USER MOD reduce.3.24.130724 H: found=0, std=0, add=525, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 523 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 4 HIS : no HD1:sc= -12.8! C(o=-15!,f=-26!) USER MOD Set 1.2: A 47 SER OG : rot -61:sc= -2.11! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -114:sc= 0.929 (180deg=-1.37!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 10 MET CE :methyl -175:sc= -0.292 (180deg=-0.316) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 CYS SG : rot 180:sc= 0 USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 110:sc= -0.738 USER MOD Single : A 24 ASN : amide:sc= -1.1 K(o=-1.1,f=-1.7) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.132) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc=-0.00233 X(o=-0.0023,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0128) USER MOD Single : A 41 CYS SG : rot 180:sc= -1.58! USER MOD Single : A 44 SER OG : rot 180:sc= -0.326 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= -2.55 USER MOD Single : A 54 THR OG1 : rot -113:sc= -1.52 USER MOD Single : A 56 LYS NZ :NH3+ -141:sc= -1.5 (180deg=-3.01!) USER MOD Single : A 57 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.179) USER MOD Single : A 58 THR OG1 : rot 140:sc= -2.17! USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.0441 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.596 -19.965 -23.225 1.00 0.00 N ATOM 2 CA MET A 1 -16.212 -18.742 -22.466 1.00 0.00 C ATOM 3 C MET A 1 -16.476 -17.509 -23.324 1.00 0.00 C ATOM 4 O MET A 1 -15.553 -16.924 -23.892 1.00 0.00 O ATOM 5 CB MET A 1 -14.728 -18.819 -22.098 1.00 0.00 C ATOM 6 CG MET A 1 -14.495 -20.007 -21.164 1.00 0.00 C ATOM 7 SD MET A 1 -14.218 -21.503 -22.145 1.00 0.00 S ATOM 8 CE MET A 1 -15.078 -22.655 -21.048 1.00 0.00 C ATOM 0 H1 MET A 1 -17.406 -20.422 -22.760 1.00 0.00 H new ATOM 0 H2 MET A 1 -16.858 -19.703 -24.197 1.00 0.00 H new ATOM 0 H3 MET A 1 -15.793 -20.625 -23.249 1.00 0.00 H new ATOM 0 HA MET A 1 -16.803 -18.673 -21.553 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.124 -18.927 -22.999 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.414 -17.895 -21.613 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.635 -19.816 -20.523 1.00 0.00 H new ATOM 0 HG3 MET A 1 -15.356 -20.143 -20.510 1.00 0.00 H new ATOM 0 HE1 MET A 1 -15.031 -23.660 -21.467 1.00 0.00 H new ATOM 0 HE2 MET A 1 -14.602 -22.648 -20.068 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.120 -22.352 -20.947 1.00 0.00 H new ATOM 20 N PRO A 2 -17.714 -17.112 -23.423 1.00 0.00 N ATOM 21 CA PRO A 2 -18.120 -15.923 -24.227 1.00 0.00 C ATOM 22 C PRO A 2 -17.430 -14.649 -23.746 1.00 0.00 C ATOM 23 O PRO A 2 -17.148 -14.495 -22.559 1.00 0.00 O ATOM 24 CB PRO A 2 -19.638 -15.829 -24.024 1.00 0.00 C ATOM 25 CG PRO A 2 -20.067 -17.160 -23.499 1.00 0.00 C ATOM 26 CD PRO A 2 -18.863 -17.756 -22.776 1.00 0.00 C ATOM 0 HA PRO A 2 -17.838 -16.028 -25.275 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -19.889 -15.034 -23.322 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -20.143 -15.598 -24.962 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -20.913 -17.054 -22.819 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -20.391 -17.810 -24.312 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -18.892 -17.543 -21.707 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -18.828 -18.840 -22.884 1.00 0.00 H new ATOM 34 N LYS A 3 -17.164 -13.739 -24.677 1.00 0.00 N ATOM 35 CA LYS A 3 -16.509 -12.480 -24.336 1.00 0.00 C ATOM 36 C LYS A 3 -17.546 -11.389 -24.092 1.00 0.00 C ATOM 37 O LYS A 3 -18.618 -11.395 -24.697 1.00 0.00 O ATOM 38 CB LYS A 3 -15.576 -12.053 -25.471 1.00 0.00 C ATOM 39 CG LYS A 3 -14.409 -13.037 -25.576 1.00 0.00 C ATOM 40 CD LYS A 3 -13.116 -12.268 -25.856 1.00 0.00 C ATOM 41 CE LYS A 3 -11.927 -13.226 -25.781 1.00 0.00 C ATOM 42 NZ LYS A 3 -10.981 -12.933 -26.895 1.00 0.00 N ATOM 0 H LYS A 3 -17.389 -13.847 -25.666 1.00 0.00 H new ATOM 0 HA LYS A 3 -15.929 -12.627 -23.425 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -16.124 -12.022 -26.413 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -15.200 -11.046 -25.287 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -14.314 -13.605 -24.650 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -14.597 -13.756 -26.373 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -13.162 -11.805 -26.842 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -12.995 -11.463 -25.131 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -11.420 -13.119 -24.822 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -12.273 -14.258 -25.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -10.172 -13.585 -26.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -11.468 -13.056 -27.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -10.642 -11.953 -26.814 1.00 0.00 H new ATOM 56 N HIS A 4 -17.224 -10.453 -23.204 1.00 0.00 N ATOM 57 CA HIS A 4 -18.142 -9.361 -22.898 1.00 0.00 C ATOM 58 C HIS A 4 -17.528 -8.027 -23.309 1.00 0.00 C ATOM 59 O HIS A 4 -16.360 -7.759 -23.026 1.00 0.00 O ATOM 60 CB HIS A 4 -18.457 -9.346 -21.401 1.00 0.00 C ATOM 61 CG HIS A 4 -19.664 -8.485 -21.144 1.00 0.00 C ATOM 62 ND1 HIS A 4 -20.058 -8.131 -19.862 1.00 0.00 N ATOM 63 CD2 HIS A 4 -20.573 -7.896 -21.989 1.00 0.00 C ATOM 64 CE1 HIS A 4 -21.157 -7.364 -19.972 1.00 0.00 C ATOM 65 NE2 HIS A 4 -21.514 -7.191 -21.248 1.00 0.00 N ATOM 0 H HIS A 4 -16.344 -10.428 -22.689 1.00 0.00 H new ATOM 0 HA HIS A 4 -19.066 -9.513 -23.456 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -18.641 -10.361 -21.048 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -17.601 -8.965 -20.844 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -20.559 -7.970 -23.066 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -21.686 -6.940 -19.132 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -22.307 -6.656 -21.602 1.00 0.00 H new ATOM 73 N GLU A 5 -18.315 -7.197 -23.986 1.00 0.00 N ATOM 74 CA GLU A 5 -17.824 -5.899 -24.434 1.00 0.00 C ATOM 75 C GLU A 5 -18.643 -4.766 -23.827 1.00 0.00 C ATOM 76 O GLU A 5 -19.872 -4.769 -23.891 1.00 0.00 O ATOM 77 CB GLU A 5 -17.892 -5.819 -25.960 1.00 0.00 C ATOM 78 CG GLU A 5 -17.959 -7.233 -26.543 1.00 0.00 C ATOM 79 CD GLU A 5 -17.680 -7.191 -28.041 1.00 0.00 C ATOM 80 OE1 GLU A 5 -18.335 -6.421 -28.725 1.00 0.00 O ATOM 81 OE2 GLU A 5 -16.816 -7.930 -28.485 1.00 0.00 O ATOM 0 H GLU A 5 -19.284 -7.396 -24.234 1.00 0.00 H new ATOM 0 HA GLU A 5 -16.790 -5.793 -24.105 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -18.767 -5.246 -26.266 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -17.017 -5.296 -26.347 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -17.231 -7.875 -26.047 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -18.943 -7.665 -26.360 1.00 0.00 H new ATOM 88 N PHE A 6 -17.950 -3.792 -23.245 1.00 0.00 N ATOM 89 CA PHE A 6 -18.620 -2.650 -22.636 1.00 0.00 C ATOM 90 C PHE A 6 -18.101 -1.350 -23.243 1.00 0.00 C ATOM 91 O PHE A 6 -16.903 -1.206 -23.489 1.00 0.00 O ATOM 92 CB PHE A 6 -18.382 -2.651 -21.121 1.00 0.00 C ATOM 93 CG PHE A 6 -19.684 -2.907 -20.401 1.00 0.00 C ATOM 94 CD1 PHE A 6 -20.525 -3.945 -20.822 1.00 0.00 C ATOM 95 CD2 PHE A 6 -20.053 -2.105 -19.315 1.00 0.00 C ATOM 96 CE1 PHE A 6 -21.733 -4.181 -20.157 1.00 0.00 C ATOM 97 CE2 PHE A 6 -21.261 -2.342 -18.648 1.00 0.00 C ATOM 98 CZ PHE A 6 -22.101 -3.379 -19.070 1.00 0.00 C ATOM 0 H PHE A 6 -16.932 -3.771 -23.183 1.00 0.00 H new ATOM 0 HA PHE A 6 -19.690 -2.726 -22.829 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -17.653 -3.418 -20.858 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -17.964 -1.694 -20.808 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -20.241 -4.564 -21.660 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -19.406 -1.303 -18.991 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -22.381 -4.981 -20.482 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -21.545 -1.725 -17.808 1.00 0.00 H new ATOM 0 HZ PHE A 6 -23.034 -3.561 -18.557 1.00 0.00 H new ATOM 108 N SER A 7 -19.006 -0.409 -23.486 1.00 0.00 N ATOM 109 CA SER A 7 -18.623 0.874 -24.069 1.00 0.00 C ATOM 110 C SER A 7 -18.583 1.956 -22.996 1.00 0.00 C ATOM 111 O SER A 7 -19.614 2.314 -22.425 1.00 0.00 O ATOM 112 CB SER A 7 -19.620 1.268 -25.159 1.00 0.00 C ATOM 113 OG SER A 7 -19.083 2.339 -25.923 1.00 0.00 O ATOM 0 H SER A 7 -20.002 -0.507 -23.291 1.00 0.00 H new ATOM 0 HA SER A 7 -17.629 0.774 -24.506 1.00 0.00 H new ATOM 0 HB2 SER A 7 -19.827 0.414 -25.804 1.00 0.00 H new ATOM 0 HB3 SER A 7 -20.568 1.566 -24.710 1.00 0.00 H new ATOM 0 HG SER A 7 -19.720 2.592 -26.624 1.00 0.00 H new ATOM 119 N VAL A 8 -17.389 2.471 -22.723 1.00 0.00 N ATOM 120 CA VAL A 8 -17.234 3.509 -21.712 1.00 0.00 C ATOM 121 C VAL A 8 -16.411 4.676 -22.248 1.00 0.00 C ATOM 122 O VAL A 8 -15.323 4.484 -22.790 1.00 0.00 O ATOM 123 CB VAL A 8 -16.550 2.929 -20.471 1.00 0.00 C ATOM 124 CG1 VAL A 8 -15.159 2.413 -20.848 1.00 0.00 C ATOM 125 CG2 VAL A 8 -16.415 4.018 -19.404 1.00 0.00 C ATOM 0 H VAL A 8 -16.523 2.190 -23.183 1.00 0.00 H new ATOM 0 HA VAL A 8 -18.226 3.876 -21.448 1.00 0.00 H new ATOM 0 HB VAL A 8 -17.150 2.108 -20.079 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -14.672 2.000 -19.964 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -15.252 1.636 -21.607 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -14.560 3.235 -21.241 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -15.928 3.604 -18.521 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -15.816 4.840 -19.797 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -17.404 4.387 -19.133 1.00 0.00 H new ATOM 135 N ASP A 9 -16.931 5.887 -22.076 1.00 0.00 N ATOM 136 CA ASP A 9 -16.227 7.081 -22.531 1.00 0.00 C ATOM 137 C ASP A 9 -15.186 7.489 -21.496 1.00 0.00 C ATOM 138 O ASP A 9 -15.529 7.843 -20.367 1.00 0.00 O ATOM 139 CB ASP A 9 -17.219 8.227 -22.743 1.00 0.00 C ATOM 140 CG ASP A 9 -16.738 9.132 -23.873 1.00 0.00 C ATOM 141 OD1 ASP A 9 -15.535 9.256 -24.036 1.00 0.00 O ATOM 142 OD2 ASP A 9 -17.579 9.690 -24.558 1.00 0.00 O ATOM 0 H ASP A 9 -17.830 6.067 -21.629 1.00 0.00 H new ATOM 0 HA ASP A 9 -15.731 6.861 -23.476 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -18.204 7.826 -22.981 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -17.323 8.803 -21.824 1.00 0.00 H new ATOM 147 N MET A 10 -13.914 7.426 -21.874 1.00 0.00 N ATOM 148 CA MET A 10 -12.845 7.780 -20.949 1.00 0.00 C ATOM 149 C MET A 10 -12.885 9.267 -20.612 1.00 0.00 C ATOM 150 O MET A 10 -12.687 10.119 -21.479 1.00 0.00 O ATOM 151 CB MET A 10 -11.486 7.437 -21.563 1.00 0.00 C ATOM 152 CG MET A 10 -10.373 7.769 -20.566 1.00 0.00 C ATOM 153 SD MET A 10 -9.298 9.045 -21.267 1.00 0.00 S ATOM 154 CE MET A 10 -8.102 7.932 -22.044 1.00 0.00 C ATOM 0 H MET A 10 -13.601 7.137 -22.801 1.00 0.00 H new ATOM 0 HA MET A 10 -12.989 7.209 -20.032 1.00 0.00 H new ATOM 0 HB2 MET A 10 -11.450 6.379 -21.824 1.00 0.00 H new ATOM 0 HB3 MET A 10 -11.341 7.998 -22.486 1.00 0.00 H new ATOM 0 HG2 MET A 10 -10.803 8.116 -19.627 1.00 0.00 H new ATOM 0 HG3 MET A 10 -9.794 6.874 -20.340 1.00 0.00 H new ATOM 0 HE1 MET A 10 -7.285 8.515 -22.469 1.00 0.00 H new ATOM 0 HE2 MET A 10 -7.706 7.244 -21.297 1.00 0.00 H new ATOM 0 HE3 MET A 10 -8.593 7.365 -22.835 1.00 0.00 H new ATOM 164 N THR A 11 -13.129 9.566 -19.341 1.00 0.00 N ATOM 165 CA THR A 11 -13.178 10.947 -18.880 1.00 0.00 C ATOM 166 C THR A 11 -11.982 11.240 -17.981 1.00 0.00 C ATOM 167 O THR A 11 -11.391 12.319 -18.042 1.00 0.00 O ATOM 168 CB THR A 11 -14.476 11.195 -18.109 1.00 0.00 C ATOM 169 OG1 THR A 11 -15.584 10.851 -18.928 1.00 0.00 O ATOM 170 CG2 THR A 11 -14.566 12.672 -17.719 1.00 0.00 C ATOM 0 H THR A 11 -13.296 8.871 -18.613 1.00 0.00 H new ATOM 0 HA THR A 11 -13.144 11.608 -19.746 1.00 0.00 H new ATOM 0 HB THR A 11 -14.486 10.583 -17.207 1.00 0.00 H new ATOM 0 HG1 THR A 11 -16.416 11.008 -18.435 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.491 12.848 -17.170 1.00 0.00 H new ATOM 0 HG22 THR A 11 -13.715 12.935 -17.090 1.00 0.00 H new ATOM 0 HG23 THR A 11 -14.556 13.287 -18.619 1.00 0.00 H new ATOM 178 N CYS A 12 -11.636 10.265 -17.146 1.00 0.00 N ATOM 179 CA CYS A 12 -10.514 10.410 -16.228 1.00 0.00 C ATOM 180 C CYS A 12 -9.326 9.577 -16.695 1.00 0.00 C ATOM 181 O CYS A 12 -8.620 8.987 -15.882 1.00 0.00 O ATOM 182 CB CYS A 12 -10.939 9.968 -14.827 1.00 0.00 C ATOM 183 SG CYS A 12 -11.462 11.414 -13.872 1.00 0.00 S ATOM 0 H CYS A 12 -12.117 9.367 -17.087 1.00 0.00 H new ATOM 0 HA CYS A 12 -10.213 11.457 -16.205 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -11.755 9.248 -14.893 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -10.111 9.467 -14.325 1.00 0.00 H new ATOM 0 HG CYS A 12 -11.826 11.039 -12.681 1.00 0.00 H new ATOM 189 N GLY A 13 -9.111 9.539 -18.008 1.00 0.00 N ATOM 190 CA GLY A 13 -8.002 8.776 -18.577 1.00 0.00 C ATOM 191 C GLY A 13 -6.944 8.476 -17.521 1.00 0.00 C ATOM 192 O GLY A 13 -6.548 7.325 -17.332 1.00 0.00 O ATOM 0 H GLY A 13 -9.687 10.025 -18.695 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -8.376 7.842 -18.997 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.553 9.337 -19.397 1.00 0.00 H new ATOM 196 N GLY A 14 -6.498 9.518 -16.828 1.00 0.00 N ATOM 197 CA GLY A 14 -5.496 9.355 -15.782 1.00 0.00 C ATOM 198 C GLY A 14 -6.042 8.510 -14.636 1.00 0.00 C ATOM 199 O GLY A 14 -5.418 7.536 -14.217 1.00 0.00 O ATOM 0 H GLY A 14 -6.812 10.478 -16.970 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -4.605 8.882 -16.196 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -5.193 10.333 -15.407 1.00 0.00 H new ATOM 203 N CYS A 15 -7.213 8.891 -14.135 1.00 0.00 N ATOM 204 CA CYS A 15 -7.837 8.163 -13.036 1.00 0.00 C ATOM 205 C CYS A 15 -8.653 6.985 -13.565 1.00 0.00 C ATOM 206 O CYS A 15 -8.579 5.880 -13.028 1.00 0.00 O ATOM 207 CB CYS A 15 -8.740 9.102 -12.237 1.00 0.00 C ATOM 208 SG CYS A 15 -8.112 9.244 -10.545 1.00 0.00 S ATOM 0 H CYS A 15 -7.746 9.694 -14.470 1.00 0.00 H new ATOM 0 HA CYS A 15 -7.052 7.777 -12.386 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -8.771 10.084 -12.709 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -9.761 8.721 -12.227 1.00 0.00 H new ATOM 0 HG CYS A 15 -8.877 10.044 -9.864 1.00 0.00 H new ATOM 214 N ALA A 16 -9.429 7.225 -14.619 1.00 0.00 N ATOM 215 CA ALA A 16 -10.247 6.169 -15.204 1.00 0.00 C ATOM 216 C ALA A 16 -9.381 4.967 -15.571 1.00 0.00 C ATOM 217 O ALA A 16 -9.827 3.823 -15.496 1.00 0.00 O ATOM 218 CB ALA A 16 -10.961 6.690 -16.454 1.00 0.00 C ATOM 0 H ALA A 16 -9.508 8.131 -15.080 1.00 0.00 H new ATOM 0 HA ALA A 16 -10.989 5.858 -14.469 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -11.569 5.894 -16.884 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -11.601 7.530 -16.184 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -10.222 7.017 -17.185 1.00 0.00 H new ATOM 224 N GLU A 17 -8.138 5.235 -15.965 1.00 0.00 N ATOM 225 CA GLU A 17 -7.219 4.164 -16.335 1.00 0.00 C ATOM 226 C GLU A 17 -6.948 3.264 -15.135 1.00 0.00 C ATOM 227 O GLU A 17 -6.973 2.039 -15.247 1.00 0.00 O ATOM 228 CB GLU A 17 -5.901 4.752 -16.839 1.00 0.00 C ATOM 229 CG GLU A 17 -4.826 3.662 -16.844 1.00 0.00 C ATOM 230 CD GLU A 17 -3.863 3.887 -18.004 1.00 0.00 C ATOM 231 OE1 GLU A 17 -3.926 4.947 -18.605 1.00 0.00 O ATOM 232 OE2 GLU A 17 -3.075 2.995 -18.276 1.00 0.00 O ATOM 0 H GLU A 17 -7.748 6.175 -16.036 1.00 0.00 H new ATOM 0 HA GLU A 17 -7.677 3.574 -17.129 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -6.030 5.155 -17.843 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -5.592 5.580 -16.201 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.281 3.673 -15.900 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -5.292 2.680 -16.932 1.00 0.00 H new ATOM 239 N ALA A 18 -6.693 3.882 -13.986 1.00 0.00 N ATOM 240 CA ALA A 18 -6.426 3.126 -12.769 1.00 0.00 C ATOM 241 C ALA A 18 -7.661 2.330 -12.368 1.00 0.00 C ATOM 242 O ALA A 18 -7.558 1.259 -11.768 1.00 0.00 O ATOM 243 CB ALA A 18 -6.039 4.080 -11.636 1.00 0.00 C ATOM 0 H ALA A 18 -6.666 4.895 -13.873 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.602 2.438 -12.956 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.841 3.507 -10.730 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -5.144 4.635 -11.917 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.856 4.778 -11.453 1.00 0.00 H new ATOM 249 N VAL A 19 -8.828 2.862 -12.712 1.00 0.00 N ATOM 250 CA VAL A 19 -10.088 2.202 -12.397 1.00 0.00 C ATOM 251 C VAL A 19 -10.210 0.888 -13.161 1.00 0.00 C ATOM 252 O VAL A 19 -10.746 -0.093 -12.645 1.00 0.00 O ATOM 253 CB VAL A 19 -11.265 3.118 -12.747 1.00 0.00 C ATOM 254 CG1 VAL A 19 -12.513 2.273 -13.002 1.00 0.00 C ATOM 255 CG2 VAL A 19 -11.528 4.074 -11.581 1.00 0.00 C ATOM 0 H VAL A 19 -8.927 3.747 -13.208 1.00 0.00 H new ATOM 0 HA VAL A 19 -10.107 1.988 -11.328 1.00 0.00 H new ATOM 0 HB VAL A 19 -11.026 3.691 -13.643 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -13.350 2.926 -13.251 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -12.327 1.590 -13.831 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -12.754 1.700 -12.107 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -12.365 4.727 -11.828 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -11.767 3.499 -10.686 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -10.639 4.677 -11.398 1.00 0.00 H new ATOM 265 N SER A 20 -9.714 0.874 -14.394 1.00 0.00 N ATOM 266 CA SER A 20 -9.782 -0.328 -15.218 1.00 0.00 C ATOM 267 C SER A 20 -9.116 -1.499 -14.502 1.00 0.00 C ATOM 268 O SER A 20 -9.547 -2.644 -14.634 1.00 0.00 O ATOM 269 CB SER A 20 -9.088 -0.085 -16.559 1.00 0.00 C ATOM 270 OG SER A 20 -9.385 -1.161 -17.441 1.00 0.00 O ATOM 0 H SER A 20 -9.265 1.673 -14.842 1.00 0.00 H new ATOM 0 HA SER A 20 -10.830 -0.569 -15.394 1.00 0.00 H new ATOM 0 HB2 SER A 20 -9.424 0.858 -16.990 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.011 -0.004 -16.415 1.00 0.00 H new ATOM 0 HG SER A 20 -9.980 -0.846 -18.153 1.00 0.00 H new ATOM 276 N ARG A 21 -8.071 -1.205 -13.736 1.00 0.00 N ATOM 277 CA ARG A 21 -7.368 -2.244 -12.994 1.00 0.00 C ATOM 278 C ARG A 21 -8.292 -2.839 -11.936 1.00 0.00 C ATOM 279 O ARG A 21 -8.308 -4.049 -11.711 1.00 0.00 O ATOM 280 CB ARG A 21 -6.123 -1.659 -12.320 1.00 0.00 C ATOM 281 CG ARG A 21 -4.979 -1.585 -13.334 1.00 0.00 C ATOM 282 CD ARG A 21 -4.113 -0.358 -13.041 1.00 0.00 C ATOM 283 NE ARG A 21 -3.904 -0.215 -11.604 1.00 0.00 N ATOM 284 CZ ARG A 21 -2.929 -0.871 -10.982 1.00 0.00 C ATOM 285 NH1 ARG A 21 -2.141 -1.663 -11.655 1.00 0.00 N ATOM 286 NH2 ARG A 21 -2.763 -0.724 -9.696 1.00 0.00 N ATOM 0 H ARG A 21 -7.695 -0.265 -13.613 1.00 0.00 H new ATOM 0 HA ARG A 21 -7.062 -3.027 -13.688 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -6.341 -0.665 -11.929 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -5.831 -2.278 -11.472 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -4.374 -2.490 -13.282 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -5.380 -1.527 -14.346 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -3.152 -0.454 -13.547 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -4.594 0.537 -13.436 1.00 0.00 H new ATOM 0 HE ARG A 21 -4.517 0.399 -11.067 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -2.272 -1.780 -12.660 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -1.393 -2.166 -11.177 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -3.381 -0.106 -9.169 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -2.015 -1.227 -9.218 1.00 0.00 H new ATOM 300 N VAL A 22 -9.063 -1.967 -11.294 1.00 0.00 N ATOM 301 CA VAL A 22 -9.999 -2.387 -10.258 1.00 0.00 C ATOM 302 C VAL A 22 -11.006 -3.397 -10.805 1.00 0.00 C ATOM 303 O VAL A 22 -11.639 -4.124 -10.042 1.00 0.00 O ATOM 304 CB VAL A 22 -10.740 -1.169 -9.706 1.00 0.00 C ATOM 305 CG1 VAL A 22 -11.913 -1.632 -8.840 1.00 0.00 C ATOM 306 CG2 VAL A 22 -9.780 -0.334 -8.856 1.00 0.00 C ATOM 0 H VAL A 22 -9.058 -0.963 -11.474 1.00 0.00 H new ATOM 0 HA VAL A 22 -9.432 -2.865 -9.459 1.00 0.00 H new ATOM 0 HB VAL A 22 -11.116 -0.567 -10.533 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -12.440 -0.763 -8.447 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -12.597 -2.229 -9.443 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -11.539 -2.234 -8.012 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -10.306 0.535 -8.461 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -9.406 -0.938 -8.029 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -8.943 -0.003 -9.471 1.00 0.00 H new ATOM 316 N LEU A 23 -11.160 -3.431 -12.125 1.00 0.00 N ATOM 317 CA LEU A 23 -12.108 -4.355 -12.738 1.00 0.00 C ATOM 318 C LEU A 23 -11.754 -5.794 -12.386 1.00 0.00 C ATOM 319 O LEU A 23 -12.636 -6.636 -12.214 1.00 0.00 O ATOM 320 CB LEU A 23 -12.106 -4.188 -14.259 1.00 0.00 C ATOM 321 CG LEU A 23 -13.545 -4.255 -14.772 1.00 0.00 C ATOM 322 CD1 LEU A 23 -13.582 -3.888 -16.255 1.00 0.00 C ATOM 323 CD2 LEU A 23 -14.087 -5.674 -14.583 1.00 0.00 C ATOM 0 H LEU A 23 -10.650 -2.840 -12.782 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.102 -4.128 -12.352 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.654 -3.235 -14.532 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.505 -4.970 -14.722 1.00 0.00 H new ATOM 0 HG LEU A 23 -14.161 -3.551 -14.212 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -14.609 -3.937 -16.616 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -13.198 -2.877 -16.389 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -12.965 -4.588 -16.819 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -15.113 -5.723 -14.948 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -13.469 -6.377 -15.141 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -14.066 -5.934 -13.525 1.00 0.00 H new ATOM 335 N ASN A 24 -10.463 -6.069 -12.272 1.00 0.00 N ATOM 336 CA ASN A 24 -10.012 -7.410 -11.931 1.00 0.00 C ATOM 337 C ASN A 24 -10.568 -7.828 -10.572 1.00 0.00 C ATOM 338 O ASN A 24 -10.825 -9.007 -10.331 1.00 0.00 O ATOM 339 CB ASN A 24 -8.483 -7.450 -11.895 1.00 0.00 C ATOM 340 CG ASN A 24 -7.984 -8.795 -12.414 1.00 0.00 C ATOM 341 OD1 ASN A 24 -7.705 -9.699 -11.627 1.00 0.00 O ATOM 342 ND2 ASN A 24 -7.854 -8.980 -13.699 1.00 0.00 N ATOM 0 H ASN A 24 -9.716 -5.389 -12.409 1.00 0.00 H new ATOM 0 HA ASN A 24 -10.375 -8.104 -12.689 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -8.075 -6.642 -12.503 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -8.131 -7.291 -10.876 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -7.520 -9.876 -14.054 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -8.086 -8.229 -14.348 1.00 0.00 H new ATOM 349 N LYS A 25 -10.750 -6.852 -9.687 1.00 0.00 N ATOM 350 CA LYS A 25 -11.275 -7.131 -8.354 1.00 0.00 C ATOM 351 C LYS A 25 -12.731 -7.585 -8.430 1.00 0.00 C ATOM 352 O LYS A 25 -13.122 -8.548 -7.773 1.00 0.00 O ATOM 353 CB LYS A 25 -11.170 -5.880 -7.478 1.00 0.00 C ATOM 354 CG LYS A 25 -12.036 -6.055 -6.228 1.00 0.00 C ATOM 355 CD LYS A 25 -11.379 -5.340 -5.045 1.00 0.00 C ATOM 356 CE LYS A 25 -10.427 -6.300 -4.328 1.00 0.00 C ATOM 357 NZ LYS A 25 -9.778 -5.598 -3.185 1.00 0.00 N ATOM 0 H LYS A 25 -10.544 -5.869 -9.866 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.683 -7.933 -7.913 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.132 -5.709 -7.193 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.495 -5.003 -8.038 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -13.032 -5.649 -6.404 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.158 -7.115 -6.003 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.833 -4.464 -5.395 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.142 -4.984 -4.353 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.975 -7.171 -3.969 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.669 -6.663 -5.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.131 -6.251 -2.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.242 -4.780 -3.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.507 -5.272 -2.519 1.00 0.00 H new ATOM 371 N LEU A 26 -13.529 -6.888 -9.234 1.00 0.00 N ATOM 372 CA LEU A 26 -14.936 -7.238 -9.381 1.00 0.00 C ATOM 373 C LEU A 26 -15.091 -8.462 -10.278 1.00 0.00 C ATOM 374 O LEU A 26 -15.906 -9.344 -10.009 1.00 0.00 O ATOM 375 CB LEU A 26 -15.700 -6.060 -9.993 1.00 0.00 C ATOM 376 CG LEU A 26 -16.976 -5.792 -9.194 1.00 0.00 C ATOM 377 CD1 LEU A 26 -17.742 -7.100 -8.986 1.00 0.00 C ATOM 378 CD2 LEU A 26 -16.611 -5.192 -7.834 1.00 0.00 C ATOM 0 H LEU A 26 -13.229 -6.086 -9.788 1.00 0.00 H new ATOM 0 HA LEU A 26 -15.342 -7.468 -8.396 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -15.070 -5.170 -9.997 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -15.950 -6.278 -11.031 1.00 0.00 H new ATOM 0 HG LEU A 26 -17.604 -5.092 -9.745 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -18.650 -6.903 -8.416 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -18.006 -7.525 -9.954 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -17.116 -7.805 -8.439 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -17.521 -5.001 -7.265 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -15.980 -5.891 -7.286 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -16.072 -4.256 -7.982 1.00 0.00 H new ATOM 390 N GLY A 27 -14.300 -8.506 -11.346 1.00 0.00 N ATOM 391 CA GLY A 27 -14.358 -9.625 -12.280 1.00 0.00 C ATOM 392 C GLY A 27 -13.226 -10.615 -12.032 1.00 0.00 C ATOM 393 O GLY A 27 -13.466 -11.799 -11.797 1.00 0.00 O ATOM 0 H GLY A 27 -13.617 -7.787 -11.585 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -15.317 -10.134 -12.181 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -14.299 -9.251 -13.302 1.00 0.00 H new ATOM 397 N GLY A 28 -11.990 -10.126 -12.095 1.00 0.00 N ATOM 398 CA GLY A 28 -10.832 -10.986 -11.884 1.00 0.00 C ATOM 399 C GLY A 28 -10.686 -11.973 -13.037 1.00 0.00 C ATOM 400 O GLY A 28 -10.441 -13.161 -12.825 1.00 0.00 O ATOM 0 H GLY A 28 -11.767 -9.150 -12.288 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -9.931 -10.379 -11.800 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -10.940 -11.528 -10.944 1.00 0.00 H new ATOM 404 N VAL A 29 -10.850 -11.471 -14.256 1.00 0.00 N ATOM 405 CA VAL A 29 -10.746 -12.314 -15.440 1.00 0.00 C ATOM 406 C VAL A 29 -10.045 -11.575 -16.572 1.00 0.00 C ATOM 407 O VAL A 29 -9.576 -10.449 -16.402 1.00 0.00 O ATOM 408 CB VAL A 29 -12.142 -12.740 -15.894 1.00 0.00 C ATOM 409 CG1 VAL A 29 -12.132 -14.230 -16.241 1.00 0.00 C ATOM 410 CG2 VAL A 29 -13.143 -12.486 -14.765 1.00 0.00 C ATOM 0 H VAL A 29 -11.054 -10.491 -14.449 1.00 0.00 H new ATOM 0 HA VAL A 29 -10.158 -13.195 -15.184 1.00 0.00 H new ATOM 0 HB VAL A 29 -12.431 -12.164 -16.773 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -13.127 -14.535 -16.565 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.418 -14.412 -17.044 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.844 -14.806 -15.362 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -14.139 -12.789 -15.087 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -12.854 -13.063 -13.886 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -13.149 -11.425 -14.516 1.00 0.00 H new ATOM 420 N LYS A 30 -9.977 -12.223 -17.726 1.00 0.00 N ATOM 421 CA LYS A 30 -9.329 -11.631 -18.890 1.00 0.00 C ATOM 422 C LYS A 30 -9.865 -10.227 -19.141 1.00 0.00 C ATOM 423 O LYS A 30 -11.077 -10.013 -19.189 1.00 0.00 O ATOM 424 CB LYS A 30 -9.569 -12.502 -20.125 1.00 0.00 C ATOM 425 CG LYS A 30 -8.296 -12.545 -20.975 1.00 0.00 C ATOM 426 CD LYS A 30 -7.290 -13.514 -20.345 1.00 0.00 C ATOM 427 CE LYS A 30 -6.977 -14.642 -21.331 1.00 0.00 C ATOM 428 NZ LYS A 30 -8.195 -15.475 -21.537 1.00 0.00 N ATOM 0 H LYS A 30 -10.361 -13.155 -17.882 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.258 -11.571 -18.695 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -9.851 -13.510 -19.823 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.397 -12.101 -20.710 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -8.535 -12.862 -21.990 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -7.860 -11.548 -21.047 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -6.375 -12.984 -20.081 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -7.697 -13.927 -19.422 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -6.643 -14.226 -22.282 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -6.163 -15.258 -20.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -7.922 -16.398 -21.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -8.677 -15.616 -20.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -8.837 -14.993 -22.198 1.00 0.00 H new ATOM 442 N TYR A 31 -8.955 -9.275 -19.296 1.00 0.00 N ATOM 443 CA TYR A 31 -9.347 -7.891 -19.537 1.00 0.00 C ATOM 444 C TYR A 31 -8.467 -7.258 -20.613 1.00 0.00 C ATOM 445 O TYR A 31 -7.317 -7.653 -20.801 1.00 0.00 O ATOM 446 CB TYR A 31 -9.233 -7.083 -18.244 1.00 0.00 C ATOM 447 CG TYR A 31 -7.776 -6.864 -17.913 1.00 0.00 C ATOM 448 CD1 TYR A 31 -6.963 -7.952 -17.574 1.00 0.00 C ATOM 449 CD2 TYR A 31 -7.237 -5.572 -17.946 1.00 0.00 C ATOM 450 CE1 TYR A 31 -5.611 -7.750 -17.269 1.00 0.00 C ATOM 451 CE2 TYR A 31 -5.886 -5.369 -17.641 1.00 0.00 C ATOM 452 CZ TYR A 31 -5.074 -6.458 -17.301 1.00 0.00 C ATOM 453 OH TYR A 31 -3.742 -6.257 -17.001 1.00 0.00 O ATOM 0 H TYR A 31 -7.948 -9.432 -19.260 1.00 0.00 H new ATOM 0 HA TYR A 31 -10.381 -7.884 -19.882 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -9.739 -6.124 -18.356 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -9.727 -7.611 -17.428 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -7.379 -8.948 -17.548 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -7.864 -4.732 -18.207 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -4.984 -8.590 -17.010 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -5.470 -4.373 -17.668 1.00 0.00 H new ATOM 0 HH TYR A 31 -3.531 -5.303 -17.071 1.00 0.00 H new ATOM 463 N ASP A 32 -9.019 -6.271 -21.311 1.00 0.00 N ATOM 464 CA ASP A 32 -8.282 -5.582 -22.365 1.00 0.00 C ATOM 465 C ASP A 32 -8.697 -4.115 -22.428 1.00 0.00 C ATOM 466 O ASP A 32 -9.879 -3.802 -22.560 1.00 0.00 O ATOM 467 CB ASP A 32 -8.547 -6.252 -23.716 1.00 0.00 C ATOM 468 CG ASP A 32 -7.274 -6.913 -24.233 1.00 0.00 C ATOM 469 OD1 ASP A 32 -6.208 -6.366 -23.997 1.00 0.00 O ATOM 470 OD2 ASP A 32 -7.382 -7.955 -24.857 1.00 0.00 O ATOM 0 H ASP A 32 -9.970 -5.931 -21.167 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.217 -5.640 -22.139 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -9.336 -6.997 -23.613 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.899 -5.512 -24.435 1.00 0.00 H new ATOM 475 N ILE A 33 -7.718 -3.222 -22.324 1.00 0.00 N ATOM 476 CA ILE A 33 -7.999 -1.791 -22.361 1.00 0.00 C ATOM 477 C ILE A 33 -7.300 -1.128 -23.545 1.00 0.00 C ATOM 478 O ILE A 33 -6.073 -1.137 -23.637 1.00 0.00 O ATOM 479 CB ILE A 33 -7.527 -1.138 -21.060 1.00 0.00 C ATOM 480 CG1 ILE A 33 -7.253 -2.220 -20.013 1.00 0.00 C ATOM 481 CG2 ILE A 33 -8.613 -0.193 -20.539 1.00 0.00 C ATOM 482 CD1 ILE A 33 -6.647 -1.580 -18.763 1.00 0.00 C ATOM 0 H ILE A 33 -6.732 -3.460 -22.214 1.00 0.00 H new ATOM 0 HA ILE A 33 -9.075 -1.657 -22.473 1.00 0.00 H new ATOM 0 HB ILE A 33 -6.613 -0.575 -21.250 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -8.178 -2.736 -19.758 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -6.572 -2.968 -20.418 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -8.277 0.272 -19.612 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -8.810 0.580 -21.282 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -9.527 -0.757 -20.351 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -6.452 -2.351 -18.018 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -5.712 -1.084 -19.025 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -7.344 -0.848 -18.354 1.00 0.00 H new ATOM 494 N ASP A 34 -8.090 -0.547 -24.442 1.00 0.00 N ATOM 495 CA ASP A 34 -7.535 0.128 -25.610 1.00 0.00 C ATOM 496 C ASP A 34 -7.843 1.621 -25.556 1.00 0.00 C ATOM 497 O ASP A 34 -8.950 2.050 -25.884 1.00 0.00 O ATOM 498 CB ASP A 34 -8.122 -0.471 -26.888 1.00 0.00 C ATOM 499 CG ASP A 34 -8.433 -1.949 -26.676 1.00 0.00 C ATOM 500 OD1 ASP A 34 -7.690 -2.594 -25.956 1.00 0.00 O ATOM 501 OD2 ASP A 34 -9.412 -2.414 -27.237 1.00 0.00 O ATOM 0 H ASP A 34 -9.108 -0.530 -24.384 1.00 0.00 H new ATOM 0 HA ASP A 34 -6.454 -0.011 -25.610 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.030 0.064 -27.166 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -7.418 -0.354 -27.711 1.00 0.00 H new ATOM 506 N LEU A 35 -6.857 2.408 -25.136 1.00 0.00 N ATOM 507 CA LEU A 35 -7.031 3.853 -25.034 1.00 0.00 C ATOM 508 C LEU A 35 -7.348 4.466 -26.397 1.00 0.00 C ATOM 509 O LEU A 35 -8.282 5.257 -26.533 1.00 0.00 O ATOM 510 CB LEU A 35 -5.756 4.489 -24.471 1.00 0.00 C ATOM 511 CG LEU A 35 -6.086 5.267 -23.195 1.00 0.00 C ATOM 512 CD1 LEU A 35 -6.229 4.292 -22.025 1.00 0.00 C ATOM 513 CD2 LEU A 35 -4.958 6.257 -22.896 1.00 0.00 C ATOM 0 H LEU A 35 -5.934 2.072 -24.862 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.869 4.049 -24.365 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -5.017 3.717 -24.256 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -5.314 5.156 -25.211 1.00 0.00 H new ATOM 0 HG LEU A 35 -7.021 5.810 -23.333 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -6.464 4.846 -21.116 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -7.031 3.585 -22.237 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.294 3.749 -21.887 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -5.192 6.812 -21.987 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.023 5.713 -22.759 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.854 6.952 -23.729 1.00 0.00 H new ATOM 525 N PRO A 36 -6.579 4.124 -27.395 1.00 0.00 N ATOM 526 CA PRO A 36 -6.757 4.655 -28.780 1.00 0.00 C ATOM 527 C PRO A 36 -8.169 4.438 -29.319 1.00 0.00 C ATOM 528 O PRO A 36 -8.638 5.193 -30.170 1.00 0.00 O ATOM 529 CB PRO A 36 -5.736 3.873 -29.614 1.00 0.00 C ATOM 530 CG PRO A 36 -4.731 3.351 -28.643 1.00 0.00 C ATOM 531 CD PRO A 36 -5.449 3.190 -27.305 1.00 0.00 C ATOM 0 HA PRO A 36 -6.608 5.734 -28.812 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -6.216 3.058 -30.156 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -5.264 4.516 -30.357 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -4.326 2.397 -28.981 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -3.890 4.039 -28.550 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -5.789 2.165 -27.155 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -4.794 3.435 -26.468 1.00 0.00 H new ATOM 539 N ASN A 37 -8.838 3.403 -28.827 1.00 0.00 N ATOM 540 CA ASN A 37 -10.192 3.100 -29.279 1.00 0.00 C ATOM 541 C ASN A 37 -11.218 3.502 -28.226 1.00 0.00 C ATOM 542 O ASN A 37 -12.423 3.466 -28.476 1.00 0.00 O ATOM 543 CB ASN A 37 -10.319 1.604 -29.573 1.00 0.00 C ATOM 544 CG ASN A 37 -10.364 1.371 -31.078 1.00 0.00 C ATOM 545 OD1 ASN A 37 -11.299 0.749 -31.583 1.00 0.00 O ATOM 546 ND2 ASN A 37 -9.403 1.835 -31.830 1.00 0.00 N ATOM 0 H ASN A 37 -8.471 2.764 -28.122 1.00 0.00 H new ATOM 0 HA ASN A 37 -10.385 3.670 -30.188 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -9.476 1.067 -29.139 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -11.222 1.209 -29.108 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -9.426 1.683 -32.838 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -8.630 2.350 -31.409 1.00 0.00 H new ATOM 553 N LYS A 38 -10.737 3.877 -27.047 1.00 0.00 N ATOM 554 CA LYS A 38 -11.628 4.276 -25.966 1.00 0.00 C ATOM 555 C LYS A 38 -12.681 3.200 -25.730 1.00 0.00 C ATOM 556 O LYS A 38 -13.845 3.502 -25.466 1.00 0.00 O ATOM 557 CB LYS A 38 -12.313 5.597 -26.311 1.00 0.00 C ATOM 558 CG LYS A 38 -11.327 6.501 -27.055 1.00 0.00 C ATOM 559 CD LYS A 38 -11.961 7.876 -27.273 1.00 0.00 C ATOM 560 CE LYS A 38 -10.931 8.820 -27.893 1.00 0.00 C ATOM 561 NZ LYS A 38 -10.099 9.426 -26.816 1.00 0.00 N ATOM 0 H LYS A 38 -9.744 3.913 -26.817 1.00 0.00 H new ATOM 0 HA LYS A 38 -11.039 4.405 -25.058 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.192 5.413 -26.929 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -12.659 6.088 -25.402 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -10.405 6.600 -26.482 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.060 6.055 -28.013 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -12.829 7.788 -27.926 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -12.315 8.279 -26.324 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -10.298 8.275 -28.593 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -11.435 9.602 -28.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -9.398 10.068 -27.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -10.709 9.960 -26.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -9.608 8.674 -26.292 1.00 0.00 H new ATOM 575 N LYS A 39 -12.261 1.945 -25.827 1.00 0.00 N ATOM 576 CA LYS A 39 -13.169 0.823 -25.624 1.00 0.00 C ATOM 577 C LYS A 39 -12.502 -0.238 -24.759 1.00 0.00 C ATOM 578 O LYS A 39 -11.275 -0.331 -24.716 1.00 0.00 O ATOM 579 CB LYS A 39 -13.567 0.220 -26.972 1.00 0.00 C ATOM 580 CG LYS A 39 -14.719 1.029 -27.570 1.00 0.00 C ATOM 581 CD LYS A 39 -14.666 0.950 -29.097 1.00 0.00 C ATOM 582 CE LYS A 39 -15.635 1.973 -29.695 1.00 0.00 C ATOM 583 NZ LYS A 39 -17.036 1.518 -29.474 1.00 0.00 N ATOM 0 H LYS A 39 -11.301 1.679 -26.044 1.00 0.00 H new ATOM 0 HA LYS A 39 -14.065 1.182 -25.118 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -12.714 0.224 -27.651 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -13.867 -0.820 -26.843 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -15.673 0.644 -27.209 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -14.652 2.068 -27.247 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -13.652 1.146 -29.447 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -14.930 -0.054 -29.429 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -15.481 2.949 -29.234 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -15.444 2.091 -30.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -17.694 2.195 -29.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -17.169 0.581 -29.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -17.225 1.460 -28.453 1.00 0.00 H new ATOM 597 N VAL A 40 -13.309 -1.032 -24.066 1.00 0.00 N ATOM 598 CA VAL A 40 -12.766 -2.072 -23.202 1.00 0.00 C ATOM 599 C VAL A 40 -13.436 -3.415 -23.465 1.00 0.00 C ATOM 600 O VAL A 40 -14.657 -3.541 -23.375 1.00 0.00 O ATOM 601 CB VAL A 40 -12.962 -1.685 -21.735 1.00 0.00 C ATOM 602 CG1 VAL A 40 -12.200 -2.667 -20.844 1.00 0.00 C ATOM 603 CG2 VAL A 40 -12.427 -0.268 -21.507 1.00 0.00 C ATOM 0 H VAL A 40 -14.327 -0.978 -24.084 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.703 -2.169 -23.421 1.00 0.00 H new ATOM 0 HB VAL A 40 -14.023 -1.718 -21.488 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -12.339 -2.392 -19.798 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -12.579 -3.676 -21.008 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -11.139 -2.633 -21.090 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -12.566 0.010 -20.462 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -11.366 -0.236 -21.753 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -12.968 0.432 -22.143 1.00 0.00 H new ATOM 613 N CYS A 41 -12.623 -4.420 -23.773 1.00 0.00 N ATOM 614 CA CYS A 41 -13.136 -5.759 -24.028 1.00 0.00 C ATOM 615 C CYS A 41 -12.765 -6.679 -22.872 1.00 0.00 C ATOM 616 O CYS A 41 -11.586 -6.944 -22.634 1.00 0.00 O ATOM 617 CB CYS A 41 -12.545 -6.305 -25.328 1.00 0.00 C ATOM 618 SG CYS A 41 -11.065 -5.360 -25.762 1.00 0.00 S ATOM 0 H CYS A 41 -11.610 -4.332 -23.852 1.00 0.00 H new ATOM 0 HA CYS A 41 -14.221 -5.713 -24.120 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -12.295 -7.359 -25.211 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -13.280 -6.239 -26.130 1.00 0.00 H new ATOM 0 HG CYS A 41 -10.561 -5.826 -26.866 1.00 0.00 H new ATOM 624 N ILE A 42 -13.769 -7.149 -22.142 1.00 0.00 N ATOM 625 CA ILE A 42 -13.515 -8.020 -21.002 1.00 0.00 C ATOM 626 C ILE A 42 -14.293 -9.327 -21.107 1.00 0.00 C ATOM 627 O ILE A 42 -15.482 -9.335 -21.426 1.00 0.00 O ATOM 628 CB ILE A 42 -13.911 -7.304 -19.711 1.00 0.00 C ATOM 629 CG1 ILE A 42 -14.226 -8.337 -18.624 1.00 0.00 C ATOM 630 CG2 ILE A 42 -15.148 -6.442 -19.970 1.00 0.00 C ATOM 631 CD1 ILE A 42 -14.255 -7.655 -17.256 1.00 0.00 C ATOM 0 H ILE A 42 -14.753 -6.945 -22.315 1.00 0.00 H new ATOM 0 HA ILE A 42 -12.451 -8.256 -20.994 1.00 0.00 H new ATOM 0 HB ILE A 42 -13.087 -6.672 -19.379 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -15.187 -8.809 -18.826 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -13.475 -9.127 -18.631 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -15.433 -5.930 -19.051 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -14.923 -5.705 -20.741 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -15.970 -7.076 -20.302 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -14.479 -8.393 -16.486 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -13.284 -7.204 -17.054 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -15.023 -6.881 -17.251 1.00 0.00 H new ATOM 643 N GLU A 43 -13.614 -10.427 -20.800 1.00 0.00 N ATOM 644 CA GLU A 43 -14.245 -11.738 -20.823 1.00 0.00 C ATOM 645 C GLU A 43 -14.343 -12.257 -19.397 1.00 0.00 C ATOM 646 O GLU A 43 -13.326 -12.469 -18.739 1.00 0.00 O ATOM 647 CB GLU A 43 -13.419 -12.706 -21.671 1.00 0.00 C ATOM 648 CG GLU A 43 -14.035 -14.105 -21.603 1.00 0.00 C ATOM 649 CD GLU A 43 -13.117 -15.112 -22.285 1.00 0.00 C ATOM 650 OE1 GLU A 43 -13.257 -15.296 -23.483 1.00 0.00 O ATOM 651 OE2 GLU A 43 -12.285 -15.683 -21.601 1.00 0.00 O ATOM 0 H GLU A 43 -12.630 -10.435 -20.533 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.240 -11.658 -21.260 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.386 -12.362 -22.705 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -12.390 -12.733 -21.311 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -14.194 -14.391 -20.563 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -15.012 -14.105 -22.087 1.00 0.00 H new ATOM 658 N SER A 44 -15.564 -12.441 -18.912 1.00 0.00 N ATOM 659 CA SER A 44 -15.752 -12.912 -17.548 1.00 0.00 C ATOM 660 C SER A 44 -16.856 -13.956 -17.468 1.00 0.00 C ATOM 661 O SER A 44 -17.655 -14.111 -18.392 1.00 0.00 O ATOM 662 CB SER A 44 -16.101 -11.736 -16.637 1.00 0.00 C ATOM 663 OG SER A 44 -16.598 -12.231 -15.400 1.00 0.00 O ATOM 0 H SER A 44 -16.425 -12.274 -19.433 1.00 0.00 H new ATOM 0 HA SER A 44 -14.819 -13.372 -17.222 1.00 0.00 H new ATOM 0 HB2 SER A 44 -15.219 -11.119 -16.467 1.00 0.00 H new ATOM 0 HB3 SER A 44 -16.847 -11.101 -17.114 1.00 0.00 H new ATOM 0 HG SER A 44 -16.821 -11.479 -14.813 1.00 0.00 H new ATOM 669 N GLU A 45 -16.890 -14.666 -16.348 1.00 0.00 N ATOM 670 CA GLU A 45 -17.888 -15.696 -16.127 1.00 0.00 C ATOM 671 C GLU A 45 -19.243 -15.071 -15.814 1.00 0.00 C ATOM 672 O GLU A 45 -20.289 -15.663 -16.082 1.00 0.00 O ATOM 673 CB GLU A 45 -17.444 -16.576 -14.962 1.00 0.00 C ATOM 674 CG GLU A 45 -16.038 -17.116 -15.242 1.00 0.00 C ATOM 675 CD GLU A 45 -15.509 -17.853 -14.017 1.00 0.00 C ATOM 676 OE1 GLU A 45 -15.962 -18.960 -13.774 1.00 0.00 O ATOM 677 OE2 GLU A 45 -14.657 -17.302 -13.340 1.00 0.00 O ATOM 0 H GLU A 45 -16.233 -14.544 -15.577 1.00 0.00 H new ATOM 0 HA GLU A 45 -17.988 -16.297 -17.031 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.448 -16.002 -14.036 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.143 -17.402 -14.828 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.062 -17.789 -16.099 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.369 -16.295 -15.500 1.00 0.00 H new ATOM 684 N HIS A 46 -19.217 -13.870 -15.242 1.00 0.00 N ATOM 685 CA HIS A 46 -20.449 -13.172 -14.895 1.00 0.00 C ATOM 686 C HIS A 46 -20.770 -12.103 -15.932 1.00 0.00 C ATOM 687 O HIS A 46 -21.706 -12.246 -16.717 1.00 0.00 O ATOM 688 CB HIS A 46 -20.312 -12.523 -13.517 1.00 0.00 C ATOM 689 CG HIS A 46 -21.583 -12.722 -12.738 1.00 0.00 C ATOM 690 ND1 HIS A 46 -21.631 -13.488 -11.585 1.00 0.00 N ATOM 691 CD2 HIS A 46 -22.862 -12.264 -12.938 1.00 0.00 C ATOM 692 CE1 HIS A 46 -22.900 -13.469 -11.137 1.00 0.00 C ATOM 693 NE2 HIS A 46 -23.692 -12.737 -11.926 1.00 0.00 N ATOM 0 H HIS A 46 -18.362 -13.364 -15.011 1.00 0.00 H new ATOM 0 HA HIS A 46 -21.261 -13.898 -14.875 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -19.471 -12.961 -12.979 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -20.102 -11.459 -13.624 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -23.176 -11.633 -13.756 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -23.237 -13.982 -10.249 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -24.690 -12.562 -11.811 1.00 0.00 H new ATOM 701 N SER A 47 -19.985 -11.034 -15.925 1.00 0.00 N ATOM 702 CA SER A 47 -20.192 -9.942 -16.867 1.00 0.00 C ATOM 703 C SER A 47 -21.569 -9.319 -16.662 1.00 0.00 C ATOM 704 O SER A 47 -22.497 -9.978 -16.193 1.00 0.00 O ATOM 705 CB SER A 47 -20.071 -10.457 -18.301 1.00 0.00 C ATOM 706 OG SER A 47 -18.834 -10.024 -18.851 1.00 0.00 O ATOM 0 H SER A 47 -19.204 -10.900 -15.282 1.00 0.00 H new ATOM 0 HA SER A 47 -19.429 -9.183 -16.691 1.00 0.00 H new ATOM 0 HB2 SER A 47 -20.128 -11.545 -18.315 1.00 0.00 H new ATOM 0 HB3 SER A 47 -20.900 -10.087 -18.904 1.00 0.00 H new ATOM 0 HG SER A 47 -18.808 -9.044 -18.866 1.00 0.00 H new ATOM 712 N MET A 48 -21.691 -8.044 -17.012 1.00 0.00 N ATOM 713 CA MET A 48 -22.957 -7.338 -16.859 1.00 0.00 C ATOM 714 C MET A 48 -23.244 -7.073 -15.385 1.00 0.00 C ATOM 715 O MET A 48 -24.389 -7.135 -14.939 1.00 0.00 O ATOM 716 CB MET A 48 -24.094 -8.158 -17.469 1.00 0.00 C ATOM 717 CG MET A 48 -24.948 -7.257 -18.361 1.00 0.00 C ATOM 718 SD MET A 48 -24.104 -6.999 -19.942 1.00 0.00 S ATOM 719 CE MET A 48 -25.031 -8.224 -20.900 1.00 0.00 C ATOM 0 H MET A 48 -20.934 -7.481 -17.401 1.00 0.00 H new ATOM 0 HA MET A 48 -22.886 -6.383 -17.380 1.00 0.00 H new ATOM 0 HB2 MET A 48 -23.689 -8.986 -18.051 1.00 0.00 H new ATOM 0 HB3 MET A 48 -24.707 -8.593 -16.680 1.00 0.00 H new ATOM 0 HG2 MET A 48 -25.924 -7.712 -18.528 1.00 0.00 H new ATOM 0 HG3 MET A 48 -25.122 -6.300 -17.869 1.00 0.00 H new ATOM 0 HE1 MET A 48 -24.667 -8.234 -21.927 1.00 0.00 H new ATOM 0 HE2 MET A 48 -24.895 -9.211 -20.458 1.00 0.00 H new ATOM 0 HE3 MET A 48 -26.090 -7.966 -20.893 1.00 0.00 H new ATOM 729 N ASP A 49 -22.187 -6.773 -14.642 1.00 0.00 N ATOM 730 CA ASP A 49 -22.311 -6.489 -13.218 1.00 0.00 C ATOM 731 C ASP A 49 -20.991 -5.950 -12.678 1.00 0.00 C ATOM 732 O ASP A 49 -20.965 -5.012 -11.882 1.00 0.00 O ATOM 733 CB ASP A 49 -22.696 -7.762 -12.460 1.00 0.00 C ATOM 734 CG ASP A 49 -22.785 -7.472 -10.966 1.00 0.00 C ATOM 735 OD1 ASP A 49 -22.026 -6.639 -10.498 1.00 0.00 O ATOM 736 OD2 ASP A 49 -23.612 -8.086 -10.311 1.00 0.00 O ATOM 0 H ASP A 49 -21.234 -6.720 -15.002 1.00 0.00 H new ATOM 0 HA ASP A 49 -23.090 -5.740 -13.076 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -23.653 -8.137 -12.824 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -21.957 -8.542 -12.644 1.00 0.00 H new ATOM 741 N THR A 50 -19.898 -6.555 -13.126 1.00 0.00 N ATOM 742 CA THR A 50 -18.566 -6.144 -12.699 1.00 0.00 C ATOM 743 C THR A 50 -18.115 -4.895 -13.453 1.00 0.00 C ATOM 744 O THR A 50 -17.401 -4.049 -12.912 1.00 0.00 O ATOM 745 CB THR A 50 -17.567 -7.276 -12.962 1.00 0.00 C ATOM 746 OG1 THR A 50 -16.267 -6.728 -13.132 1.00 0.00 O ATOM 747 CG2 THR A 50 -17.966 -8.039 -14.231 1.00 0.00 C ATOM 0 H THR A 50 -19.908 -7.333 -13.786 1.00 0.00 H new ATOM 0 HA THR A 50 -18.603 -5.919 -11.633 1.00 0.00 H new ATOM 0 HB THR A 50 -17.570 -7.961 -12.114 1.00 0.00 H new ATOM 0 HG1 THR A 50 -15.627 -7.451 -13.299 1.00 0.00 H new ATOM 0 HG21 THR A 50 -17.252 -8.842 -14.412 1.00 0.00 H new ATOM 0 HG22 THR A 50 -18.963 -8.462 -14.103 1.00 0.00 H new ATOM 0 HG23 THR A 50 -17.968 -7.356 -15.081 1.00 0.00 H new ATOM 755 N LEU A 51 -18.519 -4.805 -14.714 1.00 0.00 N ATOM 756 CA LEU A 51 -18.142 -3.680 -15.563 1.00 0.00 C ATOM 757 C LEU A 51 -18.729 -2.357 -15.075 1.00 0.00 C ATOM 758 O LEU A 51 -18.009 -1.374 -14.912 1.00 0.00 O ATOM 759 CB LEU A 51 -18.615 -3.938 -16.996 1.00 0.00 C ATOM 760 CG LEU A 51 -18.513 -5.431 -17.316 1.00 0.00 C ATOM 761 CD1 LEU A 51 -18.746 -5.649 -18.811 1.00 0.00 C ATOM 762 CD2 LEU A 51 -17.120 -5.939 -16.940 1.00 0.00 C ATOM 0 H LEU A 51 -19.109 -5.499 -15.173 1.00 0.00 H new ATOM 0 HA LEU A 51 -17.056 -3.596 -15.524 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -19.645 -3.601 -17.115 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -18.009 -3.364 -17.697 1.00 0.00 H new ATOM 0 HG LEU A 51 -19.266 -5.976 -16.747 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -18.673 -6.712 -19.039 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -19.738 -5.287 -19.081 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -17.993 -5.104 -19.380 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -17.047 -7.002 -17.168 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -16.368 -5.393 -17.510 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -16.951 -5.784 -15.874 1.00 0.00 H new ATOM 774 N LEU A 52 -20.042 -2.327 -14.888 1.00 0.00 N ATOM 775 CA LEU A 52 -20.725 -1.103 -14.472 1.00 0.00 C ATOM 776 C LEU A 52 -20.149 -0.509 -13.187 1.00 0.00 C ATOM 777 O LEU A 52 -19.800 0.669 -13.152 1.00 0.00 O ATOM 778 CB LEU A 52 -22.214 -1.389 -14.268 1.00 0.00 C ATOM 779 CG LEU A 52 -22.397 -2.815 -13.738 1.00 0.00 C ATOM 780 CD1 LEU A 52 -23.652 -2.874 -12.864 1.00 0.00 C ATOM 781 CD2 LEU A 52 -22.542 -3.802 -14.904 1.00 0.00 C ATOM 0 H LEU A 52 -20.656 -3.131 -15.016 1.00 0.00 H new ATOM 0 HA LEU A 52 -20.576 -0.371 -15.266 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -22.639 -0.672 -13.566 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -22.750 -1.269 -15.210 1.00 0.00 H new ATOM 0 HG LEU A 52 -21.522 -3.089 -13.149 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -23.785 -3.888 -12.486 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -23.545 -2.185 -12.026 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -24.522 -2.591 -13.457 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -22.671 -4.811 -14.513 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -23.411 -3.531 -15.504 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -21.647 -3.766 -15.525 1.00 0.00 H new ATOM 793 N ALA A 53 -20.064 -1.307 -12.129 1.00 0.00 N ATOM 794 CA ALA A 53 -19.545 -0.810 -10.856 1.00 0.00 C ATOM 795 C ALA A 53 -18.089 -0.386 -10.990 1.00 0.00 C ATOM 796 O ALA A 53 -17.676 0.639 -10.446 1.00 0.00 O ATOM 797 CB ALA A 53 -19.665 -1.895 -9.785 1.00 0.00 C ATOM 0 H ALA A 53 -20.343 -2.288 -12.124 1.00 0.00 H new ATOM 0 HA ALA A 53 -20.135 0.059 -10.565 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -19.276 -1.517 -8.839 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -20.712 -2.171 -9.663 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -19.092 -2.771 -10.089 1.00 0.00 H new ATOM 803 N THR A 54 -17.320 -1.188 -11.703 1.00 0.00 N ATOM 804 CA THR A 54 -15.908 -0.912 -11.898 1.00 0.00 C ATOM 805 C THR A 54 -15.687 0.324 -12.768 1.00 0.00 C ATOM 806 O THR A 54 -14.890 1.193 -12.428 1.00 0.00 O ATOM 807 CB THR A 54 -15.256 -2.121 -12.559 1.00 0.00 C ATOM 808 OG1 THR A 54 -15.955 -2.426 -13.758 1.00 0.00 O ATOM 809 CG2 THR A 54 -15.322 -3.317 -11.608 1.00 0.00 C ATOM 0 H THR A 54 -17.651 -2.039 -12.158 1.00 0.00 H new ATOM 0 HA THR A 54 -15.459 -0.717 -10.924 1.00 0.00 H new ATOM 0 HB THR A 54 -14.213 -1.901 -12.788 1.00 0.00 H new ATOM 0 HG1 THR A 54 -16.409 -3.289 -13.661 1.00 0.00 H new ATOM 0 HG21 THR A 54 -14.856 -4.183 -12.079 1.00 0.00 H new ATOM 0 HG22 THR A 54 -14.793 -3.078 -10.685 1.00 0.00 H new ATOM 0 HG23 THR A 54 -16.364 -3.544 -11.381 1.00 0.00 H new ATOM 817 N LEU A 55 -16.376 0.381 -13.902 1.00 0.00 N ATOM 818 CA LEU A 55 -16.223 1.505 -14.824 1.00 0.00 C ATOM 819 C LEU A 55 -16.696 2.822 -14.204 1.00 0.00 C ATOM 820 O LEU A 55 -16.042 3.854 -14.355 1.00 0.00 O ATOM 821 CB LEU A 55 -17.007 1.234 -16.112 1.00 0.00 C ATOM 822 CG LEU A 55 -16.090 0.589 -17.158 1.00 0.00 C ATOM 823 CD1 LEU A 55 -15.215 -0.482 -16.501 1.00 0.00 C ATOM 824 CD2 LEU A 55 -16.942 -0.061 -18.251 1.00 0.00 C ATOM 0 H LEU A 55 -17.041 -0.330 -14.205 1.00 0.00 H new ATOM 0 HA LEU A 55 -15.161 1.603 -15.048 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -17.851 0.577 -15.902 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -17.417 2.166 -16.501 1.00 0.00 H new ATOM 0 HG LEU A 55 -15.452 1.359 -17.593 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -14.567 -0.934 -17.252 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -14.604 -0.025 -15.723 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -15.850 -1.250 -16.060 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -16.291 -0.520 -18.995 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -17.581 -0.825 -17.808 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -17.561 0.698 -18.729 1.00 0.00 H new ATOM 836 N LYS A 56 -17.840 2.790 -13.526 1.00 0.00 N ATOM 837 CA LYS A 56 -18.388 4.002 -12.917 1.00 0.00 C ATOM 838 C LYS A 56 -17.507 4.511 -11.777 1.00 0.00 C ATOM 839 O LYS A 56 -17.600 5.677 -11.390 1.00 0.00 O ATOM 840 CB LYS A 56 -19.800 3.734 -12.387 1.00 0.00 C ATOM 841 CG LYS A 56 -20.747 4.841 -12.861 1.00 0.00 C ATOM 842 CD LYS A 56 -21.154 4.579 -14.313 1.00 0.00 C ATOM 843 CE LYS A 56 -22.234 5.580 -14.730 1.00 0.00 C ATOM 844 NZ LYS A 56 -22.062 5.921 -16.170 1.00 0.00 N ATOM 0 H LYS A 56 -18.401 1.950 -13.384 1.00 0.00 H new ATOM 0 HA LYS A 56 -18.422 4.769 -13.690 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -20.153 2.765 -12.739 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -19.789 3.693 -11.298 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -21.631 4.874 -12.225 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -20.258 5.812 -12.779 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -20.287 4.670 -14.967 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -21.527 3.560 -14.419 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -23.224 5.156 -14.561 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -22.165 6.481 -14.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -22.250 6.934 -16.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -21.088 5.705 -16.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -22.728 5.362 -16.741 1.00 0.00 H new ATOM 858 N LYS A 57 -16.661 3.642 -11.232 1.00 0.00 N ATOM 859 CA LYS A 57 -15.789 4.039 -10.133 1.00 0.00 C ATOM 860 C LYS A 57 -15.286 5.467 -10.325 1.00 0.00 C ATOM 861 O LYS A 57 -15.290 6.264 -9.386 1.00 0.00 O ATOM 862 CB LYS A 57 -14.597 3.088 -10.035 1.00 0.00 C ATOM 863 CG LYS A 57 -14.966 1.893 -9.155 1.00 0.00 C ATOM 864 CD LYS A 57 -14.805 2.273 -7.681 1.00 0.00 C ATOM 865 CE LYS A 57 -13.341 2.118 -7.268 1.00 0.00 C ATOM 866 NZ LYS A 57 -13.193 0.912 -6.407 1.00 0.00 N ATOM 0 H LYS A 57 -16.561 2.671 -11.529 1.00 0.00 H new ATOM 0 HA LYS A 57 -16.368 3.993 -9.211 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.309 2.746 -11.029 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -13.736 3.609 -9.616 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -15.993 1.587 -9.352 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -14.328 1.042 -9.394 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -15.131 3.301 -7.522 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -15.438 1.638 -7.060 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -12.710 2.026 -8.152 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -13.008 3.005 -6.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -12.183 0.708 -6.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -13.644 1.086 -5.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -13.649 0.099 -6.868 1.00 0.00 H new ATOM 880 N THR A 58 -14.852 5.787 -11.540 1.00 0.00 N ATOM 881 CA THR A 58 -14.347 7.128 -11.826 1.00 0.00 C ATOM 882 C THR A 58 -15.498 8.072 -12.162 1.00 0.00 C ATOM 883 O THR A 58 -15.385 9.287 -11.997 1.00 0.00 O ATOM 884 CB THR A 58 -13.362 7.081 -12.997 1.00 0.00 C ATOM 885 OG1 THR A 58 -13.200 5.736 -13.425 1.00 0.00 O ATOM 886 CG2 THR A 58 -12.010 7.645 -12.555 1.00 0.00 C ATOM 0 H THR A 58 -14.839 5.147 -12.334 1.00 0.00 H new ATOM 0 HA THR A 58 -13.834 7.499 -10.939 1.00 0.00 H new ATOM 0 HB THR A 58 -13.750 7.680 -13.821 1.00 0.00 H new ATOM 0 HG1 THR A 58 -13.160 5.707 -14.404 1.00 0.00 H new ATOM 0 HG21 THR A 58 -11.311 7.610 -13.390 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.135 8.678 -12.229 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.619 7.049 -11.730 1.00 0.00 H new ATOM 894 N GLY A 59 -16.605 7.505 -12.628 1.00 0.00 N ATOM 895 CA GLY A 59 -17.771 8.307 -12.981 1.00 0.00 C ATOM 896 C GLY A 59 -17.936 8.401 -14.494 1.00 0.00 C ATOM 897 O GLY A 59 -18.668 9.255 -14.994 1.00 0.00 O ATOM 0 H GLY A 59 -16.720 6.501 -12.769 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -18.666 7.866 -12.541 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -17.669 9.307 -12.561 1.00 0.00 H new ATOM 901 N ALA A 60 -17.252 7.523 -15.218 1.00 0.00 N ATOM 902 CA ALA A 60 -17.333 7.523 -16.675 1.00 0.00 C ATOM 903 C ALA A 60 -18.650 6.910 -17.141 1.00 0.00 C ATOM 904 O ALA A 60 -19.192 6.014 -16.493 1.00 0.00 O ATOM 905 CB ALA A 60 -16.165 6.730 -17.263 1.00 0.00 C ATOM 0 H ALA A 60 -16.640 6.808 -14.825 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.284 8.555 -17.021 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -16.233 6.735 -18.351 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -15.224 7.187 -16.956 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -16.204 5.702 -16.902 1.00 0.00 H new ATOM 911 N THR A 61 -19.157 7.397 -18.269 1.00 0.00 N ATOM 912 CA THR A 61 -20.411 6.887 -18.813 1.00 0.00 C ATOM 913 C THR A 61 -20.278 5.407 -19.156 1.00 0.00 C ATOM 914 O THR A 61 -19.305 4.991 -19.783 1.00 0.00 O ATOM 915 CB THR A 61 -20.795 7.672 -20.069 1.00 0.00 C ATOM 916 OG1 THR A 61 -20.404 9.029 -19.913 1.00 0.00 O ATOM 917 CG2 THR A 61 -22.309 7.595 -20.276 1.00 0.00 C ATOM 0 H THR A 61 -18.724 8.138 -18.820 1.00 0.00 H new ATOM 0 HA THR A 61 -21.190 7.008 -18.060 1.00 0.00 H new ATOM 0 HB THR A 61 -20.290 7.245 -20.936 1.00 0.00 H new ATOM 0 HG1 THR A 61 -20.647 9.534 -20.717 1.00 0.00 H new ATOM 0 HG21 THR A 61 -22.583 8.154 -21.171 1.00 0.00 H new ATOM 0 HG22 THR A 61 -22.608 6.553 -20.394 1.00 0.00 H new ATOM 0 HG23 THR A 61 -22.817 8.023 -19.411 1.00 0.00 H new ATOM 925 N VAL A 62 -21.259 4.616 -18.735 1.00 0.00 N ATOM 926 CA VAL A 62 -21.237 3.182 -19.000 1.00 0.00 C ATOM 927 C VAL A 62 -22.362 2.795 -19.953 1.00 0.00 C ATOM 928 O VAL A 62 -23.509 3.204 -19.776 1.00 0.00 O ATOM 929 CB VAL A 62 -21.387 2.409 -17.689 1.00 0.00 C ATOM 930 CG1 VAL A 62 -21.732 0.949 -17.990 1.00 0.00 C ATOM 931 CG2 VAL A 62 -20.071 2.468 -16.911 1.00 0.00 C ATOM 0 H VAL A 62 -22.073 4.940 -18.213 1.00 0.00 H new ATOM 0 HA VAL A 62 -20.283 2.931 -19.464 1.00 0.00 H new ATOM 0 HB VAL A 62 -22.185 2.855 -17.095 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -21.838 0.400 -17.054 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -22.668 0.904 -18.546 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -20.935 0.502 -18.584 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -20.176 1.918 -15.976 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -19.275 2.022 -17.508 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -19.823 3.507 -16.694 1.00 0.00 H new ATOM 941 N SER A 63 -22.025 2.001 -20.965 1.00 0.00 N ATOM 942 CA SER A 63 -23.016 1.562 -21.942 1.00 0.00 C ATOM 943 C SER A 63 -22.827 0.084 -22.262 1.00 0.00 C ATOM 944 O SER A 63 -21.773 -0.324 -22.750 1.00 0.00 O ATOM 945 CB SER A 63 -22.890 2.385 -23.222 1.00 0.00 C ATOM 946 OG SER A 63 -23.264 1.582 -24.334 1.00 0.00 O ATOM 0 H SER A 63 -21.081 1.651 -21.129 1.00 0.00 H new ATOM 0 HA SER A 63 -24.009 1.708 -21.517 1.00 0.00 H new ATOM 0 HB2 SER A 63 -23.527 3.268 -23.165 1.00 0.00 H new ATOM 0 HB3 SER A 63 -21.866 2.738 -23.342 1.00 0.00 H new ATOM 0 HG SER A 63 -23.186 2.107 -25.158 1.00 0.00 H new ATOM 952 N TYR A 64 -23.852 -0.713 -21.983 1.00 0.00 N ATOM 953 CA TYR A 64 -23.783 -2.146 -22.244 1.00 0.00 C ATOM 954 C TYR A 64 -23.998 -2.431 -23.731 1.00 0.00 C ATOM 955 O TYR A 64 -25.089 -2.224 -24.262 1.00 0.00 O ATOM 956 CB TYR A 64 -24.832 -2.882 -21.394 1.00 0.00 C ATOM 957 CG TYR A 64 -25.927 -3.450 -22.271 1.00 0.00 C ATOM 958 CD1 TYR A 64 -25.641 -4.492 -23.163 1.00 0.00 C ATOM 959 CD2 TYR A 64 -27.227 -2.936 -22.188 1.00 0.00 C ATOM 960 CE1 TYR A 64 -26.656 -5.019 -23.970 1.00 0.00 C ATOM 961 CE2 TYR A 64 -28.241 -3.464 -22.997 1.00 0.00 C ATOM 962 CZ TYR A 64 -27.955 -4.506 -23.888 1.00 0.00 C ATOM 963 OH TYR A 64 -28.956 -5.026 -24.684 1.00 0.00 O ATOM 0 H TYR A 64 -24.733 -0.395 -21.580 1.00 0.00 H new ATOM 0 HA TYR A 64 -22.792 -2.508 -21.970 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -24.354 -3.686 -20.833 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -25.262 -2.196 -20.664 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -24.638 -4.888 -23.228 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -27.448 -2.133 -21.500 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -26.436 -5.823 -24.657 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -29.244 -3.068 -22.934 1.00 0.00 H new ATOM 0 HH TYR A 64 -29.797 -4.557 -24.501 1.00 0.00 H new ATOM 973 N LEU A 65 -22.948 -2.906 -24.391 1.00 0.00 N ATOM 974 CA LEU A 65 -23.030 -3.218 -25.812 1.00 0.00 C ATOM 975 C LEU A 65 -23.766 -4.536 -26.030 1.00 0.00 C ATOM 976 O LEU A 65 -24.611 -4.647 -26.917 1.00 0.00 O ATOM 977 CB LEU A 65 -21.623 -3.310 -26.407 1.00 0.00 C ATOM 978 CG LEU A 65 -21.045 -1.903 -26.563 1.00 0.00 C ATOM 979 CD1 LEU A 65 -19.569 -1.997 -26.953 1.00 0.00 C ATOM 980 CD2 LEU A 65 -21.815 -1.156 -27.656 1.00 0.00 C ATOM 0 H LEU A 65 -22.037 -3.082 -23.968 1.00 0.00 H new ATOM 0 HA LEU A 65 -23.583 -2.421 -26.309 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -20.981 -3.909 -25.761 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -21.657 -3.810 -27.375 1.00 0.00 H new ATOM 0 HG LEU A 65 -21.137 -1.365 -25.619 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -19.157 -0.994 -27.064 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -19.021 -2.530 -26.176 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -19.476 -2.534 -27.897 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -21.405 -0.153 -27.769 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -21.722 -1.694 -28.599 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -22.867 -1.089 -27.379 1.00 0.00 H new ATOM 992 N GLY A 66 -23.440 -5.532 -25.211 1.00 0.00 N ATOM 993 CA GLY A 66 -24.080 -6.837 -25.322 1.00 0.00 C ATOM 994 C GLY A 66 -23.048 -7.934 -25.564 1.00 0.00 C ATOM 995 O GLY A 66 -21.876 -7.654 -25.815 1.00 0.00 O ATOM 0 H GLY A 66 -22.743 -5.461 -24.470 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -24.637 -7.052 -24.410 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -24.801 -6.824 -26.140 1.00 0.00 H new ATOM 999 N LEU A 67 -23.494 -9.183 -25.487 1.00 0.00 N ATOM 1000 CA LEU A 67 -22.604 -10.319 -25.698 1.00 0.00 C ATOM 1001 C LEU A 67 -22.551 -10.694 -27.175 1.00 0.00 C ATOM 1002 O LEU A 67 -23.532 -10.538 -27.900 1.00 0.00 O ATOM 1003 CB LEU A 67 -23.090 -11.519 -24.883 1.00 0.00 C ATOM 1004 CG LEU A 67 -22.723 -11.319 -23.411 1.00 0.00 C ATOM 1005 CD1 LEU A 67 -23.661 -12.150 -22.534 1.00 0.00 C ATOM 1006 CD2 LEU A 67 -21.279 -11.772 -23.182 1.00 0.00 C ATOM 0 H LEU A 67 -24.461 -9.434 -25.281 1.00 0.00 H new ATOM 0 HA LEU A 67 -21.603 -10.037 -25.372 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -24.169 -11.630 -24.988 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -22.637 -12.436 -25.260 1.00 0.00 H new ATOM 0 HG LEU A 67 -22.821 -10.265 -23.151 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -23.400 -12.008 -21.485 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -24.690 -11.831 -22.698 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -23.562 -13.204 -22.793 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -21.015 -11.630 -22.134 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -21.183 -12.826 -23.441 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -20.609 -11.182 -23.808 1.00 0.00 H new ATOM 1018 N GLU A 68 -21.399 -11.189 -27.614 1.00 0.00 N ATOM 1019 CA GLU A 68 -21.227 -11.583 -29.004 1.00 0.00 C ATOM 1020 C GLU A 68 -21.652 -13.034 -29.204 1.00 0.00 C ATOM 1021 O GLU A 68 -20.822 -13.821 -29.628 1.00 0.00 O ATOM 1022 CB GLU A 68 -19.761 -11.413 -29.407 1.00 0.00 C ATOM 1023 CG GLU A 68 -19.432 -9.923 -29.534 1.00 0.00 C ATOM 1024 CD GLU A 68 -18.663 -9.663 -30.824 1.00 0.00 C ATOM 1025 OE1 GLU A 68 -19.173 -10.013 -31.876 1.00 0.00 O ATOM 1026 OE2 GLU A 68 -17.574 -9.118 -30.742 1.00 0.00 O ATOM 1027 OXT GLU A 68 -22.802 -13.337 -28.928 1.00 0.00 O ATOM 0 H GLU A 68 -20.575 -11.326 -27.029 1.00 0.00 H new ATOM 0 HA GLU A 68 -21.854 -10.947 -29.630 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -19.113 -11.877 -28.663 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -19.573 -11.919 -30.354 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -20.352 -9.338 -29.526 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -18.840 -9.599 -28.678 1.00 0.00 H new TER 1034 GLU A 68