USER MOD reduce.3.24.130724 H: found=0, std=0, add=525, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 523 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 12 CYS SG : rot -151:sc= 0.772 USER MOD Set 1.2: A 15 CYS SG : rot 122:sc= -1.55! USER MOD Set 2.1: A 7 SER OG : rot -160:sc= -3.32! USER MOD Set 2.2: A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 4 HIS : no HD1:sc= -4.7! C(o=-4.1!,f=-12!) USER MOD Set 3.2: A 47 SER OG : rot -78:sc= 0.62 USER MOD Single : A 1 MET CE :methyl -175:sc= 0 (180deg=-0.0246) USER MOD Single : A 1 MET N :NH3+ -122:sc= -2.5! (180deg=-5.51!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 MET CE :methyl -176:sc= -0.367 (180deg=-0.428) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -85:sc= 0.528 USER MOD Single : A 24 ASN : amide:sc= -0.208 K(o=-0.21,f=-1.7!) USER MOD Single : A 25 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.00803) USER MOD Single : A 30 LYS NZ :NH3+ -159:sc= -0.274 (180deg=-0.913) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 151:sc= -0.0746 (180deg=-0.528) USER MOD Single : A 41 CYS SG : rot 180:sc= -0.589 USER MOD Single : A 44 SER OG : rot 180:sc= 0.14 USER MOD Single : A 46 HIS : no HD1:sc= -0.345 X(o=-0.35,f=-0.017) USER MOD Single : A 48 MET CE :methyl -136:sc= 0 (180deg=-0.0259) USER MOD Single : A 50 THR OG1 : rot -170:sc= -2.14! USER MOD Single : A 54 THR OG1 : rot -40:sc= -2.34 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ -157:sc= -0.458 (180deg=-1.05) USER MOD Single : A 58 THR OG1 : rot 140:sc= -0.783 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.406 -17.948 -20.083 1.00 0.00 N ATOM 2 CA MET A 1 -17.032 -18.520 -21.407 1.00 0.00 C ATOM 3 C MET A 1 -17.111 -17.433 -22.479 1.00 0.00 C ATOM 4 O MET A 1 -16.119 -17.133 -23.142 1.00 0.00 O ATOM 5 CB MET A 1 -17.981 -19.670 -21.751 1.00 0.00 C ATOM 6 CG MET A 1 -17.243 -21.002 -21.602 1.00 0.00 C ATOM 7 SD MET A 1 -15.805 -21.023 -22.702 1.00 0.00 S ATOM 8 CE MET A 1 -16.675 -21.552 -24.198 1.00 0.00 C ATOM 0 H1 MET A 1 -16.622 -18.082 -19.413 1.00 0.00 H new ATOM 0 H2 MET A 1 -17.602 -16.932 -20.187 1.00 0.00 H new ATOM 0 H3 MET A 1 -18.255 -18.430 -19.724 1.00 0.00 H new ATOM 0 HA MET A 1 -16.011 -18.900 -21.366 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.850 -19.648 -21.093 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.350 -19.559 -22.771 1.00 0.00 H new ATOM 0 HG2 MET A 1 -16.925 -21.140 -20.568 1.00 0.00 H new ATOM 0 HG3 MET A 1 -17.911 -21.829 -21.844 1.00 0.00 H new ATOM 0 HE1 MET A 1 -15.954 -21.719 -24.998 1.00 0.00 H new ATOM 0 HE2 MET A 1 -17.215 -22.478 -23.997 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.381 -20.779 -24.501 1.00 0.00 H new ATOM 20 N PRO A 2 -18.265 -16.844 -22.658 1.00 0.00 N ATOM 21 CA PRO A 2 -18.469 -15.768 -23.674 1.00 0.00 C ATOM 22 C PRO A 2 -17.725 -14.485 -23.312 1.00 0.00 C ATOM 23 O PRO A 2 -17.481 -14.205 -22.139 1.00 0.00 O ATOM 24 CB PRO A 2 -19.983 -15.537 -23.672 1.00 0.00 C ATOM 25 CG PRO A 2 -20.463 -16.036 -22.350 1.00 0.00 C ATOM 26 CD PRO A 2 -19.501 -17.141 -21.918 1.00 0.00 C ATOM 0 HA PRO A 2 -18.081 -16.056 -24.651 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -20.219 -14.481 -23.801 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -20.462 -16.073 -24.491 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -20.480 -15.230 -21.616 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -21.481 -16.418 -22.428 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -19.335 -17.127 -20.841 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -19.889 -18.129 -22.168 1.00 0.00 H new ATOM 34 N LYS A 3 -17.371 -13.707 -24.330 1.00 0.00 N ATOM 35 CA LYS A 3 -16.659 -12.454 -24.108 1.00 0.00 C ATOM 36 C LYS A 3 -17.646 -11.316 -23.879 1.00 0.00 C ATOM 37 O LYS A 3 -18.741 -11.309 -24.443 1.00 0.00 O ATOM 38 CB LYS A 3 -15.779 -12.134 -25.318 1.00 0.00 C ATOM 39 CG LYS A 3 -14.877 -13.329 -25.624 1.00 0.00 C ATOM 40 CD LYS A 3 -14.082 -13.056 -26.901 1.00 0.00 C ATOM 41 CE LYS A 3 -13.253 -11.783 -26.721 1.00 0.00 C ATOM 42 NZ LYS A 3 -11.954 -11.932 -27.434 1.00 0.00 N ATOM 0 H LYS A 3 -17.564 -13.920 -25.309 1.00 0.00 H new ATOM 0 HA LYS A 3 -16.033 -12.562 -23.223 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -16.401 -11.904 -26.183 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -15.174 -11.250 -25.117 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -14.197 -13.507 -24.791 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -15.478 -14.230 -25.743 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -13.429 -13.900 -27.123 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -14.760 -12.945 -27.748 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -13.798 -10.923 -27.111 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -13.079 -11.596 -25.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -11.390 -11.067 -27.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -11.434 -12.743 -27.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -12.130 -12.091 -28.447 1.00 0.00 H new ATOM 56 N HIS A 4 -17.258 -10.357 -23.045 1.00 0.00 N ATOM 57 CA HIS A 4 -18.126 -9.223 -22.753 1.00 0.00 C ATOM 58 C HIS A 4 -17.491 -7.922 -23.225 1.00 0.00 C ATOM 59 O HIS A 4 -16.320 -7.655 -22.951 1.00 0.00 O ATOM 60 CB HIS A 4 -18.395 -9.143 -21.250 1.00 0.00 C ATOM 61 CG HIS A 4 -19.797 -8.644 -21.020 1.00 0.00 C ATOM 62 ND1 HIS A 4 -20.653 -9.239 -20.105 1.00 0.00 N ATOM 63 CD2 HIS A 4 -20.506 -7.611 -21.582 1.00 0.00 C ATOM 64 CE1 HIS A 4 -21.817 -8.565 -20.144 1.00 0.00 C ATOM 65 NE2 HIS A 4 -21.781 -7.563 -21.028 1.00 0.00 N ATOM 0 H HIS A 4 -16.359 -10.342 -22.564 1.00 0.00 H new ATOM 0 HA HIS A 4 -19.067 -9.368 -23.284 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -18.267 -10.124 -20.793 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -17.677 -8.474 -20.776 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -20.131 -6.938 -22.339 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -22.676 -8.805 -19.535 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -22.528 -6.905 -21.249 1.00 0.00 H new ATOM 73 N GLU A 5 -18.273 -7.111 -23.929 1.00 0.00 N ATOM 74 CA GLU A 5 -17.777 -5.834 -24.427 1.00 0.00 C ATOM 75 C GLU A 5 -18.646 -4.696 -23.909 1.00 0.00 C ATOM 76 O GLU A 5 -19.870 -4.728 -24.037 1.00 0.00 O ATOM 77 CB GLU A 5 -17.785 -5.829 -25.955 1.00 0.00 C ATOM 78 CG GLU A 5 -16.395 -6.197 -26.475 1.00 0.00 C ATOM 79 CD GLU A 5 -16.513 -6.902 -27.821 1.00 0.00 C ATOM 80 OE1 GLU A 5 -16.849 -8.075 -27.826 1.00 0.00 O ATOM 81 OE2 GLU A 5 -16.265 -6.259 -28.828 1.00 0.00 O ATOM 0 H GLU A 5 -19.244 -7.313 -24.166 1.00 0.00 H new ATOM 0 HA GLU A 5 -16.756 -5.694 -24.072 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -18.524 -6.539 -26.327 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -18.074 -4.845 -26.324 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -15.786 -5.299 -26.578 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -15.889 -6.845 -25.759 1.00 0.00 H new ATOM 88 N PHE A 6 -18.004 -3.689 -23.328 1.00 0.00 N ATOM 89 CA PHE A 6 -18.723 -2.540 -22.793 1.00 0.00 C ATOM 90 C PHE A 6 -18.168 -1.248 -23.388 1.00 0.00 C ATOM 91 O PHE A 6 -16.977 -1.153 -23.685 1.00 0.00 O ATOM 92 CB PHE A 6 -18.593 -2.506 -21.266 1.00 0.00 C ATOM 93 CG PHE A 6 -19.901 -2.927 -20.632 1.00 0.00 C ATOM 94 CD1 PHE A 6 -20.556 -4.085 -21.070 1.00 0.00 C ATOM 95 CD2 PHE A 6 -20.456 -2.159 -19.602 1.00 0.00 C ATOM 96 CE1 PHE A 6 -21.764 -4.472 -20.480 1.00 0.00 C ATOM 97 CE2 PHE A 6 -21.666 -2.546 -19.012 1.00 0.00 C ATOM 98 CZ PHE A 6 -22.319 -3.704 -19.450 1.00 0.00 C ATOM 0 H PHE A 6 -16.991 -3.645 -23.216 1.00 0.00 H new ATOM 0 HA PHE A 6 -19.776 -2.629 -23.061 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -17.792 -3.171 -20.945 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -18.325 -1.502 -20.937 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -20.128 -4.680 -21.864 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -19.951 -1.267 -19.262 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -22.269 -5.364 -20.820 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -22.095 -1.951 -18.219 1.00 0.00 H new ATOM 0 HZ PHE A 6 -23.250 -4.005 -18.993 1.00 0.00 H new ATOM 108 N SER A 7 -19.038 -0.259 -23.565 1.00 0.00 N ATOM 109 CA SER A 7 -18.617 1.019 -24.134 1.00 0.00 C ATOM 110 C SER A 7 -18.561 2.095 -23.057 1.00 0.00 C ATOM 111 O SER A 7 -19.587 2.476 -22.494 1.00 0.00 O ATOM 112 CB SER A 7 -19.592 1.445 -25.231 1.00 0.00 C ATOM 113 OG SER A 7 -19.226 0.816 -26.453 1.00 0.00 O ATOM 0 H SER A 7 -20.028 -0.315 -23.326 1.00 0.00 H new ATOM 0 HA SER A 7 -17.621 0.895 -24.558 1.00 0.00 H new ATOM 0 HB2 SER A 7 -20.610 1.168 -24.957 1.00 0.00 H new ATOM 0 HB3 SER A 7 -19.576 2.529 -25.347 1.00 0.00 H new ATOM 0 HG SER A 7 -19.621 1.306 -27.204 1.00 0.00 H new ATOM 119 N VAL A 8 -17.358 2.580 -22.769 1.00 0.00 N ATOM 120 CA VAL A 8 -17.191 3.610 -21.753 1.00 0.00 C ATOM 121 C VAL A 8 -16.333 4.758 -22.267 1.00 0.00 C ATOM 122 O VAL A 8 -15.238 4.543 -22.788 1.00 0.00 O ATOM 123 CB VAL A 8 -16.530 3.013 -20.511 1.00 0.00 C ATOM 124 CG1 VAL A 8 -15.222 2.328 -20.909 1.00 0.00 C ATOM 125 CG2 VAL A 8 -16.237 4.130 -19.506 1.00 0.00 C ATOM 0 H VAL A 8 -16.494 2.280 -23.220 1.00 0.00 H new ATOM 0 HA VAL A 8 -18.179 3.996 -21.503 1.00 0.00 H new ATOM 0 HB VAL A 8 -17.199 2.281 -20.058 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -14.750 1.902 -20.023 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -15.431 1.534 -21.626 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -14.552 3.059 -21.361 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -15.765 3.707 -18.619 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -15.567 4.861 -19.959 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -17.169 4.619 -19.223 1.00 0.00 H new ATOM 135 N ASP A 9 -16.823 5.980 -22.091 1.00 0.00 N ATOM 136 CA ASP A 9 -16.072 7.151 -22.516 1.00 0.00 C ATOM 137 C ASP A 9 -15.089 7.539 -21.419 1.00 0.00 C ATOM 138 O ASP A 9 -15.494 7.937 -20.328 1.00 0.00 O ATOM 139 CB ASP A 9 -17.024 8.316 -22.797 1.00 0.00 C ATOM 140 CG ASP A 9 -16.760 8.882 -24.188 1.00 0.00 C ATOM 141 OD1 ASP A 9 -15.762 9.564 -24.349 1.00 0.00 O ATOM 142 OD2 ASP A 9 -17.560 8.625 -25.073 1.00 0.00 O ATOM 0 H ASP A 9 -17.726 6.183 -21.662 1.00 0.00 H new ATOM 0 HA ASP A 9 -15.528 6.918 -23.431 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -18.058 7.978 -22.723 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -16.890 9.095 -22.047 1.00 0.00 H new ATOM 147 N MET A 10 -13.801 7.397 -21.703 1.00 0.00 N ATOM 148 CA MET A 10 -12.780 7.716 -20.713 1.00 0.00 C ATOM 149 C MET A 10 -12.648 9.221 -20.515 1.00 0.00 C ATOM 150 O MET A 10 -12.268 9.950 -21.430 1.00 0.00 O ATOM 151 CB MET A 10 -11.436 7.138 -21.157 1.00 0.00 C ATOM 152 CG MET A 10 -11.449 6.926 -22.673 1.00 0.00 C ATOM 153 SD MET A 10 -12.318 5.386 -23.059 1.00 0.00 S ATOM 154 CE MET A 10 -10.874 4.298 -23.022 1.00 0.00 C ATOM 0 H MET A 10 -13.441 7.067 -22.599 1.00 0.00 H new ATOM 0 HA MET A 10 -13.080 7.274 -19.763 1.00 0.00 H new ATOM 0 HB2 MET A 10 -10.628 7.815 -20.880 1.00 0.00 H new ATOM 0 HB3 MET A 10 -11.248 6.192 -20.648 1.00 0.00 H new ATOM 0 HG2 MET A 10 -11.940 7.766 -23.164 1.00 0.00 H new ATOM 0 HG3 MET A 10 -10.429 6.886 -23.054 1.00 0.00 H new ATOM 0 HE1 MET A 10 -11.171 3.289 -23.308 1.00 0.00 H new ATOM 0 HE2 MET A 10 -10.123 4.666 -23.721 1.00 0.00 H new ATOM 0 HE3 MET A 10 -10.456 4.282 -22.015 1.00 0.00 H new ATOM 164 N THR A 11 -12.948 9.673 -19.301 1.00 0.00 N ATOM 165 CA THR A 11 -12.843 11.088 -18.970 1.00 0.00 C ATOM 166 C THR A 11 -11.687 11.310 -18.001 1.00 0.00 C ATOM 167 O THR A 11 -10.952 12.292 -18.105 1.00 0.00 O ATOM 168 CB THR A 11 -14.148 11.582 -18.338 1.00 0.00 C ATOM 169 OG1 THR A 11 -15.251 11.105 -19.097 1.00 0.00 O ATOM 170 CG2 THR A 11 -14.162 13.114 -18.322 1.00 0.00 C ATOM 0 H THR A 11 -13.265 9.081 -18.533 1.00 0.00 H new ATOM 0 HA THR A 11 -12.658 11.649 -19.886 1.00 0.00 H new ATOM 0 HB THR A 11 -14.221 11.209 -17.316 1.00 0.00 H new ATOM 0 HG1 THR A 11 -16.087 11.419 -18.693 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.091 13.465 -17.872 1.00 0.00 H new ATOM 0 HG22 THR A 11 -13.316 13.480 -17.740 1.00 0.00 H new ATOM 0 HG23 THR A 11 -14.089 13.489 -19.343 1.00 0.00 H new ATOM 178 N CYS A 12 -11.538 10.383 -17.058 1.00 0.00 N ATOM 179 CA CYS A 12 -10.474 10.468 -16.064 1.00 0.00 C ATOM 180 C CYS A 12 -9.274 9.630 -16.489 1.00 0.00 C ATOM 181 O CYS A 12 -8.601 9.034 -15.652 1.00 0.00 O ATOM 182 CB CYS A 12 -10.988 9.978 -14.710 1.00 0.00 C ATOM 183 SG CYS A 12 -11.553 11.391 -13.730 1.00 0.00 S ATOM 0 H CYS A 12 -12.140 9.566 -16.962 1.00 0.00 H new ATOM 0 HA CYS A 12 -10.162 11.509 -15.980 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -11.806 9.272 -14.854 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -10.197 9.447 -14.180 1.00 0.00 H new ATOM 0 HG CYS A 12 -11.408 11.128 -12.465 1.00 0.00 H new ATOM 189 N GLY A 13 -9.013 9.597 -17.795 1.00 0.00 N ATOM 190 CA GLY A 13 -7.889 8.831 -18.328 1.00 0.00 C ATOM 191 C GLY A 13 -6.870 8.523 -17.237 1.00 0.00 C ATOM 192 O GLY A 13 -6.487 7.371 -17.038 1.00 0.00 O ATOM 0 H GLY A 13 -9.562 10.089 -18.500 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -8.253 7.900 -18.764 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.410 9.392 -19.130 1.00 0.00 H new ATOM 196 N GLY A 14 -6.441 9.561 -16.527 1.00 0.00 N ATOM 197 CA GLY A 14 -5.472 9.390 -15.451 1.00 0.00 C ATOM 198 C GLY A 14 -6.055 8.546 -14.323 1.00 0.00 C ATOM 199 O GLY A 14 -5.446 7.568 -13.888 1.00 0.00 O ATOM 0 H GLY A 14 -6.746 10.523 -16.676 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -4.572 8.914 -15.839 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -5.175 10.365 -15.065 1.00 0.00 H new ATOM 203 N CYS A 15 -7.236 8.932 -13.851 1.00 0.00 N ATOM 204 CA CYS A 15 -7.892 8.204 -12.771 1.00 0.00 C ATOM 205 C CYS A 15 -8.673 7.014 -13.321 1.00 0.00 C ATOM 206 O CYS A 15 -8.608 5.914 -12.773 1.00 0.00 O ATOM 207 CB CYS A 15 -8.837 9.135 -12.009 1.00 0.00 C ATOM 208 SG CYS A 15 -8.681 10.816 -12.663 1.00 0.00 S ATOM 0 H CYS A 15 -7.755 9.739 -14.196 1.00 0.00 H new ATOM 0 HA CYS A 15 -7.125 7.834 -12.091 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.866 8.788 -12.109 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -8.598 9.123 -10.946 1.00 0.00 H new ATOM 0 HG CYS A 15 -9.842 11.230 -13.077 1.00 0.00 H new ATOM 214 N ALA A 16 -9.411 7.237 -14.406 1.00 0.00 N ATOM 215 CA ALA A 16 -10.195 6.165 -15.011 1.00 0.00 C ATOM 216 C ALA A 16 -9.304 4.967 -15.331 1.00 0.00 C ATOM 217 O ALA A 16 -9.742 3.819 -15.249 1.00 0.00 O ATOM 218 CB ALA A 16 -10.861 6.664 -16.294 1.00 0.00 C ATOM 0 H ALA A 16 -9.482 8.138 -14.879 1.00 0.00 H new ATOM 0 HA ALA A 16 -10.962 5.856 -14.301 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -11.444 5.857 -16.739 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -11.519 7.501 -16.061 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -10.096 6.990 -16.998 1.00 0.00 H new ATOM 224 N GLU A 17 -8.052 5.237 -15.694 1.00 0.00 N ATOM 225 CA GLU A 17 -7.117 4.163 -16.018 1.00 0.00 C ATOM 226 C GLU A 17 -6.836 3.312 -14.784 1.00 0.00 C ATOM 227 O GLU A 17 -6.854 2.082 -14.850 1.00 0.00 O ATOM 228 CB GLU A 17 -5.806 4.749 -16.549 1.00 0.00 C ATOM 229 CG GLU A 17 -4.800 3.619 -16.786 1.00 0.00 C ATOM 230 CD GLU A 17 -3.900 3.960 -17.970 1.00 0.00 C ATOM 231 OE1 GLU A 17 -3.705 5.138 -18.223 1.00 0.00 O ATOM 232 OE2 GLU A 17 -3.418 3.038 -18.606 1.00 0.00 O ATOM 0 H GLU A 17 -7.665 6.178 -15.771 1.00 0.00 H new ATOM 0 HA GLU A 17 -7.567 3.534 -16.786 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -5.987 5.290 -17.478 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -5.401 5.467 -15.836 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.196 3.466 -15.892 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -5.328 2.685 -16.978 1.00 0.00 H new ATOM 239 N ALA A 18 -6.585 3.973 -13.656 1.00 0.00 N ATOM 240 CA ALA A 18 -6.310 3.263 -12.411 1.00 0.00 C ATOM 241 C ALA A 18 -7.555 2.515 -11.950 1.00 0.00 C ATOM 242 O ALA A 18 -7.466 1.481 -11.288 1.00 0.00 O ATOM 243 CB ALA A 18 -5.877 4.251 -11.327 1.00 0.00 C ATOM 0 H ALA A 18 -6.566 4.990 -13.579 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.506 2.549 -12.587 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.674 3.711 -10.402 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -4.975 4.771 -11.648 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.673 4.976 -11.157 1.00 0.00 H new ATOM 249 N VAL A 19 -8.714 3.051 -12.311 1.00 0.00 N ATOM 250 CA VAL A 19 -9.984 2.439 -11.943 1.00 0.00 C ATOM 251 C VAL A 19 -10.112 1.056 -12.575 1.00 0.00 C ATOM 252 O VAL A 19 -10.658 0.136 -11.968 1.00 0.00 O ATOM 253 CB VAL A 19 -11.139 3.338 -12.399 1.00 0.00 C ATOM 254 CG1 VAL A 19 -12.345 2.483 -12.797 1.00 0.00 C ATOM 255 CG2 VAL A 19 -11.537 4.269 -11.252 1.00 0.00 C ATOM 0 H VAL A 19 -8.801 3.908 -12.858 1.00 0.00 H new ATOM 0 HA VAL A 19 -10.023 2.326 -10.860 1.00 0.00 H new ATOM 0 HB VAL A 19 -10.817 3.924 -13.260 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -13.160 3.131 -13.119 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -12.066 1.818 -13.614 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -12.669 1.891 -11.941 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -12.358 4.910 -11.572 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -11.853 3.675 -10.394 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -10.683 4.886 -10.971 1.00 0.00 H new ATOM 265 N SER A 20 -9.615 0.921 -13.799 1.00 0.00 N ATOM 266 CA SER A 20 -9.690 -0.351 -14.509 1.00 0.00 C ATOM 267 C SER A 20 -9.039 -1.469 -13.699 1.00 0.00 C ATOM 268 O SER A 20 -9.480 -2.617 -13.750 1.00 0.00 O ATOM 269 CB SER A 20 -8.992 -0.228 -15.864 1.00 0.00 C ATOM 270 OG SER A 20 -7.625 -0.590 -15.721 1.00 0.00 O ATOM 0 H SER A 20 -9.159 1.671 -14.318 1.00 0.00 H new ATOM 0 HA SER A 20 -10.741 -0.599 -14.657 1.00 0.00 H new ATOM 0 HB2 SER A 20 -9.477 -0.874 -16.596 1.00 0.00 H new ATOM 0 HB3 SER A 20 -9.073 0.793 -16.237 1.00 0.00 H new ATOM 0 HG SER A 20 -7.111 0.187 -15.418 1.00 0.00 H new ATOM 276 N ARG A 21 -7.994 -1.132 -12.952 1.00 0.00 N ATOM 277 CA ARG A 21 -7.301 -2.128 -12.138 1.00 0.00 C ATOM 278 C ARG A 21 -8.280 -2.812 -11.186 1.00 0.00 C ATOM 279 O ARG A 21 -8.237 -4.029 -11.004 1.00 0.00 O ATOM 280 CB ARG A 21 -6.187 -1.460 -11.331 1.00 0.00 C ATOM 281 CG ARG A 21 -5.175 -0.822 -12.284 1.00 0.00 C ATOM 282 CD ARG A 21 -4.175 0.009 -11.479 1.00 0.00 C ATOM 283 NE ARG A 21 -4.852 0.686 -10.380 1.00 0.00 N ATOM 284 CZ ARG A 21 -4.173 1.162 -9.342 1.00 0.00 C ATOM 285 NH1 ARG A 21 -2.876 1.024 -9.294 1.00 0.00 N ATOM 286 NH2 ARG A 21 -4.803 1.765 -8.371 1.00 0.00 N ATOM 0 H ARG A 21 -7.610 -0.189 -12.892 1.00 0.00 H new ATOM 0 HA ARG A 21 -6.869 -2.877 -12.801 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -6.607 -0.702 -10.670 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -5.692 -2.196 -10.698 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -4.652 -1.595 -12.848 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -5.689 -0.191 -13.009 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -3.387 -0.635 -11.089 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -3.695 0.742 -12.127 1.00 0.00 H new ATOM 0 HE ARG A 21 -5.866 0.796 -10.408 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -2.385 0.551 -10.053 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -2.353 1.389 -8.498 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -5.817 1.871 -8.409 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -4.282 2.130 -7.574 1.00 0.00 H new ATOM 300 N VAL A 22 -9.160 -2.021 -10.582 1.00 0.00 N ATOM 301 CA VAL A 22 -10.148 -2.555 -9.649 1.00 0.00 C ATOM 302 C VAL A 22 -11.032 -3.599 -10.332 1.00 0.00 C ATOM 303 O VAL A 22 -11.675 -4.409 -9.663 1.00 0.00 O ATOM 304 CB VAL A 22 -11.013 -1.424 -9.087 1.00 0.00 C ATOM 305 CG1 VAL A 22 -10.158 -0.165 -8.915 1.00 0.00 C ATOM 306 CG2 VAL A 22 -12.165 -1.131 -10.050 1.00 0.00 C ATOM 0 H VAL A 22 -9.210 -1.012 -10.720 1.00 0.00 H new ATOM 0 HA VAL A 22 -9.615 -3.036 -8.829 1.00 0.00 H new ATOM 0 HB VAL A 22 -11.418 -1.724 -8.120 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -10.773 0.641 -8.515 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -9.339 -0.373 -8.226 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -9.752 0.134 -9.881 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.779 -0.326 -9.648 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -11.763 -0.832 -11.018 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -12.775 -2.026 -10.171 1.00 0.00 H new ATOM 316 N LEU A 23 -11.068 -3.568 -11.663 1.00 0.00 N ATOM 317 CA LEU A 23 -11.889 -4.516 -12.414 1.00 0.00 C ATOM 318 C LEU A 23 -11.477 -5.946 -12.091 1.00 0.00 C ATOM 319 O LEU A 23 -12.312 -6.845 -12.051 1.00 0.00 O ATOM 320 CB LEU A 23 -11.734 -4.274 -13.919 1.00 0.00 C ATOM 321 CG LEU A 23 -12.590 -5.277 -14.697 1.00 0.00 C ATOM 322 CD1 LEU A 23 -14.071 -4.933 -14.523 1.00 0.00 C ATOM 323 CD2 LEU A 23 -12.226 -5.214 -16.183 1.00 0.00 C ATOM 0 H LEU A 23 -10.546 -2.906 -12.237 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.930 -4.368 -12.128 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -12.036 -3.256 -14.166 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.688 -4.375 -14.207 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.404 -6.281 -14.317 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -14.678 -5.648 -15.078 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -14.333 -4.977 -13.466 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -14.258 -3.928 -14.901 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.835 -5.928 -16.737 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -12.411 -4.208 -16.561 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.172 -5.461 -16.310 1.00 0.00 H new ATOM 335 N ASN A 24 -10.187 -6.150 -11.857 1.00 0.00 N ATOM 336 CA ASN A 24 -9.688 -7.481 -11.533 1.00 0.00 C ATOM 337 C ASN A 24 -10.421 -8.039 -10.315 1.00 0.00 C ATOM 338 O ASN A 24 -10.714 -9.234 -10.248 1.00 0.00 O ATOM 339 CB ASN A 24 -8.185 -7.423 -11.249 1.00 0.00 C ATOM 340 CG ASN A 24 -7.405 -7.547 -12.554 1.00 0.00 C ATOM 341 OD1 ASN A 24 -7.829 -8.256 -13.466 1.00 0.00 O ATOM 342 ND2 ASN A 24 -6.284 -6.893 -12.698 1.00 0.00 N ATOM 0 H ASN A 24 -9.474 -5.421 -11.885 1.00 0.00 H new ATOM 0 HA ASN A 24 -9.867 -8.137 -12.385 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.936 -6.485 -10.754 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -7.903 -8.227 -10.569 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.757 -6.969 -13.568 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -5.935 -6.306 -11.940 1.00 0.00 H new ATOM 349 N LYS A 25 -10.714 -7.166 -9.357 1.00 0.00 N ATOM 350 CA LYS A 25 -11.413 -7.578 -8.143 1.00 0.00 C ATOM 351 C LYS A 25 -12.852 -7.981 -8.453 1.00 0.00 C ATOM 352 O LYS A 25 -13.340 -8.999 -7.960 1.00 0.00 O ATOM 353 CB LYS A 25 -11.413 -6.436 -7.126 1.00 0.00 C ATOM 354 CG LYS A 25 -12.545 -6.648 -6.118 1.00 0.00 C ATOM 355 CD LYS A 25 -12.314 -5.756 -4.898 1.00 0.00 C ATOM 356 CE LYS A 25 -13.494 -5.893 -3.935 1.00 0.00 C ATOM 357 NZ LYS A 25 -14.625 -5.049 -4.413 1.00 0.00 N ATOM 0 H LYS A 25 -10.480 -6.174 -9.396 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.890 -8.439 -7.727 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.454 -6.396 -6.609 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.540 -5.481 -7.636 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -13.505 -6.412 -6.578 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.585 -7.694 -5.815 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.388 -6.039 -4.398 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.204 -4.717 -5.209 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -13.806 -6.935 -3.871 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.196 -5.587 -2.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -15.396 -5.075 -3.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.300 -4.069 -4.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -14.970 -5.414 -5.324 1.00 0.00 H new ATOM 371 N LEU A 26 -13.530 -7.175 -9.266 1.00 0.00 N ATOM 372 CA LEU A 26 -14.912 -7.459 -9.628 1.00 0.00 C ATOM 373 C LEU A 26 -14.970 -8.586 -10.653 1.00 0.00 C ATOM 374 O LEU A 26 -15.828 -9.467 -10.580 1.00 0.00 O ATOM 375 CB LEU A 26 -15.560 -6.202 -10.213 1.00 0.00 C ATOM 376 CG LEU A 26 -16.918 -5.964 -9.552 1.00 0.00 C ATOM 377 CD1 LEU A 26 -17.739 -7.253 -9.593 1.00 0.00 C ATOM 378 CD2 LEU A 26 -16.710 -5.538 -8.097 1.00 0.00 C ATOM 0 H LEU A 26 -13.147 -6.327 -9.683 1.00 0.00 H new ATOM 0 HA LEU A 26 -15.453 -7.767 -8.733 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -14.912 -5.340 -10.054 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -15.684 -6.313 -11.290 1.00 0.00 H new ATOM 0 HG LEU A 26 -17.449 -5.178 -10.088 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -18.707 -7.083 -9.122 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -17.888 -7.557 -10.629 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -17.208 -8.040 -9.057 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -17.678 -5.368 -7.626 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -16.178 -6.324 -7.560 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -16.126 -4.618 -8.067 1.00 0.00 H new ATOM 390 N GLY A 27 -14.046 -8.553 -11.605 1.00 0.00 N ATOM 391 CA GLY A 27 -13.988 -9.574 -12.644 1.00 0.00 C ATOM 392 C GLY A 27 -12.899 -10.597 -12.339 1.00 0.00 C ATOM 393 O GLY A 27 -13.181 -11.772 -12.106 1.00 0.00 O ATOM 0 H GLY A 27 -13.328 -7.832 -11.679 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -14.953 -10.075 -12.721 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -13.794 -9.106 -13.609 1.00 0.00 H new ATOM 397 N GLY A 28 -11.649 -10.138 -12.348 1.00 0.00 N ATOM 398 CA GLY A 28 -10.520 -11.021 -12.078 1.00 0.00 C ATOM 399 C GLY A 28 -10.293 -11.975 -13.243 1.00 0.00 C ATOM 400 O GLY A 28 -9.839 -13.105 -13.055 1.00 0.00 O ATOM 0 H GLY A 28 -11.395 -9.168 -12.538 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -9.621 -10.429 -11.906 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -10.706 -11.589 -11.167 1.00 0.00 H new ATOM 404 N VAL A 29 -10.618 -11.515 -14.446 1.00 0.00 N ATOM 405 CA VAL A 29 -10.455 -12.336 -15.638 1.00 0.00 C ATOM 406 C VAL A 29 -9.804 -11.541 -16.760 1.00 0.00 C ATOM 407 O VAL A 29 -9.343 -10.417 -16.562 1.00 0.00 O ATOM 408 CB VAL A 29 -11.817 -12.852 -16.101 1.00 0.00 C ATOM 409 CG1 VAL A 29 -11.678 -14.293 -16.597 1.00 0.00 C ATOM 410 CG2 VAL A 29 -12.801 -12.809 -14.930 1.00 0.00 C ATOM 0 H VAL A 29 -10.994 -10.583 -14.620 1.00 0.00 H new ATOM 0 HA VAL A 29 -9.809 -13.177 -15.388 1.00 0.00 H new ATOM 0 HB VAL A 29 -12.186 -12.224 -16.912 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -12.650 -14.660 -16.927 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -10.976 -14.325 -17.430 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.308 -14.922 -15.787 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -13.773 -13.177 -15.258 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -12.430 -13.437 -14.120 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -12.902 -11.783 -14.577 1.00 0.00 H new ATOM 420 N LYS A 30 -9.769 -12.147 -17.938 1.00 0.00 N ATOM 421 CA LYS A 30 -9.171 -11.511 -19.104 1.00 0.00 C ATOM 422 C LYS A 30 -9.807 -10.149 -19.365 1.00 0.00 C ATOM 423 O LYS A 30 -11.029 -10.007 -19.347 1.00 0.00 O ATOM 424 CB LYS A 30 -9.346 -12.405 -20.336 1.00 0.00 C ATOM 425 CG LYS A 30 -9.577 -13.851 -19.893 1.00 0.00 C ATOM 426 CD LYS A 30 -9.384 -14.788 -21.088 1.00 0.00 C ATOM 427 CE LYS A 30 -8.114 -15.616 -20.890 1.00 0.00 C ATOM 428 NZ LYS A 30 -6.972 -14.706 -20.592 1.00 0.00 N ATOM 0 H LYS A 30 -10.147 -13.078 -18.112 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.109 -11.367 -18.907 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -10.189 -12.058 -20.933 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -8.461 -12.345 -20.970 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -8.882 -14.114 -19.095 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.583 -13.962 -19.489 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -10.247 -15.446 -21.190 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -9.313 -14.209 -22.009 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -8.252 -16.324 -20.073 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -7.904 -16.200 -21.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -6.077 -15.191 -20.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -7.049 -13.849 -21.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -6.992 -14.442 -19.586 1.00 0.00 H new ATOM 442 N TYR A 31 -8.963 -9.154 -19.608 1.00 0.00 N ATOM 443 CA TYR A 31 -9.438 -7.799 -19.874 1.00 0.00 C ATOM 444 C TYR A 31 -8.486 -7.076 -20.824 1.00 0.00 C ATOM 445 O TYR A 31 -7.323 -7.455 -20.960 1.00 0.00 O ATOM 446 CB TYR A 31 -9.545 -7.014 -18.564 1.00 0.00 C ATOM 447 CG TYR A 31 -8.201 -6.418 -18.227 1.00 0.00 C ATOM 448 CD1 TYR A 31 -7.181 -7.232 -17.721 1.00 0.00 C ATOM 449 CD2 TYR A 31 -7.972 -5.051 -18.423 1.00 0.00 C ATOM 450 CE1 TYR A 31 -5.932 -6.681 -17.412 1.00 0.00 C ATOM 451 CE2 TYR A 31 -6.722 -4.499 -18.116 1.00 0.00 C ATOM 452 CZ TYR A 31 -5.703 -5.314 -17.610 1.00 0.00 C ATOM 453 OH TYR A 31 -4.471 -4.770 -17.307 1.00 0.00 O ATOM 0 H TYR A 31 -7.948 -9.258 -19.627 1.00 0.00 H new ATOM 0 HA TYR A 31 -10.422 -7.864 -20.339 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -10.291 -6.225 -18.659 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -9.876 -7.671 -17.760 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -7.358 -8.286 -17.569 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -8.759 -4.422 -18.811 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -5.146 -7.310 -17.021 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -6.545 -3.445 -18.270 1.00 0.00 H new ATOM 0 HH TYR A 31 -4.480 -3.810 -17.504 1.00 0.00 H new ATOM 463 N ASP A 32 -8.987 -6.031 -21.478 1.00 0.00 N ATOM 464 CA ASP A 32 -8.165 -5.264 -22.411 1.00 0.00 C ATOM 465 C ASP A 32 -8.655 -3.823 -22.508 1.00 0.00 C ATOM 466 O ASP A 32 -9.855 -3.568 -22.608 1.00 0.00 O ATOM 467 CB ASP A 32 -8.205 -5.911 -23.797 1.00 0.00 C ATOM 468 CG ASP A 32 -6.837 -5.801 -24.460 1.00 0.00 C ATOM 469 OD1 ASP A 32 -6.570 -4.770 -25.056 1.00 0.00 O ATOM 470 OD2 ASP A 32 -6.075 -6.749 -24.362 1.00 0.00 O ATOM 0 H ASP A 32 -9.946 -5.698 -21.381 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.141 -5.261 -22.039 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.494 -6.958 -23.711 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.959 -5.422 -24.415 1.00 0.00 H new ATOM 475 N ILE A 33 -7.715 -2.883 -22.480 1.00 0.00 N ATOM 476 CA ILE A 33 -8.053 -1.470 -22.566 1.00 0.00 C ATOM 477 C ILE A 33 -7.442 -0.849 -23.819 1.00 0.00 C ATOM 478 O ILE A 33 -6.221 -0.759 -23.944 1.00 0.00 O ATOM 479 CB ILE A 33 -7.528 -0.742 -21.330 1.00 0.00 C ATOM 480 CG1 ILE A 33 -6.255 -1.433 -20.838 1.00 0.00 C ATOM 481 CG2 ILE A 33 -8.589 -0.777 -20.229 1.00 0.00 C ATOM 482 CD1 ILE A 33 -5.703 -0.685 -19.624 1.00 0.00 C ATOM 0 H ILE A 33 -6.717 -3.075 -22.399 1.00 0.00 H new ATOM 0 HA ILE A 33 -9.137 -1.373 -22.618 1.00 0.00 H new ATOM 0 HB ILE A 33 -7.304 0.294 -21.583 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -6.470 -2.468 -20.573 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -5.510 -1.455 -21.634 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -8.215 -0.258 -19.347 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -9.496 -0.286 -20.582 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -8.813 -1.812 -19.973 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -4.796 -1.178 -19.274 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -5.472 0.343 -19.904 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -6.447 -0.686 -18.827 1.00 0.00 H new ATOM 494 N ASP A 34 -8.295 -0.422 -24.744 1.00 0.00 N ATOM 495 CA ASP A 34 -7.814 0.190 -25.978 1.00 0.00 C ATOM 496 C ASP A 34 -8.050 1.698 -25.956 1.00 0.00 C ATOM 497 O ASP A 34 -9.158 2.171 -26.210 1.00 0.00 O ATOM 498 CB ASP A 34 -8.527 -0.427 -27.182 1.00 0.00 C ATOM 499 CG ASP A 34 -8.143 -1.897 -27.322 1.00 0.00 C ATOM 500 OD1 ASP A 34 -8.770 -2.718 -26.671 1.00 0.00 O ATOM 501 OD2 ASP A 34 -7.230 -2.180 -28.080 1.00 0.00 O ATOM 0 H ASP A 34 -9.310 -0.487 -24.666 1.00 0.00 H new ATOM 0 HA ASP A 34 -6.743 0.004 -26.060 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.606 -0.335 -27.062 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.260 0.115 -28.089 1.00 0.00 H new ATOM 506 N LEU A 35 -6.995 2.442 -25.644 1.00 0.00 N ATOM 507 CA LEU A 35 -7.072 3.897 -25.577 1.00 0.00 C ATOM 508 C LEU A 35 -7.448 4.521 -26.925 1.00 0.00 C ATOM 509 O LEU A 35 -8.393 5.306 -27.004 1.00 0.00 O ATOM 510 CB LEU A 35 -5.725 4.459 -25.113 1.00 0.00 C ATOM 511 CG LEU A 35 -5.922 5.295 -23.846 1.00 0.00 C ATOM 512 CD1 LEU A 35 -6.909 6.427 -24.131 1.00 0.00 C ATOM 513 CD2 LEU A 35 -6.474 4.407 -22.727 1.00 0.00 C ATOM 0 H LEU A 35 -6.073 2.060 -25.433 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.857 4.152 -24.865 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -5.028 3.644 -24.917 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -5.286 5.072 -25.900 1.00 0.00 H new ATOM 0 HG LEU A 35 -4.965 5.715 -23.537 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.050 7.023 -23.229 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.516 7.060 -24.927 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -7.866 6.006 -24.441 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.614 5.003 -21.825 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -7.431 3.985 -23.036 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -5.771 3.600 -22.523 1.00 0.00 H new ATOM 525 N PRO A 36 -6.723 4.213 -27.975 1.00 0.00 N ATOM 526 CA PRO A 36 -6.991 4.789 -29.330 1.00 0.00 C ATOM 527 C PRO A 36 -8.389 4.469 -29.851 1.00 0.00 C ATOM 528 O PRO A 36 -8.955 5.233 -30.633 1.00 0.00 O ATOM 529 CB PRO A 36 -5.918 4.169 -30.232 1.00 0.00 C ATOM 530 CG PRO A 36 -5.356 3.009 -29.478 1.00 0.00 C ATOM 531 CD PRO A 36 -5.576 3.292 -27.994 1.00 0.00 C ATOM 0 HA PRO A 36 -6.951 5.878 -29.303 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -6.347 3.845 -31.180 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -5.139 4.895 -30.466 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -5.850 2.083 -29.771 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -4.295 2.886 -29.694 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -5.789 2.378 -27.440 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -4.694 3.743 -27.538 1.00 0.00 H new ATOM 539 N ASN A 37 -8.943 3.340 -29.426 1.00 0.00 N ATOM 540 CA ASN A 37 -10.275 2.950 -29.874 1.00 0.00 C ATOM 541 C ASN A 37 -11.326 3.304 -28.827 1.00 0.00 C ATOM 542 O ASN A 37 -12.526 3.193 -29.078 1.00 0.00 O ATOM 543 CB ASN A 37 -10.314 1.446 -30.154 1.00 0.00 C ATOM 544 CG ASN A 37 -9.988 1.178 -31.619 1.00 0.00 C ATOM 545 OD1 ASN A 37 -10.808 0.619 -32.347 1.00 0.00 O ATOM 546 ND2 ASN A 37 -8.831 1.548 -32.097 1.00 0.00 N ATOM 0 H ASN A 37 -8.499 2.686 -28.781 1.00 0.00 H new ATOM 0 HA ASN A 37 -10.500 3.496 -30.790 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -9.598 0.930 -29.514 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -11.300 1.049 -29.914 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -8.605 1.374 -33.076 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -8.153 2.011 -31.491 1.00 0.00 H new ATOM 553 N LYS A 38 -10.872 3.730 -27.652 1.00 0.00 N ATOM 554 CA LYS A 38 -11.792 4.094 -26.580 1.00 0.00 C ATOM 555 C LYS A 38 -12.762 2.952 -26.300 1.00 0.00 C ATOM 556 O LYS A 38 -13.947 3.180 -26.051 1.00 0.00 O ATOM 557 CB LYS A 38 -12.586 5.345 -26.965 1.00 0.00 C ATOM 558 CG LYS A 38 -11.803 6.155 -28.002 1.00 0.00 C ATOM 559 CD LYS A 38 -12.308 7.600 -28.005 1.00 0.00 C ATOM 560 CE LYS A 38 -12.232 8.170 -29.423 1.00 0.00 C ATOM 561 NZ LYS A 38 -13.233 7.484 -30.289 1.00 0.00 N ATOM 0 H LYS A 38 -9.884 3.831 -27.420 1.00 0.00 H new ATOM 0 HA LYS A 38 -11.206 4.297 -25.683 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.557 5.061 -27.370 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -12.775 5.954 -26.081 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -10.738 6.131 -27.770 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.924 5.714 -28.991 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -13.335 7.637 -27.642 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -11.708 8.206 -27.326 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -12.425 9.243 -29.406 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -11.230 8.032 -29.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -13.541 8.131 -31.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -12.803 6.638 -30.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -14.054 7.204 -29.716 1.00 0.00 H new ATOM 575 N LYS A 39 -12.257 1.725 -26.344 1.00 0.00 N ATOM 576 CA LYS A 39 -13.092 0.558 -26.096 1.00 0.00 C ATOM 577 C LYS A 39 -12.440 -0.361 -25.071 1.00 0.00 C ATOM 578 O LYS A 39 -11.216 -0.385 -24.934 1.00 0.00 O ATOM 579 CB LYS A 39 -13.312 -0.216 -27.397 1.00 0.00 C ATOM 580 CG LYS A 39 -14.129 0.633 -28.373 1.00 0.00 C ATOM 581 CD LYS A 39 -14.989 -0.282 -29.247 1.00 0.00 C ATOM 582 CE LYS A 39 -16.358 -0.479 -28.594 1.00 0.00 C ATOM 583 NZ LYS A 39 -17.353 0.416 -29.251 1.00 0.00 N ATOM 0 H LYS A 39 -11.280 1.514 -26.548 1.00 0.00 H new ATOM 0 HA LYS A 39 -14.050 0.902 -25.707 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -12.352 -0.476 -27.843 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -13.832 -1.151 -27.191 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -14.762 1.330 -27.824 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -13.464 1.230 -28.997 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -15.108 0.153 -30.239 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -14.496 -1.245 -29.378 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -16.671 -1.519 -28.686 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -16.300 -0.257 -27.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -18.285 0.283 -28.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -17.055 1.406 -29.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -17.414 0.183 -30.263 1.00 0.00 H new ATOM 597 N VAL A 40 -13.263 -1.123 -24.363 1.00 0.00 N ATOM 598 CA VAL A 40 -12.757 -2.051 -23.362 1.00 0.00 C ATOM 599 C VAL A 40 -13.382 -3.426 -23.563 1.00 0.00 C ATOM 600 O VAL A 40 -14.602 -3.578 -23.508 1.00 0.00 O ATOM 601 CB VAL A 40 -13.083 -1.535 -21.958 1.00 0.00 C ATOM 602 CG1 VAL A 40 -12.548 -2.518 -20.914 1.00 0.00 C ATOM 603 CG2 VAL A 40 -12.430 -0.165 -21.752 1.00 0.00 C ATOM 0 H VAL A 40 -14.278 -1.117 -24.463 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.675 -2.131 -23.471 1.00 0.00 H new ATOM 0 HB VAL A 40 -14.163 -1.442 -21.848 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -12.781 -2.150 -19.915 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -13.014 -3.492 -21.059 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -11.468 -2.613 -21.023 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -12.662 0.202 -20.752 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -11.350 -0.257 -21.863 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -12.813 0.536 -22.494 1.00 0.00 H new ATOM 613 N CYS A 41 -12.539 -4.427 -23.800 1.00 0.00 N ATOM 614 CA CYS A 41 -13.025 -5.784 -24.010 1.00 0.00 C ATOM 615 C CYS A 41 -12.703 -6.652 -22.801 1.00 0.00 C ATOM 616 O CYS A 41 -11.536 -6.912 -22.506 1.00 0.00 O ATOM 617 CB CYS A 41 -12.376 -6.377 -25.261 1.00 0.00 C ATOM 618 SG CYS A 41 -11.177 -5.199 -25.933 1.00 0.00 S ATOM 0 H CYS A 41 -11.525 -4.324 -23.851 1.00 0.00 H new ATOM 0 HA CYS A 41 -14.106 -5.755 -24.144 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -11.881 -7.317 -25.016 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -13.138 -6.603 -26.007 1.00 0.00 H new ATOM 0 HG CYS A 41 -10.623 -5.703 -26.996 1.00 0.00 H new ATOM 624 N ILE A 42 -13.740 -7.092 -22.100 1.00 0.00 N ATOM 625 CA ILE A 42 -13.547 -7.923 -20.922 1.00 0.00 C ATOM 626 C ILE A 42 -14.373 -9.202 -21.009 1.00 0.00 C ATOM 627 O ILE A 42 -15.562 -9.168 -21.327 1.00 0.00 O ATOM 628 CB ILE A 42 -13.939 -7.133 -19.667 1.00 0.00 C ATOM 629 CG1 ILE A 42 -14.585 -8.071 -18.637 1.00 0.00 C ATOM 630 CG2 ILE A 42 -14.932 -6.035 -20.048 1.00 0.00 C ATOM 631 CD1 ILE A 42 -14.706 -7.357 -17.289 1.00 0.00 C ATOM 0 H ILE A 42 -14.714 -6.889 -22.325 1.00 0.00 H new ATOM 0 HA ILE A 42 -12.495 -8.203 -20.867 1.00 0.00 H new ATOM 0 HB ILE A 42 -13.045 -6.686 -19.232 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -15.570 -8.383 -18.983 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -13.985 -8.974 -18.528 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -15.212 -5.472 -19.157 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -14.471 -5.363 -20.772 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -15.822 -6.486 -20.487 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -15.165 -8.027 -16.562 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -13.715 -7.068 -16.940 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -15.325 -6.467 -17.403 1.00 0.00 H new ATOM 643 N GLU A 43 -13.739 -10.322 -20.686 1.00 0.00 N ATOM 644 CA GLU A 43 -14.426 -11.604 -20.692 1.00 0.00 C ATOM 645 C GLU A 43 -14.571 -12.079 -19.256 1.00 0.00 C ATOM 646 O GLU A 43 -13.578 -12.334 -18.579 1.00 0.00 O ATOM 647 CB GLU A 43 -13.628 -12.629 -21.500 1.00 0.00 C ATOM 648 CG GLU A 43 -14.062 -14.044 -21.109 1.00 0.00 C ATOM 649 CD GLU A 43 -13.591 -15.041 -22.164 1.00 0.00 C ATOM 650 OE1 GLU A 43 -12.434 -14.966 -22.543 1.00 0.00 O ATOM 651 OE2 GLU A 43 -14.393 -15.862 -22.574 1.00 0.00 O ATOM 0 H GLU A 43 -12.756 -10.368 -20.418 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.408 -11.493 -21.152 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.788 -12.471 -22.566 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -12.561 -12.501 -21.316 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -13.645 -14.306 -20.137 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -15.147 -14.088 -21.013 1.00 0.00 H new ATOM 658 N SER A 44 -15.805 -12.178 -18.785 1.00 0.00 N ATOM 659 CA SER A 44 -16.038 -12.601 -17.414 1.00 0.00 C ATOM 660 C SER A 44 -17.049 -13.734 -17.353 1.00 0.00 C ATOM 661 O SER A 44 -17.775 -13.993 -18.311 1.00 0.00 O ATOM 662 CB SER A 44 -16.543 -11.421 -16.586 1.00 0.00 C ATOM 663 OG SER A 44 -17.057 -11.898 -15.350 1.00 0.00 O ATOM 0 H SER A 44 -16.648 -11.975 -19.322 1.00 0.00 H new ATOM 0 HA SER A 44 -15.093 -12.961 -17.006 1.00 0.00 H new ATOM 0 HB2 SER A 44 -15.732 -10.715 -16.407 1.00 0.00 H new ATOM 0 HB3 SER A 44 -17.319 -10.884 -17.132 1.00 0.00 H new ATOM 0 HG SER A 44 -17.380 -11.142 -14.816 1.00 0.00 H new ATOM 669 N GLU A 45 -17.082 -14.403 -16.210 1.00 0.00 N ATOM 670 CA GLU A 45 -17.995 -15.508 -16.005 1.00 0.00 C ATOM 671 C GLU A 45 -19.343 -14.998 -15.505 1.00 0.00 C ATOM 672 O GLU A 45 -20.351 -15.701 -15.578 1.00 0.00 O ATOM 673 CB GLU A 45 -17.390 -16.466 -14.984 1.00 0.00 C ATOM 674 CG GLU A 45 -15.931 -16.757 -15.358 1.00 0.00 C ATOM 675 CD GLU A 45 -15.373 -17.858 -14.463 1.00 0.00 C ATOM 676 OE1 GLU A 45 -16.003 -18.898 -14.374 1.00 0.00 O ATOM 677 OE2 GLU A 45 -14.322 -17.644 -13.880 1.00 0.00 O ATOM 0 H GLU A 45 -16.483 -14.196 -15.410 1.00 0.00 H new ATOM 0 HA GLU A 45 -18.154 -16.027 -16.950 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.441 -16.031 -13.986 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.962 -17.394 -14.957 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.868 -17.060 -16.403 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.332 -15.852 -15.252 1.00 0.00 H new ATOM 684 N HIS A 46 -19.351 -13.767 -14.999 1.00 0.00 N ATOM 685 CA HIS A 46 -20.580 -13.168 -14.492 1.00 0.00 C ATOM 686 C HIS A 46 -21.268 -12.359 -15.587 1.00 0.00 C ATOM 687 O HIS A 46 -22.449 -12.556 -15.871 1.00 0.00 O ATOM 688 CB HIS A 46 -20.265 -12.262 -13.300 1.00 0.00 C ATOM 689 CG HIS A 46 -21.515 -12.043 -12.492 1.00 0.00 C ATOM 690 ND1 HIS A 46 -21.547 -12.221 -11.118 1.00 0.00 N ATOM 691 CD2 HIS A 46 -22.783 -11.662 -12.851 1.00 0.00 C ATOM 692 CE1 HIS A 46 -22.799 -11.951 -10.704 1.00 0.00 C ATOM 693 NE2 HIS A 46 -23.593 -11.605 -11.721 1.00 0.00 N ATOM 0 H HIS A 46 -18.527 -13.170 -14.930 1.00 0.00 H new ATOM 0 HA HIS A 46 -21.250 -13.966 -14.171 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -19.493 -12.716 -12.679 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -19.873 -11.307 -13.649 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -23.104 -11.440 -13.858 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -23.122 -12.007 -9.675 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -24.581 -11.353 -11.678 1.00 0.00 H new ATOM 701 N SER A 47 -20.513 -11.458 -16.202 1.00 0.00 N ATOM 702 CA SER A 47 -21.045 -10.625 -17.275 1.00 0.00 C ATOM 703 C SER A 47 -22.238 -9.802 -16.797 1.00 0.00 C ATOM 704 O SER A 47 -23.281 -10.350 -16.441 1.00 0.00 O ATOM 705 CB SER A 47 -21.471 -11.504 -18.450 1.00 0.00 C ATOM 706 OG SER A 47 -20.314 -11.942 -19.150 1.00 0.00 O ATOM 0 H SER A 47 -19.533 -11.285 -15.978 1.00 0.00 H new ATOM 0 HA SER A 47 -20.259 -9.939 -17.591 1.00 0.00 H new ATOM 0 HB2 SER A 47 -22.040 -12.362 -18.091 1.00 0.00 H new ATOM 0 HB3 SER A 47 -22.126 -10.945 -19.119 1.00 0.00 H new ATOM 0 HG SER A 47 -19.980 -11.216 -19.717 1.00 0.00 H new ATOM 712 N MET A 48 -22.076 -8.482 -16.801 1.00 0.00 N ATOM 713 CA MET A 48 -23.147 -7.585 -16.378 1.00 0.00 C ATOM 714 C MET A 48 -23.111 -7.367 -14.869 1.00 0.00 C ATOM 715 O MET A 48 -24.066 -7.692 -14.163 1.00 0.00 O ATOM 716 CB MET A 48 -24.504 -8.167 -16.779 1.00 0.00 C ATOM 717 CG MET A 48 -25.462 -7.033 -17.148 1.00 0.00 C ATOM 718 SD MET A 48 -25.466 -6.804 -18.943 1.00 0.00 S ATOM 719 CE MET A 48 -26.611 -8.148 -19.342 1.00 0.00 C ATOM 0 H MET A 48 -21.219 -8.012 -17.091 1.00 0.00 H new ATOM 0 HA MET A 48 -23.001 -6.624 -16.871 1.00 0.00 H new ATOM 0 HB2 MET A 48 -24.385 -8.845 -17.624 1.00 0.00 H new ATOM 0 HB3 MET A 48 -24.917 -8.752 -15.957 1.00 0.00 H new ATOM 0 HG2 MET A 48 -26.468 -7.265 -16.798 1.00 0.00 H new ATOM 0 HG3 MET A 48 -25.157 -6.110 -16.654 1.00 0.00 H new ATOM 0 HE1 MET A 48 -26.233 -8.705 -20.199 1.00 0.00 H new ATOM 0 HE2 MET A 48 -26.700 -8.816 -18.486 1.00 0.00 H new ATOM 0 HE3 MET A 48 -27.590 -7.733 -19.582 1.00 0.00 H new ATOM 729 N ASP A 49 -22.009 -6.809 -14.383 1.00 0.00 N ATOM 730 CA ASP A 49 -21.862 -6.544 -12.958 1.00 0.00 C ATOM 731 C ASP A 49 -20.455 -6.044 -12.652 1.00 0.00 C ATOM 732 O ASP A 49 -20.270 -5.116 -11.865 1.00 0.00 O ATOM 733 CB ASP A 49 -22.137 -7.818 -12.154 1.00 0.00 C ATOM 734 CG ASP A 49 -23.109 -7.515 -11.018 1.00 0.00 C ATOM 735 OD1 ASP A 49 -23.162 -6.370 -10.602 1.00 0.00 O ATOM 736 OD2 ASP A 49 -23.786 -8.432 -10.582 1.00 0.00 O ATOM 0 H ASP A 49 -21.208 -6.533 -14.951 1.00 0.00 H new ATOM 0 HA ASP A 49 -22.582 -5.776 -12.675 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -22.553 -8.587 -12.805 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -21.204 -8.213 -11.751 1.00 0.00 H new ATOM 741 N THR A 50 -19.467 -6.670 -13.280 1.00 0.00 N ATOM 742 CA THR A 50 -18.075 -6.290 -13.073 1.00 0.00 C ATOM 743 C THR A 50 -17.729 -5.033 -13.870 1.00 0.00 C ATOM 744 O THR A 50 -16.985 -4.173 -13.401 1.00 0.00 O ATOM 745 CB THR A 50 -17.159 -7.439 -13.505 1.00 0.00 C ATOM 746 OG1 THR A 50 -15.876 -6.923 -13.829 1.00 0.00 O ATOM 747 CG2 THR A 50 -17.753 -8.136 -14.731 1.00 0.00 C ATOM 0 H THR A 50 -19.603 -7.440 -13.935 1.00 0.00 H new ATOM 0 HA THR A 50 -17.929 -6.079 -12.014 1.00 0.00 H new ATOM 0 HB THR A 50 -17.069 -8.157 -12.690 1.00 0.00 H new ATOM 0 HG1 THR A 50 -15.339 -7.624 -14.253 1.00 0.00 H new ATOM 0 HG21 THR A 50 -17.100 -8.953 -15.037 1.00 0.00 H new ATOM 0 HG22 THR A 50 -18.738 -8.532 -14.483 1.00 0.00 H new ATOM 0 HG23 THR A 50 -17.845 -7.420 -15.548 1.00 0.00 H new ATOM 755 N LEU A 51 -18.264 -4.945 -15.083 1.00 0.00 N ATOM 756 CA LEU A 51 -17.999 -3.803 -15.953 1.00 0.00 C ATOM 757 C LEU A 51 -18.563 -2.503 -15.377 1.00 0.00 C ATOM 758 O LEU A 51 -17.875 -1.483 -15.337 1.00 0.00 O ATOM 759 CB LEU A 51 -18.617 -4.056 -17.329 1.00 0.00 C ATOM 760 CG LEU A 51 -18.438 -5.528 -17.708 1.00 0.00 C ATOM 761 CD1 LEU A 51 -19.732 -6.291 -17.426 1.00 0.00 C ATOM 762 CD2 LEU A 51 -18.102 -5.635 -19.199 1.00 0.00 C ATOM 0 H LEU A 51 -18.883 -5.649 -15.486 1.00 0.00 H new ATOM 0 HA LEU A 51 -16.918 -3.692 -16.036 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -19.676 -3.799 -17.316 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -18.143 -3.418 -18.075 1.00 0.00 H new ATOM 0 HG LEU A 51 -17.627 -5.956 -17.119 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -19.603 -7.339 -17.696 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -19.974 -6.217 -16.366 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -20.543 -5.862 -18.014 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -17.974 -6.683 -19.469 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -18.913 -5.205 -19.787 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -17.179 -5.093 -19.404 1.00 0.00 H new ATOM 774 N LEU A 52 -19.822 -2.536 -14.956 1.00 0.00 N ATOM 775 CA LEU A 52 -20.471 -1.344 -14.415 1.00 0.00 C ATOM 776 C LEU A 52 -19.724 -0.794 -13.201 1.00 0.00 C ATOM 777 O LEU A 52 -19.450 0.404 -13.124 1.00 0.00 O ATOM 778 CB LEU A 52 -21.917 -1.661 -14.024 1.00 0.00 C ATOM 779 CG LEU A 52 -22.081 -3.166 -13.814 1.00 0.00 C ATOM 780 CD1 LEU A 52 -23.290 -3.425 -12.913 1.00 0.00 C ATOM 781 CD2 LEU A 52 -22.299 -3.851 -15.166 1.00 0.00 C ATOM 0 H LEU A 52 -20.412 -3.368 -14.978 1.00 0.00 H new ATOM 0 HA LEU A 52 -20.458 -0.583 -15.195 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -22.182 -1.127 -13.112 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -22.597 -1.317 -14.803 1.00 0.00 H new ATOM 0 HG LEU A 52 -21.183 -3.567 -13.344 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -23.408 -4.498 -12.762 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -23.137 -2.938 -11.950 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -24.187 -3.024 -13.384 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -22.416 -4.924 -15.015 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -23.197 -3.451 -15.636 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -21.439 -3.666 -15.810 1.00 0.00 H new ATOM 793 N ALA A 53 -19.412 -1.664 -12.249 1.00 0.00 N ATOM 794 CA ALA A 53 -18.714 -1.239 -11.039 1.00 0.00 C ATOM 795 C ALA A 53 -17.396 -0.543 -11.377 1.00 0.00 C ATOM 796 O ALA A 53 -17.092 0.523 -10.842 1.00 0.00 O ATOM 797 CB ALA A 53 -18.438 -2.452 -10.149 1.00 0.00 C ATOM 0 H ALA A 53 -19.628 -2.660 -12.288 1.00 0.00 H new ATOM 0 HA ALA A 53 -19.351 -0.530 -10.511 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -17.917 -2.131 -9.247 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -19.381 -2.924 -9.874 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -17.819 -3.167 -10.690 1.00 0.00 H new ATOM 803 N THR A 54 -16.616 -1.155 -12.262 1.00 0.00 N ATOM 804 CA THR A 54 -15.331 -0.587 -12.659 1.00 0.00 C ATOM 805 C THR A 54 -15.520 0.687 -13.478 1.00 0.00 C ATOM 806 O THR A 54 -14.897 1.712 -13.204 1.00 0.00 O ATOM 807 CB THR A 54 -14.547 -1.614 -13.481 1.00 0.00 C ATOM 808 OG1 THR A 54 -14.368 -2.791 -12.708 1.00 0.00 O ATOM 809 CG2 THR A 54 -13.180 -1.042 -13.868 1.00 0.00 C ATOM 0 H THR A 54 -16.848 -2.038 -12.716 1.00 0.00 H new ATOM 0 HA THR A 54 -14.776 -0.333 -11.756 1.00 0.00 H new ATOM 0 HB THR A 54 -15.102 -1.850 -14.389 1.00 0.00 H new ATOM 0 HG1 THR A 54 -14.168 -2.546 -11.780 1.00 0.00 H new ATOM 0 HG21 THR A 54 -12.629 -1.779 -14.452 1.00 0.00 H new ATOM 0 HG22 THR A 54 -13.319 -0.138 -14.462 1.00 0.00 H new ATOM 0 HG23 THR A 54 -12.618 -0.801 -12.966 1.00 0.00 H new ATOM 817 N LEU A 55 -16.368 0.612 -14.495 1.00 0.00 N ATOM 818 CA LEU A 55 -16.615 1.763 -15.355 1.00 0.00 C ATOM 819 C LEU A 55 -17.254 2.908 -14.571 1.00 0.00 C ATOM 820 O LEU A 55 -16.850 4.063 -14.705 1.00 0.00 O ATOM 821 CB LEU A 55 -17.526 1.348 -16.514 1.00 0.00 C ATOM 822 CG LEU A 55 -16.684 0.766 -17.656 1.00 0.00 C ATOM 823 CD1 LEU A 55 -15.617 -0.177 -17.090 1.00 0.00 C ATOM 824 CD2 LEU A 55 -17.590 -0.016 -18.612 1.00 0.00 C ATOM 0 H LEU A 55 -16.893 -0.226 -14.744 1.00 0.00 H new ATOM 0 HA LEU A 55 -15.661 2.115 -15.747 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -18.251 0.609 -16.172 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -18.092 2.209 -16.870 1.00 0.00 H new ATOM 0 HG LEU A 55 -16.198 1.582 -18.191 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -15.023 -0.586 -17.907 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -14.968 0.375 -16.410 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -16.100 -0.991 -16.550 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -16.992 -0.430 -19.424 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -18.077 -0.827 -18.070 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -18.347 0.651 -19.023 1.00 0.00 H new ATOM 836 N LYS A 56 -18.254 2.584 -13.756 1.00 0.00 N ATOM 837 CA LYS A 56 -18.942 3.599 -12.959 1.00 0.00 C ATOM 838 C LYS A 56 -18.074 4.085 -11.799 1.00 0.00 C ATOM 839 O LYS A 56 -18.416 5.060 -11.129 1.00 0.00 O ATOM 840 CB LYS A 56 -20.251 3.032 -12.406 1.00 0.00 C ATOM 841 CG LYS A 56 -21.210 2.741 -13.561 1.00 0.00 C ATOM 842 CD LYS A 56 -22.318 1.803 -13.080 1.00 0.00 C ATOM 843 CE LYS A 56 -23.295 2.577 -12.192 1.00 0.00 C ATOM 844 NZ LYS A 56 -24.554 1.794 -12.038 1.00 0.00 N ATOM 0 H LYS A 56 -18.605 1.635 -13.629 1.00 0.00 H new ATOM 0 HA LYS A 56 -19.150 4.446 -13.612 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -20.055 2.119 -11.843 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -20.703 3.742 -11.714 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -21.642 3.670 -13.932 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -20.669 2.287 -14.391 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -22.845 1.378 -13.934 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -21.888 0.970 -12.525 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -22.847 2.762 -11.215 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -23.511 3.550 -12.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -25.218 2.320 -11.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -24.983 1.639 -12.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -24.340 0.876 -11.599 1.00 0.00 H new ATOM 858 N LYS A 57 -16.962 3.400 -11.554 1.00 0.00 N ATOM 859 CA LYS A 57 -16.076 3.778 -10.456 1.00 0.00 C ATOM 860 C LYS A 57 -15.643 5.237 -10.574 1.00 0.00 C ATOM 861 O LYS A 57 -15.775 6.008 -9.622 1.00 0.00 O ATOM 862 CB LYS A 57 -14.842 2.874 -10.440 1.00 0.00 C ATOM 863 CG LYS A 57 -14.536 2.439 -9.006 1.00 0.00 C ATOM 864 CD LYS A 57 -13.965 3.622 -8.222 1.00 0.00 C ATOM 865 CE LYS A 57 -14.602 3.671 -6.833 1.00 0.00 C ATOM 866 NZ LYS A 57 -16.065 3.919 -6.968 1.00 0.00 N ATOM 0 H LYS A 57 -16.654 2.590 -12.092 1.00 0.00 H new ATOM 0 HA LYS A 57 -16.627 3.657 -9.523 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -15.013 1.999 -11.066 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -13.987 3.404 -10.859 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -15.443 2.074 -8.524 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -13.823 1.614 -9.010 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -12.883 3.525 -8.134 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -14.159 4.553 -8.755 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -14.428 2.732 -6.308 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -14.142 4.459 -6.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -16.430 4.332 -6.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -16.234 4.578 -7.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -16.553 3.021 -7.157 1.00 0.00 H new ATOM 880 N THR A 58 -15.119 5.614 -11.738 1.00 0.00 N ATOM 881 CA THR A 58 -14.669 6.988 -11.945 1.00 0.00 C ATOM 882 C THR A 58 -15.834 7.883 -12.361 1.00 0.00 C ATOM 883 O THR A 58 -15.633 9.035 -12.748 1.00 0.00 O ATOM 884 CB THR A 58 -13.580 7.023 -13.022 1.00 0.00 C ATOM 885 OG1 THR A 58 -13.312 5.701 -13.466 1.00 0.00 O ATOM 886 CG2 THR A 58 -12.304 7.636 -12.441 1.00 0.00 C ATOM 0 H THR A 58 -14.997 4.998 -12.541 1.00 0.00 H new ATOM 0 HA THR A 58 -14.263 7.362 -11.005 1.00 0.00 H new ATOM 0 HB THR A 58 -13.920 7.627 -13.863 1.00 0.00 H new ATOM 0 HG1 THR A 58 -13.182 5.702 -14.437 1.00 0.00 H new ATOM 0 HG21 THR A 58 -11.530 7.660 -13.208 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.510 8.651 -12.101 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.962 7.034 -11.599 1.00 0.00 H new ATOM 894 N GLY A 59 -17.049 7.352 -12.273 1.00 0.00 N ATOM 895 CA GLY A 59 -18.235 8.121 -12.636 1.00 0.00 C ATOM 896 C GLY A 59 -18.332 8.296 -14.148 1.00 0.00 C ATOM 897 O GLY A 59 -19.080 9.143 -14.637 1.00 0.00 O ATOM 0 H GLY A 59 -17.238 6.401 -11.957 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -19.127 7.616 -12.267 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -18.200 9.098 -12.155 1.00 0.00 H new ATOM 901 N ALA A 60 -17.572 7.493 -14.883 1.00 0.00 N ATOM 902 CA ALA A 60 -17.581 7.571 -16.340 1.00 0.00 C ATOM 903 C ALA A 60 -18.843 6.925 -16.906 1.00 0.00 C ATOM 904 O ALA A 60 -19.377 5.975 -16.332 1.00 0.00 O ATOM 905 CB ALA A 60 -16.349 6.865 -16.908 1.00 0.00 C ATOM 0 H ALA A 60 -16.946 6.785 -14.499 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.564 8.622 -16.627 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -16.363 6.928 -17.996 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -15.447 7.345 -16.529 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -16.357 5.818 -16.605 1.00 0.00 H new ATOM 911 N THR A 61 -19.313 7.447 -18.035 1.00 0.00 N ATOM 912 CA THR A 61 -20.513 6.912 -18.671 1.00 0.00 C ATOM 913 C THR A 61 -20.278 5.476 -19.129 1.00 0.00 C ATOM 914 O THR A 61 -19.252 5.170 -19.738 1.00 0.00 O ATOM 915 CB THR A 61 -20.901 7.778 -19.873 1.00 0.00 C ATOM 916 OG1 THR A 61 -22.081 7.256 -20.468 1.00 0.00 O ATOM 917 CG2 THR A 61 -19.764 7.773 -20.895 1.00 0.00 C ATOM 0 H THR A 61 -18.886 8.233 -18.525 1.00 0.00 H new ATOM 0 HA THR A 61 -21.324 6.922 -17.943 1.00 0.00 H new ATOM 0 HB THR A 61 -21.083 8.801 -19.543 1.00 0.00 H new ATOM 0 HG1 THR A 61 -22.332 7.810 -21.237 1.00 0.00 H new ATOM 0 HG21 THR A 61 -20.041 8.389 -21.750 1.00 0.00 H new ATOM 0 HG22 THR A 61 -18.860 8.174 -20.436 1.00 0.00 H new ATOM 0 HG23 THR A 61 -19.579 6.752 -21.229 1.00 0.00 H new ATOM 925 N VAL A 62 -21.229 4.598 -18.829 1.00 0.00 N ATOM 926 CA VAL A 62 -21.105 3.196 -19.214 1.00 0.00 C ATOM 927 C VAL A 62 -22.253 2.777 -20.125 1.00 0.00 C ATOM 928 O VAL A 62 -23.414 3.097 -19.867 1.00 0.00 O ATOM 929 CB VAL A 62 -21.103 2.310 -17.968 1.00 0.00 C ATOM 930 CG1 VAL A 62 -22.483 2.357 -17.311 1.00 0.00 C ATOM 931 CG2 VAL A 62 -20.778 0.871 -18.371 1.00 0.00 C ATOM 0 H VAL A 62 -22.086 4.828 -18.326 1.00 0.00 H new ATOM 0 HA VAL A 62 -20.166 3.077 -19.754 1.00 0.00 H new ATOM 0 HB VAL A 62 -20.353 2.669 -17.264 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -22.485 1.726 -16.422 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -22.716 3.383 -17.028 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -23.233 1.995 -18.014 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -20.776 0.237 -17.485 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -21.530 0.511 -19.073 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -19.796 0.838 -18.843 1.00 0.00 H new ATOM 941 N SER A 63 -21.920 2.053 -21.189 1.00 0.00 N ATOM 942 CA SER A 63 -22.929 1.586 -22.131 1.00 0.00 C ATOM 943 C SER A 63 -22.648 0.143 -22.541 1.00 0.00 C ATOM 944 O SER A 63 -21.584 -0.162 -23.078 1.00 0.00 O ATOM 945 CB SER A 63 -22.940 2.477 -23.373 1.00 0.00 C ATOM 946 OG SER A 63 -23.527 1.769 -24.455 1.00 0.00 O ATOM 0 H SER A 63 -20.965 1.779 -21.419 1.00 0.00 H new ATOM 0 HA SER A 63 -23.903 1.633 -21.644 1.00 0.00 H new ATOM 0 HB2 SER A 63 -23.501 3.390 -23.174 1.00 0.00 H new ATOM 0 HB3 SER A 63 -21.924 2.777 -23.628 1.00 0.00 H new ATOM 0 HG SER A 63 -23.537 2.339 -25.252 1.00 0.00 H new ATOM 952 N TYR A 64 -23.608 -0.740 -22.282 1.00 0.00 N ATOM 953 CA TYR A 64 -23.447 -2.148 -22.630 1.00 0.00 C ATOM 954 C TYR A 64 -23.680 -2.360 -24.125 1.00 0.00 C ATOM 955 O TYR A 64 -24.755 -2.060 -24.645 1.00 0.00 O ATOM 956 CB TYR A 64 -24.426 -3.004 -21.813 1.00 0.00 C ATOM 957 CG TYR A 64 -25.645 -3.342 -22.641 1.00 0.00 C ATOM 958 CD1 TYR A 64 -25.650 -4.492 -23.440 1.00 0.00 C ATOM 959 CD2 TYR A 64 -26.768 -2.507 -22.610 1.00 0.00 C ATOM 960 CE1 TYR A 64 -26.779 -4.808 -24.205 1.00 0.00 C ATOM 961 CE2 TYR A 64 -27.897 -2.824 -23.375 1.00 0.00 C ATOM 962 CZ TYR A 64 -27.901 -3.973 -24.174 1.00 0.00 C ATOM 963 OH TYR A 64 -29.014 -4.285 -24.929 1.00 0.00 O ATOM 0 H TYR A 64 -24.496 -0.509 -21.837 1.00 0.00 H new ATOM 0 HA TYR A 64 -22.427 -2.452 -22.394 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -23.934 -3.920 -21.487 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -24.727 -2.466 -20.914 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -24.783 -5.135 -23.466 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -26.764 -1.618 -21.996 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -26.784 -5.696 -24.819 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -28.765 -2.182 -23.348 1.00 0.00 H new ATOM 0 HH TYR A 64 -29.704 -3.603 -24.792 1.00 0.00 H new ATOM 973 N LEU A 65 -22.664 -2.877 -24.809 1.00 0.00 N ATOM 974 CA LEU A 65 -22.767 -3.126 -26.243 1.00 0.00 C ATOM 975 C LEU A 65 -23.555 -4.405 -26.511 1.00 0.00 C ATOM 976 O LEU A 65 -24.337 -4.476 -27.458 1.00 0.00 O ATOM 977 CB LEU A 65 -21.369 -3.248 -26.852 1.00 0.00 C ATOM 978 CG LEU A 65 -20.738 -1.860 -26.968 1.00 0.00 C ATOM 979 CD1 LEU A 65 -19.217 -1.980 -26.868 1.00 0.00 C ATOM 980 CD2 LEU A 65 -21.113 -1.240 -28.316 1.00 0.00 C ATOM 0 H LEU A 65 -21.766 -3.130 -24.397 1.00 0.00 H new ATOM 0 HA LEU A 65 -23.292 -2.288 -26.702 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -20.746 -3.891 -26.231 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -21.429 -3.715 -27.835 1.00 0.00 H new ATOM 0 HG LEU A 65 -21.106 -1.226 -26.161 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -18.768 -0.990 -26.951 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -18.949 -2.421 -25.908 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -18.848 -2.614 -27.674 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -20.663 -0.251 -28.399 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -20.746 -1.874 -29.123 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -22.197 -1.153 -28.387 1.00 0.00 H new ATOM 992 N GLY A 66 -23.340 -5.412 -25.671 1.00 0.00 N ATOM 993 CA GLY A 66 -24.033 -6.686 -25.827 1.00 0.00 C ATOM 994 C GLY A 66 -23.053 -7.849 -25.743 1.00 0.00 C ATOM 995 O GLY A 66 -21.837 -7.651 -25.754 1.00 0.00 O ATOM 0 H GLY A 66 -22.696 -5.372 -24.881 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -24.793 -6.789 -25.053 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -24.550 -6.709 -26.786 1.00 0.00 H new ATOM 999 N LEU A 67 -23.586 -9.064 -25.660 1.00 0.00 N ATOM 1000 CA LEU A 67 -22.744 -10.250 -25.578 1.00 0.00 C ATOM 1001 C LEU A 67 -22.506 -10.833 -26.966 1.00 0.00 C ATOM 1002 O LEU A 67 -23.367 -10.750 -27.842 1.00 0.00 O ATOM 1003 CB LEU A 67 -23.406 -11.302 -24.688 1.00 0.00 C ATOM 1004 CG LEU A 67 -23.567 -10.746 -23.273 1.00 0.00 C ATOM 1005 CD1 LEU A 67 -24.681 -11.503 -22.549 1.00 0.00 C ATOM 1006 CD2 LEU A 67 -22.253 -10.917 -22.507 1.00 0.00 C ATOM 0 H LEU A 67 -24.589 -9.252 -25.648 1.00 0.00 H new ATOM 0 HA LEU A 67 -21.785 -9.962 -25.146 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -24.379 -11.577 -25.095 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -22.801 -12.209 -24.667 1.00 0.00 H new ATOM 0 HG LEU A 67 -23.824 -9.688 -23.326 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -24.795 -11.106 -21.540 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -25.617 -11.382 -23.094 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -24.426 -12.561 -22.495 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -22.366 -10.521 -21.498 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -21.997 -11.975 -22.455 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -21.459 -10.377 -23.022 1.00 0.00 H new ATOM 1018 N GLU A 68 -21.332 -11.424 -27.159 1.00 0.00 N ATOM 1019 CA GLU A 68 -20.989 -12.020 -28.445 1.00 0.00 C ATOM 1020 C GLU A 68 -21.631 -13.395 -28.588 1.00 0.00 C ATOM 1021 O GLU A 68 -22.054 -13.936 -27.579 1.00 0.00 O ATOM 1022 CB GLU A 68 -19.470 -12.149 -28.572 1.00 0.00 C ATOM 1023 CG GLU A 68 -19.097 -12.379 -30.036 1.00 0.00 C ATOM 1024 CD GLU A 68 -17.594 -12.207 -30.223 1.00 0.00 C ATOM 1025 OE1 GLU A 68 -16.892 -12.202 -29.225 1.00 0.00 O ATOM 1026 OE2 GLU A 68 -17.168 -12.083 -31.358 1.00 0.00 O ATOM 1027 OXT GLU A 68 -21.690 -13.887 -29.703 1.00 0.00 O ATOM 0 H GLU A 68 -20.606 -11.503 -26.447 1.00 0.00 H new ATOM 0 HA GLU A 68 -21.367 -11.372 -29.236 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -18.986 -11.246 -28.200 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -19.113 -12.977 -27.960 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -19.398 -13.380 -30.344 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -19.634 -11.675 -30.672 1.00 0.00 H new TER 1034 GLU A 68