USER MOD reduce.3.24.130724 H: found=0, std=0, add=870, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 868 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 24 MET CE :methyl -132:sc= -5.89! (180deg=-8.22!) USER MOD Set 1.2: A 26 ASN : amide:sc= -2.62 X(o=-8.5,f=-8.2!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -152:sc= -0.0877 (180deg=-0.404) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= -1 USER MOD Single : A 10 GLN : amide:sc= -5.35! C(o=-5.3!,f=-10!) USER MOD Single : A 14 LYS NZ :NH3+ -167:sc= -0.329 (180deg=-0.358) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= -0.935 K(o=-0.93,f=-0.33) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= -0.0397 X(o=-0.04,f=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl 172:sc= -0.874 (180deg=-1.02) USER MOD Single : A 49 THR OG1 : rot -122:sc= 0.212 USER MOD Single : A 52 HIS : no HD1:sc= -4.31! C(o=-4.3!,f=-6.1!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot -176:sc= 0.0126 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 89:sc= 0.79 USER MOD Single : A 68 THR OG1 : rot 136:sc= 1.53 USER MOD Single : A 73 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.186) USER MOD Single : A 74 MET CE :methyl 179:sc= -0.13 (180deg=-0.131) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot -86:sc= 1.14 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -175:sc= 0.00737 (180deg=0.000289) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 92 SER OG : rot 70:sc= 1.05 USER MOD Single : A 96 HIS : no HE2:sc= -0.824 K(o=-0.82,f=-2.9!) USER MOD Single : A 100 LYS NZ :NH3+ -144:sc= -0.0777 (180deg=-0.789) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 CYS SG : rot 180:sc= 0.0156 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -22.006 -10.240 10.471 1.00 0.00 N ATOM 2 CA MET A 1 -21.895 -10.633 9.036 1.00 0.00 C ATOM 3 C MET A 1 -22.856 -11.783 8.727 1.00 0.00 C ATOM 4 O MET A 1 -22.454 -12.928 8.663 1.00 0.00 O ATOM 5 CB MET A 1 -20.444 -11.084 8.860 1.00 0.00 C ATOM 6 CG MET A 1 -19.820 -10.346 7.674 1.00 0.00 C ATOM 7 SD MET A 1 -18.701 -9.060 8.282 1.00 0.00 S ATOM 8 CE MET A 1 -19.499 -7.659 7.460 1.00 0.00 C ATOM 0 H1 MET A 1 -21.757 -9.236 10.576 1.00 0.00 H new ATOM 0 H2 MET A 1 -22.982 -10.391 10.798 1.00 0.00 H new ATOM 0 H3 MET A 1 -21.356 -10.819 11.041 1.00 0.00 H new ATOM 0 HA MET A 1 -22.152 -9.815 8.363 1.00 0.00 H new ATOM 0 HB2 MET A 1 -19.876 -10.881 9.768 1.00 0.00 H new ATOM 0 HB3 MET A 1 -20.404 -12.161 8.694 1.00 0.00 H new ATOM 0 HG2 MET A 1 -19.275 -11.047 7.042 1.00 0.00 H new ATOM 0 HG3 MET A 1 -20.601 -9.901 7.057 1.00 0.00 H new ATOM 0 HE1 MET A 1 -18.962 -6.742 7.701 1.00 0.00 H new ATOM 0 HE2 MET A 1 -19.485 -7.814 6.381 1.00 0.00 H new ATOM 0 HE3 MET A 1 -20.531 -7.576 7.802 1.00 0.00 H new ATOM 20 N PRO A 2 -24.100 -11.434 8.545 1.00 0.00 N ATOM 21 CA PRO A 2 -25.140 -12.447 8.238 1.00 0.00 C ATOM 22 C PRO A 2 -24.986 -12.954 6.800 1.00 0.00 C ATOM 23 O PRO A 2 -25.261 -14.100 6.503 1.00 0.00 O ATOM 24 CB PRO A 2 -26.448 -11.680 8.407 1.00 0.00 C ATOM 25 CG PRO A 2 -26.088 -10.246 8.183 1.00 0.00 C ATOM 26 CD PRO A 2 -24.651 -10.077 8.608 1.00 0.00 C ATOM 0 HA PRO A 2 -25.082 -13.328 8.878 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -27.197 -12.015 7.690 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -26.868 -11.831 9.401 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -26.214 -9.977 7.134 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -26.740 -9.591 8.761 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -24.116 -9.398 7.944 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -24.578 -9.663 9.614 1.00 0.00 H new ATOM 34 N VAL A 3 -24.548 -12.110 5.907 1.00 0.00 N ATOM 35 CA VAL A 3 -24.377 -12.545 4.490 1.00 0.00 C ATOM 36 C VAL A 3 -22.915 -12.914 4.224 1.00 0.00 C ATOM 37 O VAL A 3 -22.074 -12.059 4.033 1.00 0.00 O ATOM 38 CB VAL A 3 -24.786 -11.334 3.651 1.00 0.00 C ATOM 39 CG1 VAL A 3 -24.433 -11.586 2.184 1.00 0.00 C ATOM 40 CG2 VAL A 3 -26.295 -11.111 3.779 1.00 0.00 C ATOM 0 H VAL A 3 -24.301 -11.139 6.096 1.00 0.00 H new ATOM 0 HA VAL A 3 -24.975 -13.425 4.253 1.00 0.00 H new ATOM 0 HB VAL A 3 -24.255 -10.451 4.007 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -24.725 -10.723 1.586 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -23.359 -11.746 2.091 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -24.964 -12.469 1.829 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -26.587 -10.248 3.181 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -26.825 -11.995 3.424 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -26.549 -10.931 4.824 1.00 0.00 H new ATOM 50 N LYS A 4 -22.607 -14.182 4.209 1.00 0.00 N ATOM 51 CA LYS A 4 -21.199 -14.603 3.955 1.00 0.00 C ATOM 52 C LYS A 4 -21.009 -14.948 2.475 1.00 0.00 C ATOM 53 O LYS A 4 -21.505 -15.945 1.991 1.00 0.00 O ATOM 54 CB LYS A 4 -20.992 -15.844 4.825 1.00 0.00 C ATOM 55 CG LYS A 4 -21.567 -15.594 6.221 1.00 0.00 C ATOM 56 CD LYS A 4 -22.724 -16.561 6.478 1.00 0.00 C ATOM 57 CE LYS A 4 -23.428 -16.181 7.782 1.00 0.00 C ATOM 58 NZ LYS A 4 -24.702 -16.953 7.768 1.00 0.00 N ATOM 0 H LYS A 4 -23.268 -14.944 4.361 1.00 0.00 H new ATOM 0 HA LYS A 4 -20.484 -13.815 4.192 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -21.479 -16.706 4.369 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -19.930 -16.079 4.895 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -20.791 -15.730 6.975 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -21.915 -14.564 6.303 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -23.430 -16.528 5.648 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -22.351 -17.583 6.539 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -22.820 -16.438 8.649 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -23.616 -15.109 7.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -25.243 -16.746 8.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -25.263 -16.682 6.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -24.491 -17.971 7.727 1.00 0.00 H new ATOM 72 N CYS A 5 -20.293 -14.129 1.752 1.00 0.00 N ATOM 73 CA CYS A 5 -20.072 -14.413 0.305 1.00 0.00 C ATOM 74 C CYS A 5 -18.615 -14.832 0.063 1.00 0.00 C ATOM 75 O CYS A 5 -17.732 -14.434 0.797 1.00 0.00 O ATOM 76 CB CYS A 5 -20.376 -13.095 -0.409 1.00 0.00 C ATOM 77 SG CYS A 5 -19.164 -11.845 0.087 1.00 0.00 S ATOM 0 H CYS A 5 -19.853 -13.277 2.100 1.00 0.00 H new ATOM 0 HA CYS A 5 -20.701 -15.227 -0.056 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -20.345 -13.239 -1.489 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -21.383 -12.759 -0.161 1.00 0.00 H new ATOM 82 N PRO A 6 -18.404 -15.624 -0.962 1.00 0.00 N ATOM 83 CA PRO A 6 -19.517 -16.087 -1.832 1.00 0.00 C ATOM 84 C PRO A 6 -20.331 -17.177 -1.129 1.00 0.00 C ATOM 85 O PRO A 6 -19.879 -17.789 -0.181 1.00 0.00 O ATOM 86 CB PRO A 6 -18.804 -16.653 -3.056 1.00 0.00 C ATOM 87 CG PRO A 6 -17.444 -17.044 -2.572 1.00 0.00 C ATOM 88 CD PRO A 6 -17.108 -16.156 -1.400 1.00 0.00 C ATOM 0 HA PRO A 6 -20.221 -15.293 -2.081 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -19.339 -17.511 -3.462 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -18.740 -15.912 -3.852 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -17.429 -18.093 -2.275 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -16.706 -16.927 -3.366 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -16.619 -16.717 -0.604 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -16.427 -15.356 -1.690 1.00 0.00 H new ATOM 96 N GLY A 7 -21.529 -17.422 -1.585 1.00 0.00 N ATOM 97 CA GLY A 7 -22.370 -18.470 -0.942 1.00 0.00 C ATOM 98 C GLY A 7 -23.702 -18.584 -1.685 1.00 0.00 C ATOM 99 O GLY A 7 -23.986 -17.827 -2.591 1.00 0.00 O ATOM 0 H GLY A 7 -21.961 -16.942 -2.374 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.850 -19.428 -0.957 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -22.546 -18.219 0.104 1.00 0.00 H new ATOM 103 N GLU A 8 -24.521 -19.529 -1.311 1.00 0.00 N ATOM 104 CA GLU A 8 -25.835 -19.691 -1.998 1.00 0.00 C ATOM 105 C GLU A 8 -26.967 -19.162 -1.114 1.00 0.00 C ATOM 106 O GLU A 8 -27.162 -19.611 -0.003 1.00 0.00 O ATOM 107 CB GLU A 8 -25.984 -21.197 -2.216 1.00 0.00 C ATOM 108 CG GLU A 8 -27.142 -21.463 -3.181 1.00 0.00 C ATOM 109 CD GLU A 8 -27.398 -22.967 -3.270 1.00 0.00 C ATOM 110 OE1 GLU A 8 -27.917 -23.518 -2.314 1.00 0.00 O ATOM 111 OE2 GLU A 8 -27.069 -23.544 -4.294 1.00 0.00 O ATOM 0 H GLU A 8 -24.338 -20.195 -0.561 1.00 0.00 H new ATOM 0 HA GLU A 8 -25.881 -19.136 -2.935 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -25.059 -21.610 -2.619 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -26.168 -21.696 -1.265 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -28.040 -20.950 -2.837 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -26.906 -21.065 -4.168 1.00 0.00 H new ATOM 118 N TYR A 9 -27.715 -18.210 -1.600 1.00 0.00 N ATOM 119 CA TYR A 9 -28.836 -17.653 -0.789 1.00 0.00 C ATOM 120 C TYR A 9 -30.078 -17.465 -1.665 1.00 0.00 C ATOM 121 O TYR A 9 -29.984 -17.323 -2.868 1.00 0.00 O ATOM 122 CB TYR A 9 -28.327 -16.302 -0.285 1.00 0.00 C ATOM 123 CG TYR A 9 -27.277 -16.524 0.777 1.00 0.00 C ATOM 124 CD1 TYR A 9 -27.659 -16.852 2.085 1.00 0.00 C ATOM 125 CD2 TYR A 9 -25.919 -16.401 0.454 1.00 0.00 C ATOM 126 CE1 TYR A 9 -26.684 -17.057 3.070 1.00 0.00 C ATOM 127 CE2 TYR A 9 -24.943 -16.607 1.439 1.00 0.00 C ATOM 128 CZ TYR A 9 -25.326 -16.935 2.747 1.00 0.00 C ATOM 129 OH TYR A 9 -24.365 -17.137 3.716 1.00 0.00 O ATOM 0 H TYR A 9 -27.599 -17.793 -2.524 1.00 0.00 H new ATOM 0 HA TYR A 9 -29.121 -18.313 0.031 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -27.908 -15.728 -1.111 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -29.153 -15.719 0.122 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -28.706 -16.947 2.334 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -25.624 -16.148 -0.554 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -26.979 -17.309 4.078 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -23.896 -16.513 1.190 1.00 0.00 H new ATOM 0 HH TYR A 9 -23.475 -17.015 3.325 1.00 0.00 H new ATOM 139 N GLN A 10 -31.240 -17.466 -1.071 1.00 0.00 N ATOM 140 CA GLN A 10 -32.485 -17.289 -1.873 1.00 0.00 C ATOM 141 C GLN A 10 -33.209 -16.008 -1.452 1.00 0.00 C ATOM 142 O GLN A 10 -33.196 -15.625 -0.299 1.00 0.00 O ATOM 143 CB GLN A 10 -33.338 -18.517 -1.554 1.00 0.00 C ATOM 144 CG GLN A 10 -32.834 -19.713 -2.364 1.00 0.00 C ATOM 145 CD GLN A 10 -31.430 -20.096 -1.892 1.00 0.00 C ATOM 146 OE1 GLN A 10 -30.475 -19.989 -2.637 1.00 0.00 O ATOM 147 NE2 GLN A 10 -31.262 -20.540 -0.677 1.00 0.00 N ATOM 0 H GLN A 10 -31.382 -17.581 -0.067 1.00 0.00 H new ATOM 0 HA GLN A 10 -32.280 -17.200 -2.940 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -33.289 -18.740 -0.488 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -34.383 -18.318 -1.791 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -33.512 -20.558 -2.245 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -32.817 -19.465 -3.425 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -32.063 -20.630 -0.052 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -30.330 -20.797 -0.352 1.00 0.00 H new ATOM 156 N VAL A 11 -33.841 -15.341 -2.379 1.00 0.00 N ATOM 157 CA VAL A 11 -34.566 -14.084 -2.031 1.00 0.00 C ATOM 158 C VAL A 11 -36.024 -14.168 -2.492 1.00 0.00 C ATOM 159 O VAL A 11 -36.307 -14.428 -3.644 1.00 0.00 O ATOM 160 CB VAL A 11 -33.828 -12.979 -2.786 1.00 0.00 C ATOM 161 CG1 VAL A 11 -34.425 -11.621 -2.416 1.00 0.00 C ATOM 162 CG2 VAL A 11 -32.346 -13.004 -2.407 1.00 0.00 C ATOM 0 H VAL A 11 -33.887 -15.611 -3.362 1.00 0.00 H new ATOM 0 HA VAL A 11 -34.583 -13.902 -0.956 1.00 0.00 H new ATOM 0 HB VAL A 11 -33.932 -13.141 -3.859 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -33.898 -10.833 -2.955 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -35.481 -11.602 -2.686 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -34.322 -11.458 -1.343 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -31.819 -12.216 -2.945 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -32.242 -12.842 -1.334 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -31.919 -13.972 -2.671 1.00 0.00 H new ATOM 172 N ASP A 12 -36.951 -13.947 -1.599 1.00 0.00 N ATOM 173 CA ASP A 12 -38.390 -14.012 -1.985 1.00 0.00 C ATOM 174 C ASP A 12 -38.669 -15.285 -2.789 1.00 0.00 C ATOM 175 O ASP A 12 -38.979 -16.322 -2.236 1.00 0.00 O ATOM 176 CB ASP A 12 -38.625 -12.770 -2.846 1.00 0.00 C ATOM 177 CG ASP A 12 -39.167 -11.638 -1.971 1.00 0.00 C ATOM 178 OD1 ASP A 12 -38.475 -11.246 -1.047 1.00 0.00 O ATOM 179 OD2 ASP A 12 -40.266 -11.183 -2.242 1.00 0.00 O ATOM 0 H ASP A 12 -36.774 -13.724 -0.619 1.00 0.00 H new ATOM 0 HA ASP A 12 -39.049 -14.037 -1.117 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -37.694 -12.462 -3.321 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -39.331 -12.996 -3.645 1.00 0.00 H new ATOM 184 N GLY A 13 -38.562 -15.217 -4.088 1.00 0.00 N ATOM 185 CA GLY A 13 -38.822 -16.425 -4.921 1.00 0.00 C ATOM 186 C GLY A 13 -37.772 -16.520 -6.028 1.00 0.00 C ATOM 187 O GLY A 13 -38.089 -16.517 -7.201 1.00 0.00 O ATOM 0 H GLY A 13 -38.306 -14.378 -4.608 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -38.793 -17.320 -4.300 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -39.820 -16.371 -5.356 1.00 0.00 H new ATOM 191 N LYS A 14 -36.521 -16.604 -5.667 1.00 0.00 N ATOM 192 CA LYS A 14 -35.450 -16.699 -6.701 1.00 0.00 C ATOM 193 C LYS A 14 -34.155 -17.223 -6.075 1.00 0.00 C ATOM 194 O LYS A 14 -34.037 -17.336 -4.871 1.00 0.00 O ATOM 195 CB LYS A 14 -35.260 -15.270 -7.208 1.00 0.00 C ATOM 196 CG LYS A 14 -35.065 -15.287 -8.725 1.00 0.00 C ATOM 197 CD LYS A 14 -35.624 -13.997 -9.328 1.00 0.00 C ATOM 198 CE LYS A 14 -34.587 -13.385 -10.274 1.00 0.00 C ATOM 199 NZ LYS A 14 -34.441 -11.972 -9.821 1.00 0.00 N ATOM 0 H LYS A 14 -36.193 -16.611 -4.701 1.00 0.00 H new ATOM 0 HA LYS A 14 -35.714 -17.385 -7.506 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -36.128 -14.663 -6.949 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -34.396 -14.814 -6.725 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -34.006 -15.384 -8.965 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -35.570 -16.151 -9.157 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -36.547 -14.206 -9.869 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -35.872 -13.290 -8.536 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -33.638 -13.918 -10.218 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -34.920 -13.435 -11.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -33.924 -11.428 -10.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -35.383 -11.553 -9.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -33.914 -11.948 -8.924 1.00 0.00 H new ATOM 213 N LYS A 15 -33.182 -17.545 -6.883 1.00 0.00 N ATOM 214 CA LYS A 15 -31.896 -18.062 -6.332 1.00 0.00 C ATOM 215 C LYS A 15 -30.733 -17.172 -6.779 1.00 0.00 C ATOM 216 O LYS A 15 -30.644 -16.778 -7.923 1.00 0.00 O ATOM 217 CB LYS A 15 -31.752 -19.466 -6.919 1.00 0.00 C ATOM 218 CG LYS A 15 -30.411 -20.064 -6.487 1.00 0.00 C ATOM 219 CD LYS A 15 -30.653 -21.167 -5.456 1.00 0.00 C ATOM 220 CE LYS A 15 -31.559 -22.242 -6.060 1.00 0.00 C ATOM 221 NZ LYS A 15 -30.710 -23.463 -6.134 1.00 0.00 N ATOM 0 H LYS A 15 -33.221 -17.473 -7.900 1.00 0.00 H new ATOM 0 HA LYS A 15 -31.887 -18.072 -5.242 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -32.571 -20.100 -6.579 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -31.811 -19.425 -8.007 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -29.886 -20.469 -7.352 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -29.774 -19.288 -6.062 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -29.704 -21.607 -5.149 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -31.114 -20.748 -4.562 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -32.440 -22.410 -5.440 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -31.916 -21.949 -7.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -31.262 -24.246 -6.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -29.883 -23.275 -6.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -30.391 -23.722 -5.179 1.00 0.00 H new ATOM 235 N VAL A 16 -29.839 -16.856 -5.882 1.00 0.00 N ATOM 236 CA VAL A 16 -28.681 -15.993 -6.255 1.00 0.00 C ATOM 237 C VAL A 16 -27.396 -16.534 -5.623 1.00 0.00 C ATOM 238 O VAL A 16 -27.401 -17.042 -4.519 1.00 0.00 O ATOM 239 CB VAL A 16 -29.019 -14.614 -5.689 1.00 0.00 C ATOM 240 CG1 VAL A 16 -27.790 -13.708 -5.782 1.00 0.00 C ATOM 241 CG2 VAL A 16 -30.165 -14.001 -6.498 1.00 0.00 C ATOM 0 H VAL A 16 -29.860 -17.158 -4.908 1.00 0.00 H new ATOM 0 HA VAL A 16 -28.516 -15.962 -7.332 1.00 0.00 H new ATOM 0 HB VAL A 16 -29.319 -14.712 -4.646 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -28.031 -12.725 -5.378 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -26.972 -14.145 -5.209 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -27.490 -13.608 -6.825 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -30.408 -13.017 -6.096 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -29.863 -13.903 -7.541 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -31.041 -14.646 -6.434 1.00 0.00 H new ATOM 251 N ILE A 17 -26.293 -16.428 -6.313 1.00 0.00 N ATOM 252 CA ILE A 17 -25.009 -16.939 -5.751 1.00 0.00 C ATOM 253 C ILE A 17 -24.063 -15.773 -5.452 1.00 0.00 C ATOM 254 O ILE A 17 -23.490 -15.181 -6.347 1.00 0.00 O ATOM 255 CB ILE A 17 -24.427 -17.835 -6.843 1.00 0.00 C ATOM 256 CG1 ILE A 17 -25.353 -19.034 -7.065 1.00 0.00 C ATOM 257 CG2 ILE A 17 -23.045 -18.331 -6.416 1.00 0.00 C ATOM 258 CD1 ILE A 17 -25.160 -19.573 -8.483 1.00 0.00 C ATOM 0 H ILE A 17 -26.225 -16.010 -7.241 1.00 0.00 H new ATOM 0 HA ILE A 17 -25.153 -17.479 -4.815 1.00 0.00 H new ATOM 0 HB ILE A 17 -24.338 -17.267 -7.769 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -25.136 -19.814 -6.335 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -26.391 -18.738 -6.916 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -22.631 -18.970 -7.196 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -22.385 -17.478 -6.258 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -23.132 -18.899 -5.490 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -25.819 -20.427 -8.641 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -25.399 -18.792 -9.205 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -24.124 -19.885 -8.616 1.00 0.00 H new ATOM 270 N LEU A 18 -23.892 -15.441 -4.202 1.00 0.00 N ATOM 271 CA LEU A 18 -22.981 -14.314 -3.849 1.00 0.00 C ATOM 272 C LEU A 18 -21.549 -14.640 -4.282 1.00 0.00 C ATOM 273 O LEU A 18 -21.025 -15.694 -3.983 1.00 0.00 O ATOM 274 CB LEU A 18 -23.068 -14.196 -2.327 1.00 0.00 C ATOM 275 CG LEU A 18 -24.235 -13.283 -1.947 1.00 0.00 C ATOM 276 CD1 LEU A 18 -24.229 -13.052 -0.435 1.00 0.00 C ATOM 277 CD2 LEU A 18 -24.089 -11.940 -2.665 1.00 0.00 C ATOM 0 H LEU A 18 -24.343 -15.900 -3.410 1.00 0.00 H new ATOM 0 HA LEU A 18 -23.260 -13.385 -4.345 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -23.206 -15.182 -1.883 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -22.136 -13.795 -1.930 1.00 0.00 H new ATOM 0 HG LEU A 18 -25.173 -13.753 -2.242 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -25.060 -12.401 -0.163 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -24.333 -14.007 0.079 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -23.290 -12.582 -0.142 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -24.921 -11.290 -2.394 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -23.151 -11.470 -2.371 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -24.091 -12.102 -3.743 1.00 0.00 H new ATOM 289 N ASP A 19 -20.914 -13.741 -4.985 1.00 0.00 N ATOM 290 CA ASP A 19 -19.517 -14.001 -5.437 1.00 0.00 C ATOM 291 C ASP A 19 -18.523 -13.628 -4.333 1.00 0.00 C ATOM 292 O ASP A 19 -18.875 -13.529 -3.175 1.00 0.00 O ATOM 293 CB ASP A 19 -19.322 -13.104 -6.660 1.00 0.00 C ATOM 294 CG ASP A 19 -18.366 -13.781 -7.643 1.00 0.00 C ATOM 295 OD1 ASP A 19 -18.199 -14.985 -7.543 1.00 0.00 O ATOM 296 OD2 ASP A 19 -17.815 -13.083 -8.479 1.00 0.00 O ATOM 0 H ASP A 19 -21.301 -12.840 -5.265 1.00 0.00 H new ATOM 0 HA ASP A 19 -19.349 -15.052 -5.672 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -20.281 -12.914 -7.142 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -18.922 -12.137 -6.355 1.00 0.00 H new ATOM 301 N GLU A 20 -17.283 -13.422 -4.684 1.00 0.00 N ATOM 302 CA GLU A 20 -16.267 -13.056 -3.655 1.00 0.00 C ATOM 303 C GLU A 20 -16.472 -11.609 -3.199 1.00 0.00 C ATOM 304 O GLU A 20 -15.917 -11.176 -2.210 1.00 0.00 O ATOM 305 CB GLU A 20 -14.919 -13.213 -4.357 1.00 0.00 C ATOM 306 CG GLU A 20 -14.050 -14.204 -3.581 1.00 0.00 C ATOM 307 CD GLU A 20 -12.802 -14.541 -4.400 1.00 0.00 C ATOM 308 OE1 GLU A 20 -12.908 -14.580 -5.614 1.00 0.00 O ATOM 309 OE2 GLU A 20 -11.763 -14.753 -3.797 1.00 0.00 O ATOM 0 H GLU A 20 -16.929 -13.491 -5.638 1.00 0.00 H new ATOM 0 HA GLU A 20 -16.337 -13.681 -2.764 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -15.068 -13.566 -5.378 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -14.417 -12.248 -4.423 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -13.763 -13.777 -2.620 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -14.615 -15.112 -3.370 1.00 0.00 H new ATOM 316 N ASP A 21 -17.266 -10.860 -3.914 1.00 0.00 N ATOM 317 CA ASP A 21 -17.504 -9.441 -3.521 1.00 0.00 C ATOM 318 C ASP A 21 -18.917 -9.281 -2.952 1.00 0.00 C ATOM 319 O ASP A 21 -19.500 -8.217 -3.003 1.00 0.00 O ATOM 320 CB ASP A 21 -17.354 -8.643 -4.816 1.00 0.00 C ATOM 321 CG ASP A 21 -15.870 -8.436 -5.120 1.00 0.00 C ATOM 322 OD1 ASP A 21 -15.209 -7.785 -4.327 1.00 0.00 O ATOM 323 OD2 ASP A 21 -15.418 -8.931 -6.139 1.00 0.00 O ATOM 0 H ASP A 21 -17.760 -11.168 -4.752 1.00 0.00 H new ATOM 0 HA ASP A 21 -16.811 -9.102 -2.751 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -17.834 -9.172 -5.639 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -17.854 -7.679 -4.722 1.00 0.00 H new ATOM 328 N CYS A 22 -19.470 -10.331 -2.408 1.00 0.00 N ATOM 329 CA CYS A 22 -20.845 -10.235 -1.836 1.00 0.00 C ATOM 330 C CYS A 22 -21.798 -9.607 -2.857 1.00 0.00 C ATOM 331 O CYS A 22 -22.816 -9.045 -2.506 1.00 0.00 O ATOM 332 CB CYS A 22 -20.702 -9.333 -0.611 1.00 0.00 C ATOM 333 SG CYS A 22 -20.283 -10.340 0.836 1.00 0.00 S ATOM 0 H CYS A 22 -19.031 -11.249 -2.335 1.00 0.00 H new ATOM 0 HA CYS A 22 -21.255 -11.211 -1.577 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -19.927 -8.586 -0.784 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -21.632 -8.792 -0.434 1.00 0.00 H new ATOM 338 N PHE A 23 -21.473 -9.697 -4.118 1.00 0.00 N ATOM 339 CA PHE A 23 -22.360 -9.103 -5.160 1.00 0.00 C ATOM 340 C PHE A 23 -23.051 -10.209 -5.962 1.00 0.00 C ATOM 341 O PHE A 23 -22.570 -11.321 -6.046 1.00 0.00 O ATOM 342 CB PHE A 23 -21.426 -8.292 -6.059 1.00 0.00 C ATOM 343 CG PHE A 23 -22.173 -7.845 -7.292 1.00 0.00 C ATOM 344 CD1 PHE A 23 -23.032 -6.740 -7.229 1.00 0.00 C ATOM 345 CD2 PHE A 23 -22.008 -8.535 -8.501 1.00 0.00 C ATOM 346 CE1 PHE A 23 -23.726 -6.324 -8.374 1.00 0.00 C ATOM 347 CE2 PHE A 23 -22.701 -8.119 -9.646 1.00 0.00 C ATOM 348 CZ PHE A 23 -23.559 -7.015 -9.583 1.00 0.00 C ATOM 0 H PHE A 23 -20.633 -10.155 -4.472 1.00 0.00 H new ATOM 0 HA PHE A 23 -23.148 -8.486 -4.728 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -21.045 -7.426 -5.518 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -20.563 -8.895 -6.343 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -23.160 -6.208 -6.298 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -21.347 -9.387 -8.550 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -24.388 -5.472 -8.325 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -22.573 -8.651 -10.577 1.00 0.00 H new ATOM 0 HZ PHE A 23 -24.093 -6.695 -10.466 1.00 0.00 H new ATOM 358 N MET A 24 -24.176 -9.912 -6.552 1.00 0.00 N ATOM 359 CA MET A 24 -24.898 -10.946 -7.348 1.00 0.00 C ATOM 360 C MET A 24 -24.012 -11.447 -8.492 1.00 0.00 C ATOM 361 O MET A 24 -23.339 -10.679 -9.150 1.00 0.00 O ATOM 362 CB MET A 24 -26.131 -10.231 -7.901 1.00 0.00 C ATOM 363 CG MET A 24 -27.395 -10.933 -7.401 1.00 0.00 C ATOM 364 SD MET A 24 -28.816 -10.390 -8.382 1.00 0.00 S ATOM 365 CE MET A 24 -29.379 -12.031 -8.894 1.00 0.00 C ATOM 0 H MET A 24 -24.627 -8.998 -6.518 1.00 0.00 H new ATOM 0 HA MET A 24 -25.165 -11.816 -6.748 1.00 0.00 H new ATOM 0 HB2 MET A 24 -26.132 -9.188 -7.585 1.00 0.00 H new ATOM 0 HB3 MET A 24 -26.108 -10.233 -8.991 1.00 0.00 H new ATOM 0 HG2 MET A 24 -27.278 -12.014 -7.478 1.00 0.00 H new ATOM 0 HG3 MET A 24 -27.558 -10.705 -6.348 1.00 0.00 H new ATOM 0 HE1 MET A 24 -29.565 -12.033 -9.968 1.00 0.00 H new ATOM 0 HE2 MET A 24 -28.612 -12.769 -8.657 1.00 0.00 H new ATOM 0 HE3 MET A 24 -30.299 -12.281 -8.366 1.00 0.00 H new ATOM 375 N GLN A 25 -24.008 -12.730 -8.734 1.00 0.00 N ATOM 376 CA GLN A 25 -23.165 -13.278 -9.835 1.00 0.00 C ATOM 377 C GLN A 25 -23.911 -13.183 -11.169 1.00 0.00 C ATOM 378 O GLN A 25 -23.316 -13.217 -12.228 1.00 0.00 O ATOM 379 CB GLN A 25 -22.925 -14.741 -9.459 1.00 0.00 C ATOM 380 CG GLN A 25 -21.421 -15.002 -9.361 1.00 0.00 C ATOM 381 CD GLN A 25 -20.768 -14.754 -10.721 1.00 0.00 C ATOM 382 OE1 GLN A 25 -20.734 -15.631 -11.561 1.00 0.00 O ATOM 383 NE2 GLN A 25 -20.246 -13.585 -10.977 1.00 0.00 N ATOM 0 H GLN A 25 -24.551 -13.422 -8.218 1.00 0.00 H new ATOM 0 HA GLN A 25 -22.231 -12.728 -9.953 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -23.407 -14.967 -8.508 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -23.371 -15.398 -10.206 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -20.977 -14.350 -8.609 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -21.240 -16.028 -9.041 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -20.274 -12.848 -10.272 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -19.810 -13.408 -11.882 1.00 0.00 H new ATOM 392 N ASN A 26 -25.210 -13.062 -11.125 1.00 0.00 N ATOM 393 CA ASN A 26 -25.992 -12.964 -12.390 1.00 0.00 C ATOM 394 C ASN A 26 -26.852 -11.697 -12.379 1.00 0.00 C ATOM 395 O ASN A 26 -28.059 -11.765 -12.253 1.00 0.00 O ATOM 396 CB ASN A 26 -26.876 -14.212 -12.409 1.00 0.00 C ATOM 397 CG ASN A 26 -27.563 -14.373 -11.052 1.00 0.00 C ATOM 398 OD1 ASN A 26 -26.941 -14.766 -10.085 1.00 0.00 O ATOM 399 ND2 ASN A 26 -28.830 -14.085 -10.937 1.00 0.00 N ATOM 0 H ASN A 26 -25.763 -13.027 -10.269 1.00 0.00 H new ATOM 0 HA ASN A 26 -25.351 -12.907 -13.270 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -27.623 -14.129 -13.199 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -26.274 -15.093 -12.630 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -29.297 -14.190 -10.036 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -29.354 -13.755 -11.748 1.00 0.00 H new ATOM 406 N PRO A 27 -26.194 -10.579 -12.513 1.00 0.00 N ATOM 407 CA PRO A 27 -26.899 -9.273 -12.521 1.00 0.00 C ATOM 408 C PRO A 27 -27.692 -9.100 -13.820 1.00 0.00 C ATOM 409 O PRO A 27 -28.476 -8.182 -13.962 1.00 0.00 O ATOM 410 CB PRO A 27 -25.765 -8.254 -12.433 1.00 0.00 C ATOM 411 CG PRO A 27 -24.569 -8.963 -12.984 1.00 0.00 C ATOM 412 CD PRO A 27 -24.744 -10.425 -12.670 1.00 0.00 C ATOM 0 HA PRO A 27 -27.621 -9.170 -11.711 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -25.993 -7.358 -13.009 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -25.597 -7.937 -11.404 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -24.489 -8.806 -14.060 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -23.652 -8.579 -12.536 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -24.360 -11.055 -13.472 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -24.211 -10.705 -11.761 1.00 0.00 H new ATOM 420 N GLU A 28 -27.496 -9.974 -14.768 1.00 0.00 N ATOM 421 CA GLU A 28 -28.242 -9.858 -16.054 1.00 0.00 C ATOM 422 C GLU A 28 -29.727 -9.604 -15.780 1.00 0.00 C ATOM 423 O GLU A 28 -30.386 -8.880 -16.499 1.00 0.00 O ATOM 424 CB GLU A 28 -28.048 -11.206 -16.749 1.00 0.00 C ATOM 425 CG GLU A 28 -26.661 -11.254 -17.393 1.00 0.00 C ATOM 426 CD GLU A 28 -25.948 -12.541 -16.975 1.00 0.00 C ATOM 427 OE1 GLU A 28 -26.351 -13.122 -15.981 1.00 0.00 O ATOM 428 OE2 GLU A 28 -25.011 -12.923 -17.656 1.00 0.00 O ATOM 0 H GLU A 28 -26.852 -10.763 -14.709 1.00 0.00 H new ATOM 0 HA GLU A 28 -27.885 -9.030 -16.666 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -28.154 -12.017 -16.029 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -28.818 -11.350 -17.507 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -26.751 -11.212 -18.478 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -26.076 -10.386 -17.087 1.00 0.00 H new ATOM 435 N ASP A 29 -30.255 -10.193 -14.743 1.00 0.00 N ATOM 436 CA ASP A 29 -31.696 -9.985 -14.421 1.00 0.00 C ATOM 437 C ASP A 29 -31.850 -8.835 -13.421 1.00 0.00 C ATOM 438 O ASP A 29 -32.260 -7.747 -13.773 1.00 0.00 O ATOM 439 CB ASP A 29 -32.157 -11.303 -13.798 1.00 0.00 C ATOM 440 CG ASP A 29 -32.103 -12.412 -14.851 1.00 0.00 C ATOM 441 OD1 ASP A 29 -32.805 -12.295 -15.841 1.00 0.00 O ATOM 442 OD2 ASP A 29 -31.360 -13.359 -14.648 1.00 0.00 O ATOM 0 H ASP A 29 -29.752 -10.809 -14.105 1.00 0.00 H new ATOM 0 HA ASP A 29 -32.284 -9.724 -15.301 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -31.520 -11.560 -12.951 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -33.172 -11.201 -13.414 1.00 0.00 H new ATOM 447 N TRP A 30 -31.523 -9.067 -12.180 1.00 0.00 N ATOM 448 CA TRP A 30 -31.649 -7.987 -11.159 1.00 0.00 C ATOM 449 C TRP A 30 -33.055 -7.382 -11.197 1.00 0.00 C ATOM 450 O TRP A 30 -33.387 -6.612 -12.076 1.00 0.00 O ATOM 451 CB TRP A 30 -30.605 -6.943 -11.560 1.00 0.00 C ATOM 452 CG TRP A 30 -30.714 -5.757 -10.657 1.00 0.00 C ATOM 453 CD1 TRP A 30 -30.048 -5.606 -9.488 1.00 0.00 C ATOM 454 CD2 TRP A 30 -31.521 -4.555 -10.826 1.00 0.00 C ATOM 455 NE1 TRP A 30 -30.396 -4.389 -8.930 1.00 0.00 N ATOM 456 CE2 TRP A 30 -31.299 -3.705 -9.717 1.00 0.00 C ATOM 457 CE3 TRP A 30 -32.415 -4.126 -11.826 1.00 0.00 C ATOM 458 CZ2 TRP A 30 -31.944 -2.470 -9.604 1.00 0.00 C ATOM 459 CZ3 TRP A 30 -33.065 -2.885 -11.715 1.00 0.00 C ATOM 460 CH2 TRP A 30 -32.829 -2.059 -10.606 1.00 0.00 C ATOM 0 H TRP A 30 -31.174 -9.958 -11.828 1.00 0.00 H new ATOM 0 HA TRP A 30 -31.491 -8.356 -10.146 1.00 0.00 H new ATOM 0 HB2 TRP A 30 -29.604 -7.371 -11.497 1.00 0.00 H new ATOM 0 HB3 TRP A 30 -30.757 -6.640 -12.596 1.00 0.00 H new ATOM 0 HD1 TRP A 30 -29.358 -6.319 -9.061 1.00 0.00 H new ATOM 0 HE1 TRP A 30 -30.029 -4.040 -8.044 1.00 0.00 H new ATOM 0 HE3 TRP A 30 -32.602 -4.755 -12.684 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 -31.760 -1.837 -8.748 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 -33.749 -2.566 -12.487 1.00 0.00 H new ATOM 0 HH2 TRP A 30 -33.331 -1.106 -10.526 1.00 0.00 H new ATOM 471 N ASP A 31 -33.885 -7.726 -10.250 1.00 0.00 N ATOM 472 CA ASP A 31 -35.269 -7.171 -10.233 1.00 0.00 C ATOM 473 C ASP A 31 -35.401 -6.109 -9.138 1.00 0.00 C ATOM 474 O ASP A 31 -34.428 -5.695 -8.539 1.00 0.00 O ATOM 475 CB ASP A 31 -36.172 -8.368 -9.933 1.00 0.00 C ATOM 476 CG ASP A 31 -36.859 -8.826 -11.220 1.00 0.00 C ATOM 477 OD1 ASP A 31 -36.737 -8.131 -12.216 1.00 0.00 O ATOM 478 OD2 ASP A 31 -37.497 -9.867 -11.191 1.00 0.00 O ATOM 0 H ASP A 31 -33.665 -8.367 -9.488 1.00 0.00 H new ATOM 0 HA ASP A 31 -35.532 -6.688 -11.174 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -35.584 -9.184 -9.512 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -36.919 -8.096 -9.187 1.00 0.00 H new ATOM 483 N GLU A 32 -36.599 -5.665 -8.873 1.00 0.00 N ATOM 484 CA GLU A 32 -36.795 -4.629 -7.818 1.00 0.00 C ATOM 485 C GLU A 32 -36.585 -5.238 -6.428 1.00 0.00 C ATOM 486 O GLU A 32 -35.756 -4.790 -5.662 1.00 0.00 O ATOM 487 CB GLU A 32 -38.242 -4.162 -7.985 1.00 0.00 C ATOM 488 CG GLU A 32 -38.317 -3.118 -9.100 1.00 0.00 C ATOM 489 CD GLU A 32 -39.658 -2.387 -9.027 1.00 0.00 C ATOM 490 OE1 GLU A 32 -39.955 -1.839 -7.978 1.00 0.00 O ATOM 491 OE2 GLU A 32 -40.365 -2.386 -10.021 1.00 0.00 O ATOM 0 H GLU A 32 -37.451 -5.974 -9.341 1.00 0.00 H new ATOM 0 HA GLU A 32 -36.086 -3.806 -7.913 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -38.884 -5.010 -8.223 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -38.608 -3.738 -7.050 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -37.497 -2.406 -9.002 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -38.206 -3.600 -10.071 1.00 0.00 H new ATOM 498 N LYS A 33 -37.332 -6.256 -6.097 1.00 0.00 N ATOM 499 CA LYS A 33 -37.176 -6.890 -4.756 1.00 0.00 C ATOM 500 C LYS A 33 -35.720 -7.308 -4.530 1.00 0.00 C ATOM 501 O LYS A 33 -35.252 -7.377 -3.410 1.00 0.00 O ATOM 502 CB LYS A 33 -38.086 -8.119 -4.793 1.00 0.00 C ATOM 503 CG LYS A 33 -37.466 -9.188 -5.694 1.00 0.00 C ATOM 504 CD LYS A 33 -38.504 -10.272 -5.989 1.00 0.00 C ATOM 505 CE LYS A 33 -39.589 -9.705 -6.907 1.00 0.00 C ATOM 506 NZ LYS A 33 -40.213 -10.897 -7.545 1.00 0.00 N ATOM 0 H LYS A 33 -38.043 -6.676 -6.696 1.00 0.00 H new ATOM 0 HA LYS A 33 -37.438 -6.210 -3.946 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -38.224 -8.513 -3.786 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -39.073 -7.843 -5.165 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -37.120 -8.738 -6.625 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -36.594 -9.627 -5.209 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -38.025 -11.130 -6.461 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -38.949 -10.627 -5.059 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -40.323 -9.129 -6.343 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -39.164 -9.034 -7.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -40.968 -10.590 -8.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -39.492 -11.421 -8.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -40.615 -11.513 -6.810 1.00 0.00 H new ATOM 520 N VAL A 34 -35.002 -7.587 -5.582 1.00 0.00 N ATOM 521 CA VAL A 34 -33.577 -8.001 -5.425 1.00 0.00 C ATOM 522 C VAL A 34 -32.707 -6.791 -5.074 1.00 0.00 C ATOM 523 O VAL A 34 -31.917 -6.829 -4.153 1.00 0.00 O ATOM 524 CB VAL A 34 -33.179 -8.571 -6.787 1.00 0.00 C ATOM 525 CG1 VAL A 34 -31.741 -9.088 -6.722 1.00 0.00 C ATOM 526 CG2 VAL A 34 -34.117 -9.724 -7.150 1.00 0.00 C ATOM 0 H VAL A 34 -35.339 -7.547 -6.544 1.00 0.00 H new ATOM 0 HA VAL A 34 -33.445 -8.728 -4.623 1.00 0.00 H new ATOM 0 HB VAL A 34 -33.252 -7.790 -7.543 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -31.456 -9.495 -7.692 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -31.071 -8.269 -6.461 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -31.669 -9.870 -5.966 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -33.834 -10.131 -8.121 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -34.043 -10.505 -6.393 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -35.143 -9.358 -7.195 1.00 0.00 H new ATOM 536 N ALA A 35 -32.844 -5.718 -5.803 1.00 0.00 N ATOM 537 CA ALA A 35 -32.022 -4.508 -5.512 1.00 0.00 C ATOM 538 C ALA A 35 -32.296 -4.006 -4.091 1.00 0.00 C ATOM 539 O ALA A 35 -31.387 -3.731 -3.333 1.00 0.00 O ATOM 540 CB ALA A 35 -32.468 -3.469 -6.542 1.00 0.00 C ATOM 0 H ALA A 35 -33.489 -5.626 -6.588 1.00 0.00 H new ATOM 0 HA ALA A 35 -30.953 -4.713 -5.574 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -31.907 -2.546 -6.394 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -32.282 -3.849 -7.546 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -33.533 -3.270 -6.421 1.00 0.00 H new ATOM 546 N GLU A 36 -33.543 -3.879 -3.727 1.00 0.00 N ATOM 547 CA GLU A 36 -33.875 -3.390 -2.356 1.00 0.00 C ATOM 548 C GLU A 36 -33.372 -4.379 -1.299 1.00 0.00 C ATOM 549 O GLU A 36 -32.826 -3.992 -0.285 1.00 0.00 O ATOM 550 CB GLU A 36 -35.401 -3.307 -2.330 1.00 0.00 C ATOM 551 CG GLU A 36 -35.836 -2.207 -1.359 1.00 0.00 C ATOM 552 CD GLU A 36 -36.939 -2.742 -0.443 1.00 0.00 C ATOM 553 OE1 GLU A 36 -37.024 -3.949 -0.296 1.00 0.00 O ATOM 554 OE2 GLU A 36 -37.677 -1.935 0.095 1.00 0.00 O ATOM 0 H GLU A 36 -34.346 -4.092 -4.318 1.00 0.00 H new ATOM 0 HA GLU A 36 -33.407 -2.431 -2.135 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -35.781 -3.096 -3.329 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -35.823 -4.264 -2.024 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -34.985 -1.874 -0.765 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -36.197 -1.340 -1.913 1.00 0.00 H new ATOM 561 N TRP A 37 -33.558 -5.650 -1.526 1.00 0.00 N ATOM 562 CA TRP A 37 -33.094 -6.662 -0.530 1.00 0.00 C ATOM 563 C TRP A 37 -31.592 -6.513 -0.274 1.00 0.00 C ATOM 564 O TRP A 37 -31.144 -6.495 0.856 1.00 0.00 O ATOM 565 CB TRP A 37 -33.396 -8.015 -1.175 1.00 0.00 C ATOM 566 CG TRP A 37 -32.763 -9.103 -0.368 1.00 0.00 C ATOM 567 CD1 TRP A 37 -33.122 -9.447 0.890 1.00 0.00 C ATOM 568 CD2 TRP A 37 -31.672 -9.994 -0.739 1.00 0.00 C ATOM 569 NE1 TRP A 37 -32.322 -10.492 1.315 1.00 0.00 N ATOM 570 CE2 TRP A 37 -31.412 -10.865 0.346 1.00 0.00 C ATOM 571 CE3 TRP A 37 -30.890 -10.130 -1.903 1.00 0.00 C ATOM 572 CZ2 TRP A 37 -30.411 -11.836 0.280 1.00 0.00 C ATOM 573 CZ3 TRP A 37 -29.881 -11.106 -1.973 1.00 0.00 C ATOM 574 CH2 TRP A 37 -29.643 -11.957 -0.884 1.00 0.00 C ATOM 0 H TRP A 37 -34.010 -6.033 -2.356 1.00 0.00 H new ATOM 0 HA TRP A 37 -33.589 -6.547 0.434 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -34.473 -8.170 -1.233 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -33.015 -8.036 -2.196 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -33.906 -8.981 1.469 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -32.395 -10.933 2.232 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -31.067 -9.480 -2.747 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -30.231 -12.489 1.121 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -29.286 -11.201 -2.869 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -28.867 -12.706 -0.943 1.00 0.00 H new ATOM 585 N LEU A 38 -30.809 -6.412 -1.312 1.00 0.00 N ATOM 586 CA LEU A 38 -29.334 -6.272 -1.126 1.00 0.00 C ATOM 587 C LEU A 38 -29.009 -4.979 -0.373 1.00 0.00 C ATOM 588 O LEU A 38 -28.179 -4.958 0.512 1.00 0.00 O ATOM 589 CB LEU A 38 -28.760 -6.225 -2.542 1.00 0.00 C ATOM 590 CG LEU A 38 -28.903 -7.599 -3.198 1.00 0.00 C ATOM 591 CD1 LEU A 38 -29.004 -7.432 -4.715 1.00 0.00 C ATOM 592 CD2 LEU A 38 -27.680 -8.453 -2.860 1.00 0.00 C ATOM 0 H LEU A 38 -31.125 -6.420 -2.282 1.00 0.00 H new ATOM 0 HA LEU A 38 -28.915 -7.090 -0.540 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -29.283 -5.472 -3.133 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -27.710 -5.933 -2.511 1.00 0.00 H new ATOM 0 HG LEU A 38 -29.803 -8.088 -2.826 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -29.106 -8.411 -5.183 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -29.874 -6.822 -4.957 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -28.104 -6.944 -5.088 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -27.780 -9.433 -3.327 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -26.780 -7.964 -3.233 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -27.607 -8.572 -1.779 1.00 0.00 H new ATOM 604 N ALA A 39 -29.652 -3.898 -0.721 1.00 0.00 N ATOM 605 CA ALA A 39 -29.372 -2.607 -0.027 1.00 0.00 C ATOM 606 C ALA A 39 -29.804 -2.684 1.441 1.00 0.00 C ATOM 607 O ALA A 39 -29.274 -1.993 2.290 1.00 0.00 O ATOM 608 CB ALA A 39 -30.205 -1.568 -0.776 1.00 0.00 C ATOM 0 H ALA A 39 -30.359 -3.852 -1.455 1.00 0.00 H new ATOM 0 HA ALA A 39 -28.310 -2.361 -0.030 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -30.054 -0.587 -0.325 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -29.896 -1.539 -1.821 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -31.260 -1.836 -0.717 1.00 0.00 H new ATOM 614 N ARG A 40 -30.766 -3.511 1.744 1.00 0.00 N ATOM 615 CA ARG A 40 -31.236 -3.624 3.156 1.00 0.00 C ATOM 616 C ARG A 40 -30.254 -4.455 3.990 1.00 0.00 C ATOM 617 O ARG A 40 -29.930 -4.110 5.108 1.00 0.00 O ATOM 618 CB ARG A 40 -32.589 -4.331 3.062 1.00 0.00 C ATOM 619 CG ARG A 40 -33.040 -4.762 4.460 1.00 0.00 C ATOM 620 CD ARG A 40 -34.230 -5.717 4.341 1.00 0.00 C ATOM 621 NE ARG A 40 -35.342 -5.035 5.057 1.00 0.00 N ATOM 622 CZ ARG A 40 -35.924 -5.620 6.068 1.00 0.00 C ATOM 623 NH1 ARG A 40 -35.202 -6.142 7.022 1.00 0.00 N ATOM 624 NH2 ARG A 40 -37.226 -5.683 6.125 1.00 0.00 N ATOM 0 H ARG A 40 -31.247 -4.114 1.077 1.00 0.00 H new ATOM 0 HA ARG A 40 -31.310 -2.651 3.642 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -33.329 -3.665 2.619 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -32.512 -5.201 2.409 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -32.219 -5.251 4.984 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -33.319 -3.888 5.049 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -34.486 -5.901 3.298 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -34.006 -6.685 4.790 1.00 0.00 H new ATOM 0 HE ARG A 40 -35.650 -4.110 4.757 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -34.184 -6.092 6.977 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -35.656 -6.600 7.813 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -37.789 -5.275 5.379 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -37.680 -6.140 6.915 1.00 0.00 H new ATOM 638 N GLU A 41 -29.786 -5.551 3.460 1.00 0.00 N ATOM 639 CA GLU A 41 -28.834 -6.406 4.230 1.00 0.00 C ATOM 640 C GLU A 41 -27.445 -5.762 4.277 1.00 0.00 C ATOM 641 O GLU A 41 -26.684 -5.979 5.199 1.00 0.00 O ATOM 642 CB GLU A 41 -28.784 -7.728 3.465 1.00 0.00 C ATOM 643 CG GLU A 41 -29.984 -8.593 3.857 1.00 0.00 C ATOM 644 CD GLU A 41 -29.510 -9.759 4.727 1.00 0.00 C ATOM 645 OE1 GLU A 41 -28.406 -9.679 5.240 1.00 0.00 O ATOM 646 OE2 GLU A 41 -30.259 -10.712 4.866 1.00 0.00 O ATOM 0 H GLU A 41 -30.020 -5.893 2.528 1.00 0.00 H new ATOM 0 HA GLU A 41 -29.151 -6.540 5.264 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -28.794 -7.539 2.392 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -27.856 -8.254 3.688 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -30.716 -7.994 4.400 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -30.481 -8.971 2.963 1.00 0.00 H new ATOM 653 N LEU A 42 -27.105 -4.978 3.292 1.00 0.00 N ATOM 654 CA LEU A 42 -25.761 -4.330 3.287 1.00 0.00 C ATOM 655 C LEU A 42 -25.762 -3.093 4.188 1.00 0.00 C ATOM 656 O LEU A 42 -24.876 -2.902 4.996 1.00 0.00 O ATOM 657 CB LEU A 42 -25.516 -3.935 1.831 1.00 0.00 C ATOM 658 CG LEU A 42 -24.145 -4.448 1.387 1.00 0.00 C ATOM 659 CD1 LEU A 42 -24.224 -5.954 1.125 1.00 0.00 C ATOM 660 CD2 LEU A 42 -23.725 -3.729 0.102 1.00 0.00 C ATOM 0 H LEU A 42 -27.697 -4.758 2.491 1.00 0.00 H new ATOM 0 HA LEU A 42 -24.983 -4.994 3.665 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -26.296 -4.352 1.194 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -25.563 -2.851 1.724 1.00 0.00 H new ATOM 0 HG LEU A 42 -23.412 -4.253 2.170 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -23.247 -6.320 0.809 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -24.525 -6.467 2.038 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -24.956 -6.149 0.341 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -22.748 -4.093 -0.216 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -24.458 -3.925 -0.681 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -23.670 -2.656 0.287 1.00 0.00 H new ATOM 672 N GLU A 43 -26.748 -2.250 4.055 1.00 0.00 N ATOM 673 CA GLU A 43 -26.799 -1.025 4.905 1.00 0.00 C ATOM 674 C GLU A 43 -27.810 -1.209 6.040 1.00 0.00 C ATOM 675 O GLU A 43 -27.523 -0.940 7.190 1.00 0.00 O ATOM 676 CB GLU A 43 -27.247 0.093 3.962 1.00 0.00 C ATOM 677 CG GLU A 43 -26.035 0.639 3.206 1.00 0.00 C ATOM 678 CD GLU A 43 -26.075 2.168 3.213 1.00 0.00 C ATOM 679 OE1 GLU A 43 -25.640 2.747 4.195 1.00 0.00 O ATOM 680 OE2 GLU A 43 -26.539 2.734 2.237 1.00 0.00 O ATOM 0 H GLU A 43 -27.520 -2.355 3.396 1.00 0.00 H new ATOM 0 HA GLU A 43 -25.838 -0.805 5.370 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -27.988 -0.286 3.258 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -27.725 0.892 4.529 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -25.114 0.287 3.671 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -26.036 0.269 2.181 1.00 0.00 H new ATOM 687 N GLY A 44 -28.992 -1.665 5.727 1.00 0.00 N ATOM 688 CA GLY A 44 -30.019 -1.865 6.789 1.00 0.00 C ATOM 689 C GLY A 44 -31.254 -1.022 6.470 1.00 0.00 C ATOM 690 O GLY A 44 -32.130 -0.850 7.294 1.00 0.00 O ATOM 0 H GLY A 44 -29.291 -1.908 4.782 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -30.291 -2.919 6.852 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -29.613 -1.582 7.760 1.00 0.00 H new ATOM 694 N ILE A 45 -31.331 -0.494 5.279 1.00 0.00 N ATOM 695 CA ILE A 45 -32.511 0.338 4.908 1.00 0.00 C ATOM 696 C ILE A 45 -33.783 -0.514 4.918 1.00 0.00 C ATOM 697 O ILE A 45 -34.006 -1.323 4.039 1.00 0.00 O ATOM 698 CB ILE A 45 -32.213 0.840 3.494 1.00 0.00 C ATOM 699 CG1 ILE A 45 -30.965 1.725 3.522 1.00 0.00 C ATOM 700 CG2 ILE A 45 -33.402 1.653 2.980 1.00 0.00 C ATOM 701 CD1 ILE A 45 -30.251 1.643 2.172 1.00 0.00 C ATOM 0 H ILE A 45 -30.629 -0.603 4.547 1.00 0.00 H new ATOM 0 HA ILE A 45 -32.673 1.159 5.606 1.00 0.00 H new ATOM 0 HB ILE A 45 -32.043 -0.011 2.834 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -31.243 2.757 3.736 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -30.296 1.403 4.320 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -33.190 2.011 1.972 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -34.292 1.024 2.962 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -33.573 2.504 3.639 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -29.362 2.273 2.192 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -29.960 0.611 1.977 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -30.922 1.986 1.384 1.00 0.00 H new ATOM 713 N GLN A 46 -34.618 -0.339 5.905 1.00 0.00 N ATOM 714 CA GLN A 46 -35.874 -1.139 5.971 1.00 0.00 C ATOM 715 C GLN A 46 -36.536 -1.200 4.593 1.00 0.00 C ATOM 716 O GLN A 46 -36.947 -2.249 4.136 1.00 0.00 O ATOM 717 CB GLN A 46 -36.767 -0.391 6.961 1.00 0.00 C ATOM 718 CG GLN A 46 -36.390 -0.789 8.390 1.00 0.00 C ATOM 719 CD GLN A 46 -37.438 -1.755 8.945 1.00 0.00 C ATOM 720 OE1 GLN A 46 -37.906 -1.592 10.054 1.00 0.00 O ATOM 721 NE2 GLN A 46 -37.829 -2.763 8.213 1.00 0.00 N ATOM 0 H GLN A 46 -34.485 0.324 6.669 1.00 0.00 H new ATOM 0 HA GLN A 46 -35.692 -2.168 6.281 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -36.652 0.685 6.830 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -37.814 -0.625 6.771 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -35.406 -1.258 8.400 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -36.327 0.098 9.021 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -37.436 -2.900 7.282 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -38.528 -3.414 8.572 1.00 0.00 H new ATOM 730 N LYS A 47 -36.643 -0.084 3.926 1.00 0.00 N ATOM 731 CA LYS A 47 -37.279 -0.079 2.576 1.00 0.00 C ATOM 732 C LYS A 47 -36.760 1.100 1.750 1.00 0.00 C ATOM 733 O LYS A 47 -36.889 2.245 2.135 1.00 0.00 O ATOM 734 CB LYS A 47 -38.777 0.072 2.846 1.00 0.00 C ATOM 735 CG LYS A 47 -39.529 0.149 1.516 1.00 0.00 C ATOM 736 CD LYS A 47 -41.028 0.288 1.784 1.00 0.00 C ATOM 737 CE LYS A 47 -41.707 0.933 0.574 1.00 0.00 C ATOM 738 NZ LYS A 47 -42.953 1.546 1.113 1.00 0.00 N ATOM 0 H LYS A 47 -36.318 0.825 4.256 1.00 0.00 H new ATOM 0 HA LYS A 47 -37.055 -0.984 2.010 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -39.139 -0.773 3.432 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -38.963 0.971 3.434 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -39.173 0.999 0.933 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -39.336 -0.746 0.925 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -41.465 -0.691 1.980 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -41.194 0.895 2.674 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -41.064 1.684 0.115 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -41.931 0.193 -0.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -43.474 2.009 0.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -43.548 0.806 1.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -42.708 2.251 1.837 1.00 0.00 H new ATOM 752 N MET A 48 -36.173 0.829 0.616 1.00 0.00 N ATOM 753 CA MET A 48 -35.646 1.936 -0.233 1.00 0.00 C ATOM 754 C MET A 48 -36.670 3.072 -0.314 1.00 0.00 C ATOM 755 O MET A 48 -37.841 2.850 -0.546 1.00 0.00 O ATOM 756 CB MET A 48 -35.431 1.311 -1.611 1.00 0.00 C ATOM 757 CG MET A 48 -34.107 0.542 -1.622 1.00 0.00 C ATOM 758 SD MET A 48 -32.745 1.693 -1.930 1.00 0.00 S ATOM 759 CE MET A 48 -32.705 1.522 -3.731 1.00 0.00 C ATOM 0 H MET A 48 -36.036 -0.110 0.241 1.00 0.00 H new ATOM 0 HA MET A 48 -34.727 2.363 0.169 1.00 0.00 H new ATOM 0 HB2 MET A 48 -36.256 0.640 -1.850 1.00 0.00 H new ATOM 0 HB3 MET A 48 -35.419 2.087 -2.376 1.00 0.00 H new ATOM 0 HG2 MET A 48 -33.960 0.035 -0.668 1.00 0.00 H new ATOM 0 HG3 MET A 48 -34.128 -0.228 -2.393 1.00 0.00 H new ATOM 0 HE1 MET A 48 -32.021 2.260 -4.151 1.00 0.00 H new ATOM 0 HE2 MET A 48 -32.365 0.520 -3.994 1.00 0.00 H new ATOM 0 HE3 MET A 48 -33.705 1.683 -4.134 1.00 0.00 H new ATOM 769 N THR A 49 -36.235 4.289 -0.126 1.00 0.00 N ATOM 770 CA THR A 49 -37.185 5.436 -0.194 1.00 0.00 C ATOM 771 C THR A 49 -37.565 5.720 -1.651 1.00 0.00 C ATOM 772 O THR A 49 -37.504 4.851 -2.499 1.00 0.00 O ATOM 773 CB THR A 49 -36.421 6.617 0.411 1.00 0.00 C ATOM 774 OG1 THR A 49 -37.337 7.653 0.738 1.00 0.00 O ATOM 775 CG2 THR A 49 -35.394 7.139 -0.595 1.00 0.00 C ATOM 0 H THR A 49 -35.266 4.538 0.071 1.00 0.00 H new ATOM 0 HA THR A 49 -38.115 5.240 0.340 1.00 0.00 H new ATOM 0 HB THR A 49 -35.904 6.289 1.313 1.00 0.00 H new ATOM 0 HG1 THR A 49 -37.085 8.474 0.265 1.00 0.00 H new ATOM 0 HG21 THR A 49 -34.853 7.979 -0.160 1.00 0.00 H new ATOM 0 HG22 THR A 49 -34.691 6.344 -0.843 1.00 0.00 H new ATOM 0 HG23 THR A 49 -35.905 7.466 -1.500 1.00 0.00 H new ATOM 783 N GLU A 50 -37.958 6.928 -1.949 1.00 0.00 N ATOM 784 CA GLU A 50 -38.341 7.262 -3.351 1.00 0.00 C ATOM 785 C GLU A 50 -37.107 7.697 -4.148 1.00 0.00 C ATOM 786 O GLU A 50 -36.869 7.230 -5.244 1.00 0.00 O ATOM 787 CB GLU A 50 -39.332 8.420 -3.225 1.00 0.00 C ATOM 788 CG GLU A 50 -39.787 8.857 -4.618 1.00 0.00 C ATOM 789 CD GLU A 50 -41.176 9.492 -4.526 1.00 0.00 C ATOM 790 OE1 GLU A 50 -41.247 10.681 -4.264 1.00 0.00 O ATOM 791 OE2 GLU A 50 -42.146 8.777 -4.720 1.00 0.00 O ATOM 0 H GLU A 50 -38.031 7.698 -1.284 1.00 0.00 H new ATOM 0 HA GLU A 50 -38.773 6.410 -3.875 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -40.192 8.113 -2.630 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -38.866 9.256 -2.704 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -39.077 9.570 -5.037 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -39.812 7.999 -5.290 1.00 0.00 H new ATOM 798 N GLU A 51 -36.324 8.589 -3.607 1.00 0.00 N ATOM 799 CA GLU A 51 -35.108 9.053 -4.333 1.00 0.00 C ATOM 800 C GLU A 51 -34.171 7.873 -4.608 1.00 0.00 C ATOM 801 O GLU A 51 -33.401 7.885 -5.547 1.00 0.00 O ATOM 802 CB GLU A 51 -34.442 10.058 -3.391 1.00 0.00 C ATOM 803 CG GLU A 51 -35.020 11.452 -3.640 1.00 0.00 C ATOM 804 CD GLU A 51 -34.286 12.473 -2.768 1.00 0.00 C ATOM 805 OE1 GLU A 51 -33.215 12.902 -3.166 1.00 0.00 O ATOM 806 OE2 GLU A 51 -34.806 12.807 -1.717 1.00 0.00 O ATOM 0 H GLU A 51 -36.474 9.017 -2.693 1.00 0.00 H new ATOM 0 HA GLU A 51 -35.350 9.497 -5.299 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -34.606 9.765 -2.354 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -33.364 10.065 -3.553 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -34.918 11.717 -4.692 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -36.086 11.462 -3.411 1.00 0.00 H new ATOM 813 N HIS A 52 -34.231 6.856 -3.793 1.00 0.00 N ATOM 814 CA HIS A 52 -33.342 5.676 -4.005 1.00 0.00 C ATOM 815 C HIS A 52 -33.667 4.994 -5.337 1.00 0.00 C ATOM 816 O HIS A 52 -32.810 4.817 -6.180 1.00 0.00 O ATOM 817 CB HIS A 52 -33.648 4.739 -2.837 1.00 0.00 C ATOM 818 CG HIS A 52 -32.492 4.739 -1.875 1.00 0.00 C ATOM 819 ND1 HIS A 52 -32.674 4.630 -0.490 1.00 0.00 N ATOM 820 CD2 HIS A 52 -31.132 4.832 -2.070 1.00 0.00 C ATOM 821 CE1 HIS A 52 -31.454 4.660 0.086 1.00 0.00 C ATOM 822 NE2 HIS A 52 -30.512 4.781 -0.838 1.00 0.00 N ATOM 0 H HIS A 52 -34.856 6.790 -2.990 1.00 0.00 H new ATOM 0 HA HIS A 52 -32.289 5.956 -4.043 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -34.557 5.060 -2.329 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -33.828 3.729 -3.205 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -30.635 4.928 -3.024 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -31.271 4.595 1.148 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -29.507 4.828 -0.669 1.00 0.00 H new ATOM 830 N TRP A 53 -34.897 4.604 -5.531 1.00 0.00 N ATOM 831 CA TRP A 53 -35.275 3.927 -6.806 1.00 0.00 C ATOM 832 C TRP A 53 -35.043 4.857 -8.000 1.00 0.00 C ATOM 833 O TRP A 53 -34.426 4.483 -8.977 1.00 0.00 O ATOM 834 CB TRP A 53 -36.762 3.606 -6.658 1.00 0.00 C ATOM 835 CG TRP A 53 -36.919 2.243 -6.062 1.00 0.00 C ATOM 836 CD1 TRP A 53 -37.769 1.928 -5.057 1.00 0.00 C ATOM 837 CD2 TRP A 53 -36.226 1.011 -6.414 1.00 0.00 C ATOM 838 NE1 TRP A 53 -37.640 0.581 -4.768 1.00 0.00 N ATOM 839 CE2 TRP A 53 -36.701 -0.028 -5.578 1.00 0.00 C ATOM 840 CE3 TRP A 53 -35.239 0.698 -7.368 1.00 0.00 C ATOM 841 CZ2 TRP A 53 -36.215 -1.332 -5.687 1.00 0.00 C ATOM 842 CZ3 TRP A 53 -34.747 -0.613 -7.479 1.00 0.00 C ATOM 843 CH2 TRP A 53 -35.235 -1.626 -6.640 1.00 0.00 C ATOM 0 H TRP A 53 -35.658 4.724 -4.862 1.00 0.00 H new ATOM 0 HA TRP A 53 -34.678 3.033 -6.986 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -37.245 4.350 -6.024 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -37.253 3.649 -7.630 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -38.438 2.616 -4.562 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -38.173 0.097 -4.045 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -34.858 1.471 -8.019 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -36.594 -2.109 -5.039 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -33.989 -0.842 -8.214 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -34.854 -2.632 -6.730 1.00 0.00 H new ATOM 854 N LYS A 54 -35.534 6.063 -7.934 1.00 0.00 N ATOM 855 CA LYS A 54 -35.343 7.010 -9.071 1.00 0.00 C ATOM 856 C LYS A 54 -33.861 7.096 -9.448 1.00 0.00 C ATOM 857 O LYS A 54 -33.501 7.045 -10.607 1.00 0.00 O ATOM 858 CB LYS A 54 -35.843 8.358 -8.554 1.00 0.00 C ATOM 859 CG LYS A 54 -36.643 9.060 -9.653 1.00 0.00 C ATOM 860 CD LYS A 54 -37.206 10.377 -9.115 1.00 0.00 C ATOM 861 CE LYS A 54 -37.917 11.127 -10.244 1.00 0.00 C ATOM 862 NZ LYS A 54 -37.964 12.546 -9.793 1.00 0.00 N ATOM 0 H LYS A 54 -36.059 6.435 -7.143 1.00 0.00 H new ATOM 0 HA LYS A 54 -35.879 6.692 -9.965 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -36.466 8.213 -7.672 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -35.000 8.979 -8.250 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -36.005 9.251 -10.516 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -37.455 8.417 -9.993 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -37.902 10.181 -8.299 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -36.402 10.989 -8.707 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -37.376 11.029 -11.185 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -38.919 10.732 -10.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -38.438 13.124 -10.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -38.491 12.609 -8.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -36.996 12.897 -9.649 1.00 0.00 H new ATOM 876 N LEU A 55 -32.998 7.228 -8.477 1.00 0.00 N ATOM 877 CA LEU A 55 -31.540 7.319 -8.780 1.00 0.00 C ATOM 878 C LEU A 55 -31.057 6.034 -9.456 1.00 0.00 C ATOM 879 O LEU A 55 -30.580 6.049 -10.574 1.00 0.00 O ATOM 880 CB LEU A 55 -30.866 7.497 -7.419 1.00 0.00 C ATOM 881 CG LEU A 55 -29.610 8.353 -7.579 1.00 0.00 C ATOM 882 CD1 LEU A 55 -29.827 9.709 -6.904 1.00 0.00 C ATOM 883 CD2 LEU A 55 -28.424 7.643 -6.923 1.00 0.00 C ATOM 0 H LEU A 55 -33.239 7.277 -7.487 1.00 0.00 H new ATOM 0 HA LEU A 55 -31.309 8.139 -9.461 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -31.555 7.971 -6.720 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -30.605 6.525 -7.001 1.00 0.00 H new ATOM 0 HG LEU A 55 -29.405 8.503 -8.639 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -28.931 10.320 -7.018 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -30.673 10.215 -7.369 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -30.031 9.559 -5.844 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -27.527 8.252 -7.036 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -28.630 7.494 -5.863 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -28.269 6.676 -7.402 1.00 0.00 H new ATOM 895 N VAL A 56 -31.177 4.918 -8.788 1.00 0.00 N ATOM 896 CA VAL A 56 -30.723 3.634 -9.393 1.00 0.00 C ATOM 897 C VAL A 56 -31.286 3.487 -10.810 1.00 0.00 C ATOM 898 O VAL A 56 -30.705 2.834 -11.655 1.00 0.00 O ATOM 899 CB VAL A 56 -31.285 2.545 -8.479 1.00 0.00 C ATOM 900 CG1 VAL A 56 -31.183 1.189 -9.178 1.00 0.00 C ATOM 901 CG2 VAL A 56 -30.482 2.508 -7.178 1.00 0.00 C ATOM 0 H VAL A 56 -31.570 4.841 -7.850 1.00 0.00 H new ATOM 0 HA VAL A 56 -29.638 3.578 -9.475 1.00 0.00 H new ATOM 0 HB VAL A 56 -32.330 2.761 -8.256 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -31.584 0.413 -8.526 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -31.754 1.214 -10.106 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -30.138 0.972 -9.401 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -30.882 1.732 -6.526 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -29.437 2.292 -7.401 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -30.554 3.474 -6.679 1.00 0.00 H new ATOM 911 N LYS A 57 -32.412 4.089 -11.076 1.00 0.00 N ATOM 912 CA LYS A 57 -33.012 3.984 -12.436 1.00 0.00 C ATOM 913 C LYS A 57 -32.195 4.804 -13.439 1.00 0.00 C ATOM 914 O LYS A 57 -31.844 4.331 -14.501 1.00 0.00 O ATOM 915 CB LYS A 57 -34.420 4.560 -12.293 1.00 0.00 C ATOM 916 CG LYS A 57 -35.372 3.830 -13.243 1.00 0.00 C ATOM 917 CD LYS A 57 -36.755 4.483 -13.183 1.00 0.00 C ATOM 918 CE LYS A 57 -36.980 5.320 -14.444 1.00 0.00 C ATOM 919 NZ LYS A 57 -38.366 5.849 -14.310 1.00 0.00 N ATOM 0 H LYS A 57 -32.943 4.650 -10.410 1.00 0.00 H new ATOM 0 HA LYS A 57 -33.027 2.958 -12.803 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -34.764 4.454 -11.264 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -34.412 5.626 -12.518 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -34.985 3.866 -14.261 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -35.443 2.778 -12.966 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -37.527 3.718 -13.099 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -36.833 5.113 -12.297 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -36.253 6.129 -14.516 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -36.873 4.715 -15.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -38.596 6.435 -15.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -39.036 5.056 -14.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -38.435 6.426 -13.448 1.00 0.00 H new ATOM 933 N TYR A 58 -31.891 6.029 -13.109 1.00 0.00 N ATOM 934 CA TYR A 58 -31.098 6.878 -14.044 1.00 0.00 C ATOM 935 C TYR A 58 -29.746 6.223 -14.338 1.00 0.00 C ATOM 936 O TYR A 58 -29.244 6.283 -15.443 1.00 0.00 O ATOM 937 CB TYR A 58 -30.904 8.204 -13.307 1.00 0.00 C ATOM 938 CG TYR A 58 -31.062 9.348 -14.279 1.00 0.00 C ATOM 939 CD1 TYR A 58 -30.380 9.326 -15.504 1.00 0.00 C ATOM 940 CD2 TYR A 58 -31.890 10.432 -13.957 1.00 0.00 C ATOM 941 CE1 TYR A 58 -30.527 10.388 -16.406 1.00 0.00 C ATOM 942 CE2 TYR A 58 -32.036 11.494 -14.859 1.00 0.00 C ATOM 943 CZ TYR A 58 -31.354 11.473 -16.084 1.00 0.00 C ATOM 944 OH TYR A 58 -31.498 12.518 -16.972 1.00 0.00 O ATOM 0 H TYR A 58 -32.157 6.479 -12.233 1.00 0.00 H new ATOM 0 HA TYR A 58 -31.598 7.014 -15.003 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -31.632 8.294 -12.501 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -29.916 8.236 -12.848 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -29.742 8.491 -15.752 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -32.415 10.449 -13.014 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -30.003 10.371 -17.350 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -32.674 12.329 -14.611 1.00 0.00 H new ATOM 0 HH TYR A 58 -32.055 13.216 -16.568 1.00 0.00 H new ATOM 954 N LEU A 59 -29.152 5.597 -13.358 1.00 0.00 N ATOM 955 CA LEU A 59 -27.833 4.939 -13.584 1.00 0.00 C ATOM 956 C LEU A 59 -27.998 3.717 -14.492 1.00 0.00 C ATOM 957 O LEU A 59 -27.218 3.493 -15.396 1.00 0.00 O ATOM 958 CB LEU A 59 -27.356 4.514 -12.195 1.00 0.00 C ATOM 959 CG LEU A 59 -25.838 4.679 -12.103 1.00 0.00 C ATOM 960 CD1 LEU A 59 -25.501 5.711 -11.025 1.00 0.00 C ATOM 961 CD2 LEU A 59 -25.201 3.337 -11.739 1.00 0.00 C ATOM 0 H LEU A 59 -29.523 5.513 -12.411 1.00 0.00 H new ATOM 0 HA LEU A 59 -27.121 5.604 -14.073 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -27.845 5.118 -11.431 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -27.632 3.476 -12.006 1.00 0.00 H new ATOM 0 HG LEU A 59 -25.451 5.017 -13.064 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -24.419 5.829 -10.959 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -25.955 6.668 -11.283 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -25.888 5.373 -10.064 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -24.119 3.454 -11.673 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -25.589 2.999 -10.778 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -25.441 2.601 -12.506 1.00 0.00 H new ATOM 973 N ARG A 60 -29.007 2.925 -14.258 1.00 0.00 N ATOM 974 CA ARG A 60 -29.222 1.718 -15.107 1.00 0.00 C ATOM 975 C ARG A 60 -29.273 2.112 -16.586 1.00 0.00 C ATOM 976 O ARG A 60 -28.651 1.492 -17.426 1.00 0.00 O ATOM 977 CB ARG A 60 -30.568 1.151 -14.656 1.00 0.00 C ATOM 978 CG ARG A 60 -30.664 -0.322 -15.057 1.00 0.00 C ATOM 979 CD ARG A 60 -31.860 -0.966 -14.352 1.00 0.00 C ATOM 980 NE ARG A 60 -32.127 -2.218 -15.113 1.00 0.00 N ATOM 981 CZ ARG A 60 -33.353 -2.641 -15.265 1.00 0.00 C ATOM 982 NH1 ARG A 60 -34.295 -1.803 -15.603 1.00 0.00 N ATOM 983 NH2 ARG A 60 -33.636 -3.900 -15.076 1.00 0.00 N ATOM 0 H ARG A 60 -29.693 3.061 -13.515 1.00 0.00 H new ATOM 0 HA ARG A 60 -28.417 0.991 -15.001 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -30.673 1.252 -13.576 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -31.382 1.716 -15.110 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -30.775 -0.409 -16.138 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -29.746 -0.844 -14.788 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -31.634 -1.180 -13.307 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -32.727 -0.305 -14.362 1.00 0.00 H new ATOM 0 HE ARG A 60 -31.352 -2.745 -15.516 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -34.073 -0.818 -15.748 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -35.253 -2.133 -15.722 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -32.900 -4.554 -14.810 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -34.594 -4.231 -15.195 1.00 0.00 H new ATOM 997 N GLU A 61 -30.012 3.136 -16.911 1.00 0.00 N ATOM 998 CA GLU A 61 -30.105 3.568 -18.336 1.00 0.00 C ATOM 999 C GLU A 61 -28.712 3.620 -18.971 1.00 0.00 C ATOM 1000 O GLU A 61 -28.525 3.246 -20.112 1.00 0.00 O ATOM 1001 CB GLU A 61 -30.722 4.967 -18.285 1.00 0.00 C ATOM 1002 CG GLU A 61 -32.201 4.888 -18.668 1.00 0.00 C ATOM 1003 CD GLU A 61 -32.596 6.146 -19.442 1.00 0.00 C ATOM 1004 OE1 GLU A 61 -31.791 6.610 -20.233 1.00 0.00 O ATOM 1005 OE2 GLU A 61 -33.698 6.626 -19.229 1.00 0.00 O ATOM 0 H GLU A 61 -30.556 3.693 -16.252 1.00 0.00 H new ATOM 0 HA GLU A 61 -30.699 2.879 -18.936 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -30.617 5.386 -17.284 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -30.194 5.634 -18.967 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -32.383 4.002 -19.276 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -32.815 4.792 -17.772 1.00 0.00 H new ATOM 1012 N TYR A 62 -27.733 4.084 -18.242 1.00 0.00 N ATOM 1013 CA TYR A 62 -26.356 4.162 -18.809 1.00 0.00 C ATOM 1014 C TYR A 62 -25.703 2.776 -18.822 1.00 0.00 C ATOM 1015 O TYR A 62 -24.968 2.436 -19.729 1.00 0.00 O ATOM 1016 CB TYR A 62 -25.594 5.104 -17.875 1.00 0.00 C ATOM 1017 CG TYR A 62 -24.574 5.883 -18.668 1.00 0.00 C ATOM 1018 CD1 TYR A 62 -23.651 5.206 -19.478 1.00 0.00 C ATOM 1019 CD2 TYR A 62 -24.547 7.282 -18.596 1.00 0.00 C ATOM 1020 CE1 TYR A 62 -22.704 5.929 -20.216 1.00 0.00 C ATOM 1021 CE2 TYR A 62 -23.601 8.005 -19.334 1.00 0.00 C ATOM 1022 CZ TYR A 62 -22.678 7.328 -20.143 1.00 0.00 C ATOM 1023 OH TYR A 62 -21.746 8.039 -20.871 1.00 0.00 O ATOM 0 H TYR A 62 -27.827 4.412 -17.281 1.00 0.00 H new ATOM 0 HA TYR A 62 -26.357 4.520 -19.839 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -26.288 5.787 -17.385 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -25.100 4.533 -17.089 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -23.670 4.128 -19.533 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -25.256 7.804 -17.971 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -21.994 5.408 -20.841 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -23.583 9.083 -19.280 1.00 0.00 H new ATOM 0 HH TYR A 62 -21.866 8.998 -20.708 1.00 0.00 H new ATOM 1033 N TRP A 63 -25.959 1.976 -17.824 1.00 0.00 N ATOM 1034 CA TRP A 63 -25.347 0.616 -17.784 1.00 0.00 C ATOM 1035 C TRP A 63 -26.067 -0.323 -18.756 1.00 0.00 C ATOM 1036 O TRP A 63 -25.756 -1.494 -18.846 1.00 0.00 O ATOM 1037 CB TRP A 63 -25.533 0.140 -16.343 1.00 0.00 C ATOM 1038 CG TRP A 63 -24.519 -0.916 -16.034 1.00 0.00 C ATOM 1039 CD1 TRP A 63 -23.247 -0.678 -15.641 1.00 0.00 C ATOM 1040 CD2 TRP A 63 -24.669 -2.364 -16.086 1.00 0.00 C ATOM 1041 NE1 TRP A 63 -22.605 -1.888 -15.448 1.00 0.00 N ATOM 1042 CE2 TRP A 63 -23.439 -2.957 -15.710 1.00 0.00 C ATOM 1043 CE3 TRP A 63 -25.741 -3.213 -16.421 1.00 0.00 C ATOM 1044 CZ2 TRP A 63 -23.280 -4.343 -15.666 1.00 0.00 C ATOM 1045 CZ3 TRP A 63 -25.585 -4.609 -16.377 1.00 0.00 C ATOM 1046 CH2 TRP A 63 -24.355 -5.172 -16.002 1.00 0.00 C ATOM 0 H TRP A 63 -26.564 2.204 -17.035 1.00 0.00 H new ATOM 0 HA TRP A 63 -24.298 0.630 -18.078 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -25.423 0.978 -15.654 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -26.539 -0.255 -16.206 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -22.805 0.297 -15.501 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -21.634 -1.979 -15.149 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -26.690 -2.788 -16.714 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -22.333 -4.772 -15.374 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -26.415 -5.251 -16.633 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -24.239 -6.245 -15.973 1.00 0.00 H new ATOM 1057 N GLU A 64 -27.025 0.181 -19.484 1.00 0.00 N ATOM 1058 CA GLU A 64 -27.759 -0.688 -20.450 1.00 0.00 C ATOM 1059 C GLU A 64 -27.529 -0.198 -21.882 1.00 0.00 C ATOM 1060 O GLU A 64 -27.962 -0.813 -22.836 1.00 0.00 O ATOM 1061 CB GLU A 64 -29.233 -0.551 -20.066 1.00 0.00 C ATOM 1062 CG GLU A 64 -29.932 -1.901 -20.239 1.00 0.00 C ATOM 1063 CD GLU A 64 -31.362 -1.809 -19.703 1.00 0.00 C ATOM 1064 OE1 GLU A 64 -32.068 -0.900 -20.109 1.00 0.00 O ATOM 1065 OE2 GLU A 64 -31.727 -2.648 -18.897 1.00 0.00 O ATOM 0 H GLU A 64 -27.331 1.153 -19.453 1.00 0.00 H new ATOM 0 HA GLU A 64 -27.423 -1.724 -20.411 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -29.321 -0.213 -19.033 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -29.714 0.202 -20.690 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -29.945 -2.183 -21.292 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -29.382 -2.678 -19.707 1.00 0.00 H new ATOM 1072 N THR A 65 -26.850 0.905 -22.039 1.00 0.00 N ATOM 1073 CA THR A 65 -26.593 1.433 -23.410 1.00 0.00 C ATOM 1074 C THR A 65 -25.125 1.220 -23.791 1.00 0.00 C ATOM 1075 O THR A 65 -24.814 0.806 -24.890 1.00 0.00 O ATOM 1076 CB THR A 65 -26.915 2.925 -23.326 1.00 0.00 C ATOM 1077 OG1 THR A 65 -28.015 3.122 -22.449 1.00 0.00 O ATOM 1078 CG2 THR A 65 -27.269 3.451 -24.718 1.00 0.00 C ATOM 0 H THR A 65 -26.462 1.463 -21.279 1.00 0.00 H new ATOM 0 HA THR A 65 -27.194 0.929 -24.167 1.00 0.00 H new ATOM 0 HB THR A 65 -26.047 3.464 -22.946 1.00 0.00 H new ATOM 0 HG1 THR A 65 -27.687 3.228 -21.532 1.00 0.00 H new ATOM 0 HG21 THR A 65 -27.499 4.515 -24.657 1.00 0.00 H new ATOM 0 HG22 THR A 65 -26.424 3.300 -25.390 1.00 0.00 H new ATOM 0 HG23 THR A 65 -28.137 2.914 -25.100 1.00 0.00 H new ATOM 1086 N PHE A 66 -24.222 1.499 -22.892 1.00 0.00 N ATOM 1087 CA PHE A 66 -22.777 1.313 -23.204 1.00 0.00 C ATOM 1088 C PHE A 66 -22.186 0.201 -22.334 1.00 0.00 C ATOM 1089 O PHE A 66 -21.437 -0.634 -22.800 1.00 0.00 O ATOM 1090 CB PHE A 66 -22.124 2.656 -22.875 1.00 0.00 C ATOM 1091 CG PHE A 66 -20.648 2.588 -23.182 1.00 0.00 C ATOM 1092 CD1 PHE A 66 -19.765 2.012 -22.258 1.00 0.00 C ATOM 1093 CD2 PHE A 66 -20.159 3.102 -24.391 1.00 0.00 C ATOM 1094 CE1 PHE A 66 -18.395 1.949 -22.543 1.00 0.00 C ATOM 1095 CE2 PHE A 66 -18.788 3.039 -24.675 1.00 0.00 C ATOM 1096 CZ PHE A 66 -17.906 2.463 -23.752 1.00 0.00 C ATOM 0 H PHE A 66 -24.422 1.848 -21.955 1.00 0.00 H new ATOM 0 HA PHE A 66 -22.613 1.024 -24.242 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -22.591 3.451 -23.456 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -22.277 2.898 -21.823 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -20.141 1.617 -21.326 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -20.838 3.546 -25.103 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -17.715 1.504 -21.831 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -18.411 3.435 -25.606 1.00 0.00 H new ATOM 0 HZ PHE A 66 -16.850 2.415 -23.972 1.00 0.00 H new ATOM 1106 N GLY A 67 -22.518 0.183 -21.072 1.00 0.00 N ATOM 1107 CA GLY A 67 -21.976 -0.875 -20.174 1.00 0.00 C ATOM 1108 C GLY A 67 -20.861 -0.288 -19.308 1.00 0.00 C ATOM 1109 O GLY A 67 -19.759 -0.797 -19.269 1.00 0.00 O ATOM 0 H GLY A 67 -23.141 0.855 -20.624 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -22.770 -1.273 -19.542 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -21.592 -1.707 -20.765 1.00 0.00 H new ATOM 1113 N THR A 68 -21.139 0.780 -18.611 1.00 0.00 N ATOM 1114 CA THR A 68 -20.092 1.398 -17.747 1.00 0.00 C ATOM 1115 C THR A 68 -20.732 2.001 -16.494 1.00 0.00 C ATOM 1116 O THR A 68 -21.843 2.493 -16.527 1.00 0.00 O ATOM 1117 CB THR A 68 -19.464 2.494 -18.609 1.00 0.00 C ATOM 1118 OG1 THR A 68 -18.695 1.897 -19.643 1.00 0.00 O ATOM 1119 CG2 THR A 68 -18.562 3.374 -17.742 1.00 0.00 C ATOM 0 H THR A 68 -22.044 1.251 -18.602 1.00 0.00 H new ATOM 0 HA THR A 68 -19.352 0.672 -17.409 1.00 0.00 H new ATOM 0 HB THR A 68 -20.251 3.107 -19.048 1.00 0.00 H new ATOM 0 HG1 THR A 68 -18.874 2.356 -20.490 1.00 0.00 H new ATOM 0 HG21 THR A 68 -18.115 4.155 -18.358 1.00 0.00 H new ATOM 0 HG22 THR A 68 -19.154 3.831 -16.949 1.00 0.00 H new ATOM 0 HG23 THR A 68 -17.774 2.764 -17.301 1.00 0.00 H new ATOM 1127 N CYS A 69 -20.039 1.968 -15.388 1.00 0.00 N ATOM 1128 CA CYS A 69 -20.608 2.539 -14.134 1.00 0.00 C ATOM 1129 C CYS A 69 -19.948 3.884 -13.819 1.00 0.00 C ATOM 1130 O CYS A 69 -18.891 3.934 -13.224 1.00 0.00 O ATOM 1131 CB CYS A 69 -20.280 1.514 -13.047 1.00 0.00 C ATOM 1132 SG CYS A 69 -20.847 2.133 -11.443 1.00 0.00 S ATOM 0 H CYS A 69 -19.104 1.570 -15.299 1.00 0.00 H new ATOM 0 HA CYS A 69 -21.680 2.721 -14.212 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -20.761 0.562 -13.272 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -19.206 1.329 -13.019 1.00 0.00 H new ATOM 1137 N PRO A 70 -20.601 4.935 -14.236 1.00 0.00 N ATOM 1138 CA PRO A 70 -20.078 6.302 -13.999 1.00 0.00 C ATOM 1139 C PRO A 70 -20.243 6.691 -12.528 1.00 0.00 C ATOM 1140 O PRO A 70 -20.995 6.073 -11.801 1.00 0.00 O ATOM 1141 CB PRO A 70 -20.950 7.179 -14.894 1.00 0.00 C ATOM 1142 CG PRO A 70 -22.222 6.411 -15.068 1.00 0.00 C ATOM 1143 CD PRO A 70 -21.878 4.947 -14.958 1.00 0.00 C ATOM 0 HA PRO A 70 -19.015 6.398 -14.221 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -21.135 8.150 -14.435 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -20.468 7.366 -15.853 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -22.949 6.694 -14.307 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -22.673 6.628 -16.036 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -22.647 4.396 -14.417 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -21.785 4.484 -15.940 1.00 0.00 H new ATOM 1151 N PRO A 71 -19.527 7.711 -12.139 1.00 0.00 N ATOM 1152 CA PRO A 71 -19.590 8.195 -10.738 1.00 0.00 C ATOM 1153 C PRO A 71 -20.919 8.910 -10.478 1.00 0.00 C ATOM 1154 O PRO A 71 -21.891 8.304 -10.072 1.00 0.00 O ATOM 1155 CB PRO A 71 -18.418 9.169 -10.645 1.00 0.00 C ATOM 1156 CG PRO A 71 -18.180 9.627 -12.049 1.00 0.00 C ATOM 1157 CD PRO A 71 -18.602 8.502 -12.958 1.00 0.00 C ATOM 0 HA PRO A 71 -19.531 7.393 -10.003 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -18.654 10.009 -9.991 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -17.533 8.683 -10.233 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -18.752 10.530 -12.262 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -17.129 9.872 -12.202 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -19.088 8.878 -13.859 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -17.747 7.908 -13.281 1.00 0.00 H new ATOM 1165 N ILE A 72 -20.971 10.193 -10.710 1.00 0.00 N ATOM 1166 CA ILE A 72 -22.239 10.941 -10.477 1.00 0.00 C ATOM 1167 C ILE A 72 -22.062 12.415 -10.855 1.00 0.00 C ATOM 1168 O ILE A 72 -22.170 13.296 -10.026 1.00 0.00 O ATOM 1169 CB ILE A 72 -22.512 10.801 -8.978 1.00 0.00 C ATOM 1170 CG1 ILE A 72 -23.654 11.738 -8.580 1.00 0.00 C ATOM 1171 CG2 ILE A 72 -21.252 11.173 -8.194 1.00 0.00 C ATOM 1172 CD1 ILE A 72 -24.770 10.929 -7.916 1.00 0.00 C ATOM 0 H ILE A 72 -20.191 10.755 -11.051 1.00 0.00 H new ATOM 0 HA ILE A 72 -23.062 10.556 -11.079 1.00 0.00 H new ATOM 0 HB ILE A 72 -22.790 9.771 -8.753 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -23.289 12.504 -7.896 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -24.038 12.254 -9.460 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -21.445 11.074 -7.126 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -20.437 10.508 -8.479 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -20.975 12.203 -8.418 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -25.584 11.596 -7.632 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -25.142 10.180 -8.615 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -24.380 10.433 -7.027 1.00 0.00 H new ATOM 1184 N LYS A 73 -21.792 12.687 -12.102 1.00 0.00 N ATOM 1185 CA LYS A 73 -21.609 14.104 -12.532 1.00 0.00 C ATOM 1186 C LYS A 73 -22.642 14.469 -13.602 1.00 0.00 C ATOM 1187 O LYS A 73 -23.368 15.435 -13.472 1.00 0.00 O ATOM 1188 CB LYS A 73 -20.194 14.161 -13.111 1.00 0.00 C ATOM 1189 CG LYS A 73 -19.343 15.128 -12.284 1.00 0.00 C ATOM 1190 CD LYS A 73 -18.323 15.815 -13.194 1.00 0.00 C ATOM 1191 CE LYS A 73 -17.772 17.060 -12.494 1.00 0.00 C ATOM 1192 NZ LYS A 73 -16.906 16.535 -11.401 1.00 0.00 N ATOM 0 H LYS A 73 -21.690 11.992 -12.841 1.00 0.00 H new ATOM 0 HA LYS A 73 -21.742 14.807 -11.709 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -19.746 13.167 -13.103 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -20.228 14.487 -14.151 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -19.980 15.873 -11.806 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -18.831 14.589 -11.487 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -17.510 15.128 -13.431 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -18.791 16.093 -14.138 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -17.203 17.682 -13.185 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -18.577 17.679 -12.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -16.299 17.299 -11.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -17.502 16.173 -10.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -16.311 15.765 -11.769 1.00 0.00 H new ATOM 1206 N MET A 74 -22.711 13.708 -14.658 1.00 0.00 N ATOM 1207 CA MET A 74 -23.696 14.014 -15.736 1.00 0.00 C ATOM 1208 C MET A 74 -25.120 13.739 -15.246 1.00 0.00 C ATOM 1209 O MET A 74 -26.075 14.312 -15.731 1.00 0.00 O ATOM 1210 CB MET A 74 -23.332 13.073 -16.885 1.00 0.00 C ATOM 1211 CG MET A 74 -22.291 13.743 -17.783 1.00 0.00 C ATOM 1212 SD MET A 74 -22.946 13.881 -19.465 1.00 0.00 S ATOM 1213 CE MET A 74 -24.089 15.249 -19.152 1.00 0.00 C ATOM 0 H MET A 74 -22.129 12.887 -14.823 1.00 0.00 H new ATOM 0 HA MET A 74 -23.663 15.060 -16.041 1.00 0.00 H new ATOM 0 HB2 MET A 74 -22.939 12.136 -16.491 1.00 0.00 H new ATOM 0 HB3 MET A 74 -24.222 12.827 -17.464 1.00 0.00 H new ATOM 0 HG2 MET A 74 -22.043 14.731 -17.396 1.00 0.00 H new ATOM 0 HG3 MET A 74 -21.369 13.161 -17.787 1.00 0.00 H new ATOM 0 HE1 MET A 74 -24.598 15.517 -20.078 1.00 0.00 H new ATOM 0 HE2 MET A 74 -24.825 14.945 -18.408 1.00 0.00 H new ATOM 0 HE3 MET A 74 -23.533 16.110 -18.782 1.00 0.00 H new ATOM 1223 N VAL A 75 -25.271 12.865 -14.288 1.00 0.00 N ATOM 1224 CA VAL A 75 -26.634 12.556 -13.770 1.00 0.00 C ATOM 1225 C VAL A 75 -27.163 13.728 -12.939 1.00 0.00 C ATOM 1226 O VAL A 75 -28.314 14.105 -13.041 1.00 0.00 O ATOM 1227 CB VAL A 75 -26.452 11.317 -12.893 1.00 0.00 C ATOM 1228 CG1 VAL A 75 -27.821 10.813 -12.430 1.00 0.00 C ATOM 1229 CG2 VAL A 75 -25.755 10.220 -13.701 1.00 0.00 C ATOM 0 H VAL A 75 -24.510 12.352 -13.842 1.00 0.00 H new ATOM 0 HA VAL A 75 -27.352 12.387 -14.572 1.00 0.00 H new ATOM 0 HB VAL A 75 -25.845 11.573 -12.024 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -27.691 9.930 -11.805 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -28.321 11.593 -11.856 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -28.427 10.557 -13.299 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -25.624 9.336 -13.077 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -26.363 9.965 -14.569 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -24.780 10.577 -14.033 1.00 0.00 H new ATOM 1239 N THR A 76 -26.332 14.307 -12.117 1.00 0.00 N ATOM 1240 CA THR A 76 -26.788 15.455 -11.281 1.00 0.00 C ATOM 1241 C THR A 76 -27.088 16.668 -12.167 1.00 0.00 C ATOM 1242 O THR A 76 -27.930 17.487 -11.850 1.00 0.00 O ATOM 1243 CB THR A 76 -25.618 15.752 -10.342 1.00 0.00 C ATOM 1244 OG1 THR A 76 -25.487 14.692 -9.404 1.00 0.00 O ATOM 1245 CG2 THR A 76 -25.876 17.065 -9.600 1.00 0.00 C ATOM 0 H THR A 76 -25.357 14.036 -11.987 1.00 0.00 H new ATOM 0 HA THR A 76 -27.702 15.229 -10.732 1.00 0.00 H new ATOM 0 HB THR A 76 -24.699 15.841 -10.922 1.00 0.00 H new ATOM 0 HG1 THR A 76 -24.737 14.879 -8.802 1.00 0.00 H new ATOM 0 HG21 THR A 76 -25.041 17.275 -8.931 1.00 0.00 H new ATOM 0 HG22 THR A 76 -25.977 17.876 -10.321 1.00 0.00 H new ATOM 0 HG23 THR A 76 -26.794 16.980 -9.019 1.00 0.00 H new ATOM 1253 N LYS A 77 -26.408 16.790 -13.274 1.00 0.00 N ATOM 1254 CA LYS A 77 -26.655 17.950 -14.177 1.00 0.00 C ATOM 1255 C LYS A 77 -28.160 18.171 -14.355 1.00 0.00 C ATOM 1256 O LYS A 77 -28.631 19.290 -14.403 1.00 0.00 O ATOM 1257 CB LYS A 77 -26.009 17.561 -15.507 1.00 0.00 C ATOM 1258 CG LYS A 77 -25.324 18.783 -16.119 1.00 0.00 C ATOM 1259 CD LYS A 77 -24.761 18.418 -17.494 1.00 0.00 C ATOM 1260 CE LYS A 77 -25.199 19.465 -18.521 1.00 0.00 C ATOM 1261 NZ LYS A 77 -23.975 19.758 -19.317 1.00 0.00 N ATOM 0 H LYS A 77 -25.692 16.137 -13.592 1.00 0.00 H new ATOM 0 HA LYS A 77 -26.243 18.878 -13.780 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -25.282 16.764 -15.351 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -26.764 17.174 -16.191 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -26.036 19.603 -16.212 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -24.522 19.129 -15.466 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -23.673 18.368 -17.451 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -25.114 17.431 -17.793 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -26.001 19.085 -19.155 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -25.577 20.363 -18.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -24.195 20.469 -20.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -23.232 20.124 -18.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -23.642 18.886 -19.776 1.00 0.00 H new ATOM 1275 N GLU A 78 -28.917 17.112 -14.453 1.00 0.00 N ATOM 1276 CA GLU A 78 -30.391 17.264 -14.628 1.00 0.00 C ATOM 1277 C GLU A 78 -31.105 17.076 -13.287 1.00 0.00 C ATOM 1278 O GLU A 78 -31.538 18.025 -12.665 1.00 0.00 O ATOM 1279 CB GLU A 78 -30.789 16.160 -15.608 1.00 0.00 C ATOM 1280 CG GLU A 78 -31.023 16.766 -16.993 1.00 0.00 C ATOM 1281 CD GLU A 78 -32.441 16.438 -17.462 1.00 0.00 C ATOM 1282 OE1 GLU A 78 -32.820 15.282 -17.372 1.00 0.00 O ATOM 1283 OE2 GLU A 78 -33.123 17.348 -17.904 1.00 0.00 O ATOM 0 H GLU A 78 -28.580 16.150 -14.420 1.00 0.00 H new ATOM 0 HA GLU A 78 -30.664 18.253 -14.996 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -30.005 15.404 -15.658 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -31.693 15.660 -15.261 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -30.881 17.846 -16.957 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -30.294 16.372 -17.702 1.00 0.00 H new ATOM 1290 N THR A 79 -31.233 15.856 -12.838 1.00 0.00 N ATOM 1291 CA THR A 79 -31.919 15.609 -11.537 1.00 0.00 C ATOM 1292 C THR A 79 -31.468 16.638 -10.497 1.00 0.00 C ATOM 1293 O THR A 79 -32.269 17.199 -9.776 1.00 0.00 O ATOM 1294 CB THR A 79 -31.488 14.202 -11.122 1.00 0.00 C ATOM 1295 OG1 THR A 79 -30.070 14.139 -11.074 1.00 0.00 O ATOM 1296 CG2 THR A 79 -32.011 13.185 -12.138 1.00 0.00 C ATOM 0 H THR A 79 -30.893 15.021 -13.315 1.00 0.00 H new ATOM 0 HA THR A 79 -33.002 15.695 -11.619 1.00 0.00 H new ATOM 0 HB THR A 79 -31.897 13.972 -10.138 1.00 0.00 H new ATOM 0 HG1 THR A 79 -29.721 13.934 -11.967 1.00 0.00 H new ATOM 0 HG21 THR A 79 -31.703 12.183 -11.841 1.00 0.00 H new ATOM 0 HG22 THR A 79 -33.099 13.234 -12.175 1.00 0.00 H new ATOM 0 HG23 THR A 79 -31.604 13.413 -13.123 1.00 0.00 H new ATOM 1304 N GLY A 80 -30.191 16.889 -10.414 1.00 0.00 N ATOM 1305 CA GLY A 80 -29.690 17.882 -9.422 1.00 0.00 C ATOM 1306 C GLY A 80 -29.705 17.259 -8.024 1.00 0.00 C ATOM 1307 O GLY A 80 -29.955 17.926 -7.040 1.00 0.00 O ATOM 0 H GLY A 80 -29.473 16.450 -10.990 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -28.678 18.193 -9.682 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -30.313 18.776 -9.440 1.00 0.00 H new ATOM 1311 N PHE A 81 -29.439 15.985 -7.930 1.00 0.00 N ATOM 1312 CA PHE A 81 -29.438 15.321 -6.595 1.00 0.00 C ATOM 1313 C PHE A 81 -28.421 15.994 -5.669 1.00 0.00 C ATOM 1314 O PHE A 81 -27.233 15.981 -5.922 1.00 0.00 O ATOM 1315 CB PHE A 81 -29.034 13.873 -6.872 1.00 0.00 C ATOM 1316 CG PHE A 81 -30.198 12.958 -6.574 1.00 0.00 C ATOM 1317 CD1 PHE A 81 -31.245 12.833 -7.498 1.00 0.00 C ATOM 1318 CD2 PHE A 81 -30.233 12.236 -5.374 1.00 0.00 C ATOM 1319 CE1 PHE A 81 -32.325 11.985 -7.221 1.00 0.00 C ATOM 1320 CE2 PHE A 81 -31.314 11.388 -5.098 1.00 0.00 C ATOM 1321 CZ PHE A 81 -32.360 11.262 -6.022 1.00 0.00 C ATOM 0 H PHE A 81 -29.223 15.375 -8.719 1.00 0.00 H new ATOM 0 HA PHE A 81 -30.408 15.386 -6.102 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -28.728 13.763 -7.912 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -28.177 13.600 -6.257 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -31.219 13.390 -8.423 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -29.427 12.333 -4.662 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -33.132 11.889 -7.933 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -31.341 10.831 -4.173 1.00 0.00 H new ATOM 0 HZ PHE A 81 -33.193 10.608 -5.810 1.00 0.00 H new ATOM 1331 N SER A 82 -28.878 16.584 -4.598 1.00 0.00 N ATOM 1332 CA SER A 82 -27.937 17.257 -3.659 1.00 0.00 C ATOM 1333 C SER A 82 -27.017 16.225 -3.003 1.00 0.00 C ATOM 1334 O SER A 82 -27.466 15.229 -2.469 1.00 0.00 O ATOM 1335 CB SER A 82 -28.829 17.922 -2.611 1.00 0.00 C ATOM 1336 OG SER A 82 -28.315 19.211 -2.306 1.00 0.00 O ATOM 0 H SER A 82 -29.862 16.629 -4.333 1.00 0.00 H new ATOM 0 HA SER A 82 -27.296 17.979 -4.165 1.00 0.00 H new ATOM 0 HB2 SER A 82 -29.850 18.004 -2.985 1.00 0.00 H new ATOM 0 HB3 SER A 82 -28.868 17.311 -1.709 1.00 0.00 H new ATOM 0 HG SER A 82 -28.886 19.641 -1.635 1.00 0.00 H new ATOM 1342 N LEU A 83 -25.732 16.452 -3.038 1.00 0.00 N ATOM 1343 CA LEU A 83 -24.787 15.481 -2.416 1.00 0.00 C ATOM 1344 C LEU A 83 -25.250 15.125 -1.000 1.00 0.00 C ATOM 1345 O LEU A 83 -25.126 13.998 -0.561 1.00 0.00 O ATOM 1346 CB LEU A 83 -23.441 16.207 -2.375 1.00 0.00 C ATOM 1347 CG LEU A 83 -22.320 15.189 -2.157 1.00 0.00 C ATOM 1348 CD1 LEU A 83 -22.082 14.407 -3.449 1.00 0.00 C ATOM 1349 CD2 LEU A 83 -21.037 15.925 -1.763 1.00 0.00 C ATOM 0 H LEU A 83 -25.296 17.267 -3.470 1.00 0.00 H new ATOM 0 HA LEU A 83 -24.728 14.547 -2.974 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -23.279 16.748 -3.307 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -23.438 16.945 -1.573 1.00 0.00 H new ATOM 0 HG LEU A 83 -22.604 14.499 -1.363 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -21.283 13.682 -3.293 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -22.996 13.885 -3.732 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -21.797 15.096 -4.244 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -20.236 15.202 -1.607 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -20.754 16.614 -2.559 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -21.206 16.484 -0.842 1.00 0.00 H new ATOM 1361 N GLU A 84 -25.783 16.076 -0.282 1.00 0.00 N ATOM 1362 CA GLU A 84 -26.253 15.789 1.103 1.00 0.00 C ATOM 1363 C GLU A 84 -27.181 14.571 1.103 1.00 0.00 C ATOM 1364 O GLU A 84 -27.063 13.689 1.931 1.00 0.00 O ATOM 1365 CB GLU A 84 -27.015 17.044 1.531 1.00 0.00 C ATOM 1366 CG GLU A 84 -27.626 16.823 2.917 1.00 0.00 C ATOM 1367 CD GLU A 84 -29.098 17.238 2.898 1.00 0.00 C ATOM 1368 OE1 GLU A 84 -29.886 16.532 2.290 1.00 0.00 O ATOM 1369 OE2 GLU A 84 -29.414 18.256 3.493 1.00 0.00 O ATOM 0 H GLU A 84 -25.913 17.038 -0.594 1.00 0.00 H new ATOM 0 HA GLU A 84 -25.430 15.562 1.780 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -26.342 17.902 1.551 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -27.799 17.271 0.808 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -27.536 15.775 3.203 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -27.083 17.404 3.662 1.00 0.00 H new ATOM 1376 N LYS A 85 -28.102 14.516 0.180 1.00 0.00 N ATOM 1377 CA LYS A 85 -29.035 13.355 0.126 1.00 0.00 C ATOM 1378 C LYS A 85 -28.252 12.058 -0.096 1.00 0.00 C ATOM 1379 O LYS A 85 -28.547 11.035 0.491 1.00 0.00 O ATOM 1380 CB LYS A 85 -29.951 13.640 -1.065 1.00 0.00 C ATOM 1381 CG LYS A 85 -31.370 13.167 -0.743 1.00 0.00 C ATOM 1382 CD LYS A 85 -32.281 14.380 -0.549 1.00 0.00 C ATOM 1383 CE LYS A 85 -31.756 15.234 0.607 1.00 0.00 C ATOM 1384 NZ LYS A 85 -32.044 16.640 0.207 1.00 0.00 N ATOM 0 H LYS A 85 -28.249 15.225 -0.539 1.00 0.00 H new ATOM 0 HA LYS A 85 -29.597 13.232 1.052 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -29.954 14.707 -1.288 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -29.579 13.130 -1.954 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -31.748 12.541 -1.551 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -31.365 12.555 0.159 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -32.317 14.971 -1.464 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -33.300 14.053 -0.340 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -32.253 14.980 1.543 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -30.688 15.078 0.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -31.638 17.291 0.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -31.623 16.829 -0.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -33.073 16.783 0.157 1.00 0.00 H new ATOM 1398 N ILE A 86 -27.257 12.093 -0.938 1.00 0.00 N ATOM 1399 CA ILE A 86 -26.455 10.863 -1.197 1.00 0.00 C ATOM 1400 C ILE A 86 -25.684 10.458 0.061 1.00 0.00 C ATOM 1401 O ILE A 86 -25.369 9.302 0.263 1.00 0.00 O ATOM 1402 CB ILE A 86 -25.489 11.249 -2.317 1.00 0.00 C ATOM 1403 CG1 ILE A 86 -26.285 11.727 -3.534 1.00 0.00 C ATOM 1404 CG2 ILE A 86 -24.646 10.034 -2.707 1.00 0.00 C ATOM 1405 CD1 ILE A 86 -27.000 10.537 -4.178 1.00 0.00 C ATOM 0 H ILE A 86 -26.964 12.920 -1.458 1.00 0.00 H new ATOM 0 HA ILE A 86 -27.080 10.013 -1.472 1.00 0.00 H new ATOM 0 HB ILE A 86 -24.835 12.049 -1.971 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -27.012 12.481 -3.233 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -25.618 12.198 -4.256 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -23.958 10.310 -3.506 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -24.079 9.692 -1.841 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -25.300 9.233 -3.052 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -27.567 10.878 -5.044 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -26.264 9.798 -4.494 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -27.680 10.086 -3.455 1.00 0.00 H new ATOM 1417 N TYR A 87 -25.373 11.401 0.908 1.00 0.00 N ATOM 1418 CA TYR A 87 -24.620 11.068 2.151 1.00 0.00 C ATOM 1419 C TYR A 87 -25.550 10.414 3.177 1.00 0.00 C ATOM 1420 O TYR A 87 -25.213 9.420 3.790 1.00 0.00 O ATOM 1421 CB TYR A 87 -24.104 12.409 2.674 1.00 0.00 C ATOM 1422 CG TYR A 87 -22.617 12.315 2.921 1.00 0.00 C ATOM 1423 CD1 TYR A 87 -22.136 11.631 4.046 1.00 0.00 C ATOM 1424 CD2 TYR A 87 -21.719 12.912 2.027 1.00 0.00 C ATOM 1425 CE1 TYR A 87 -20.756 11.544 4.276 1.00 0.00 C ATOM 1426 CE2 TYR A 87 -20.339 12.825 2.257 1.00 0.00 C ATOM 1427 CZ TYR A 87 -19.858 12.141 3.382 1.00 0.00 C ATOM 1428 OH TYR A 87 -18.500 12.056 3.609 1.00 0.00 O ATOM 0 H TYR A 87 -25.607 12.387 0.793 1.00 0.00 H new ATOM 0 HA TYR A 87 -23.809 10.364 1.964 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -24.314 13.198 1.952 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -24.621 12.675 3.596 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -22.829 11.171 4.735 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -22.090 13.439 1.161 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -20.385 11.017 5.142 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -19.646 13.285 1.568 1.00 0.00 H new ATOM 0 HH TYR A 87 -18.019 12.522 2.894 1.00 0.00 H new ATOM 1438 N GLN A 88 -26.719 10.962 3.368 1.00 0.00 N ATOM 1439 CA GLN A 88 -27.667 10.368 4.354 1.00 0.00 C ATOM 1440 C GLN A 88 -28.109 8.977 3.890 1.00 0.00 C ATOM 1441 O GLN A 88 -28.006 8.009 4.616 1.00 0.00 O ATOM 1442 CB GLN A 88 -28.859 11.326 4.385 1.00 0.00 C ATOM 1443 CG GLN A 88 -28.859 12.100 5.706 1.00 0.00 C ATOM 1444 CD GLN A 88 -29.367 13.523 5.465 1.00 0.00 C ATOM 1445 OE1 GLN A 88 -30.332 13.724 4.754 1.00 0.00 O ATOM 1446 NE2 GLN A 88 -28.754 14.526 6.031 1.00 0.00 N ATOM 0 H GLN A 88 -27.059 11.794 2.885 1.00 0.00 H new ATOM 0 HA GLN A 88 -27.216 10.247 5.339 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -28.804 12.019 3.545 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -29.790 10.769 4.278 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -29.493 11.595 6.435 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -27.852 12.128 6.123 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -27.944 14.358 6.628 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -29.085 15.479 5.877 1.00 0.00 H new ATOM 1455 N LEU A 89 -28.599 8.871 2.686 1.00 0.00 N ATOM 1456 CA LEU A 89 -29.045 7.542 2.177 1.00 0.00 C ATOM 1457 C LEU A 89 -27.861 6.574 2.120 1.00 0.00 C ATOM 1458 O LEU A 89 -27.958 5.434 2.534 1.00 0.00 O ATOM 1459 CB LEU A 89 -29.581 7.816 0.771 1.00 0.00 C ATOM 1460 CG LEU A 89 -30.824 8.702 0.862 1.00 0.00 C ATOM 1461 CD1 LEU A 89 -31.023 9.442 -0.462 1.00 0.00 C ATOM 1462 CD2 LEU A 89 -32.050 7.832 1.145 1.00 0.00 C ATOM 0 H LEU A 89 -28.710 9.646 2.032 1.00 0.00 H new ATOM 0 HA LEU A 89 -29.798 7.085 2.819 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -28.816 8.305 0.168 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -29.826 6.877 0.275 1.00 0.00 H new ATOM 0 HG LEU A 89 -30.695 9.425 1.667 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -31.909 10.073 -0.396 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -30.150 10.062 -0.667 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -31.152 8.719 -1.267 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -32.937 8.463 1.210 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -32.177 7.109 0.339 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -31.911 7.303 2.088 1.00 0.00 H new ATOM 1474 N PHE A 90 -26.743 7.017 1.613 1.00 0.00 N ATOM 1475 CA PHE A 90 -25.553 6.122 1.530 1.00 0.00 C ATOM 1476 C PHE A 90 -24.324 6.824 2.113 1.00 0.00 C ATOM 1477 O PHE A 90 -23.548 7.419 1.392 1.00 0.00 O ATOM 1478 CB PHE A 90 -25.362 5.856 0.037 1.00 0.00 C ATOM 1479 CG PHE A 90 -25.383 4.368 -0.218 1.00 0.00 C ATOM 1480 CD1 PHE A 90 -24.319 3.567 0.218 1.00 0.00 C ATOM 1481 CD2 PHE A 90 -26.468 3.788 -0.889 1.00 0.00 C ATOM 1482 CE1 PHE A 90 -24.339 2.186 -0.018 1.00 0.00 C ATOM 1483 CE2 PHE A 90 -26.489 2.407 -1.124 1.00 0.00 C ATOM 1484 CZ PHE A 90 -25.424 1.606 -0.689 1.00 0.00 C ATOM 0 H PHE A 90 -26.602 7.961 1.252 1.00 0.00 H new ATOM 0 HA PHE A 90 -25.689 5.199 2.094 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -26.152 6.344 -0.534 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -24.416 6.280 -0.300 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -23.483 4.014 0.736 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -27.288 4.406 -1.225 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -23.519 1.569 0.317 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -27.326 1.960 -1.640 1.00 0.00 H new ATOM 0 HZ PHE A 90 -25.440 0.542 -0.871 1.00 0.00 H new ATOM 1494 N PRO A 91 -24.190 6.729 3.407 1.00 0.00 N ATOM 1495 CA PRO A 91 -23.045 7.362 4.104 1.00 0.00 C ATOM 1496 C PRO A 91 -21.757 6.577 3.837 1.00 0.00 C ATOM 1497 O PRO A 91 -21.380 5.708 4.597 1.00 0.00 O ATOM 1498 CB PRO A 91 -23.436 7.285 5.578 1.00 0.00 C ATOM 1499 CG PRO A 91 -24.389 6.136 5.667 1.00 0.00 C ATOM 1500 CD PRO A 91 -25.087 6.031 4.335 1.00 0.00 C ATOM 0 HA PRO A 91 -22.852 8.382 3.773 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -22.563 7.123 6.210 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -23.903 8.212 5.911 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -23.858 5.212 5.897 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -25.111 6.296 6.468 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -25.233 4.991 4.042 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -26.072 6.496 4.363 1.00 0.00 H new ATOM 1508 N SER A 92 -21.079 6.879 2.763 1.00 0.00 N ATOM 1509 CA SER A 92 -19.816 6.150 2.448 1.00 0.00 C ATOM 1510 C SER A 92 -19.306 6.551 1.062 1.00 0.00 C ATOM 1511 O SER A 92 -18.120 6.702 0.846 1.00 0.00 O ATOM 1512 CB SER A 92 -20.197 4.670 2.474 1.00 0.00 C ATOM 1513 OG SER A 92 -19.806 4.107 3.719 1.00 0.00 O ATOM 0 H SER A 92 -21.344 7.598 2.090 1.00 0.00 H new ATOM 0 HA SER A 92 -19.019 6.377 3.156 1.00 0.00 H new ATOM 0 HB2 SER A 92 -21.272 4.557 2.332 1.00 0.00 H new ATOM 0 HB3 SER A 92 -19.710 4.143 1.654 1.00 0.00 H new ATOM 0 HG SER A 92 -20.380 4.459 4.432 1.00 0.00 H new ATOM 1519 N GLY A 93 -20.193 6.723 0.120 1.00 0.00 N ATOM 1520 CA GLY A 93 -19.758 7.113 -1.251 1.00 0.00 C ATOM 1521 C GLY A 93 -20.714 6.507 -2.281 1.00 0.00 C ATOM 1522 O GLY A 93 -20.967 5.318 -2.267 1.00 0.00 O ATOM 0 H GLY A 93 -21.200 6.610 0.241 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -19.746 8.199 -1.345 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -18.741 6.766 -1.434 1.00 0.00 H new ATOM 1526 N PRO A 94 -21.220 7.347 -3.145 1.00 0.00 N ATOM 1527 CA PRO A 94 -22.161 6.885 -4.195 1.00 0.00 C ATOM 1528 C PRO A 94 -21.414 6.092 -5.271 1.00 0.00 C ATOM 1529 O PRO A 94 -22.005 5.357 -6.037 1.00 0.00 O ATOM 1530 CB PRO A 94 -22.724 8.182 -4.768 1.00 0.00 C ATOM 1531 CG PRO A 94 -21.681 9.216 -4.484 1.00 0.00 C ATOM 1532 CD PRO A 94 -20.966 8.790 -3.227 1.00 0.00 C ATOM 0 HA PRO A 94 -22.937 6.222 -3.813 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -22.910 8.093 -5.838 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -23.674 8.441 -4.300 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -20.982 9.297 -5.316 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -22.137 10.198 -4.354 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -19.899 9.005 -3.283 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -21.351 9.313 -2.352 1.00 0.00 H new ATOM 1540 N ALA A 95 -20.118 6.235 -5.335 1.00 0.00 N ATOM 1541 CA ALA A 95 -19.335 5.490 -6.362 1.00 0.00 C ATOM 1542 C ALA A 95 -19.725 4.009 -6.354 1.00 0.00 C ATOM 1543 O ALA A 95 -20.484 3.553 -7.186 1.00 0.00 O ATOM 1544 CB ALA A 95 -17.874 5.662 -5.946 1.00 0.00 C ATOM 0 H ALA A 95 -19.568 6.835 -4.721 1.00 0.00 H new ATOM 0 HA ALA A 95 -19.519 5.860 -7.371 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -17.230 5.141 -6.654 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -17.620 6.722 -5.938 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -17.728 5.246 -4.949 1.00 0.00 H new ATOM 1550 N HIS A 96 -19.211 3.254 -5.423 1.00 0.00 N ATOM 1551 CA HIS A 96 -19.552 1.803 -5.364 1.00 0.00 C ATOM 1552 C HIS A 96 -20.963 1.612 -4.800 1.00 0.00 C ATOM 1553 O HIS A 96 -21.479 0.514 -4.751 1.00 0.00 O ATOM 1554 CB HIS A 96 -18.513 1.189 -4.425 1.00 0.00 C ATOM 1555 CG HIS A 96 -17.373 0.633 -5.234 1.00 0.00 C ATOM 1556 ND1 HIS A 96 -16.476 -0.285 -4.711 1.00 0.00 N ATOM 1557 CD2 HIS A 96 -16.970 0.856 -6.527 1.00 0.00 C ATOM 1558 CE1 HIS A 96 -15.587 -0.578 -5.677 1.00 0.00 C ATOM 1559 NE2 HIS A 96 -15.842 0.091 -6.805 1.00 0.00 N ATOM 0 H HIS A 96 -18.569 3.578 -4.700 1.00 0.00 H new ATOM 0 HA HIS A 96 -19.538 1.337 -6.349 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -18.145 1.943 -3.729 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -18.969 0.399 -3.828 1.00 0.00 H new ATOM 0 HD1 HIS A 96 -16.488 -0.668 -3.766 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -17.455 1.524 -7.223 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -14.767 -1.270 -5.556 1.00 0.00 H new ATOM 1567 N GLY A 97 -21.588 2.674 -4.370 1.00 0.00 N ATOM 1568 CA GLY A 97 -22.963 2.551 -3.809 1.00 0.00 C ATOM 1569 C GLY A 97 -23.974 2.420 -4.949 1.00 0.00 C ATOM 1570 O GLY A 97 -24.368 1.333 -5.319 1.00 0.00 O ATOM 0 H GLY A 97 -21.207 3.620 -4.383 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -23.023 1.681 -3.155 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -23.198 3.424 -3.200 1.00 0.00 H new ATOM 1574 N ALA A 98 -24.400 3.520 -5.504 1.00 0.00 N ATOM 1575 CA ALA A 98 -25.390 3.461 -6.619 1.00 0.00 C ATOM 1576 C ALA A 98 -25.030 2.340 -7.598 1.00 0.00 C ATOM 1577 O ALA A 98 -25.886 1.768 -8.243 1.00 0.00 O ATOM 1578 CB ALA A 98 -25.290 4.823 -7.307 1.00 0.00 C ATOM 0 H ALA A 98 -24.106 4.459 -5.235 1.00 0.00 H new ATOM 0 HA ALA A 98 -26.398 3.254 -6.261 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -25.990 4.861 -8.142 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -25.534 5.610 -6.593 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -24.275 4.970 -7.677 1.00 0.00 H new ATOM 1584 N CYS A 99 -23.769 2.023 -7.720 1.00 0.00 N ATOM 1585 CA CYS A 99 -23.360 0.941 -8.663 1.00 0.00 C ATOM 1586 C CYS A 99 -23.729 -0.432 -8.093 1.00 0.00 C ATOM 1587 O CYS A 99 -24.319 -1.255 -8.766 1.00 0.00 O ATOM 1588 CB CYS A 99 -21.843 1.079 -8.788 1.00 0.00 C ATOM 1589 SG CYS A 99 -21.312 0.464 -10.405 1.00 0.00 S ATOM 0 H CYS A 99 -23.005 2.465 -7.209 1.00 0.00 H new ATOM 0 HA CYS A 99 -23.860 1.026 -9.628 1.00 0.00 H new ATOM 0 HB2 CYS A 99 -21.551 2.123 -8.670 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -21.350 0.519 -7.994 1.00 0.00 H new ATOM 1594 N LYS A 100 -23.381 -0.689 -6.862 1.00 0.00 N ATOM 1595 CA LYS A 100 -23.709 -2.011 -6.254 1.00 0.00 C ATOM 1596 C LYS A 100 -25.225 -2.222 -6.221 1.00 0.00 C ATOM 1597 O LYS A 100 -25.711 -3.324 -6.385 1.00 0.00 O ATOM 1598 CB LYS A 100 -23.146 -1.943 -4.834 1.00 0.00 C ATOM 1599 CG LYS A 100 -23.036 -3.356 -4.258 1.00 0.00 C ATOM 1600 CD LYS A 100 -22.132 -3.337 -3.025 1.00 0.00 C ATOM 1601 CE LYS A 100 -20.672 -3.206 -3.462 1.00 0.00 C ATOM 1602 NZ LYS A 100 -20.317 -4.542 -4.019 1.00 0.00 N ATOM 0 H LYS A 100 -22.884 -0.041 -6.251 1.00 0.00 H new ATOM 0 HA LYS A 100 -23.288 -2.841 -6.822 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -22.166 -1.466 -4.843 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -23.793 -1.332 -4.204 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -24.025 -3.729 -3.991 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -22.631 -4.035 -5.008 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -22.404 -2.505 -2.375 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -22.269 -4.251 -2.447 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -20.552 -2.422 -4.210 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -20.030 -2.945 -2.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -19.329 -4.766 -3.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -20.943 -5.265 -3.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -20.430 -4.528 -5.053 1.00 0.00 H new ATOM 1616 N VAL A 101 -25.975 -1.176 -6.009 1.00 0.00 N ATOM 1617 CA VAL A 101 -27.459 -1.320 -5.965 1.00 0.00 C ATOM 1618 C VAL A 101 -28.013 -1.540 -7.376 1.00 0.00 C ATOM 1619 O VAL A 101 -28.884 -2.358 -7.590 1.00 0.00 O ATOM 1620 CB VAL A 101 -27.968 0.000 -5.388 1.00 0.00 C ATOM 1621 CG1 VAL A 101 -29.440 -0.147 -4.998 1.00 0.00 C ATOM 1622 CG2 VAL A 101 -27.146 0.366 -4.150 1.00 0.00 C ATOM 0 H VAL A 101 -25.626 -0.229 -5.864 1.00 0.00 H new ATOM 0 HA VAL A 101 -27.773 -2.175 -5.366 1.00 0.00 H new ATOM 0 HB VAL A 101 -27.868 0.786 -6.136 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -29.803 0.795 -4.586 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -30.026 -0.407 -5.880 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -29.541 -0.933 -4.250 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -27.509 1.308 -3.738 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -27.246 -0.420 -3.402 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -26.097 0.471 -4.428 1.00 0.00 H new ATOM 1632 N ALA A 102 -27.514 -0.814 -8.339 1.00 0.00 N ATOM 1633 CA ALA A 102 -28.014 -0.983 -9.734 1.00 0.00 C ATOM 1634 C ALA A 102 -27.598 -2.349 -10.286 1.00 0.00 C ATOM 1635 O ALA A 102 -28.193 -2.861 -11.212 1.00 0.00 O ATOM 1636 CB ALA A 102 -27.352 0.142 -10.531 1.00 0.00 C ATOM 0 H ALA A 102 -26.783 -0.112 -8.221 1.00 0.00 H new ATOM 0 HA ALA A 102 -29.102 -0.938 -9.790 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -27.670 0.086 -11.572 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -27.645 1.105 -10.113 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -26.268 0.037 -10.477 1.00 0.00 H new ATOM 1642 N GLY A 103 -26.581 -2.942 -9.724 1.00 0.00 N ATOM 1643 CA GLY A 103 -26.127 -4.273 -10.217 1.00 0.00 C ATOM 1644 C GLY A 103 -24.952 -4.089 -11.179 1.00 0.00 C ATOM 1645 O GLY A 103 -25.057 -4.348 -12.360 1.00 0.00 O ATOM 0 H GLY A 103 -26.044 -2.562 -8.944 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -25.828 -4.901 -9.377 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -26.947 -4.784 -10.721 1.00 0.00 H new ATOM 1649 N ALA A 104 -23.831 -3.643 -10.680 1.00 0.00 N ATOM 1650 CA ALA A 104 -22.648 -3.442 -11.567 1.00 0.00 C ATOM 1651 C ALA A 104 -21.374 -3.926 -10.868 1.00 0.00 C ATOM 1652 O ALA A 104 -21.168 -3.665 -9.700 1.00 0.00 O ATOM 1653 CB ALA A 104 -22.586 -1.934 -11.809 1.00 0.00 C ATOM 0 H ALA A 104 -23.683 -3.409 -9.698 1.00 0.00 H new ATOM 0 HA ALA A 104 -22.731 -4.001 -12.499 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -21.739 -1.704 -12.455 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -23.508 -1.604 -12.288 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -22.467 -1.417 -10.857 1.00 0.00 H new ATOM 1659 N PRO A 105 -20.558 -4.620 -11.615 1.00 0.00 N ATOM 1660 CA PRO A 105 -19.285 -5.151 -11.067 1.00 0.00 C ATOM 1661 C PRO A 105 -18.278 -4.017 -10.860 1.00 0.00 C ATOM 1662 O PRO A 105 -18.209 -3.084 -11.637 1.00 0.00 O ATOM 1663 CB PRO A 105 -18.804 -6.114 -12.150 1.00 0.00 C ATOM 1664 CG PRO A 105 -19.440 -5.625 -13.412 1.00 0.00 C ATOM 1665 CD PRO A 105 -20.742 -4.972 -13.028 1.00 0.00 C ATOM 0 HA PRO A 105 -19.404 -5.633 -10.096 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -17.717 -6.109 -12.228 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -19.103 -7.139 -11.928 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.789 -4.915 -13.922 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -19.612 -6.451 -14.102 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -20.941 -4.090 -13.637 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -21.584 -5.650 -13.164 1.00 0.00 H new ATOM 1673 N LYS A 106 -17.495 -4.089 -9.819 1.00 0.00 N ATOM 1674 CA LYS A 106 -16.492 -3.015 -9.563 1.00 0.00 C ATOM 1675 C LYS A 106 -15.707 -2.709 -10.842 1.00 0.00 C ATOM 1676 O LYS A 106 -15.362 -3.604 -11.588 1.00 0.00 O ATOM 1677 CB LYS A 106 -15.566 -3.587 -8.489 1.00 0.00 C ATOM 1678 CG LYS A 106 -15.126 -4.996 -8.893 1.00 0.00 C ATOM 1679 CD LYS A 106 -13.948 -5.434 -8.020 1.00 0.00 C ATOM 1680 CE LYS A 106 -12.634 -5.121 -8.739 1.00 0.00 C ATOM 1681 NZ LYS A 106 -11.639 -4.915 -7.651 1.00 0.00 N ATOM 0 H LYS A 106 -17.506 -4.845 -9.134 1.00 0.00 H new ATOM 0 HA LYS A 106 -16.957 -2.082 -9.245 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -14.695 -2.944 -8.365 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -16.080 -3.616 -7.528 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -15.956 -5.694 -8.779 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -14.838 -5.011 -9.944 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -13.981 -4.918 -7.060 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -14.015 -6.502 -7.810 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -12.338 -5.940 -9.395 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -12.727 -4.232 -9.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -10.711 -4.696 -8.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -11.944 -4.125 -7.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -11.566 -5.780 -7.079 1.00 0.00 H new ATOM 1695 N PRO A 107 -15.453 -1.446 -11.049 1.00 0.00 N ATOM 1696 CA PRO A 107 -14.700 -1.008 -12.250 1.00 0.00 C ATOM 1697 C PRO A 107 -13.220 -1.377 -12.119 1.00 0.00 C ATOM 1698 O PRO A 107 -12.728 -1.635 -11.038 1.00 0.00 O ATOM 1699 CB PRO A 107 -14.885 0.507 -12.255 1.00 0.00 C ATOM 1700 CG PRO A 107 -15.158 0.868 -10.829 1.00 0.00 C ATOM 1701 CD PRO A 107 -15.837 -0.318 -10.195 1.00 0.00 C ATOM 0 HA PRO A 107 -15.048 -1.479 -13.169 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -13.993 1.012 -12.626 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -15.711 0.802 -12.902 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -14.231 1.106 -10.307 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -15.793 1.752 -10.770 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -15.506 -0.465 -9.167 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -16.919 -0.190 -10.166 1.00 0.00 H new ATOM 1709 N THR A 108 -12.507 -1.404 -13.211 1.00 0.00 N ATOM 1710 CA THR A 108 -11.060 -1.756 -13.148 1.00 0.00 C ATOM 1711 C THR A 108 -10.202 -0.492 -13.264 1.00 0.00 C ATOM 1712 O THR A 108 -10.243 0.209 -14.255 1.00 0.00 O ATOM 1713 CB THR A 108 -10.824 -2.676 -14.347 1.00 0.00 C ATOM 1714 OG1 THR A 108 -11.630 -3.839 -14.214 1.00 0.00 O ATOM 1715 CG2 THR A 108 -9.350 -3.078 -14.404 1.00 0.00 C ATOM 0 H THR A 108 -12.863 -1.198 -14.144 1.00 0.00 H new ATOM 0 HA THR A 108 -10.792 -2.236 -12.207 1.00 0.00 H new ATOM 0 HB THR A 108 -11.089 -2.152 -15.265 1.00 0.00 H new ATOM 0 HG1 THR A 108 -11.482 -4.429 -14.982 1.00 0.00 H new ATOM 0 HG21 THR A 108 -9.184 -3.733 -15.259 1.00 0.00 H new ATOM 0 HG22 THR A 108 -8.733 -2.185 -14.506 1.00 0.00 H new ATOM 0 HG23 THR A 108 -9.080 -3.602 -13.487 1.00 0.00 H new ATOM 1723 N GLY A 109 -9.426 -0.196 -12.258 1.00 0.00 N ATOM 1724 CA GLY A 109 -8.568 1.022 -12.311 1.00 0.00 C ATOM 1725 C GLY A 109 -9.022 2.014 -11.240 1.00 0.00 C ATOM 1726 O GLY A 109 -10.031 1.822 -10.590 1.00 0.00 O ATOM 0 H GLY A 109 -9.349 -0.745 -11.402 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -7.524 0.751 -12.152 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.631 1.482 -13.297 1.00 0.00 H new ATOM 1730 N CYS A 110 -8.285 3.075 -11.049 1.00 0.00 N ATOM 1731 CA CYS A 110 -8.677 4.080 -10.020 1.00 0.00 C ATOM 1732 C CYS A 110 -8.487 5.498 -10.564 1.00 0.00 C ATOM 1733 O CYS A 110 -7.969 5.692 -11.646 1.00 0.00 O ATOM 1734 CB CYS A 110 -7.735 3.826 -8.841 1.00 0.00 C ATOM 1735 SG CYS A 110 -6.021 3.876 -9.419 1.00 0.00 S ATOM 0 H CYS A 110 -7.429 3.289 -11.561 1.00 0.00 H new ATOM 0 HA CYS A 110 -9.725 3.990 -9.732 1.00 0.00 H new ATOM 0 HB2 CYS A 110 -7.892 4.578 -8.068 1.00 0.00 H new ATOM 0 HB3 CYS A 110 -7.951 2.857 -8.391 1.00 0.00 H new ATOM 0 HG CYS A 110 -5.219 3.663 -8.418 1.00 0.00 H new ATOM 1741 N VAL A 111 -8.901 6.489 -9.824 1.00 0.00 N ATOM 1742 CA VAL A 111 -8.743 7.893 -10.301 1.00 0.00 C ATOM 1743 C VAL A 111 -7.443 8.492 -9.760 1.00 0.00 C ATOM 1744 O VAL A 111 -6.961 8.001 -8.752 1.00 0.00 O ATOM 1745 CB VAL A 111 -9.953 8.640 -9.741 1.00 0.00 C ATOM 1746 CG1 VAL A 111 -11.238 7.945 -10.194 1.00 0.00 C ATOM 1747 CG2 VAL A 111 -9.887 8.641 -8.212 1.00 0.00 C ATOM 1748 OXT VAL A 111 -6.951 9.433 -10.362 1.00 0.00 O ATOM 0 H VAL A 111 -9.342 6.388 -8.910 1.00 0.00 H new ATOM 0 HA VAL A 111 -8.693 7.957 -11.388 1.00 0.00 H new ATOM 0 HB VAL A 111 -9.947 9.667 -10.107 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -12.100 8.478 -9.794 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -11.286 7.942 -11.283 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -11.245 6.918 -9.828 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -10.749 9.173 -7.811 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -9.893 7.614 -7.847 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -8.972 9.136 -7.888 1.00 0.00 H new TER 1758 VAL A 111