1.00 0.00 O ATOM 0 H GLU A 73 5.178 -3.874 0.952 1.00 0.00 H new ATOM 0 HA GLU A 73 6.832 -2.116 2.664 1.00 0.00 H new ATOM 0 HB2 GLU A 73 7.421 -3.080 -0.164 1.00 0.00 H new ATOM 0 HB3 GLU A 73 8.367 -1.903 0.725 1.00 0.00 H new ATOM 0 HG2 GLU A 73 8.575 -3.817 2.520 1.00 0.00 H new ATOM 0 HG3 GLU A 73 8.110 -4.867 1.197 1.00 0.00 H new ATOM 1196 N VAL A 74 6.431 -0.144 0.848 1.00 0.00 N ATOM 1197 CA VAL A 74 5.816 1.028 0.235 1.00 0.00 C ATOM 1198 C VAL A 74 6.442 1.328 -1.124 1.00 0.00 C ATOM 1199 O VAL A 74 7.653 1.195 -1.306 1.00 0.00 O ATOM 1200 CB VAL A 74 5.934 2.271 1.142 1.00 0.00 C ATOM 1201 CG1 VAL A 74 7.392 2.625 1.394 1.00 0.00 C ATOM 1202 CG2 VAL A 74 5.186 3.451 0.538 1.00 0.00 C ATOM 0 H VAL A 74 7.404 -0.014 1.126 1.00 0.00 H new ATOM 0 HA VAL A 74 4.760 0.797 0.098 1.00 0.00 H new ATOM 0 HB VAL A 74 5.476 2.034 2.102 1.00 0.00 H new ATOM 0 HG11 VAL A 74 7.447 3.504 2.036 1.00 0.00 H new ATOM 0 HG12 VAL A 74 7.891 1.788 1.882 1.00 0.00 H new ATOM 0 HG13 VAL A 74 7.884 2.837 0.445 1.00 0.00 H new ATOM 0 HG21 VAL A 74 5.282 4.317 1.193 1.00 0.00 H new ATOM 0 HG22 VAL A 74 5.607 3.687 -0.439 1.00 0.00 H new ATOM 0 HG23 VAL A 74 4.132 3.195 0.427 1.00 0.00 H new ATOM 1212 N GLU A 75 5.610 1.730 -2.079 1.00 0.00 N ATOM 1213 CA GLU A 75 6.082 2.045 -3.422 1.00 0.00 C ATOM 1214 C GLU A 75 6.070 3.550 -3.667 1.00 0.00 C ATOM 1215 O GLU A 75 7.121 4.173 -3.817 1.00 0.00 O ATOM 1216 CB GLU A 75 5.215 1.340 -4.470 1.00 0.00 C ATOM 1217 CG GLU A 75 5.959 1.020 -5.756 1.00 0.00 C ATOM 1218 CD GLU A 75 6.613 -0.347 -5.728 1.00 0.00 C ATOM 1219 OE1 GLU A 75 6.798 -0.894 -4.621 1.00 0.00 O ATOM 1220 OE2 GLU A 75 6.938 -0.871 -6.814 1.00 0.00 O ATOM 0 H GLU A 75 4.605 1.845 -1.948 1.00 0.00 H new ATOM 0 HA GLU A 75 7.109 1.690 -3.509 1.00 0.00 H new ATOM 0 HB2 GLU A 75 4.825 0.415 -4.045 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.357 1.970 -4.703 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.264 1.069 -6.595 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.721 1.780 -5.929 1.00 0.00 H new ATOM 1227 N PHE A 76 4.874 4.131 -3.706 1.00 0.00 N ATOM 1228 CA PHE A 76 4.727 5.564 -3.932 1.00 0.00 C ATOM 1229 C PHE A 76 3.581 6.132 -3.102 1.00 0.00 C ATOM 1230 O PHE A 76 2.467 5.610 -3.120 1.00 0.00 O ATOM 1231 CB PHE A 76 4.485 5.845 -5.417 1.00 0.00 C ATOM 1232 CG PHE A 76 3.263 5.166 -5.964 1.00 0.00 C ATOM 1233 CD1 PHE A 76 3.302 3.831 -6.334 1.00 0.00 C ATOM 1234 CD2 PHE A 76 2.073 5.862 -6.108 1.00 0.00 C ATOM 1235 CE1 PHE A 76 2.178 3.203 -6.838 1.00 0.00 C ATOM 1236 CE2 PHE A 76 0.946 5.240 -6.611 1.00 0.00 C ATOM 1237 CZ PHE A 76 0.999 3.909 -6.977 1.00 0.00 C ATOM 0 H PHE A 76 3.993 3.631 -3.584 1.00 0.00 H new ATOM 0 HA PHE A 76 5.651 6.052 -3.622 1.00 0.00 H new ATOM 0 HB2 PHE A 76 4.390 6.921 -5.564 1.00 0.00 H new ATOM 0 HB3 PHE A 76 5.356 5.521 -5.986 1.00 0.00 H new ATOM 0 HD1 PHE A 76 4.221 3.274 -6.227 1.00 0.00 H new ATOM 0 HD2 PHE A 76 2.026 6.903 -5.824 1.00 0.00 H new ATOM 0 HE1 PHE A 76 2.222 2.162 -7.123 1.00 0.00 H new ATOM 0 HE2 PHE A 76 0.025 5.794 -6.718 1.00 0.00 H new ATOM 0 HZ PHE A 76 0.120 3.421 -7.371 1.00 0.00 H new ATOM 1247 N ASP A 77 3.863 7.209 -2.373 1.00 0.00 N ATOM 1248 CA ASP A 77 2.857 7.851 -1.537 1.00 0.00 C ATOM 1249 C ASP A 77 2.184 9.001 -2.278 1.00 0.00 C ATOM 1250 O ASP A 77 2.741 9.549 -3.229 1.00 0.00 O ATOM 1251 CB ASP A 77 3.491 8.363 -0.242 1.00 0.00 C ATOM 1252 CG ASP A 77 3.278 7.416 0.922 1.00 0.00 C ATOM 1253 OD1 ASP A 77 3.696 6.243 0.818 1.00 0.00 O ATOM 1254 OD2 ASP A 77 2.694 7.847 1.939 1.00 0.00 O ATOM 0 H ASP A 77 4.780 7.654 -2.346 1.00 0.00 H new ATOM 0 HA ASP A 77 2.097 7.109 -1.293 1.00 0.00 H new ATOM 0 HB2 ASP A 77 4.560 8.508 -0.397 1.00 0.00 H new ATOM 0 HB3 ASP A 77 3.069 9.337 0.005 1.00 0.00 H new ATOM 1259 N LYS A 78 0.983 9.363 -1.837 1.00 0.00 N ATOM 1260 CA LYS A 78 0.233 10.449 -2.458 1.00 0.00 C ATOM 1261 C LYS A 78 1.020 11.754 -2.399 1.00 0.00 C ATOM 1262 O LYS A 78 1.173 12.446 -3.407 1.00 0.00 O ATOM 1263 CB LYS A 78 -1.120 10.623 -1.767 1.00 0.00 C ATOM 1264 CG LYS A 78 -2.212 11.143 -2.688 1.00 0.00 C ATOM 1265 CD LYS A 78 -3.103 10.017 -3.191 1.00 0.00 C ATOM 1266 CE LYS A 78 -2.862 9.731 -4.664 1.00 0.00 C ATOM 1267 NZ LYS A 78 -3.771 10.520 -5.540 1.00 0.00 N ATOM 0 H LYS A 78 0.508 8.919 -1.051 1.00 0.00 H new ATOM 0 HA LYS A 78 0.067 10.192 -3.504 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -1.432 9.665 -1.352 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -1.005 11.311 -0.929 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -2.818 11.877 -2.157 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -1.759 11.656 -3.536 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -2.915 9.115 -2.609 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -4.149 10.283 -3.037 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -1.827 9.962 -4.914 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -3.006 8.668 -4.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -3.574 10.296 -6.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -4.759 10.281 -5.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -3.616 11.535 -5.377 1.00 0.00 H new ATOM 1281 N GLY A 79 1.518 12.085 -1.212 1.00 0.00 N ATOM 1282 CA GLY A 79 2.283 13.307 -1.044 1.00 0.00 C ATOM 1283 C GLY A 79 1.457 14.551 -1.302 1.00 0.00 C ATOM 1284 O GLY A 79 1.975 15.562 -1.776 1.00 0.00 O ATOM 0 H GLY A 79 1.406 11.529 -0.364 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.683 13.345 -0.031 1.00 0.00 H new ATOM 0 HA3 GLY A 79 3.136 13.294 -1.723 1.00 0.00 H new ATOM 1288 N GLN A 80 0.168 14.480 -0.986 1.00 0.00 N ATOM 1289 CA GLN A 80 -0.732 15.610 -1.187 1.00 0.00 C ATOM 1290 C GLN A 80 -1.002 16.346 0.126 1.00 0.00 C ATOM 1291 O GLN A 80 -1.868 17.218 0.189 1.00 0.00 O ATOM 1292 CB GLN A 80 -2.051 15.135 -1.799 1.00 0.00 C ATOM 1293 CG GLN A 80 -2.858 14.230 -0.881 1.00 0.00 C ATOM 1294 CD GLN A 80 -4.273 14.009 -1.377 1.00 0.00 C ATOM 1295 OE1 GLN A 80 -4.718 12.872 -1.533 1.00 0.00 O ATOM 1296 NE2 GLN A 80 -4.989 15.099 -1.629 1.00 0.00 N ATOM 0 H GLN A 80 -0.277 13.652 -0.590 1.00 0.00 H new ATOM 0 HA GLN A 80 -0.247 16.305 -1.873 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -2.654 16.004 -2.060 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -1.840 14.603 -2.727 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -2.354 13.268 -0.791 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -2.891 14.667 0.117 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -4.580 16.022 -1.486 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -5.948 15.013 -1.966 1.00 0.00 H new ATOM 1305 N ARG A 81 -0.257 15.992 1.173 1.00 0.00 N ATOM 1306 CA ARG A 81 -0.424 16.624 2.478 1.00 0.00 C ATOM 1307 C ARG A 81 -1.871 16.537 2.951 1.00 0.00 C ATOM 1308 O ARG A 81 -2.702 17.370 2.589 1.00 0.00 O ATOM 1309 CB ARG A 81 0.013 18.089 2.417 1.00 0.00 C ATOM 1310 CG ARG A 81 1.392 18.291 1.814 1.00 0.00 C ATOM 1311 CD ARG A 81 1.652 19.757 1.504 1.00 0.00 C ATOM 1312 NE ARG A 81 1.301 20.095 0.127 1.00 0.00 N ATOM 1313 CZ ARG A 81 0.998 21.326 -0.282 1.00 0.00 C ATOM 1314 NH1 ARG A 81 1.007 22.341 0.574 1.00 0.00 N ATOM 1315 NH2 ARG A 81 0.686 21.543 -1.553 1.00 0.00 N ATOM 0 H ARG A 81 0.466 15.273 1.142 1.00 0.00 H new ATOM 0 HA ARG A 81 0.204 16.090 3.191 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -0.715 18.652 1.833 1.00 0.00 H new ATOM 0 HB3 ARG A 81 0.003 18.504 3.425 1.00 0.00 H new ATOM 0 HG2 ARG A 81 2.151 17.923 2.505 1.00 0.00 H new ATOM 0 HG3 ARG A 81 1.481 17.703 0.901 1.00 0.00 H new ATOM 0 HD2 ARG A 81 1.076 20.380 2.188 1.00 0.00 H new ATOM 0 HD3 ARG A 81 2.704 19.983 1.676 1.00 0.00 H new ATOM 0 HE ARG A 81 1.287 19.344 -0.563 1.00 0.00 H new ATOM 0 HH11 ARG A 81 1.247 22.181 1.552 1.00 0.00 H new ATOM 0 HH12 ARG A 81 0.774 23.281 0.253 1.00 0.00 H new ATOM 0 HH21 ARG A 81 0.678 20.768 -2.216 1.00 0.00 H new ATOM 0 HH22 ARG A 81 0.454 22.485 -1.867 1.00 0.00 H new ATOM 1329 N THR A 82 -2.168 15.525 3.759 1.00 0.00 N ATOM 1330 CA THR A 82 -3.519 15.341 4.279 1.00 0.00 C ATOM 1331 C THR A 82 -3.930 16.529 5.141 1.00 0.00 C ATOM 1332 O THR A 82 -3.093 17.166 5.780 1.00 0.00 O ATOM 1333 CB THR A 82 -3.611 14.045 5.086 1.00 0.00 C ATOM 1334 OG1 THR A 82 -3.167 12.943 4.313 1.00 0.00 O ATOM 1335 CG2 THR A 82 -5.014 13.741 5.564 1.00 0.00 C ATOM 0 H THR A 82 -1.496 14.823 4.067 1.00 0.00 H new ATOM 0 HA THR A 82 -4.203 15.274 3.433 1.00 0.00 H new ATOM 0 HB THR A 82 -2.974 14.196 5.957 1.00 0.00 H new ATOM 0 HG1 THR A 82 -3.755 12.175 4.470 1.00 0.00 H new ATOM 0 HG21 THR A 82 -5.012 12.809 6.130 1.00 0.00 H new ATOM 0 HG22 THR A 82 -5.365 14.552 6.202 1.00 0.00 H new ATOM 0 HG23 THR A 82 -5.678 13.642 4.705 1.00 0.00 H new ATOM 1343 N ASP A 83 -5.226 16.827 5.146 1.00 0.00 N ATOM 1344 CA ASP A 83 -5.749 17.946 5.923 1.00 0.00 C ATOM 1345 C ASP A 83 -6.684 17.464 7.028 1.00 0.00 C ATOM 1346 O ASP A 83 -6.663 17.988 8.142 1.00 0.00 O ATOM 1347 CB ASP A 83 -6.488 18.925 5.008 1.00 0.00 C ATOM 1348 CG ASP A 83 -5.578 19.533 3.959 1.00 0.00 C ATOM 1349 OD1 ASP A 83 -4.350 19.559 4.180 1.00 0.00 O ATOM 1350 OD2 ASP A 83 -6.095 19.983 2.915 1.00 0.00 O ATOM 0 H ASP A 83 -5.932 16.310 4.622 1.00 0.00 H new ATOM 0 HA ASP A 83 -4.904 18.454 6.388 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -7.311 18.407 4.515 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -6.927 19.721 5.610 1.00 0.00 H new ATOM 1355 N LYS A 84 -7.509 16.471 6.708 1.00 0.00 N ATOM 1356 CA LYS A 84 -8.462 15.919 7.670 1.00 0.00 C ATOM 1357 C LYS A 84 -7.803 15.680 9.027 1.00 0.00 C ATOM 1358 O LYS A 84 -8.183 16.287 10.028 1.00 0.00 O ATOM 1359 CB LYS A 84 -9.054 14.612 7.138 1.00 0.00 C ATOM 1360 CG LYS A 84 -10.474 14.758 6.614 1.00 0.00 C ATOM 1361 CD LYS A 84 -11.472 14.918 7.748 1.00 0.00 C ATOM 1362 CE LYS A 84 -11.813 16.379 7.990 1.00 0.00 C ATOM 1363 NZ LYS A 84 -13.146 16.540 8.631 1.00 0.00 N ATOM 0 H LYS A 84 -7.538 16.030 5.788 1.00 0.00 H new ATOM 0 HA LYS A 84 -9.262 16.647 7.805 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -8.417 14.233 6.339 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -9.044 13.867 7.934 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -10.532 15.622 5.952 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -10.735 13.883 6.019 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -12.382 14.365 7.514 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -11.061 14.484 8.659 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -11.049 16.830 8.623 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -11.799 16.917 7.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -13.340 17.551 8.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -13.879 16.133 8.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -13.152 16.049 9.548 1.00 0.00 H new ATOM 1377 N TYR A 85 -6.818 14.790 9.051 1.00 0.00 N ATOM 1378 CA TYR A 85 -6.110 14.469 10.286 1.00 0.00 C ATOM 1379 C TYR A 85 -4.599 14.607 10.107 1.00 0.00 C ATOM 1380 O TYR A 85 -3.890 15.006 11.031 1.00 0.00 O ATOM 1381 CB TYR A 85 -6.459 13.051 10.743 1.00 0.00 C ATOM 1382 CG TYR A 85 -6.896 12.969 12.189 1.00 0.00 C ATOM 1383 CD1 TYR A 85 -5.986 13.161 13.222 1.00 0.00 C ATOM 1384 CD2 TYR A 85 -8.217 12.697 12.521 1.00 0.00 C ATOM 1385 CE1 TYR A 85 -6.381 13.086 14.544 1.00 0.00 C ATOM 1386 CE2 TYR A 85 -8.620 12.621 13.841 1.00 0.00 C ATOM 1387 CZ TYR A 85 -7.699 12.817 14.847 1.00 0.00 C ATOM 1388 OH TYR A 85 -8.097 12.740 16.163 1.00 0.00 O ATOM 0 H TYR A 85 -6.491 14.278 8.231 1.00 0.00 H new ATOM 0 HA TYR A 85 -6.427 15.178 11.051 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -7.255 12.660 10.109 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -5.591 12.408 10.598 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -4.953 13.372 12.987 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -8.941 12.542 11.735 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -5.662 13.237 15.335 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -9.651 12.409 14.083 1.00 0.00 H new ATOM 0 HH TYR A 85 -9.056 12.545 16.204 1.00 0.00 H new ATOM 1398 N GLY A 86 -4.112 14.267 8.918 1.00 0.00 N ATOM 1399 CA GLY A 86 -2.690 14.352 8.648 1.00 0.00 C ATOM 1400 C GLY A 86 -2.057 12.982 8.525 1.00 0.00 C ATOM 1401 O GLY A 86 -1.040 12.699 9.158 1.00 0.00 O ATOM 0 H GLY A 86 -4.677 13.934 8.137 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -2.528 14.911 7.726 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -2.201 14.908 9.448 1.00 0.00 H new ATOM 1405 N ARG A 87 -2.669 12.128 7.711 1.00 0.00 N ATOM 1406 CA ARG A 87 -2.165 10.775 7.512 1.00 0.00 C ATOM 1407 C ARG A 87 -2.093 10.431 6.029 1.00 0.00 C ATOM 1408 O ARG A 87 -3.107 10.117 5.405 1.00 0.00 O ATOM 1409 CB ARG A 87 -3.058 9.759 8.231 1.00 0.00 C ATOM 1410 CG ARG A 87 -3.497 10.201 9.620 1.00 0.00 C ATOM 1411 CD ARG A 87 -4.868 9.647 9.975 1.00 0.00 C ATOM 1412 NE ARG A 87 -5.913 10.152 9.083 1.00 0.00 N ATOM 1413 CZ ARG A 87 -6.372 9.493 8.020 1.00 0.00 C ATOM 1414 NH1 ARG A 87 -5.881 8.302 7.700 1.00 0.00 N ATOM 1415 NH2 ARG A 87 -7.326 10.029 7.272 1.00 0.00 N ATOM 0 H ARG A 87 -3.512 12.348 7.180 1.00 0.00 H new ATOM 0 HA ARG A 87 -1.160 10.730 7.931 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -3.943 9.573 7.623 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -2.523 8.813 8.313 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.767 9.867 10.357 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -3.521 11.290 9.666 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -4.843 8.558 9.924 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -5.111 9.912 11.004 1.00 0.00 H new ATOM 0 HE ARG A 87 -6.315 11.067 9.288 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -5.146 7.884 8.270 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -6.239 7.805 6.884 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -7.707 10.944 7.511 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -7.679 9.526 6.458 1.00 0.00 H new ATOM 1429 N GLY A 88 -0.889 10.490 5.469 1.00 0.00 N ATOM 1430 CA GLY A 88 -0.707 10.179 4.061 1.00 0.00 C ATOM 1431 C GLY A 88 -1.376 8.875 3.665 1.00 0.00 C ATOM 1432 O GLY A 88 -1.854 8.133 4.522 1.00 0.00 O ATOM 0 H GLY A 88 -0.035 10.748 5.964 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -1.113 10.990 3.457 1.00 0.00 H new ATOM 0 HA3 GLY A 88 0.359 10.119 3.840 1.00 0.00 H new ATOM 1436 N LEU A 89 -1.413 8.598 2.367 1.00 0.00 N ATOM 1437 CA LEU A 89 -2.034 7.376 1.868 1.00 0.00 C ATOM 1438 C LEU A 89 -0.991 6.420 1.300 1.00 0.00 C ATOM 1439 O LEU A 89 -0.372 6.699 0.273 1.00 0.00 O ATOM 1440 CB LEU A 89 -3.074 7.710 0.798 1.00 0.00 C ATOM 1441 CG LEU A 89 -4.171 8.682 1.241 1.00 0.00 C ATOM 1442 CD1 LEU A 89 -3.875 10.087 0.738 1.00 0.00 C ATOM 1443 CD2 LEU A 89 -5.532 8.214 0.748 1.00 0.00 C ATOM 0 H LEU A 89 -1.022 9.200 1.643 1.00 0.00 H new ATOM 0 HA LEU A 89 -2.527 6.884 2.706 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -2.561 8.134 -0.065 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -3.543 6.783 0.467 1.00 0.00 H new ATOM 0 HG LEU A 89 -4.190 8.704 2.331 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -4.665 10.764 1.063 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -2.920 10.424 1.141 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -3.827 10.081 -0.351 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -6.298 8.918 1.073 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.526 8.161 -0.341 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -5.748 7.227 1.158 1.00 0.00 H new ATOM 1455 N ALA A 90 -0.808 5.289 1.972 1.00 0.00 N ATOM 1456 CA ALA A 90 0.156 4.285 1.532 1.00 0.00 C ATOM 1457 C ALA A 90 -0.495 2.908 1.451 1.00 0.00 C ATOM 1458 O ALA A 90 -1.156 2.467 2.392 1.00 0.00 O ATOM 1459 CB ALA A 90 1.356 4.255 2.465 1.00 0.00 C ATOM 0 H ALA A 90 -1.314 5.044 2.823 1.00 0.00 H new ATOM 0 HA ALA A 90 0.501 4.557 0.534 1.00 0.00 H new ATOM 0 HB1 ALA A 90 2.065 3.501 2.122 1.00 0.00 H new ATOM 0 HB2 ALA A 90 1.839 5.232 2.468 1.00 0.00 H new ATOM 0 HB3 ALA A 90 1.026 4.010 3.475 1.00 0.00 H new ATOM 1465 N TYR A 91 -0.308 2.237 0.319 1.00 0.00 N ATOM 1466 CA TYR A 91 -0.883 0.911 0.115 1.00 0.00 C ATOM 1467 C TYR A 91 0.149 -0.180 0.377 1.00 0.00 C ATOM 1468 O TYR A 91 1.347 0.019 0.170 1.00 0.00 O ATOM 1469 CB TYR A 91 -1.436 0.771 -1.310 1.00 0.00 C ATOM 1470 CG TYR A 91 -1.544 2.078 -2.066 1.00 0.00 C ATOM 1471 CD1 TYR A 91 -2.336 3.115 -1.587 1.00 0.00 C ATOM 1472 CD2 TYR A 91 -0.857 2.273 -3.257 1.00 0.00 C ATOM 1473 CE1 TYR A 91 -2.437 4.310 -2.275 1.00 0.00 C ATOM 1474 CE2 TYR A 91 -0.954 3.465 -3.951 1.00 0.00 C ATOM 1475 CZ TYR A 91 -1.745 4.480 -3.455 1.00 0.00 C ATOM 1476 OH TYR A 91 -1.845 5.668 -4.143 1.00 0.00 O ATOM 0 H TYR A 91 0.236 2.588 -0.469 1.00 0.00 H new ATOM 0 HA TYR A 91 -1.701 0.794 0.825 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -0.794 0.092 -1.871 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -2.423 0.310 -1.261 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -2.881 2.985 -0.663 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -0.236 1.480 -3.648 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -3.056 5.107 -1.889 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -0.413 3.600 -4.876 1.00 0.00 H new ATOM 0 HH TYR A 91 -1.295 5.624 -4.953 1.00 0.00 H new ATOM 1486 N ILE A 92 -0.323 -1.338 0.832 1.00 0.00 N ATOM 1487 CA ILE A 92 0.556 -2.464 1.118 1.00 0.00 C ATOM 1488 C ILE A 92 0.930 -3.205 -0.160 1.00 0.00 C ATOM 1489 O ILE A 92 0.251 -3.085 -1.180 1.00 0.00 O ATOM 1490 CB ILE A 92 -0.094 -3.456 2.104 1.00 0.00 C ATOM 1491 CG1 ILE A 92 -1.405 -4.004 1.532 1.00 0.00 C ATOM 1492 CG2 ILE A 92 -0.337 -2.785 3.448 1.00 0.00 C ATOM 1493 CD1 ILE A 92 -1.210 -5.157 0.571 1.00 0.00 C ATOM 0 H ILE A 92 -1.311 -1.519 1.010 1.00 0.00 H new ATOM 0 HA ILE A 92 1.456 -2.052 1.575 1.00 0.00 H new ATOM 0 HB ILE A 92 0.590 -4.292 2.253 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -2.042 -4.330 2.354 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -1.933 -3.200 1.019 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -0.796 -3.498 4.133 1.00 0.00 H new ATOM 0 HG22 ILE A 92 0.612 -2.444 3.861 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -1.001 -1.931 3.314 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -2.180 -5.494 0.206 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.599 -4.830 -0.270 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -0.710 -5.978 1.085 1.00 0.00 H new ATOM 1505 N TYR A 93 2.016 -3.969 -0.101 1.00 0.00 N ATOM 1506 CA TYR A 93 2.479 -4.727 -1.259 1.00 0.00 C ATOM 1507 C TYR A 93 2.990 -6.101 -0.842 1.00 0.00 C ATOM 1508 O TYR A 93 3.181 -6.372 0.342 1.00 0.00 O ATOM 1509 CB TYR A 93 3.583 -3.958 -1.989 1.00 0.00 C ATOM 1510 CG TYR A 93 3.070 -3.094 -3.120 1.00 0.00 C ATOM 1511 CD1 TYR A 93 2.592 -3.665 -4.293 1.00 0.00 C ATOM 1512 CD2 TYR A 93 3.064 -1.709 -3.014 1.00 0.00 C ATOM 1513 CE1 TYR A 93 2.123 -2.879 -5.329 1.00 0.00 C ATOM 1514 CE2 TYR A 93 2.596 -0.917 -4.044 1.00 0.00 C ATOM 1515 CZ TYR A 93 2.127 -1.506 -5.199 1.00 0.00 C ATOM 1516 OH TYR A 93 1.660 -0.721 -6.228 1.00 0.00 O ATOM 0 H TYR A 93 2.591 -4.080 0.734 1.00 0.00 H new ATOM 0 HA TYR A 93 1.634 -4.864 -1.934 1.00 0.00 H new ATOM 0 HB2 TYR A 93 4.111 -3.329 -1.273 1.00 0.00 H new ATOM 0 HB3 TYR A 93 4.309 -4.668 -2.385 1.00 0.00 H new ATOM 0 HD1 TYR A 93 2.587 -4.740 -4.397 1.00 0.00 H new ATOM 0 HD2 TYR A 93 3.431 -1.244 -2.111 1.00 0.00 H new ATOM 0 HE1 TYR A 93 1.756 -3.338 -6.235 1.00 0.00 H new ATOM 0 HE2 TYR A 93 2.597 0.158 -3.945 1.00 0.00 H new ATOM 0 HH TYR A 93 1.730 0.224 -5.977 1.00 0.00 H new ATOM 1526 N ALA A 94 3.210 -6.968 -1.826 1.00 0.00 N ATOM 1527 CA ALA A 94 3.701 -8.315 -1.560 1.00 0.00 C ATOM 1528 C ALA A 94 5.213 -8.390 -1.737 1.00 0.00 C ATOM 1529 O ALA A 94 5.723 -8.256 -2.849 1.00 0.00 O ATOM 1530 CB ALA A 94 3.010 -9.318 -2.472 1.00 0.00 C ATOM 0 H ALA A 94 3.056 -6.762 -2.813 1.00 0.00 H new ATOM 0 HA ALA A 94 3.469 -8.563 -0.524 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.386 -10.319 -2.263 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.935 -9.290 -2.295 1.00 0.00 H new ATOM 0 HB3 ALA A 94 3.213 -9.064 -3.512 1.00 0.00 H new ATOM 1536 N ASP A 95 5.924 -8.603 -0.631 1.00 0.00 N ATOM 1537 CA ASP A 95 7.383 -8.700 -0.653 1.00 0.00 C ATOM 1538 C ASP A 95 8.003 -7.593 -1.505 1.00 0.00 C ATOM 1539 O ASP A 95 8.941 -7.833 -2.265 1.00 0.00 O ATOM 1540 CB ASP A 95 7.820 -10.073 -1.171 1.00 0.00 C ATOM 1541 CG ASP A 95 7.492 -10.279 -2.637 1.00 0.00 C ATOM 1542 OD1 ASP A 95 8.321 -9.902 -3.490 1.00 0.00 O ATOM 1543 OD2 ASP A 95 6.403 -10.817 -2.931 1.00 0.00 O ATOM 0 H ASP A 95 5.511 -8.712 0.295 1.00 0.00 H new ATOM 0 HA ASP A 95 7.739 -8.577 0.370 1.00 0.00 H new ATOM 0 HB2 ASP A 95 8.894 -10.187 -1.024 1.00 0.00 H new ATOM 0 HB3 ASP A 95 7.334 -10.850 -0.582 1.00 0.00 H new ATOM 1548 N GLY A 96 7.473 -6.381 -1.371 1.00 0.00 N ATOM 1549 CA GLY A 96 7.989 -5.259 -2.134 1.00 0.00 C ATOM 1550 C GLY A 96 7.081 -4.867 -3.284 1.00 0.00 C ATOM 1551 O GLY A 96 6.596 -3.738 -3.343 1.00 0.00 O ATOM 0 H GLY A 96 6.697 -6.156 -0.749 1.00 0.00 H new ATOM 0 HA2 GLY A 96 8.119 -4.403 -1.471 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.974 -5.513 -2.525 1.00 0.00 H new ATOM 1555 N LYS A 97 6.852 -5.802 -4.202 1.00 0.00 N ATOM 1556 CA LYS A 97 5.998 -5.548 -5.357 1.00 0.00 C ATOM 1557 C LYS A 97 4.927 -6.625 -5.491 1.00 0.00 C ATOM 1558 O LYS A 97 5.178 -7.801 -5.229 1.00 0.00 O ATOM 1559 CB LYS A 97 6.841 -5.485 -6.633 1.00 0.00 C ATOM 1560 CG LYS A 97 7.242 -4.072 -7.028 1.00 0.00 C ATOM 1561 CD LYS A 97 6.454 -3.582 -8.233 1.00 0.00 C ATOM 1562 CE LYS A 97 7.289 -3.635 -9.503 1.00 0.00 C ATOM 1563 NZ LYS A 97 6.685 -2.827 -10.599 1.00 0.00 N ATOM 0 H LYS A 97 7.246 -6.742 -4.168 1.00 0.00 H new ATOM 0 HA LYS A 97 5.502 -4.589 -5.209 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.741 -6.084 -6.494 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.281 -5.937 -7.451 1.00 0.00 H new ATOM 0 HG2 LYS A 97 7.078 -3.398 -6.187 1.00 0.00 H new ATOM 0 HG3 LYS A 97 8.308 -4.046 -7.254 1.00 0.00 H new ATOM 0 HD2 LYS A 97 5.560 -4.193 -8.358 1.00 0.00 H new ATOM 0 HD3 LYS A 97 6.119 -2.560 -8.059 1.00 0.00 H new ATOM 0 HE2 LYS A 97 8.294 -3.268 -9.293 1.00 0.00 H new ATOM 0 HE3 LYS A 97 7.390 -4.670 -9.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 7.284 -2.889 -11.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 5.736 -3.193 -10.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 6.612 -1.834 -10.299 1.00 0.00 H new ATOM 1577 N MET A 98 3.730 -6.215 -5.900 1.00 0.00 N ATOM 1578 CA MET A 98 2.621 -7.146 -6.068 1.00 0.00 C ATOM 1579 C MET A 98 2.959 -8.220 -7.098 1.00 0.00 C ATOM 1580 O MET A 98 3.581 -7.937 -8.122 1.00 0.00 O ATOM 1581 CB MET A 98 1.356 -6.393 -6.489 1.00 0.00 C ATOM 1582 CG MET A 98 0.331 -6.260 -5.375 1.00 0.00 C ATOM 1583 SD MET A 98 -0.652 -7.754 -5.154 1.00 0.00 S ATOM 1584 CE MET A 98 -0.365 -8.095 -3.419 1.00 0.00 C ATOM 0 H MET A 98 3.504 -5.245 -6.121 1.00 0.00 H new ATOM 0 HA MET A 98 2.442 -7.635 -5.111 1.00 0.00 H new ATOM 0 HB2 MET A 98 1.634 -5.398 -6.837 1.00 0.00 H new ATOM 0 HB3 MET A 98 0.899 -6.910 -7.333 1.00 0.00 H new ATOM 0 HG2 MET A 98 0.843 -6.025 -4.442 1.00 0.00 H new ATOM 0 HG3 MET A 98 -0.332 -5.423 -5.594 1.00 0.00 H new ATOM 0 HE1 MET A 98 -0.297 -9.172 -3.266 1.00 0.00 H new ATOM 0 HE2 MET A 98 0.567 -7.624 -3.105 1.00 0.00 H new ATOM 0 HE3 MET A 98 -1.190 -7.696 -2.829 1.00 0.00 H new ATOM 1594 N VAL A 99 2.547 -9.450 -6.816 1.00 0.00 N ATOM 1595 CA VAL A 99 2.803 -10.569 -7.716 1.00 0.00 C ATOM 1596 C VAL A 99 1.800 -10.586 -8.864 1.00 0.00 C ATOM 1597 O VAL A 99 0.755 -9.941 -8.796 1.00 0.00 O ATOM 1598 CB VAL A 99 2.738 -11.918 -6.970 1.00 0.00 C ATOM 1599 CG1 VAL A 99 3.345 -13.028 -7.816 1.00 0.00 C ATOM 1600 CG2 VAL A 99 3.442 -11.822 -5.624 1.00 0.00 C ATOM 0 H VAL A 99 2.034 -9.699 -5.970 1.00 0.00 H new ATOM 0 HA VAL A 99 3.808 -10.433 -8.115 1.00 0.00 H new ATOM 0 HB VAL A 99 1.690 -12.159 -6.790 1.00 0.00 H new ATOM 0 HG11 VAL A 99 3.290 -13.971 -7.273 1.00 0.00 H new ATOM 0 HG12 VAL A 99 2.793 -13.115 -8.752 1.00 0.00 H new ATOM 0 HG13 VAL A 99 4.388 -12.793 -8.030 1.00 0.00 H new ATOM 0 HG21 VAL A 99 3.385 -12.784 -5.114 1.00 0.00 H new ATOM 0 HG22 VAL A 99 4.487 -11.555 -5.778 1.00 0.00 H new ATOM 0 HG23 VAL A 99 2.959 -11.059 -5.014 1.00 0.00 H new ATOM 1610 N ASN A 100 2.126 -11.326 -9.922 1.00 0.00 N ATOM 1611 CA ASN A 100 1.252 -11.426 -11.089 1.00 0.00 C ATOM 1612 C ASN A 100 -0.192 -11.698 -10.675 1.00 0.00 C ATOM 1613 O ASN A 100 -0.461 -12.084 -9.538 1.00 0.00 O ATOM 1614 CB ASN A 100 1.743 -12.535 -12.022 1.00 0.00 C ATOM 1615 CG ASN A 100 1.756 -13.894 -11.351 1.00 0.00 C ATOM 1616 OD1 ASN A 100 0.844 -14.238 -10.600 1.00 0.00 O ATOM 1617 ND2 ASN A 100 2.794 -14.676 -11.620 1.00 0.00 N ATOM 0 H ASN A 100 2.989 -11.865 -9.995 1.00 0.00 H new ATOM 0 HA ASN A 100 1.283 -10.472 -11.615 1.00 0.00 H new ATOM 0 HB2 ASN A 100 1.102 -12.574 -12.903 1.00 0.00 H new ATOM 0 HB3 ASN A 100 2.748 -12.295 -12.369 1.00 0.00 H new ATOM 0 HD21 ASN A 100 2.857 -15.602 -11.198 1.00 0.00 H new ATOM 0 HD22 ASN A 100 3.528 -14.351 -12.249 1.00 0.00 H new ATOM 1624 N GLU A 101 -1.117 -11.487 -11.606 1.00 0.00 N ATOM 1625 CA GLU A 101 -2.536 -11.704 -11.339 1.00 0.00 C ATOM 1626 C GLU A 101 -2.795 -13.140 -10.892 1.00 0.00 C ATOM 1627 O GLU A 101 -2.252 -14.086 -11.462 1.00 0.00 O ATOM 1628 CB GLU A 101 -3.364 -11.387 -12.584 1.00 0.00 C ATOM 1629 CG GLU A 101 -3.001 -12.241 -13.789 1.00 0.00 C ATOM 1630 CD GLU A 101 -4.033 -12.153 -14.897 1.00 0.00 C ATOM 1631 OE1 GLU A 101 -5.214 -11.892 -14.589 1.00 0.00 O ATOM 1632 OE2 GLU A 101 -3.658 -12.343 -16.073 1.00 0.00 O ATOM 0 H GLU A 101 -0.910 -11.166 -12.552 1.00 0.00 H new ATOM 0 HA GLU A 101 -2.834 -11.034 -10.532 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -4.420 -11.528 -12.354 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.231 -10.336 -12.841 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.031 -11.926 -14.174 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.897 -13.280 -13.476 1.00 0.00 H new ATOM 1639 N ALA A 102 -3.632 -13.294 -9.872 1.00 0.00 N ATOM 1640 CA ALA A 102 -3.968 -14.613 -9.349 1.00 0.00 C ATOM 1641 C ALA A 102 -2.734 -15.322 -8.803 1.00 0.00 C ATOM 1642 O ALA A 102 -1.803 -15.630 -9.548 1.00 0.00 O ATOM 1643 CB ALA A 102 -4.630 -15.455 -10.430 1.00 0.00 C ATOM 0 H ALA A 102 -4.091 -12.521 -9.390 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.669 -14.481 -8.525 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.876 -16.437 -10.027 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -5.542 -14.963 -10.767 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -3.947 -15.569 -11.272 1.00 0.00 H new ATOM 1649 N LEU A 103 -2.732 -15.577 -7.499 1.00 0.00 N ATOM 1650 CA LEU A 103 -1.611 -16.253 -6.852 1.00 0.00 C ATOM 1651 C LEU A 103 -2.103 -17.377 -5.946 1.00 0.00 C ATOM 1652 O LEU A 103 -1.861 -18.553 -6.213 1.00 0.00 O ATOM 1653 CB LEU A 103 -0.784 -15.253 -6.041 1.00 0.00 C ATOM 1654 CG LEU A 103 0.707 -15.581 -5.934 1.00 0.00 C ATOM 1655 CD1 LEU A 103 1.426 -14.533 -5.099 1.00 0.00 C ATOM 1656 CD2 LEU A 103 0.906 -16.967 -5.339 1.00 0.00 C ATOM 0 H LEU A 103 -3.494 -15.326 -6.869 1.00 0.00 H new ATOM 0 HA LEU A 103 -0.983 -16.687 -7.630 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.892 -14.266 -6.491 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.200 -15.192 -5.035 1.00 0.00 H new ATOM 0 HG LEU A 103 1.134 -15.572 -6.937 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.485 -14.783 -5.034 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.312 -13.555 -5.566 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.997 -14.509 -4.097 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.972 -17.184 -5.270 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.463 -17.003 -4.344 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.425 -17.709 -5.976 1.00 0.00 H new ATOM 1668 N VAL A 104 -2.797 -17.005 -4.875 1.00 0.00 N ATOM 1669 CA VAL A 104 -3.325 -17.982 -3.929 1.00 0.00 C ATOM 1670 C VAL A 104 -4.673 -17.534 -3.375 1.00 0.00 C ATOM 1671 O VAL A 104 -5.023 -17.848 -2.237 1.00 0.00 O ATOM 1672 CB VAL A 104 -2.354 -18.216 -2.757 1.00 0.00 C ATOM 1673 CG1 VAL A 104 -1.130 -18.990 -3.221 1.00 0.00 C ATOM 1674 CG2 VAL A 104 -1.948 -16.892 -2.124 1.00 0.00 C ATOM 0 H VAL A 104 -3.007 -16.035 -4.641 1.00 0.00 H new ATOM 0 HA VAL A 104 -3.450 -18.916 -4.477 1.00 0.00 H new ATOM 0 HB VAL A 104 -2.866 -18.811 -2.001 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -0.456 -19.145 -2.378 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -1.440 -19.956 -3.620 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -0.615 -18.425 -3.998 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -1.262 -17.079 -1.298 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -1.456 -16.268 -2.870 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -2.835 -16.380 -1.750 1.00 0.00 H new ATOM 1684 N ARG A 105 -5.427 -16.802 -4.188 1.00 0.00 N ATOM 1685 CA ARG A 105 -6.739 -16.312 -3.782 1.00 0.00 C ATOM 1686 C ARG A 105 -7.834 -17.293 -4.187 1.00 0.00 C ATOM 1687 O ARG A 105 -7.551 -18.395 -4.657 1.00 0.00 O ATOM 1688 CB ARG A 105 -7.007 -14.938 -4.402 1.00 0.00 C ATOM 1689 CG ARG A 105 -6.751 -13.782 -3.450 1.00 0.00 C ATOM 1690 CD ARG A 105 -5.346 -13.226 -3.613 1.00 0.00 C ATOM 1691 NE ARG A 105 -5.323 -11.765 -3.554 1.00 0.00 N ATOM 1692 CZ ARG A 105 -5.640 -11.061 -2.469 1.00 0.00 C ATOM 1693 NH1 ARG A 105 -6.012 -11.677 -1.354 1.00 0.00 N ATOM 1694 NH2 ARG A 105 -5.585 -9.737 -2.501 1.00 0.00 N ATOM 0 H ARG A 105 -5.152 -16.535 -5.133 1.00 0.00 H new ATOM 0 HA ARG A 105 -6.747 -16.218 -2.696 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -6.378 -14.818 -5.284 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -8.042 -14.897 -4.740 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -7.479 -12.992 -3.632 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -6.894 -14.117 -2.423 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -4.703 -13.630 -2.831 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -4.934 -13.557 -4.566 1.00 0.00 H new ATOM 0 HE ARG A 105 -5.048 -11.255 -4.393 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -6.056 -12.696 -1.325 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -6.253 -11.132 -0.526 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -5.300 -9.259 -3.356 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -5.828 -9.196 -1.671 1.00 0.00 H new ATOM 1708 N GLN A 106 -9.086 -16.886 -4.002 1.00 0.00 N ATOM 1709 CA GLN A 106 -10.222 -17.734 -4.348 1.00 0.00 C ATOM 1710 C GLN A 106 -10.966 -17.186 -5.562 1.00 0.00 C ATOM 1711 O GLN A 106 -12.172 -17.389 -5.705 1.00 0.00 O ATOM 1712 CB GLN A 106 -11.179 -17.849 -3.160 1.00 0.00 C ATOM 1713 CG GLN A 106 -11.811 -16.527 -2.758 1.00 0.00 C ATOM 1714 CD GLN A 106 -11.222 -15.963 -1.480 1.00 0.00 C ATOM 1715 OE1 GLN A 106 -10.027 -15.678 -1.406 1.00 0.00 O ATOM 1716 NE2 GLN A 106 -12.060 -15.799 -0.464 1.00 0.00 N ATOM 0 H GLN A 106 -9.339 -15.977 -3.615 1.00 0.00 H new ATOM 0 HA GLN A 106 -9.839 -18.724 -4.597 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -11.968 -18.559 -3.407 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -10.638 -18.258 -2.307 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -11.678 -15.805 -3.564 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -12.884 -16.666 -2.628 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -13.043 -16.048 -0.569 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -11.721 -15.423 0.422 1.00 0.00 H new ATOM 1725 N GLY A 107 -10.243 -16.493 -6.437 1.00 0.00 N ATOM 1726 CA GLY A 107 -10.858 -15.933 -7.626 1.00 0.00 C ATOM 1727 C GLY A 107 -10.405 -14.513 -7.907 1.00 0.00 C ATOM 1728 O GLY A 107 -11.212 -13.584 -7.891 1.00 0.00 O ATOM 0 H GLY A 107 -9.244 -16.310 -6.344 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -10.620 -16.562 -8.484 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -11.942 -15.948 -7.511 1.00 0.00 H new ATOM 1732 N LEU A 108 -9.113 -14.346 -8.169 1.00 0.00 N ATOM 1733 CA LEU A 108 -8.554 -13.030 -8.460 1.00 0.00 C ATOM 1734 C LEU A 108 -8.881 -12.035 -7.351 1.00 0.00 C ATOM 1735 O LEU A 108 -9.876 -11.315 -7.422 1.00 0.00 O ATOM 1736 CB LEU A 108 -9.086 -12.514 -9.799 1.00 0.00 C ATOM 1737 CG LEU A 108 -8.536 -13.231 -11.033 1.00 0.00 C ATOM 1738 CD1 LEU A 108 -7.032 -13.026 -11.140 1.00 0.00 C ATOM 1739 CD2 LEU A 108 -8.872 -14.714 -10.979 1.00 0.00 C ATOM 0 H LEU A 108 -8.433 -15.106 -8.186 1.00 0.00 H new ATOM 0 HA LEU A 108 -7.470 -13.130 -8.519 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -10.172 -12.603 -9.800 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -8.853 -11.452 -9.880 1.00 0.00 H new ATOM 0 HG LEU A 108 -9.005 -12.805 -11.920 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -6.656 -13.543 -12.023 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -6.815 -11.961 -11.223 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -6.546 -13.427 -10.251 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -8.474 -15.210 -11.864 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -8.429 -15.155 -10.086 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -9.954 -14.841 -10.948 1.00 0.00 H new ATOM 1751 N ALA A 109 -8.034 -12.000 -6.326 1.00 0.00 N ATOM 1752 CA ALA A 109 -8.229 -11.095 -5.200 1.00 0.00 C ATOM 1753 C ALA A 109 -9.519 -11.416 -4.452 1.00 0.00 C ATOM 1754 O ALA A 109 -9.498 -12.080 -3.416 1.00 0.00 O ATOM 1755 CB ALA A 109 -8.233 -9.650 -5.679 1.00 0.00 C ATOM 0 H ALA A 109 -7.205 -12.590 -6.253 1.00 0.00 H new ATOM 0 HA ALA A 109 -7.399 -11.232 -4.507 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -8.380 -8.985 -4.828 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -7.280 -9.423 -6.157 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -9.042 -9.506 -6.395 1.00 0.00 H new ATOM 1761 N LYS A 110 -10.643 -10.941 -4.982 1.00 0.00 N ATOM 1762 CA LYS A 110 -11.942 -11.177 -4.361 1.00 0.00 C ATOM 1763 C LYS A 110 -11.973 -10.622 -2.941 1.00 0.00 C ATOM 1764 O LYS A 110 -13.016 -10.778 -2.269 1.00 0.00 O ATOM 1765 CB LYS A 110 -12.256 -12.675 -4.343 1.00 0.00 C ATOM 1766 CG LYS A 110 -13.720 -12.992 -4.600 1.00 0.00 C ATOM 1767 CD LYS A 110 -14.024 -13.062 -6.087 1.00 0.00 C ATOM 1768 CE LYS A 110 -13.969 -14.491 -6.602 1.00 0.00 C ATOM 1769 NZ LYS A 110 -15.238 -15.224 -6.341 1.00 0.00 N ATOM 1770 OXT LYS A 110 -10.957 -10.037 -2.511 1.00 0.00 O ATOM 0 H LYS A 110 -10.680 -10.391 -5.840 1.00 0.00 H new ATOM 0 HA LYS A 110 -12.700 -10.661 -4.951 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -11.647 -13.175 -5.096 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -11.968 -13.087 -3.376 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -13.975 -13.942 -4.131 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -14.345 -12.229 -4.136 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -15.012 -12.644 -6.277 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -13.308 -12.449 -6.635 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -13.768 -14.483 -7.673 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -13.141 -15.017 -6.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -15.160 -16.194 -6.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -15.417 -15.254 -5.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -16.024 -14.737 -6.816 1.00 0.00 H new TER 1784 LYS A 110