USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 776 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 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 65 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 39 SER OG : rot 180:sc= 0.00197 USER MOD Set 2.2: A 41 SER OG : rot -93:sc= 0.832 USER MOD Set 2.3: A 42 GLN : amide:sc= -4.79! C(o=-4!,f=-4.2!) USER MOD Set 3.1: A 18 CYS SG : rot 180:sc= 0 USER MOD Set 3.2: A 28 LYS NZ :NH3+ 159:sc= -0.0772 (180deg=-0.425) USER MOD Set 4.1: A 25 SER OG : rot -12:sc= 0.652 USER MOD Set 4.2: A 84 THR OG1 : rot -47:sc= 0.925 USER MOD Single : A 3 THR OG1 : rot 49:sc= -1.25 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 SER OG : rot 71:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= 1.04 K(o=1,f=-0.029) USER MOD Single : A 33 SER OG : rot -154:sc= 1.64 USER MOD Single : A 35 MET CE :methyl -158:sc= -2.25 (180deg=-4.91!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -119:sc= 0.785 (180deg=-1.35) USER MOD Single : A 38 LYS NZ :NH3+ -133:sc= -1.7 (180deg=-4.16!) USER MOD Single : A 40 SER OG : rot -46:sc= -0.667 USER MOD Single : A 44 LYS NZ :NH3+ -170:sc= 0.162 (180deg=0.132) USER MOD Single : A 52 ASN : amide:sc= -0.201 X(o=-0.2,f=-0.21) USER MOD Single : A 54 GLN : amide:sc= -1.45 K(o=-1.4,f=-3.2!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.85 K(o=-0.85,f=-0.07) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.684 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -102:sc= 1.24 USER MOD Single : A 83 LYS NZ :NH3+ 155:sc= -0.106 (180deg=-0.582) USER MOD Single : A 96 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.197) USER MOD Single : A 103 GLN : amide:sc= -4.2 K(o=-4.2,f=-2) USER MOD Single : A 105 MET CE :methyl 179:sc= -3.18! (180deg=-3.2!) USER MOD Single : A 107 GLN : amide:sc= -3.05 X(o=-3.1,f=-3.4!) USER MOD Single : A 108 SER OG : rot -48:sc= 0.544 USER MOD ----------------------------------------------------------------- ATOM 31 N THR A 3 1.344 -5.430 -1.058 1.00 0.00 N ATOM 32 CA THR A 3 0.143 -6.232 -1.250 1.00 0.00 C ATOM 33 C THR A 3 -1.100 -5.477 -0.793 1.00 0.00 C ATOM 34 O THR A 3 -1.942 -6.023 -0.080 1.00 0.00 O ATOM 35 CB THR A 3 0.230 -7.566 -0.484 1.00 0.00 C ATOM 36 OG1 THR A 3 0.176 -7.325 0.926 1.00 0.00 O ATOM 37 CG2 THR A 3 1.514 -8.304 -0.829 1.00 0.00 C ATOM 0 HA THR A 3 0.068 -6.439 -2.318 1.00 0.00 H new ATOM 0 HB THR A 3 -0.617 -8.186 -0.779 1.00 0.00 H new ATOM 0 HG1 THR A 3 -0.572 -6.724 1.127 1.00 0.00 H new ATOM 0 HG21 THR A 3 1.554 -9.243 -0.277 1.00 0.00 H new ATOM 0 HG22 THR A 3 1.538 -8.511 -1.899 1.00 0.00 H new ATOM 0 HG23 THR A 3 2.372 -7.688 -0.559 1.00 0.00 H new ATOM 45 N ASP A 4 -1.210 -4.220 -1.209 1.00 0.00 N ATOM 46 CA ASP A 4 -2.352 -3.391 -0.843 1.00 0.00 C ATOM 47 C ASP A 4 -3.575 -3.751 -1.681 1.00 0.00 C ATOM 48 O ASP A 4 -4.637 -4.067 -1.144 1.00 0.00 O ATOM 49 CB ASP A 4 -2.013 -1.910 -1.023 1.00 0.00 C ATOM 50 CG ASP A 4 -3.231 -1.017 -0.894 1.00 0.00 C ATOM 51 OD1 ASP A 4 -4.044 -1.253 0.024 1.00 0.00 O ATOM 52 OD2 ASP A 4 -3.372 -0.083 -1.711 1.00 0.00 O ATOM 0 H ASP A 4 -0.522 -3.753 -1.800 1.00 0.00 H new ATOM 0 HA ASP A 4 -2.584 -3.578 0.205 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -1.271 -1.617 -0.280 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -1.559 -1.761 -2.003 1.00 0.00 H new ATOM 57 N ILE A 5 -3.418 -3.699 -3.000 1.00 0.00 N ATOM 58 CA ILE A 5 -4.510 -4.019 -3.911 1.00 0.00 C ATOM 59 C ILE A 5 -4.769 -5.521 -3.952 1.00 0.00 C ATOM 60 O ILE A 5 -5.822 -5.969 -4.409 1.00 0.00 O ATOM 61 CB ILE A 5 -4.216 -3.521 -5.339 1.00 0.00 C ATOM 62 CG1 ILE A 5 -5.522 -3.216 -6.075 1.00 0.00 C ATOM 63 CG2 ILE A 5 -3.399 -4.553 -6.102 1.00 0.00 C ATOM 64 CD1 ILE A 5 -5.767 -1.738 -6.283 1.00 0.00 C ATOM 0 H ILE A 5 -2.546 -3.439 -3.461 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.396 -3.510 -3.533 1.00 0.00 H new ATOM 0 HB ILE A 5 -3.634 -2.601 -5.275 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -5.508 -3.714 -7.045 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.354 -3.638 -5.512 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -3.199 -4.187 -7.109 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -2.455 -4.725 -5.585 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -3.956 -5.488 -6.160 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.710 -1.596 -6.811 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.813 -1.237 -5.316 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -4.954 -1.314 -6.873 1.00 0.00 H new ATOM 76 N LEU A 6 -3.803 -6.296 -3.471 1.00 0.00 N ATOM 77 CA LEU A 6 -3.926 -7.749 -3.450 1.00 0.00 C ATOM 78 C LEU A 6 -3.787 -8.287 -2.030 1.00 0.00 C ATOM 79 O LEU A 6 -3.777 -7.524 -1.064 1.00 0.00 O ATOM 80 CB LEU A 6 -2.867 -8.383 -4.354 1.00 0.00 C ATOM 81 CG LEU A 6 -3.395 -9.219 -5.521 1.00 0.00 C ATOM 82 CD1 LEU A 6 -3.611 -8.348 -6.748 1.00 0.00 C ATOM 83 CD2 LEU A 6 -2.437 -10.359 -5.836 1.00 0.00 C ATOM 0 H LEU A 6 -2.926 -5.942 -3.090 1.00 0.00 H new ATOM 0 HA LEU A 6 -4.917 -8.011 -3.822 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -2.239 -7.588 -4.757 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -2.226 -9.016 -3.740 1.00 0.00 H new ATOM 0 HG LEU A 6 -4.355 -9.646 -5.231 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -3.987 -8.961 -7.568 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -4.336 -7.567 -6.517 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -2.666 -7.891 -7.041 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -2.828 -10.943 -6.669 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -1.462 -9.952 -6.105 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -2.333 -11.000 -4.960 1.00 0.00 H new ATOM 95 N SER A 7 -3.678 -9.607 -1.911 1.00 0.00 N ATOM 96 CA SER A 7 -3.540 -10.248 -0.608 1.00 0.00 C ATOM 97 C SER A 7 -2.175 -10.915 -0.472 1.00 0.00 C ATOM 98 O SER A 7 -1.794 -11.774 -1.268 1.00 0.00 O ATOM 99 CB SER A 7 -4.649 -11.282 -0.406 1.00 0.00 C ATOM 100 OG SER A 7 -5.060 -11.331 0.949 1.00 0.00 O ATOM 0 H SER A 7 -3.683 -10.253 -2.701 1.00 0.00 H new ATOM 0 HA SER A 7 -3.626 -9.479 0.159 1.00 0.00 H new ATOM 0 HB2 SER A 7 -5.501 -11.034 -1.039 1.00 0.00 H new ATOM 0 HB3 SER A 7 -4.295 -12.265 -0.718 1.00 0.00 H new ATOM 0 HG SER A 7 -5.771 -11.998 1.051 1.00 0.00 H new ATOM 106 N PRO A 8 -1.420 -10.511 0.560 1.00 0.00 N ATOM 107 CA PRO A 8 -0.086 -11.057 0.826 1.00 0.00 C ATOM 108 C PRO A 8 -0.136 -12.505 1.302 1.00 0.00 C ATOM 109 O PRO A 8 0.889 -13.185 1.361 1.00 0.00 O ATOM 110 CB PRO A 8 0.454 -10.149 1.934 1.00 0.00 C ATOM 111 CG PRO A 8 -0.760 -9.619 2.615 1.00 0.00 C ATOM 112 CD PRO A 8 -1.811 -9.492 1.548 1.00 0.00 C ATOM 0 HA PRO A 8 0.533 -11.074 -0.071 1.00 0.00 H new ATOM 0 HB2 PRO A 8 1.086 -10.704 2.627 1.00 0.00 H new ATOM 0 HB3 PRO A 8 1.062 -9.342 1.524 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -1.088 -10.292 3.408 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -0.557 -8.654 3.080 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -2.809 -9.678 1.944 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -1.822 -8.493 1.112 1.00 0.00 H new ATOM 120 N SER A 9 -1.334 -12.971 1.641 1.00 0.00 N ATOM 121 CA SER A 9 -1.517 -14.338 2.115 1.00 0.00 C ATOM 122 C SER A 9 -1.800 -15.283 0.951 1.00 0.00 C ATOM 123 O SER A 9 -2.260 -16.408 1.148 1.00 0.00 O ATOM 124 CB SER A 9 -2.662 -14.400 3.127 1.00 0.00 C ATOM 125 OG SER A 9 -2.478 -15.469 4.039 1.00 0.00 O ATOM 0 H SER A 9 -2.192 -12.422 1.596 1.00 0.00 H new ATOM 0 HA SER A 9 -0.594 -14.655 2.601 1.00 0.00 H new ATOM 0 HB2 SER A 9 -2.721 -13.458 3.673 1.00 0.00 H new ATOM 0 HB3 SER A 9 -3.609 -14.524 2.602 1.00 0.00 H new ATOM 0 HG SER A 9 -3.222 -15.487 4.677 1.00 0.00 H new ATOM 131 N ASP A 10 -1.522 -14.817 -0.262 1.00 0.00 N ATOM 132 CA ASP A 10 -1.745 -15.620 -1.459 1.00 0.00 C ATOM 133 C ASP A 10 -0.515 -15.605 -2.361 1.00 0.00 C ATOM 134 O ASP A 10 -0.204 -16.597 -3.020 1.00 0.00 O ATOM 135 CB ASP A 10 -2.963 -15.103 -2.226 1.00 0.00 C ATOM 136 CG ASP A 10 -4.266 -15.400 -1.511 1.00 0.00 C ATOM 137 OD1 ASP A 10 -4.417 -14.969 -0.349 1.00 0.00 O ATOM 138 OD2 ASP A 10 -5.136 -16.061 -2.115 1.00 0.00 O ATOM 0 H ASP A 10 -1.142 -13.888 -0.442 1.00 0.00 H new ATOM 0 HA ASP A 10 -1.931 -16.648 -1.148 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -2.868 -14.027 -2.370 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -2.984 -15.557 -3.217 1.00 0.00 H new ATOM 143 N ILE A 11 0.180 -14.472 -2.386 1.00 0.00 N ATOM 144 CA ILE A 11 1.375 -14.328 -3.207 1.00 0.00 C ATOM 145 C ILE A 11 2.501 -15.222 -2.700 1.00 0.00 C ATOM 146 O ILE A 11 3.361 -15.650 -3.469 1.00 0.00 O ATOM 147 CB ILE A 11 1.866 -12.868 -3.234 1.00 0.00 C ATOM 148 CG1 ILE A 11 0.773 -11.950 -3.785 1.00 0.00 C ATOM 149 CG2 ILE A 11 3.133 -12.752 -4.068 1.00 0.00 C ATOM 150 CD1 ILE A 11 0.693 -10.615 -3.077 1.00 0.00 C ATOM 0 H ILE A 11 -0.064 -13.641 -1.847 1.00 0.00 H new ATOM 0 HA ILE A 11 1.102 -14.630 -4.218 1.00 0.00 H new ATOM 0 HB ILE A 11 2.095 -12.557 -2.215 1.00 0.00 H new ATOM 0 HG12 ILE A 11 0.954 -11.779 -4.846 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -0.190 -12.454 -3.703 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.468 -11.715 -4.078 1.00 0.00 H new ATOM 0 HG22 ILE A 11 3.912 -13.381 -3.636 1.00 0.00 H new ATOM 0 HG23 ILE A 11 2.928 -13.077 -5.088 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -0.103 -10.016 -3.519 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.482 -10.776 -2.020 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.643 -10.090 -3.181 1.00 0.00 H new ATOM 162 N ALA A 12 2.489 -15.502 -1.401 1.00 0.00 N ATOM 163 CA ALA A 12 3.507 -16.349 -0.792 1.00 0.00 C ATOM 164 C ALA A 12 3.337 -17.803 -1.217 1.00 0.00 C ATOM 165 O ALA A 12 4.314 -18.541 -1.341 1.00 0.00 O ATOM 166 CB ALA A 12 3.454 -16.230 0.724 1.00 0.00 C ATOM 0 H ALA A 12 1.785 -15.154 -0.750 1.00 0.00 H new ATOM 0 HA ALA A 12 4.483 -16.009 -1.138 1.00 0.00 H new ATOM 0 HB1 ALA A 12 4.220 -16.868 1.166 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.632 -15.195 1.014 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.472 -16.542 1.079 1.00 0.00 H new ATOM 172 N ALA A 13 2.090 -18.209 -1.437 1.00 0.00 N ATOM 173 CA ALA A 13 1.793 -19.575 -1.849 1.00 0.00 C ATOM 174 C ALA A 13 2.446 -19.899 -3.188 1.00 0.00 C ATOM 175 O ALA A 13 2.727 -21.059 -3.488 1.00 0.00 O ATOM 176 CB ALA A 13 0.289 -19.787 -1.927 1.00 0.00 C ATOM 0 H ALA A 13 1.270 -17.611 -1.337 1.00 0.00 H new ATOM 0 HA ALA A 13 2.206 -20.252 -1.101 1.00 0.00 H new ATOM 0 HB1 ALA A 13 0.082 -20.812 -2.236 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -0.155 -19.606 -0.948 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.139 -19.096 -2.653 1.00 0.00 H new ATOM 182 N ALA A 14 2.683 -18.866 -3.990 1.00 0.00 N ATOM 183 CA ALA A 14 3.304 -19.041 -5.298 1.00 0.00 C ATOM 184 C ALA A 14 4.825 -19.034 -5.189 1.00 0.00 C ATOM 185 O ALA A 14 5.503 -19.882 -5.770 1.00 0.00 O ATOM 186 CB ALA A 14 2.836 -17.954 -6.254 1.00 0.00 C ATOM 0 H ALA A 14 2.455 -17.900 -3.757 1.00 0.00 H new ATOM 0 HA ALA A 14 2.999 -20.011 -5.691 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.307 -18.097 -7.226 1.00 0.00 H new ATOM 0 HB2 ALA A 14 1.753 -18.008 -6.364 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.112 -16.977 -5.857 1.00 0.00 H new ATOM 192 N LEU A 15 5.355 -18.072 -4.442 1.00 0.00 N ATOM 193 CA LEU A 15 6.797 -17.953 -4.257 1.00 0.00 C ATOM 194 C LEU A 15 7.384 -19.250 -3.707 1.00 0.00 C ATOM 195 O LEU A 15 8.565 -19.539 -3.900 1.00 0.00 O ATOM 196 CB LEU A 15 7.117 -16.794 -3.311 1.00 0.00 C ATOM 197 CG LEU A 15 6.873 -15.390 -3.865 1.00 0.00 C ATOM 198 CD1 LEU A 15 7.006 -14.351 -2.762 1.00 0.00 C ATOM 199 CD2 LEU A 15 7.838 -15.089 -5.002 1.00 0.00 C ATOM 0 H LEU A 15 4.808 -17.363 -3.954 1.00 0.00 H new ATOM 0 HA LEU A 15 7.248 -17.755 -5.229 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.521 -16.915 -2.406 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.164 -16.870 -3.016 1.00 0.00 H new ATOM 0 HG LEU A 15 5.857 -15.347 -4.257 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.829 -13.358 -3.175 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.274 -14.555 -1.980 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.010 -14.395 -2.340 1.00 0.00 H new ATOM 0 HD21 LEU A 15 7.649 -14.086 -5.383 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.863 -15.151 -4.636 1.00 0.00 H new ATOM 0 HD23 LEU A 15 7.694 -15.815 -5.803 1.00 0.00 H new ATOM 211 N ARG A 16 6.550 -20.028 -3.025 1.00 0.00 N ATOM 212 CA ARG A 16 6.986 -21.294 -2.448 1.00 0.00 C ATOM 213 C ARG A 16 6.750 -22.444 -3.422 1.00 0.00 C ATOM 214 O ARG A 16 7.677 -23.176 -3.771 1.00 0.00 O ATOM 215 CB ARG A 16 6.247 -21.562 -1.136 1.00 0.00 C ATOM 216 CG ARG A 16 6.984 -22.511 -0.205 1.00 0.00 C ATOM 217 CD ARG A 16 6.683 -23.964 -0.537 1.00 0.00 C ATOM 218 NE ARG A 16 5.290 -24.309 -0.268 1.00 0.00 N ATOM 219 CZ ARG A 16 4.678 -25.362 -0.798 1.00 0.00 C ATOM 220 NH1 ARG A 16 5.333 -26.168 -1.622 1.00 0.00 N ATOM 221 NH2 ARG A 16 3.408 -25.611 -0.505 1.00 0.00 N ATOM 0 H ARG A 16 5.569 -19.804 -2.858 1.00 0.00 H new ATOM 0 HA ARG A 16 8.055 -21.225 -2.247 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.083 -20.615 -0.621 1.00 0.00 H new ATOM 0 HB3 ARG A 16 5.264 -21.977 -1.360 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.057 -22.335 -0.279 1.00 0.00 H new ATOM 0 HG3 ARG A 16 6.698 -22.306 0.827 1.00 0.00 H new ATOM 0 HD2 ARG A 16 6.906 -24.150 -1.588 1.00 0.00 H new ATOM 0 HD3 ARG A 16 7.336 -24.612 0.047 1.00 0.00 H new ATOM 0 HE ARG A 16 4.758 -23.708 0.361 1.00 0.00 H new ATOM 0 HH11 ARG A 16 6.309 -25.980 -1.850 1.00 0.00 H new ATOM 0 HH12 ARG A 16 4.861 -26.976 -2.028 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.900 -24.993 0.128 1.00 0.00 H new ATOM 0 HH22 ARG A 16 2.940 -26.420 -0.913 1.00 0.00 H new ATOM 235 N ASP A 17 5.505 -22.599 -3.857 1.00 0.00 N ATOM 236 CA ASP A 17 5.146 -23.660 -4.791 1.00 0.00 C ATOM 237 C ASP A 17 6.025 -23.606 -6.037 1.00 0.00 C ATOM 238 O ASP A 17 6.466 -24.639 -6.542 1.00 0.00 O ATOM 239 CB ASP A 17 3.673 -23.545 -5.186 1.00 0.00 C ATOM 240 CG ASP A 17 3.073 -24.881 -5.576 1.00 0.00 C ATOM 241 OD1 ASP A 17 3.125 -25.819 -4.751 1.00 0.00 O ATOM 242 OD2 ASP A 17 2.550 -24.990 -6.704 1.00 0.00 O ATOM 0 H ASP A 17 4.726 -22.003 -3.578 1.00 0.00 H new ATOM 0 HA ASP A 17 5.307 -24.617 -4.295 1.00 0.00 H new ATOM 0 HB2 ASP A 17 3.108 -23.125 -4.354 1.00 0.00 H new ATOM 0 HB3 ASP A 17 3.576 -22.849 -6.020 1.00 0.00 H new ATOM 247 N CYS A 18 6.275 -22.397 -6.527 1.00 0.00 N ATOM 248 CA CYS A 18 7.099 -22.209 -7.716 1.00 0.00 C ATOM 249 C CYS A 18 8.524 -21.824 -7.333 1.00 0.00 C ATOM 250 O CYS A 18 9.261 -21.257 -8.139 1.00 0.00 O ATOM 251 CB CYS A 18 6.492 -21.134 -8.618 1.00 0.00 C ATOM 252 SG CYS A 18 4.730 -21.362 -8.955 1.00 0.00 S ATOM 0 H CYS A 18 5.919 -21.532 -6.120 1.00 0.00 H new ATOM 0 HA CYS A 18 7.130 -23.153 -8.260 1.00 0.00 H new ATOM 0 HB2 CYS A 18 6.639 -20.159 -8.153 1.00 0.00 H new ATOM 0 HB3 CYS A 18 7.033 -21.121 -9.564 1.00 0.00 H new ATOM 0 HG CYS A 18 4.308 -20.403 -9.724 1.00 0.00 H new ATOM 258 N GLN A 19 8.904 -22.134 -6.098 1.00 0.00 N ATOM 259 CA GLN A 19 10.241 -21.818 -5.608 1.00 0.00 C ATOM 260 C GLN A 19 11.309 -22.414 -6.518 1.00 0.00 C ATOM 261 O GLN A 19 12.429 -21.909 -6.590 1.00 0.00 O ATOM 262 CB GLN A 19 10.421 -22.339 -4.181 1.00 0.00 C ATOM 263 CG GLN A 19 11.756 -21.964 -3.560 1.00 0.00 C ATOM 264 CD GLN A 19 11.752 -22.085 -2.049 1.00 0.00 C ATOM 265 OE1 GLN A 19 12.376 -22.984 -1.485 1.00 0.00 O ATOM 266 NE2 GLN A 19 11.046 -21.178 -1.384 1.00 0.00 N ATOM 0 H GLN A 19 8.306 -22.603 -5.418 1.00 0.00 H new ATOM 0 HA GLN A 19 10.353 -20.734 -5.608 1.00 0.00 H new ATOM 0 HB2 GLN A 19 9.617 -21.949 -3.557 1.00 0.00 H new ATOM 0 HB3 GLN A 19 10.324 -23.425 -4.185 1.00 0.00 H new ATOM 0 HG2 GLN A 19 12.536 -22.606 -3.970 1.00 0.00 H new ATOM 0 HG3 GLN A 19 12.007 -20.940 -3.838 1.00 0.00 H new ATOM 0 HE21 GLN A 19 10.544 -20.450 -1.892 1.00 0.00 H new ATOM 0 HE22 GLN A 19 11.006 -21.209 -0.365 1.00 0.00 H new ATOM 275 N ALA A 20 10.955 -23.490 -7.212 1.00 0.00 N ATOM 276 CA ALA A 20 11.884 -24.154 -8.119 1.00 0.00 C ATOM 277 C ALA A 20 12.253 -23.246 -9.287 1.00 0.00 C ATOM 278 O ALA A 20 11.564 -22.272 -9.590 1.00 0.00 O ATOM 279 CB ALA A 20 11.283 -25.455 -8.630 1.00 0.00 C ATOM 0 H ALA A 20 10.032 -23.921 -7.164 1.00 0.00 H new ATOM 0 HA ALA A 20 12.795 -24.380 -7.565 1.00 0.00 H new ATOM 0 HB1 ALA A 20 11.987 -25.940 -9.306 1.00 0.00 H new ATOM 0 HB2 ALA A 20 11.075 -26.115 -7.788 1.00 0.00 H new ATOM 0 HB3 ALA A 20 10.356 -25.243 -9.163 1.00 0.00 H new ATOM 285 N PRO A 21 13.368 -23.569 -9.959 1.00 0.00 N ATOM 286 CA PRO A 21 13.855 -22.794 -11.105 1.00 0.00 C ATOM 287 C PRO A 21 12.957 -22.943 -12.328 1.00 0.00 C ATOM 288 O PRO A 21 12.339 -23.987 -12.534 1.00 0.00 O ATOM 289 CB PRO A 21 15.235 -23.396 -11.379 1.00 0.00 C ATOM 290 CG PRO A 21 15.158 -24.783 -10.842 1.00 0.00 C ATOM 291 CD PRO A 21 14.239 -24.716 -9.653 1.00 0.00 C ATOM 0 HA PRO A 21 13.875 -21.725 -10.895 1.00 0.00 H new ATOM 0 HB2 PRO A 21 15.462 -23.397 -12.445 1.00 0.00 H new ATOM 0 HB3 PRO A 21 16.021 -22.824 -10.886 1.00 0.00 H new ATOM 0 HG2 PRO A 21 14.774 -25.472 -11.594 1.00 0.00 H new ATOM 0 HG3 PRO A 21 16.145 -25.145 -10.553 1.00 0.00 H new ATOM 0 HD2 PRO A 21 13.666 -25.636 -9.536 1.00 0.00 H new ATOM 0 HD3 PRO A 21 14.792 -24.565 -8.726 1.00 0.00 H new ATOM 299 N ASP A 22 12.889 -21.891 -13.137 1.00 0.00 N ATOM 300 CA ASP A 22 12.068 -21.905 -14.342 1.00 0.00 C ATOM 301 C ASP A 22 10.701 -22.522 -14.061 1.00 0.00 C ATOM 302 O ASP A 22 10.111 -23.170 -14.926 1.00 0.00 O ATOM 303 CB ASP A 22 12.772 -22.681 -15.456 1.00 0.00 C ATOM 304 CG ASP A 22 12.837 -24.169 -15.174 1.00 0.00 C ATOM 305 OD1 ASP A 22 13.824 -24.612 -14.549 1.00 0.00 O ATOM 306 OD2 ASP A 22 11.900 -24.891 -15.576 1.00 0.00 O ATOM 0 H ASP A 22 13.393 -21.018 -12.980 1.00 0.00 H new ATOM 0 HA ASP A 22 11.922 -20.874 -14.664 1.00 0.00 H new ATOM 0 HB2 ASP A 22 12.248 -22.515 -16.397 1.00 0.00 H new ATOM 0 HB3 ASP A 22 13.783 -22.294 -15.582 1.00 0.00 H new ATOM 311 N SER A 23 10.204 -22.317 -12.845 1.00 0.00 N ATOM 312 CA SER A 23 8.909 -22.857 -12.448 1.00 0.00 C ATOM 313 C SER A 23 7.933 -21.734 -12.108 1.00 0.00 C ATOM 314 O SER A 23 6.717 -21.923 -12.138 1.00 0.00 O ATOM 315 CB SER A 23 9.069 -23.790 -11.246 1.00 0.00 C ATOM 316 OG SER A 23 9.363 -25.112 -11.663 1.00 0.00 O ATOM 0 H SER A 23 10.678 -21.781 -12.118 1.00 0.00 H new ATOM 0 HA SER A 23 8.506 -23.423 -13.288 1.00 0.00 H new ATOM 0 HB2 SER A 23 9.867 -23.423 -10.600 1.00 0.00 H new ATOM 0 HB3 SER A 23 8.153 -23.787 -10.655 1.00 0.00 H new ATOM 0 HG SER A 23 10.275 -25.147 -12.020 1.00 0.00 H new ATOM 322 N PHE A 24 8.476 -20.565 -11.785 1.00 0.00 N ATOM 323 CA PHE A 24 7.655 -19.410 -11.439 1.00 0.00 C ATOM 324 C PHE A 24 7.433 -18.516 -12.654 1.00 0.00 C ATOM 325 O PHE A 24 8.310 -18.381 -13.508 1.00 0.00 O ATOM 326 CB PHE A 24 8.314 -18.608 -10.314 1.00 0.00 C ATOM 327 CG PHE A 24 7.703 -17.251 -10.109 1.00 0.00 C ATOM 328 CD1 PHE A 24 6.368 -17.123 -9.764 1.00 0.00 C ATOM 329 CD2 PHE A 24 8.465 -16.104 -10.261 1.00 0.00 C ATOM 330 CE1 PHE A 24 5.803 -15.876 -9.574 1.00 0.00 C ATOM 331 CE2 PHE A 24 7.907 -14.855 -10.072 1.00 0.00 C ATOM 332 CZ PHE A 24 6.573 -14.740 -9.729 1.00 0.00 C ATOM 0 H PHE A 24 9.481 -20.392 -11.756 1.00 0.00 H new ATOM 0 HA PHE A 24 6.686 -19.774 -11.097 1.00 0.00 H new ATOM 0 HB2 PHE A 24 8.243 -19.174 -9.385 1.00 0.00 H new ATOM 0 HB3 PHE A 24 9.375 -18.491 -10.535 1.00 0.00 H new ATOM 0 HD1 PHE A 24 5.761 -18.008 -9.642 1.00 0.00 H new ATOM 0 HD2 PHE A 24 9.508 -16.188 -10.530 1.00 0.00 H new ATOM 0 HE1 PHE A 24 4.761 -15.790 -9.305 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.512 -13.969 -10.192 1.00 0.00 H new ATOM 0 HZ PHE A 24 6.134 -13.764 -9.583 1.00 0.00 H new ATOM 342 N SER A 25 6.253 -17.907 -12.727 1.00 0.00 N ATOM 343 CA SER A 25 5.913 -17.029 -13.840 1.00 0.00 C ATOM 344 C SER A 25 4.753 -16.109 -13.471 1.00 0.00 C ATOM 345 O SER A 25 3.926 -16.423 -12.615 1.00 0.00 O ATOM 346 CB SER A 25 5.552 -17.854 -15.076 1.00 0.00 C ATOM 347 OG SER A 25 6.646 -18.652 -15.494 1.00 0.00 O ATOM 0 H SER A 25 5.517 -18.006 -12.028 1.00 0.00 H new ATOM 0 HA SER A 25 6.784 -16.414 -14.065 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.696 -18.492 -14.854 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.252 -17.189 -15.886 1.00 0.00 H new ATOM 0 HG SER A 25 7.458 -18.366 -15.025 1.00 0.00 H new ATOM 353 N PRO A 26 4.689 -14.944 -14.133 1.00 0.00 N ATOM 354 CA PRO A 26 3.635 -13.954 -13.894 1.00 0.00 C ATOM 355 C PRO A 26 2.273 -14.426 -14.393 1.00 0.00 C ATOM 356 O PRO A 26 1.233 -13.978 -13.908 1.00 0.00 O ATOM 357 CB PRO A 26 4.104 -12.736 -14.692 1.00 0.00 C ATOM 358 CG PRO A 26 4.972 -13.297 -15.765 1.00 0.00 C ATOM 359 CD PRO A 26 5.641 -14.504 -15.167 1.00 0.00 C ATOM 0 HA PRO A 26 3.495 -13.756 -12.831 1.00 0.00 H new ATOM 0 HB2 PRO A 26 3.260 -12.189 -15.111 1.00 0.00 H new ATOM 0 HB3 PRO A 26 4.655 -12.038 -14.062 1.00 0.00 H new ATOM 0 HG2 PRO A 26 4.383 -13.571 -16.640 1.00 0.00 H new ATOM 0 HG3 PRO A 26 5.709 -12.565 -16.093 1.00 0.00 H new ATOM 0 HD2 PRO A 26 5.811 -15.280 -15.913 1.00 0.00 H new ATOM 0 HD3 PRO A 26 6.612 -14.255 -14.739 1.00 0.00 H new ATOM 367 N LYS A 27 2.285 -15.332 -15.364 1.00 0.00 N ATOM 368 CA LYS A 27 1.051 -15.866 -15.929 1.00 0.00 C ATOM 369 C LYS A 27 0.683 -17.193 -15.274 1.00 0.00 C ATOM 370 O LYS A 27 0.031 -18.039 -15.885 1.00 0.00 O ATOM 371 CB LYS A 27 1.198 -16.054 -17.441 1.00 0.00 C ATOM 372 CG LYS A 27 2.058 -17.246 -17.824 1.00 0.00 C ATOM 373 CD LYS A 27 2.830 -16.986 -19.107 1.00 0.00 C ATOM 374 CE LYS A 27 1.909 -16.967 -20.318 1.00 0.00 C ATOM 375 NZ LYS A 27 1.794 -18.312 -20.947 1.00 0.00 N ATOM 0 H LYS A 27 3.136 -15.713 -15.777 1.00 0.00 H new ATOM 0 HA LYS A 27 0.252 -15.151 -15.734 1.00 0.00 H new ATOM 0 HB2 LYS A 27 0.208 -16.174 -17.882 1.00 0.00 H new ATOM 0 HB3 LYS A 27 1.631 -15.151 -17.871 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.756 -17.467 -17.016 1.00 0.00 H new ATOM 0 HG3 LYS A 27 1.427 -18.126 -17.950 1.00 0.00 H new ATOM 0 HD2 LYS A 27 3.353 -16.033 -19.031 1.00 0.00 H new ATOM 0 HD3 LYS A 27 3.590 -17.757 -19.238 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.920 -16.621 -20.017 1.00 0.00 H new ATOM 0 HE3 LYS A 27 2.287 -16.254 -21.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 1.158 -18.258 -21.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.734 -18.632 -21.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.409 -18.987 -20.255 1.00 0.00 H new ATOM 389 N LYS A 28 1.104 -17.368 -14.026 1.00 0.00 N ATOM 390 CA LYS A 28 0.816 -18.591 -13.285 1.00 0.00 C ATOM 391 C LYS A 28 0.346 -18.272 -11.870 1.00 0.00 C ATOM 392 O LYS A 28 -0.573 -18.908 -11.352 1.00 0.00 O ATOM 393 CB LYS A 28 2.058 -19.483 -13.232 1.00 0.00 C ATOM 394 CG LYS A 28 1.741 -20.956 -13.034 1.00 0.00 C ATOM 395 CD LYS A 28 1.601 -21.302 -11.561 1.00 0.00 C ATOM 396 CE LYS A 28 1.695 -22.802 -11.330 1.00 0.00 C ATOM 397 NZ LYS A 28 3.054 -23.327 -11.637 1.00 0.00 N ATOM 0 H LYS A 28 1.646 -16.678 -13.506 1.00 0.00 H new ATOM 0 HA LYS A 28 0.017 -19.121 -13.803 1.00 0.00 H new ATOM 0 HB2 LYS A 28 2.621 -19.362 -14.157 1.00 0.00 H new ATOM 0 HB3 LYS A 28 2.703 -19.146 -12.420 1.00 0.00 H new ATOM 0 HG2 LYS A 28 0.817 -21.204 -13.557 1.00 0.00 H new ATOM 0 HG3 LYS A 28 2.531 -21.562 -13.478 1.00 0.00 H new ATOM 0 HD2 LYS A 28 2.380 -20.795 -10.991 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.645 -20.935 -11.189 1.00 0.00 H new ATOM 0 HE2 LYS A 28 1.445 -23.026 -10.293 1.00 0.00 H new ATOM 0 HE3 LYS A 28 0.960 -23.312 -11.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 3.193 -24.235 -11.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 3.149 -23.466 -12.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 3.770 -22.647 -11.312 1.00 0.00 H new ATOM 411 N PHE A 29 0.980 -17.283 -11.249 1.00 0.00 N ATOM 412 CA PHE A 29 0.625 -16.879 -9.893 1.00 0.00 C ATOM 413 C PHE A 29 -0.520 -15.871 -9.908 1.00 0.00 C ATOM 414 O PHE A 29 -1.091 -15.548 -8.866 1.00 0.00 O ATOM 415 CB PHE A 29 1.840 -16.278 -9.183 1.00 0.00 C ATOM 416 CG PHE A 29 1.948 -14.788 -9.338 1.00 0.00 C ATOM 417 CD1 PHE A 29 2.242 -14.226 -10.569 1.00 0.00 C ATOM 418 CD2 PHE A 29 1.755 -13.950 -8.251 1.00 0.00 C ATOM 419 CE1 PHE A 29 2.343 -12.855 -10.714 1.00 0.00 C ATOM 420 CE2 PHE A 29 1.854 -12.578 -8.390 1.00 0.00 C ATOM 421 CZ PHE A 29 2.147 -12.030 -9.623 1.00 0.00 C ATOM 0 H PHE A 29 1.742 -16.746 -11.663 1.00 0.00 H new ATOM 0 HA PHE A 29 0.298 -17.766 -9.350 1.00 0.00 H new ATOM 0 HB2 PHE A 29 1.788 -16.522 -8.122 1.00 0.00 H new ATOM 0 HB3 PHE A 29 2.746 -16.743 -9.573 1.00 0.00 H new ATOM 0 HD1 PHE A 29 2.394 -14.866 -11.425 1.00 0.00 H new ATOM 0 HD2 PHE A 29 1.525 -14.374 -7.285 1.00 0.00 H new ATOM 0 HE1 PHE A 29 2.575 -12.429 -11.679 1.00 0.00 H new ATOM 0 HE2 PHE A 29 1.702 -11.936 -7.535 1.00 0.00 H new ATOM 0 HZ PHE A 29 2.223 -10.958 -9.735 1.00 0.00 H new ATOM 431 N PHE A 30 -0.850 -15.376 -11.096 1.00 0.00 N ATOM 432 CA PHE A 30 -1.925 -14.403 -11.248 1.00 0.00 C ATOM 433 C PHE A 30 -3.227 -14.935 -10.657 1.00 0.00 C ATOM 434 O PHE A 30 -4.044 -14.172 -10.142 1.00 0.00 O ATOM 435 CB PHE A 30 -2.126 -14.059 -12.725 1.00 0.00 C ATOM 436 CG PHE A 30 -2.804 -15.146 -13.508 1.00 0.00 C ATOM 437 CD1 PHE A 30 -2.125 -16.309 -13.835 1.00 0.00 C ATOM 438 CD2 PHE A 30 -4.120 -15.006 -13.916 1.00 0.00 C ATOM 439 CE1 PHE A 30 -2.746 -17.312 -14.555 1.00 0.00 C ATOM 440 CE2 PHE A 30 -4.747 -16.006 -14.635 1.00 0.00 C ATOM 441 CZ PHE A 30 -4.059 -17.160 -14.956 1.00 0.00 C ATOM 0 H PHE A 30 -0.388 -15.633 -11.968 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.643 -13.500 -10.707 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -2.717 -13.146 -12.800 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -1.156 -13.849 -13.176 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -1.098 -16.433 -13.523 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -4.662 -14.105 -13.670 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -2.205 -18.213 -14.804 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -5.774 -15.885 -14.946 1.00 0.00 H new ATOM 0 HZ PHE A 30 -4.547 -17.942 -15.519 1.00 0.00 H new ATOM 451 N GLN A 31 -3.413 -16.249 -10.736 1.00 0.00 N ATOM 452 CA GLN A 31 -4.616 -16.883 -10.210 1.00 0.00 C ATOM 453 C GLN A 31 -4.435 -17.262 -8.744 1.00 0.00 C ATOM 454 O GLN A 31 -5.408 -17.372 -7.997 1.00 0.00 O ATOM 455 CB GLN A 31 -4.963 -18.126 -11.032 1.00 0.00 C ATOM 456 CG GLN A 31 -4.091 -19.330 -10.712 1.00 0.00 C ATOM 457 CD GLN A 31 -3.865 -20.224 -11.915 1.00 0.00 C ATOM 458 OE1 GLN A 31 -4.812 -20.613 -12.600 1.00 0.00 O ATOM 459 NE2 GLN A 31 -2.607 -20.553 -12.180 1.00 0.00 N ATOM 0 H GLN A 31 -2.746 -16.895 -11.159 1.00 0.00 H new ATOM 0 HA GLN A 31 -5.435 -16.168 -10.282 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -6.007 -18.387 -10.857 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -4.867 -17.889 -12.092 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -3.128 -18.986 -10.334 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -4.557 -19.910 -9.916 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -1.854 -20.208 -11.585 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -2.394 -21.151 -12.978 1.00 0.00 H new ATOM 468 N ILE A 32 -3.185 -17.461 -8.339 1.00 0.00 N ATOM 469 CA ILE A 32 -2.878 -17.827 -6.962 1.00 0.00 C ATOM 470 C ILE A 32 -2.920 -16.608 -6.047 1.00 0.00 C ATOM 471 O ILE A 32 -3.749 -16.527 -5.141 1.00 0.00 O ATOM 472 CB ILE A 32 -1.493 -18.491 -6.852 1.00 0.00 C ATOM 473 CG1 ILE A 32 -1.449 -19.773 -7.686 1.00 0.00 C ATOM 474 CG2 ILE A 32 -1.162 -18.787 -5.397 1.00 0.00 C ATOM 475 CD1 ILE A 32 -0.082 -20.075 -8.259 1.00 0.00 C ATOM 0 H ILE A 32 -2.369 -17.375 -8.945 1.00 0.00 H new ATOM 0 HA ILE A 32 -3.640 -18.540 -6.647 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.744 -17.802 -7.242 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.767 -20.611 -7.066 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -2.166 -19.690 -8.503 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -0.180 -19.256 -5.335 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -1.156 -17.857 -4.829 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.912 -19.460 -4.983 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.126 -20.997 -8.838 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.231 -19.255 -8.906 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.636 -20.190 -7.447 1.00 0.00 H new ATOM 487 N SER A 33 -2.020 -15.661 -6.291 1.00 0.00 N ATOM 488 CA SER A 33 -1.953 -14.445 -5.488 1.00 0.00 C ATOM 489 C SER A 33 -3.299 -13.727 -5.475 1.00 0.00 C ATOM 490 O SER A 33 -3.890 -13.511 -4.418 1.00 0.00 O ATOM 491 CB SER A 33 -0.869 -13.511 -6.028 1.00 0.00 C ATOM 492 OG SER A 33 -0.960 -13.384 -7.437 1.00 0.00 O ATOM 0 H SER A 33 -1.327 -15.712 -7.038 1.00 0.00 H new ATOM 0 HA SER A 33 -1.702 -14.728 -4.466 1.00 0.00 H new ATOM 0 HB2 SER A 33 -0.966 -12.529 -5.564 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.114 -13.895 -5.757 1.00 0.00 H new ATOM 0 HG SER A 33 -0.079 -13.157 -7.803 1.00 0.00 H new ATOM 498 N GLY A 34 -3.778 -13.360 -6.660 1.00 0.00 N ATOM 499 CA GLY A 34 -5.051 -12.670 -6.764 1.00 0.00 C ATOM 500 C GLY A 34 -5.009 -11.523 -7.754 1.00 0.00 C ATOM 501 O GLY A 34 -5.565 -10.455 -7.501 1.00 0.00 O ATOM 0 H GLY A 34 -3.308 -13.528 -7.549 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -5.822 -13.379 -7.067 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.336 -12.289 -5.783 1.00 0.00 H new ATOM 505 N MET A 35 -4.346 -11.744 -8.885 1.00 0.00 N ATOM 506 CA MET A 35 -4.234 -10.719 -9.917 1.00 0.00 C ATOM 507 C MET A 35 -5.323 -10.888 -10.971 1.00 0.00 C ATOM 508 O MET A 35 -5.712 -9.927 -11.635 1.00 0.00 O ATOM 509 CB MET A 35 -2.855 -10.779 -10.577 1.00 0.00 C ATOM 510 CG MET A 35 -1.720 -10.378 -9.649 1.00 0.00 C ATOM 511 SD MET A 35 -0.339 -9.621 -10.527 1.00 0.00 S ATOM 512 CE MET A 35 0.040 -10.897 -11.726 1.00 0.00 C ATOM 0 H MET A 35 -3.879 -12.622 -9.110 1.00 0.00 H new ATOM 0 HA MET A 35 -4.360 -9.746 -9.443 1.00 0.00 H new ATOM 0 HB2 MET A 35 -2.678 -11.792 -10.938 1.00 0.00 H new ATOM 0 HB3 MET A 35 -2.849 -10.124 -11.449 1.00 0.00 H new ATOM 0 HG2 MET A 35 -2.097 -9.680 -8.901 1.00 0.00 H new ATOM 0 HG3 MET A 35 -1.366 -11.259 -9.113 1.00 0.00 H new ATOM 0 HE1 MET A 35 1.067 -10.779 -12.071 1.00 0.00 H new ATOM 0 HE2 MET A 35 -0.077 -11.877 -11.264 1.00 0.00 H new ATOM 0 HE3 MET A 35 -0.639 -10.812 -12.574 1.00 0.00 H new ATOM 522 N SER A 36 -5.811 -12.115 -11.120 1.00 0.00 N ATOM 523 CA SER A 36 -6.853 -12.410 -12.097 1.00 0.00 C ATOM 524 C SER A 36 -8.057 -11.494 -11.901 1.00 0.00 C ATOM 525 O SER A 36 -8.736 -11.127 -12.860 1.00 0.00 O ATOM 526 CB SER A 36 -7.287 -13.873 -11.986 1.00 0.00 C ATOM 527 OG SER A 36 -8.141 -14.068 -10.872 1.00 0.00 O ATOM 0 H SER A 36 -5.502 -12.921 -10.577 1.00 0.00 H new ATOM 0 HA SER A 36 -6.443 -12.235 -13.092 1.00 0.00 H new ATOM 0 HB2 SER A 36 -7.801 -14.174 -12.899 1.00 0.00 H new ATOM 0 HB3 SER A 36 -6.408 -14.510 -11.890 1.00 0.00 H new ATOM 0 HG SER A 36 -8.406 -15.010 -10.824 1.00 0.00 H new ATOM 533 N LYS A 37 -8.316 -11.129 -10.650 1.00 0.00 N ATOM 534 CA LYS A 37 -9.437 -10.255 -10.325 1.00 0.00 C ATOM 535 C LYS A 37 -9.219 -8.856 -10.893 1.00 0.00 C ATOM 536 O LYS A 37 -10.175 -8.135 -11.179 1.00 0.00 O ATOM 537 CB LYS A 37 -9.626 -10.177 -8.808 1.00 0.00 C ATOM 538 CG LYS A 37 -8.342 -9.896 -8.048 1.00 0.00 C ATOM 539 CD LYS A 37 -8.608 -9.119 -6.770 1.00 0.00 C ATOM 540 CE LYS A 37 -8.639 -10.037 -5.557 1.00 0.00 C ATOM 541 NZ LYS A 37 -7.340 -10.738 -5.360 1.00 0.00 N ATOM 0 H LYS A 37 -7.765 -11.425 -9.844 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.336 -10.675 -10.776 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.351 -9.396 -8.581 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.049 -11.117 -8.454 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -7.848 -10.837 -7.806 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -7.659 -9.331 -8.683 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -7.835 -8.362 -6.635 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -9.559 -8.593 -6.854 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -8.876 -9.455 -4.667 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -9.434 -10.773 -5.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -7.486 -11.766 -5.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -6.668 -10.436 -6.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -6.957 -10.503 -4.422 1.00 0.00 H new ATOM 555 N LYS A 38 -7.956 -8.478 -11.054 1.00 0.00 N ATOM 556 CA LYS A 38 -7.612 -7.167 -11.591 1.00 0.00 C ATOM 557 C LYS A 38 -8.367 -6.894 -12.887 1.00 0.00 C ATOM 558 O LYS A 38 -9.024 -7.781 -13.433 1.00 0.00 O ATOM 559 CB LYS A 38 -6.104 -7.074 -11.838 1.00 0.00 C ATOM 560 CG LYS A 38 -5.272 -7.206 -10.574 1.00 0.00 C ATOM 561 CD LYS A 38 -5.747 -6.253 -9.491 1.00 0.00 C ATOM 562 CE LYS A 38 -6.590 -6.970 -8.448 1.00 0.00 C ATOM 563 NZ LYS A 38 -6.485 -6.325 -7.110 1.00 0.00 N ATOM 0 H LYS A 38 -7.153 -9.061 -10.820 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.902 -6.415 -10.857 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.810 -7.855 -12.540 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.880 -6.119 -12.312 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -5.326 -8.231 -10.207 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -4.226 -7.005 -10.804 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.886 -5.790 -9.009 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.330 -5.450 -9.942 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -7.632 -6.978 -8.767 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.271 -8.010 -8.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -6.322 -7.053 -6.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.692 -5.653 -7.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -7.368 -5.818 -6.899 1.00 0.00 H new ATOM 577 N SER A 39 -8.268 -5.662 -13.377 1.00 0.00 N ATOM 578 CA SER A 39 -8.945 -5.272 -14.608 1.00 0.00 C ATOM 579 C SER A 39 -8.146 -4.207 -15.353 1.00 0.00 C ATOM 580 O SER A 39 -8.715 -3.323 -15.993 1.00 0.00 O ATOM 581 CB SER A 39 -10.349 -4.750 -14.300 1.00 0.00 C ATOM 582 OG SER A 39 -10.355 -3.970 -13.117 1.00 0.00 O ATOM 0 H SER A 39 -7.725 -4.917 -12.940 1.00 0.00 H new ATOM 0 HA SER A 39 -9.025 -6.153 -15.244 1.00 0.00 H new ATOM 0 HB2 SER A 39 -10.709 -4.151 -15.136 1.00 0.00 H new ATOM 0 HB3 SER A 39 -11.036 -5.589 -14.190 1.00 0.00 H new ATOM 0 HG SER A 39 -11.264 -3.647 -12.943 1.00 0.00 H new ATOM 588 N SER A 40 -6.823 -4.299 -15.264 1.00 0.00 N ATOM 589 CA SER A 40 -5.944 -3.342 -15.926 1.00 0.00 C ATOM 590 C SER A 40 -6.102 -1.950 -15.321 1.00 0.00 C ATOM 591 O SER A 40 -5.629 -0.961 -15.879 1.00 0.00 O ATOM 592 CB SER A 40 -6.243 -3.295 -17.426 1.00 0.00 C ATOM 593 OG SER A 40 -5.203 -2.642 -18.133 1.00 0.00 O ATOM 0 H SER A 40 -6.336 -5.026 -14.740 1.00 0.00 H new ATOM 0 HA SER A 40 -4.915 -3.669 -15.778 1.00 0.00 H new ATOM 0 HB2 SER A 40 -6.366 -4.309 -17.807 1.00 0.00 H new ATOM 0 HB3 SER A 40 -7.185 -2.774 -17.596 1.00 0.00 H new ATOM 0 HG SER A 40 -4.955 -1.819 -17.663 1.00 0.00 H new ATOM 599 N SER A 41 -6.772 -1.883 -14.174 1.00 0.00 N ATOM 600 CA SER A 41 -6.997 -0.614 -13.494 1.00 0.00 C ATOM 601 C SER A 41 -6.203 -0.547 -12.192 1.00 0.00 C ATOM 602 O SER A 41 -6.100 0.510 -11.570 1.00 0.00 O ATOM 603 CB SER A 41 -8.487 -0.422 -13.206 1.00 0.00 C ATOM 604 OG SER A 41 -8.687 0.480 -12.132 1.00 0.00 O ATOM 0 H SER A 41 -7.168 -2.693 -13.697 1.00 0.00 H new ATOM 0 HA SER A 41 -6.655 0.187 -14.150 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.988 -0.046 -14.098 1.00 0.00 H new ATOM 0 HB3 SER A 41 -8.941 -1.384 -12.967 1.00 0.00 H new ATOM 0 HG SER A 41 -8.762 -0.021 -11.293 1.00 0.00 H new ATOM 610 N GLN A 42 -5.644 -1.683 -11.788 1.00 0.00 N ATOM 611 CA GLN A 42 -4.860 -1.754 -10.561 1.00 0.00 C ATOM 612 C GLN A 42 -3.415 -2.138 -10.860 1.00 0.00 C ATOM 613 O GLN A 42 -2.502 -1.792 -10.109 1.00 0.00 O ATOM 614 CB GLN A 42 -5.479 -2.765 -9.594 1.00 0.00 C ATOM 615 CG GLN A 42 -6.905 -2.425 -9.189 1.00 0.00 C ATOM 616 CD GLN A 42 -7.871 -2.476 -10.356 1.00 0.00 C ATOM 617 OE1 GLN A 42 -8.806 -1.679 -10.437 1.00 0.00 O ATOM 618 NE2 GLN A 42 -7.649 -3.414 -11.268 1.00 0.00 N ATOM 0 H GLN A 42 -5.719 -2.566 -12.292 1.00 0.00 H new ATOM 0 HA GLN A 42 -4.866 -0.767 -10.098 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -5.467 -3.752 -10.056 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -4.860 -2.825 -8.699 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -7.235 -3.121 -8.418 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -6.926 -1.428 -8.748 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -6.862 -4.054 -11.161 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -8.266 -3.495 -12.076 1.00 0.00 H new ATOM 627 N LEU A 43 -3.214 -2.855 -11.960 1.00 0.00 N ATOM 628 CA LEU A 43 -1.878 -3.286 -12.358 1.00 0.00 C ATOM 629 C LEU A 43 -0.898 -2.118 -12.333 1.00 0.00 C ATOM 630 O LEU A 43 0.250 -2.265 -11.914 1.00 0.00 O ATOM 631 CB LEU A 43 -1.917 -3.904 -13.757 1.00 0.00 C ATOM 632 CG LEU A 43 -3.038 -4.910 -14.016 1.00 0.00 C ATOM 633 CD1 LEU A 43 -2.747 -5.725 -15.267 1.00 0.00 C ATOM 634 CD2 LEU A 43 -3.222 -5.824 -12.813 1.00 0.00 C ATOM 0 H LEU A 43 -3.958 -3.150 -12.592 1.00 0.00 H new ATOM 0 HA LEU A 43 -1.537 -4.036 -11.644 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.004 -3.098 -14.486 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.963 -4.398 -13.941 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.965 -4.359 -14.175 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.556 -6.436 -15.435 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -2.666 -5.058 -16.125 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.810 -6.266 -15.139 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.024 -6.534 -13.015 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.296 -6.367 -12.624 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.478 -5.227 -11.938 1.00 0.00 H new ATOM 646 N LYS A 44 -1.360 -0.955 -12.782 1.00 0.00 N ATOM 647 CA LYS A 44 -0.526 0.241 -12.808 1.00 0.00 C ATOM 648 C LYS A 44 -0.723 1.069 -11.542 1.00 0.00 C ATOM 649 O LYS A 44 0.050 1.985 -11.263 1.00 0.00 O ATOM 650 CB LYS A 44 -0.852 1.088 -14.040 1.00 0.00 C ATOM 651 CG LYS A 44 -2.001 2.058 -13.825 1.00 0.00 C ATOM 652 CD LYS A 44 -3.310 1.326 -13.585 1.00 0.00 C ATOM 653 CE LYS A 44 -4.502 2.149 -14.049 1.00 0.00 C ATOM 654 NZ LYS A 44 -4.682 2.081 -15.526 1.00 0.00 N ATOM 0 H LYS A 44 -2.308 -0.816 -13.133 1.00 0.00 H new ATOM 0 HA LYS A 44 0.516 -0.074 -12.857 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.036 1.649 -14.330 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.097 0.426 -14.871 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -1.781 2.701 -12.973 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.100 2.706 -14.696 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.297 0.373 -14.113 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -3.413 1.101 -12.523 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -5.405 1.790 -13.556 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -4.366 3.187 -13.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -5.391 2.782 -15.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -3.777 2.285 -15.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -5.004 1.129 -15.793 1.00 0.00 H new ATOM 668 N GLU A 45 -1.761 0.739 -10.780 1.00 0.00 N ATOM 669 CA GLU A 45 -2.058 1.453 -9.544 1.00 0.00 C ATOM 670 C GLU A 45 -0.868 1.406 -8.589 1.00 0.00 C ATOM 671 O GLU A 45 -0.483 2.422 -8.010 1.00 0.00 O ATOM 672 CB GLU A 45 -3.293 0.855 -8.867 1.00 0.00 C ATOM 673 CG GLU A 45 -3.657 1.533 -7.557 1.00 0.00 C ATOM 674 CD GLU A 45 -3.652 3.045 -7.661 1.00 0.00 C ATOM 675 OE1 GLU A 45 -4.252 3.577 -8.619 1.00 0.00 O ATOM 676 OE2 GLU A 45 -3.048 3.698 -6.785 1.00 0.00 O ATOM 0 H GLU A 45 -2.410 -0.018 -10.997 1.00 0.00 H new ATOM 0 HA GLU A 45 -2.259 2.494 -9.796 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -4.140 0.924 -9.550 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.118 -0.205 -8.682 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -4.645 1.198 -7.241 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -2.953 1.224 -6.784 1.00 0.00 H new ATOM 683 N ILE A 46 -0.292 0.219 -8.431 1.00 0.00 N ATOM 684 CA ILE A 46 0.854 0.039 -7.548 1.00 0.00 C ATOM 685 C ILE A 46 2.161 0.340 -8.274 1.00 0.00 C ATOM 686 O ILE A 46 3.167 0.677 -7.649 1.00 0.00 O ATOM 687 CB ILE A 46 0.911 -1.393 -6.985 1.00 0.00 C ATOM 688 CG1 ILE A 46 -0.503 -1.948 -6.798 1.00 0.00 C ATOM 689 CG2 ILE A 46 1.672 -1.415 -5.668 1.00 0.00 C ATOM 690 CD1 ILE A 46 -0.959 -2.835 -7.936 1.00 0.00 C ATOM 0 H ILE A 46 -0.600 -0.632 -8.902 1.00 0.00 H new ATOM 0 HA ILE A 46 0.730 0.741 -6.723 1.00 0.00 H new ATOM 0 HB ILE A 46 1.439 -2.026 -7.698 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -0.542 -2.515 -5.868 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.200 -1.117 -6.694 1.00 0.00 H new ATOM 0 HG21 ILE A 46 1.703 -2.434 -5.283 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.689 -1.056 -5.829 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.170 -0.770 -4.947 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.969 -3.193 -7.736 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.953 -2.266 -8.866 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -0.284 -3.686 -8.027 1.00 0.00 H new ATOM 702 N PHE A 47 2.138 0.220 -9.597 1.00 0.00 N ATOM 703 CA PHE A 47 3.320 0.480 -10.409 1.00 0.00 C ATOM 704 C PHE A 47 4.583 -0.001 -9.701 1.00 0.00 C ATOM 705 O PHE A 47 5.586 0.711 -9.644 1.00 0.00 O ATOM 706 CB PHE A 47 3.434 1.974 -10.719 1.00 0.00 C ATOM 707 CG PHE A 47 3.331 2.848 -9.502 1.00 0.00 C ATOM 708 CD1 PHE A 47 2.096 3.278 -9.043 1.00 0.00 C ATOM 709 CD2 PHE A 47 4.469 3.240 -8.816 1.00 0.00 C ATOM 710 CE1 PHE A 47 1.998 4.082 -7.923 1.00 0.00 C ATOM 711 CE2 PHE A 47 4.377 4.044 -7.695 1.00 0.00 C ATOM 712 CZ PHE A 47 3.140 4.466 -7.249 1.00 0.00 C ATOM 0 H PHE A 47 1.313 -0.056 -10.130 1.00 0.00 H new ATOM 0 HA PHE A 47 3.216 -0.071 -11.344 1.00 0.00 H new ATOM 0 HB2 PHE A 47 4.387 2.163 -11.213 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.650 2.252 -11.423 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.199 2.981 -9.567 1.00 0.00 H new ATOM 0 HD2 PHE A 47 5.439 2.914 -9.161 1.00 0.00 H new ATOM 0 HE1 PHE A 47 1.029 4.409 -7.576 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.272 4.342 -7.169 1.00 0.00 H new ATOM 0 HZ PHE A 47 3.066 5.095 -6.374 1.00 0.00 H new ATOM 722 N ARG A 48 4.526 -1.215 -9.161 1.00 0.00 N ATOM 723 CA ARG A 48 5.664 -1.791 -8.455 1.00 0.00 C ATOM 724 C ARG A 48 5.712 -3.304 -8.646 1.00 0.00 C ATOM 725 O ARG A 48 6.478 -4.000 -7.977 1.00 0.00 O ATOM 726 CB ARG A 48 5.588 -1.457 -6.964 1.00 0.00 C ATOM 727 CG ARG A 48 4.750 -2.438 -6.161 1.00 0.00 C ATOM 728 CD ARG A 48 4.692 -2.051 -4.692 1.00 0.00 C ATOM 729 NE ARG A 48 4.588 -0.605 -4.511 1.00 0.00 N ATOM 730 CZ ARG A 48 4.942 0.023 -3.396 1.00 0.00 C ATOM 731 NH1 ARG A 48 5.421 -0.663 -2.368 1.00 0.00 N ATOM 732 NH2 ARG A 48 4.817 1.341 -3.307 1.00 0.00 N ATOM 0 H ARG A 48 3.704 -1.818 -9.199 1.00 0.00 H new ATOM 0 HA ARG A 48 6.575 -1.360 -8.871 1.00 0.00 H new ATOM 0 HB2 ARG A 48 6.598 -1.434 -6.554 1.00 0.00 H new ATOM 0 HB3 ARG A 48 5.173 -0.456 -6.845 1.00 0.00 H new ATOM 0 HG2 ARG A 48 3.740 -2.474 -6.569 1.00 0.00 H new ATOM 0 HG3 ARG A 48 5.169 -3.440 -6.258 1.00 0.00 H new ATOM 0 HD2 ARG A 48 3.837 -2.538 -4.222 1.00 0.00 H new ATOM 0 HD3 ARG A 48 5.585 -2.417 -4.185 1.00 0.00 H new ATOM 0 HE ARG A 48 4.224 -0.047 -5.283 1.00 0.00 H new ATOM 0 HH11 ARG A 48 5.519 -1.676 -2.432 1.00 0.00 H new ATOM 0 HH12 ARG A 48 5.692 -0.178 -1.513 1.00 0.00 H new ATOM 0 HH21 ARG A 48 4.449 1.873 -4.096 1.00 0.00 H new ATOM 0 HH22 ARG A 48 5.089 1.822 -2.450 1.00 0.00 H new ATOM 746 N ILE A 49 4.891 -3.806 -9.562 1.00 0.00 N ATOM 747 CA ILE A 49 4.841 -5.236 -9.840 1.00 0.00 C ATOM 748 C ILE A 49 5.077 -5.516 -11.321 1.00 0.00 C ATOM 749 O ILE A 49 5.140 -6.672 -11.743 1.00 0.00 O ATOM 750 CB ILE A 49 3.489 -5.844 -9.424 1.00 0.00 C ATOM 751 CG1 ILE A 49 2.345 -5.167 -10.182 1.00 0.00 C ATOM 752 CG2 ILE A 49 3.288 -5.710 -7.921 1.00 0.00 C ATOM 753 CD1 ILE A 49 1.809 -3.933 -9.490 1.00 0.00 C ATOM 0 H ILE A 49 4.252 -3.244 -10.124 1.00 0.00 H new ATOM 0 HA ILE A 49 5.634 -5.699 -9.253 1.00 0.00 H new ATOM 0 HB ILE A 49 3.491 -6.904 -9.678 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.692 -4.893 -11.178 1.00 0.00 H new ATOM 0 HG13 ILE A 49 1.533 -5.882 -10.313 1.00 0.00 H new ATOM 0 HG21 ILE A 49 2.328 -6.144 -7.642 1.00 0.00 H new ATOM 0 HG22 ILE A 49 4.089 -6.234 -7.399 1.00 0.00 H new ATOM 0 HG23 ILE A 49 3.303 -4.656 -7.644 1.00 0.00 H new ATOM 0 HD11 ILE A 49 1.001 -3.505 -10.083 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.431 -4.204 -8.504 1.00 0.00 H new ATOM 0 HD13 ILE A 49 2.608 -3.200 -9.383 1.00 0.00 H new ATOM 765 N LEU A 50 5.207 -4.452 -12.105 1.00 0.00 N ATOM 766 CA LEU A 50 5.439 -4.582 -13.539 1.00 0.00 C ATOM 767 C LEU A 50 6.807 -4.028 -13.923 1.00 0.00 C ATOM 768 O LEU A 50 7.697 -4.774 -14.333 1.00 0.00 O ATOM 769 CB LEU A 50 4.344 -3.853 -14.320 1.00 0.00 C ATOM 770 CG LEU A 50 2.953 -3.854 -13.686 1.00 0.00 C ATOM 771 CD1 LEU A 50 2.069 -2.799 -14.334 1.00 0.00 C ATOM 772 CD2 LEU A 50 2.315 -5.230 -13.800 1.00 0.00 C ATOM 0 H LEU A 50 5.156 -3.489 -11.772 1.00 0.00 H new ATOM 0 HA LEU A 50 5.414 -5.642 -13.791 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.655 -2.818 -14.463 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.270 -4.303 -15.310 1.00 0.00 H new ATOM 0 HG LEU A 50 3.058 -3.611 -12.629 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.083 -2.815 -13.869 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.518 -1.815 -14.199 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.972 -3.010 -15.399 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.325 -5.211 -13.343 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.224 -5.503 -14.851 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.937 -5.963 -13.287 1.00 0.00 H new ATOM 784 N ASP A 51 6.969 -2.717 -13.784 1.00 0.00 N ATOM 785 CA ASP A 51 8.230 -2.063 -14.113 1.00 0.00 C ATOM 786 C ASP A 51 8.484 -0.876 -13.189 1.00 0.00 C ATOM 787 O ASP A 51 7.566 -0.124 -12.863 1.00 0.00 O ATOM 788 CB ASP A 51 8.224 -1.600 -15.570 1.00 0.00 C ATOM 789 CG ASP A 51 6.844 -1.186 -16.041 1.00 0.00 C ATOM 790 OD1 ASP A 51 6.118 -0.542 -15.255 1.00 0.00 O ATOM 791 OD2 ASP A 51 6.489 -1.507 -17.195 1.00 0.00 O ATOM 0 H ASP A 51 6.243 -2.086 -13.446 1.00 0.00 H new ATOM 0 HA ASP A 51 9.033 -2.786 -13.974 1.00 0.00 H new ATOM 0 HB2 ASP A 51 8.910 -0.761 -15.684 1.00 0.00 H new ATOM 0 HB3 ASP A 51 8.595 -2.404 -16.205 1.00 0.00 H new ATOM 796 N ASN A 52 9.735 -0.715 -12.771 1.00 0.00 N ATOM 797 CA ASN A 52 10.109 0.380 -11.883 1.00 0.00 C ATOM 798 C ASN A 52 10.846 1.474 -12.650 1.00 0.00 C ATOM 799 O ASN A 52 11.556 2.289 -12.060 1.00 0.00 O ATOM 800 CB ASN A 52 10.986 -0.138 -10.742 1.00 0.00 C ATOM 801 CG ASN A 52 11.060 0.837 -9.582 1.00 0.00 C ATOM 802 OD1 ASN A 52 10.046 1.163 -8.965 1.00 0.00 O ATOM 803 ND2 ASN A 52 12.265 1.307 -9.280 1.00 0.00 N ATOM 0 H ASN A 52 10.507 -1.328 -13.033 1.00 0.00 H new ATOM 0 HA ASN A 52 9.196 0.805 -11.466 1.00 0.00 H new ATOM 0 HB2 ASN A 52 10.592 -1.091 -10.388 1.00 0.00 H new ATOM 0 HB3 ASN A 52 11.991 -0.329 -11.118 1.00 0.00 H new ATOM 0 HD21 ASN A 52 12.377 1.966 -8.509 1.00 0.00 H new ATOM 0 HD22 ASN A 52 13.078 1.009 -9.819 1.00 0.00 H new ATOM 810 N ASP A 53 10.672 1.486 -13.967 1.00 0.00 N ATOM 811 CA ASP A 53 11.319 2.481 -14.814 1.00 0.00 C ATOM 812 C ASP A 53 10.311 3.514 -15.307 1.00 0.00 C ATOM 813 O ASP A 53 10.569 4.716 -15.265 1.00 0.00 O ATOM 814 CB ASP A 53 11.997 1.803 -16.006 1.00 0.00 C ATOM 815 CG ASP A 53 13.214 2.566 -16.492 1.00 0.00 C ATOM 816 OD1 ASP A 53 13.338 3.761 -16.152 1.00 0.00 O ATOM 817 OD2 ASP A 53 14.041 1.968 -17.212 1.00 0.00 O ATOM 0 H ASP A 53 10.089 0.818 -14.471 1.00 0.00 H new ATOM 0 HA ASP A 53 12.075 2.993 -14.218 1.00 0.00 H new ATOM 0 HB2 ASP A 53 12.294 0.793 -15.725 1.00 0.00 H new ATOM 0 HB3 ASP A 53 11.281 1.709 -16.822 1.00 0.00 H new ATOM 822 N GLN A 54 9.162 3.036 -15.774 1.00 0.00 N ATOM 823 CA GLN A 54 8.116 3.919 -16.277 1.00 0.00 C ATOM 824 C GLN A 54 8.653 4.830 -17.375 1.00 0.00 C ATOM 825 O GLN A 54 8.121 5.915 -17.611 1.00 0.00 O ATOM 826 CB GLN A 54 7.538 4.760 -15.137 1.00 0.00 C ATOM 827 CG GLN A 54 6.236 4.212 -14.576 1.00 0.00 C ATOM 828 CD GLN A 54 6.423 2.897 -13.845 1.00 0.00 C ATOM 829 OE1 GLN A 54 7.549 2.442 -13.640 1.00 0.00 O ATOM 830 NE2 GLN A 54 5.317 2.278 -13.446 1.00 0.00 N ATOM 0 H GLN A 54 8.932 2.043 -15.815 1.00 0.00 H new ATOM 0 HA GLN A 54 7.325 3.300 -16.700 1.00 0.00 H new ATOM 0 HB2 GLN A 54 8.272 4.822 -14.334 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.371 5.776 -15.495 1.00 0.00 H new ATOM 0 HG2 GLN A 54 5.802 4.944 -13.894 1.00 0.00 H new ATOM 0 HG3 GLN A 54 5.524 4.073 -15.390 1.00 0.00 H new ATOM 0 HE21 GLN A 54 4.404 2.691 -13.637 1.00 0.00 H new ATOM 0 HE22 GLN A 54 5.381 1.390 -12.949 1.00 0.00 H new ATOM 839 N SER A 55 9.711 4.382 -18.044 1.00 0.00 N ATOM 840 CA SER A 55 10.324 5.159 -19.115 1.00 0.00 C ATOM 841 C SER A 55 9.649 4.868 -20.452 1.00 0.00 C ATOM 842 O SER A 55 9.657 5.699 -21.358 1.00 0.00 O ATOM 843 CB SER A 55 11.819 4.850 -19.207 1.00 0.00 C ATOM 844 OG SER A 55 12.526 5.924 -19.804 1.00 0.00 O ATOM 0 H SER A 55 10.161 3.485 -17.863 1.00 0.00 H new ATOM 0 HA SER A 55 10.193 6.216 -18.884 1.00 0.00 H new ATOM 0 HB2 SER A 55 12.216 4.659 -18.210 1.00 0.00 H new ATOM 0 HB3 SER A 55 11.971 3.942 -19.790 1.00 0.00 H new ATOM 0 HG SER A 55 13.480 5.703 -19.850 1.00 0.00 H new ATOM 850 N GLY A 56 9.066 3.678 -20.566 1.00 0.00 N ATOM 851 CA GLY A 56 8.395 3.296 -21.795 1.00 0.00 C ATOM 852 C GLY A 56 8.183 1.799 -21.899 1.00 0.00 C ATOM 853 O GLY A 56 7.047 1.328 -21.964 1.00 0.00 O ATOM 0 H GLY A 56 9.047 2.972 -19.830 1.00 0.00 H new ATOM 0 HA2 GLY A 56 7.431 3.801 -21.851 1.00 0.00 H new ATOM 0 HA3 GLY A 56 8.983 3.637 -22.647 1.00 0.00 H new ATOM 857 N PHE A 57 9.279 1.047 -21.915 1.00 0.00 N ATOM 858 CA PHE A 57 9.208 -0.406 -22.014 1.00 0.00 C ATOM 859 C PHE A 57 9.920 -1.067 -20.837 1.00 0.00 C ATOM 860 O PHE A 57 10.290 -0.402 -19.870 1.00 0.00 O ATOM 861 CB PHE A 57 9.828 -0.879 -23.331 1.00 0.00 C ATOM 862 CG PHE A 57 11.329 -0.846 -23.332 1.00 0.00 C ATOM 863 CD1 PHE A 57 12.009 0.361 -23.310 1.00 0.00 C ATOM 864 CD2 PHE A 57 12.061 -2.022 -23.357 1.00 0.00 C ATOM 865 CE1 PHE A 57 13.391 0.395 -23.311 1.00 0.00 C ATOM 866 CE2 PHE A 57 13.443 -1.995 -23.358 1.00 0.00 C ATOM 867 CZ PHE A 57 14.109 -0.784 -23.336 1.00 0.00 C ATOM 0 H PHE A 57 10.227 1.420 -21.861 1.00 0.00 H new ATOM 0 HA PHE A 57 8.158 -0.696 -21.990 1.00 0.00 H new ATOM 0 HB2 PHE A 57 9.495 -1.896 -23.536 1.00 0.00 H new ATOM 0 HB3 PHE A 57 9.458 -0.253 -24.143 1.00 0.00 H new ATOM 0 HD1 PHE A 57 11.453 1.286 -23.292 1.00 0.00 H new ATOM 0 HD2 PHE A 57 11.546 -2.971 -23.376 1.00 0.00 H new ATOM 0 HE1 PHE A 57 13.908 1.343 -23.292 1.00 0.00 H new ATOM 0 HE2 PHE A 57 14.002 -2.919 -23.376 1.00 0.00 H new ATOM 0 HZ PHE A 57 15.189 -0.760 -23.338 1.00 0.00 H new ATOM 877 N ILE A 58 10.107 -2.379 -20.928 1.00 0.00 N ATOM 878 CA ILE A 58 10.774 -3.130 -19.872 1.00 0.00 C ATOM 879 C ILE A 58 11.900 -3.989 -20.436 1.00 0.00 C ATOM 880 O ILE A 58 11.867 -4.386 -21.600 1.00 0.00 O ATOM 881 CB ILE A 58 9.785 -4.034 -19.113 1.00 0.00 C ATOM 882 CG1 ILE A 58 8.502 -3.265 -18.791 1.00 0.00 C ATOM 883 CG2 ILE A 58 10.424 -4.565 -17.839 1.00 0.00 C ATOM 884 CD1 ILE A 58 7.471 -4.091 -18.054 1.00 0.00 C ATOM 0 H ILE A 58 9.806 -2.944 -21.722 1.00 0.00 H new ATOM 0 HA ILE A 58 11.190 -2.399 -19.179 1.00 0.00 H new ATOM 0 HB ILE A 58 9.529 -4.882 -19.749 1.00 0.00 H new ATOM 0 HG12 ILE A 58 8.753 -2.391 -18.190 1.00 0.00 H new ATOM 0 HG13 ILE A 58 8.065 -2.898 -19.720 1.00 0.00 H new ATOM 0 HG21 ILE A 58 9.713 -5.202 -17.313 1.00 0.00 H new ATOM 0 HG22 ILE A 58 11.312 -5.144 -18.092 1.00 0.00 H new ATOM 0 HG23 ILE A 58 10.706 -3.730 -17.198 1.00 0.00 H new ATOM 0 HD11 ILE A 58 6.588 -3.482 -17.859 1.00 0.00 H new ATOM 0 HD12 ILE A 58 7.191 -4.951 -18.662 1.00 0.00 H new ATOM 0 HD13 ILE A 58 7.890 -4.436 -17.109 1.00 0.00 H new ATOM 896 N GLU A 59 12.895 -4.274 -19.601 1.00 0.00 N ATOM 897 CA GLU A 59 14.031 -5.088 -20.017 1.00 0.00 C ATOM 898 C GLU A 59 14.341 -6.161 -18.978 1.00 0.00 C ATOM 899 O GLU A 59 13.875 -6.092 -17.841 1.00 0.00 O ATOM 900 CB GLU A 59 15.263 -4.208 -20.240 1.00 0.00 C ATOM 901 CG GLU A 59 16.151 -4.681 -21.379 1.00 0.00 C ATOM 902 CD GLU A 59 17.227 -3.674 -21.737 1.00 0.00 C ATOM 903 OE1 GLU A 59 17.822 -3.086 -20.810 1.00 0.00 O ATOM 904 OE2 GLU A 59 17.474 -3.475 -22.945 1.00 0.00 O ATOM 0 H GLU A 59 12.937 -3.953 -18.634 1.00 0.00 H new ATOM 0 HA GLU A 59 13.769 -5.579 -20.954 1.00 0.00 H new ATOM 0 HB2 GLU A 59 14.938 -3.188 -20.443 1.00 0.00 H new ATOM 0 HB3 GLU A 59 15.849 -4.179 -19.322 1.00 0.00 H new ATOM 0 HG2 GLU A 59 16.620 -5.625 -21.101 1.00 0.00 H new ATOM 0 HG3 GLU A 59 15.536 -4.877 -22.257 1.00 0.00 H new ATOM 911 N GLU A 60 15.131 -7.154 -19.378 1.00 0.00 N ATOM 912 CA GLU A 60 15.501 -8.242 -18.482 1.00 0.00 C ATOM 913 C GLU A 60 16.221 -7.709 -17.246 1.00 0.00 C ATOM 914 O GLU A 60 16.264 -8.367 -16.207 1.00 0.00 O ATOM 915 CB GLU A 60 16.393 -9.251 -19.210 1.00 0.00 C ATOM 916 CG GLU A 60 17.668 -8.643 -19.769 1.00 0.00 C ATOM 917 CD GLU A 60 18.800 -9.647 -19.864 1.00 0.00 C ATOM 918 OE1 GLU A 60 19.265 -10.118 -18.805 1.00 0.00 O ATOM 919 OE2 GLU A 60 19.221 -9.962 -20.997 1.00 0.00 O ATOM 0 H GLU A 60 15.526 -7.226 -20.316 1.00 0.00 H new ATOM 0 HA GLU A 60 14.587 -8.741 -18.161 1.00 0.00 H new ATOM 0 HB2 GLU A 60 16.655 -10.055 -18.522 1.00 0.00 H new ATOM 0 HB3 GLU A 60 15.827 -9.701 -20.026 1.00 0.00 H new ATOM 0 HG2 GLU A 60 17.467 -8.233 -20.759 1.00 0.00 H new ATOM 0 HG3 GLU A 60 17.977 -7.811 -19.136 1.00 0.00 H new ATOM 926 N ASP A 61 16.786 -6.513 -17.369 1.00 0.00 N ATOM 927 CA ASP A 61 17.504 -5.890 -16.263 1.00 0.00 C ATOM 928 C ASP A 61 16.532 -5.289 -15.253 1.00 0.00 C ATOM 929 O ASP A 61 16.939 -4.807 -14.197 1.00 0.00 O ATOM 930 CB ASP A 61 18.449 -4.807 -16.786 1.00 0.00 C ATOM 931 CG ASP A 61 19.289 -4.190 -15.685 1.00 0.00 C ATOM 932 OD1 ASP A 61 19.981 -4.947 -14.973 1.00 0.00 O ATOM 933 OD2 ASP A 61 19.254 -2.951 -15.535 1.00 0.00 O ATOM 0 H ASP A 61 16.761 -5.956 -18.223 1.00 0.00 H new ATOM 0 HA ASP A 61 18.089 -6.661 -15.762 1.00 0.00 H new ATOM 0 HB2 ASP A 61 19.106 -5.236 -17.543 1.00 0.00 H new ATOM 0 HB3 ASP A 61 17.867 -4.026 -17.275 1.00 0.00 H new ATOM 938 N GLU A 62 15.245 -5.321 -15.587 1.00 0.00 N ATOM 939 CA GLU A 62 14.215 -4.778 -14.709 1.00 0.00 C ATOM 940 C GLU A 62 13.259 -5.874 -14.248 1.00 0.00 C ATOM 941 O GLU A 62 12.166 -5.594 -13.756 1.00 0.00 O ATOM 942 CB GLU A 62 13.435 -3.673 -15.424 1.00 0.00 C ATOM 943 CG GLU A 62 13.988 -2.280 -15.179 1.00 0.00 C ATOM 944 CD GLU A 62 14.049 -1.928 -13.705 1.00 0.00 C ATOM 945 OE1 GLU A 62 12.984 -1.927 -13.052 1.00 0.00 O ATOM 946 OE2 GLU A 62 15.160 -1.653 -13.205 1.00 0.00 O ATOM 0 H GLU A 62 14.892 -5.717 -16.458 1.00 0.00 H new ATOM 0 HA GLU A 62 14.707 -4.357 -13.832 1.00 0.00 H new ATOM 0 HB2 GLU A 62 13.439 -3.873 -16.496 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.396 -3.704 -15.098 1.00 0.00 H new ATOM 0 HG2 GLU A 62 14.988 -2.209 -15.607 1.00 0.00 H new ATOM 0 HG3 GLU A 62 13.367 -1.550 -15.698 1.00 0.00 H new ATOM 953 N LEU A 63 13.679 -7.124 -14.411 1.00 0.00 N ATOM 954 CA LEU A 63 12.861 -8.264 -14.013 1.00 0.00 C ATOM 955 C LEU A 63 13.438 -8.942 -12.775 1.00 0.00 C ATOM 956 O LEU A 63 12.717 -9.239 -11.822 1.00 0.00 O ATOM 957 CB LEU A 63 12.761 -9.271 -15.160 1.00 0.00 C ATOM 958 CG LEU A 63 12.414 -8.693 -16.532 1.00 0.00 C ATOM 959 CD1 LEU A 63 12.314 -9.801 -17.569 1.00 0.00 C ATOM 960 CD2 LEU A 63 11.115 -7.903 -16.466 1.00 0.00 C ATOM 0 H LEU A 63 14.581 -7.374 -14.816 1.00 0.00 H new ATOM 0 HA LEU A 63 11.863 -7.897 -13.772 1.00 0.00 H new ATOM 0 HB2 LEU A 63 13.713 -9.797 -15.239 1.00 0.00 H new ATOM 0 HB3 LEU A 63 12.007 -10.014 -14.900 1.00 0.00 H new ATOM 0 HG LEU A 63 13.213 -8.015 -16.831 1.00 0.00 H new ATOM 0 HD11 LEU A 63 12.066 -9.370 -18.539 1.00 0.00 H new ATOM 0 HD12 LEU A 63 13.268 -10.323 -17.637 1.00 0.00 H new ATOM 0 HD13 LEU A 63 11.535 -10.505 -17.275 1.00 0.00 H new ATOM 0 HD21 LEU A 63 10.884 -7.499 -17.452 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.306 -8.559 -16.144 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.223 -7.084 -15.755 1.00 0.00 H new ATOM 972 N LYS A 64 14.745 -9.184 -12.794 1.00 0.00 N ATOM 973 CA LYS A 64 15.422 -9.824 -11.672 1.00 0.00 C ATOM 974 C LYS A 64 15.213 -9.030 -10.386 1.00 0.00 C ATOM 975 O LYS A 64 14.757 -7.887 -10.418 1.00 0.00 O ATOM 976 CB LYS A 64 16.918 -9.960 -11.963 1.00 0.00 C ATOM 977 CG LYS A 64 17.221 -10.626 -13.294 1.00 0.00 C ATOM 978 CD LYS A 64 18.433 -10.003 -13.966 1.00 0.00 C ATOM 979 CE LYS A 64 19.711 -10.303 -13.197 1.00 0.00 C ATOM 980 NZ LYS A 64 20.748 -9.255 -13.415 1.00 0.00 N ATOM 0 H LYS A 64 15.357 -8.946 -13.575 1.00 0.00 H new ATOM 0 HA LYS A 64 14.992 -10.817 -11.539 1.00 0.00 H new ATOM 0 HB2 LYS A 64 17.374 -8.970 -11.950 1.00 0.00 H new ATOM 0 HB3 LYS A 64 17.384 -10.536 -11.164 1.00 0.00 H new ATOM 0 HG2 LYS A 64 17.397 -11.690 -13.138 1.00 0.00 H new ATOM 0 HG3 LYS A 64 16.355 -10.540 -13.951 1.00 0.00 H new ATOM 0 HD2 LYS A 64 18.522 -10.383 -14.984 1.00 0.00 H new ATOM 0 HD3 LYS A 64 18.296 -8.924 -14.039 1.00 0.00 H new ATOM 0 HE2 LYS A 64 19.486 -10.376 -12.133 1.00 0.00 H new ATOM 0 HE3 LYS A 64 20.103 -11.272 -13.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 21.603 -9.495 -12.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 20.981 -9.203 -14.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 20.384 -8.335 -13.096 1.00 0.00 H new ATOM 994 N TYR A 65 15.551 -9.642 -9.257 1.00 0.00 N ATOM 995 CA TYR A 65 15.399 -8.993 -7.960 1.00 0.00 C ATOM 996 C TYR A 65 13.941 -8.627 -7.701 1.00 0.00 C ATOM 997 O TYR A 65 13.643 -7.747 -6.893 1.00 0.00 O ATOM 998 CB TYR A 65 16.272 -7.738 -7.890 1.00 0.00 C ATOM 999 CG TYR A 65 17.680 -7.951 -8.397 1.00 0.00 C ATOM 1000 CD1 TYR A 65 17.984 -7.801 -9.745 1.00 0.00 C ATOM 1001 CD2 TYR A 65 18.707 -8.300 -7.529 1.00 0.00 C ATOM 1002 CE1 TYR A 65 19.269 -7.995 -10.213 1.00 0.00 C ATOM 1003 CE2 TYR A 65 19.995 -8.495 -7.988 1.00 0.00 C ATOM 1004 CZ TYR A 65 20.271 -8.341 -9.330 1.00 0.00 C ATOM 1005 OH TYR A 65 21.553 -8.534 -9.792 1.00 0.00 O ATOM 0 H TYR A 65 15.932 -10.587 -9.213 1.00 0.00 H new ATOM 0 HA TYR A 65 15.720 -9.695 -7.191 1.00 0.00 H new ATOM 0 HB2 TYR A 65 15.801 -6.945 -8.472 1.00 0.00 H new ATOM 0 HB3 TYR A 65 16.315 -7.393 -6.857 1.00 0.00 H new ATOM 0 HD1 TYR A 65 17.202 -7.528 -10.438 1.00 0.00 H new ATOM 0 HD2 TYR A 65 18.495 -8.421 -6.477 1.00 0.00 H new ATOM 0 HE1 TYR A 65 19.488 -7.877 -11.264 1.00 0.00 H new ATOM 0 HE2 TYR A 65 20.782 -8.767 -7.300 1.00 0.00 H new ATOM 0 HH TYR A 65 22.138 -8.772 -9.043 1.00 0.00 H new ATOM 1015 N PHE A 66 13.035 -9.311 -8.392 1.00 0.00 N ATOM 1016 CA PHE A 66 11.607 -9.059 -8.238 1.00 0.00 C ATOM 1017 C PHE A 66 11.051 -9.800 -7.026 1.00 0.00 C ATOM 1018 O PHE A 66 10.383 -9.210 -6.175 1.00 0.00 O ATOM 1019 CB PHE A 66 10.853 -9.486 -9.500 1.00 0.00 C ATOM 1020 CG PHE A 66 9.360 -9.472 -9.340 1.00 0.00 C ATOM 1021 CD1 PHE A 66 8.691 -10.586 -8.859 1.00 0.00 C ATOM 1022 CD2 PHE A 66 8.625 -8.345 -9.669 1.00 0.00 C ATOM 1023 CE1 PHE A 66 7.317 -10.577 -8.711 1.00 0.00 C ATOM 1024 CE2 PHE A 66 7.250 -8.329 -9.524 1.00 0.00 C ATOM 1025 CZ PHE A 66 6.596 -9.446 -9.043 1.00 0.00 C ATOM 0 H PHE A 66 13.264 -10.044 -9.064 1.00 0.00 H new ATOM 0 HA PHE A 66 11.467 -7.989 -8.083 1.00 0.00 H new ATOM 0 HB2 PHE A 66 11.129 -8.823 -10.320 1.00 0.00 H new ATOM 0 HB3 PHE A 66 11.171 -10.490 -9.781 1.00 0.00 H new ATOM 0 HD1 PHE A 66 9.250 -11.472 -8.597 1.00 0.00 H new ATOM 0 HD2 PHE A 66 9.132 -7.468 -10.043 1.00 0.00 H new ATOM 0 HE1 PHE A 66 6.808 -11.453 -8.336 1.00 0.00 H new ATOM 0 HE2 PHE A 66 6.689 -7.445 -9.786 1.00 0.00 H new ATOM 0 HZ PHE A 66 5.522 -9.436 -8.926 1.00 0.00 H new ATOM 1035 N LEU A 67 11.332 -11.097 -6.953 1.00 0.00 N ATOM 1036 CA LEU A 67 10.861 -11.920 -5.845 1.00 0.00 C ATOM 1037 C LEU A 67 11.207 -11.280 -4.504 1.00 0.00 C ATOM 1038 O LEU A 67 10.493 -11.459 -3.518 1.00 0.00 O ATOM 1039 CB LEU A 67 11.473 -13.320 -5.927 1.00 0.00 C ATOM 1040 CG LEU A 67 11.460 -13.978 -7.307 1.00 0.00 C ATOM 1041 CD1 LEU A 67 11.970 -15.408 -7.222 1.00 0.00 C ATOM 1042 CD2 LEU A 67 10.059 -13.943 -7.901 1.00 0.00 C ATOM 0 H LEU A 67 11.883 -11.601 -7.648 1.00 0.00 H new ATOM 0 HA LEU A 67 9.776 -11.999 -5.920 1.00 0.00 H new ATOM 0 HB2 LEU A 67 12.506 -13.264 -5.583 1.00 0.00 H new ATOM 0 HB3 LEU A 67 10.940 -13.969 -5.232 1.00 0.00 H new ATOM 0 HG LEU A 67 12.125 -13.416 -7.963 1.00 0.00 H new ATOM 0 HD11 LEU A 67 11.953 -15.860 -8.214 1.00 0.00 H new ATOM 0 HD12 LEU A 67 12.991 -15.408 -6.840 1.00 0.00 H new ATOM 0 HD13 LEU A 67 11.332 -15.983 -6.551 1.00 0.00 H new ATOM 0 HD21 LEU A 67 10.068 -14.416 -8.883 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.373 -14.480 -7.246 1.00 0.00 H new ATOM 0 HD23 LEU A 67 9.731 -12.908 -7.999 1.00 0.00 H new ATOM 1054 N GLN A 68 12.305 -10.532 -4.478 1.00 0.00 N ATOM 1055 CA GLN A 68 12.744 -9.863 -3.259 1.00 0.00 C ATOM 1056 C GLN A 68 11.613 -9.041 -2.651 1.00 0.00 C ATOM 1057 O GLN A 68 11.560 -8.842 -1.437 1.00 0.00 O ATOM 1058 CB GLN A 68 13.945 -8.962 -3.550 1.00 0.00 C ATOM 1059 CG GLN A 68 15.022 -9.017 -2.479 1.00 0.00 C ATOM 1060 CD GLN A 68 16.372 -8.546 -2.983 1.00 0.00 C ATOM 1061 OE1 GLN A 68 17.013 -7.692 -2.370 1.00 0.00 O ATOM 1062 NE2 GLN A 68 16.812 -9.103 -4.105 1.00 0.00 N ATOM 0 H GLN A 68 12.907 -10.374 -5.286 1.00 0.00 H new ATOM 0 HA GLN A 68 13.039 -10.629 -2.541 1.00 0.00 H new ATOM 0 HB2 GLN A 68 14.381 -9.250 -4.507 1.00 0.00 H new ATOM 0 HB3 GLN A 68 13.600 -7.933 -3.654 1.00 0.00 H new ATOM 0 HG2 GLN A 68 14.719 -8.400 -1.633 1.00 0.00 H new ATOM 0 HG3 GLN A 68 15.112 -10.039 -2.112 1.00 0.00 H new ATOM 0 HE21 GLN A 68 16.248 -9.807 -4.580 1.00 0.00 H new ATOM 0 HE22 GLN A 68 17.715 -8.827 -4.492 1.00 0.00 H new ATOM 1071 N ARG A 69 10.709 -8.566 -3.502 1.00 0.00 N ATOM 1072 CA ARG A 69 9.579 -7.765 -3.048 1.00 0.00 C ATOM 1073 C ARG A 69 8.673 -8.575 -2.127 1.00 0.00 C ATOM 1074 O ARG A 69 8.618 -8.332 -0.921 1.00 0.00 O ATOM 1075 CB ARG A 69 8.779 -7.250 -4.246 1.00 0.00 C ATOM 1076 CG ARG A 69 9.489 -6.159 -5.030 1.00 0.00 C ATOM 1077 CD ARG A 69 9.770 -4.942 -4.163 1.00 0.00 C ATOM 1078 NE ARG A 69 8.563 -4.445 -3.510 1.00 0.00 N ATOM 1079 CZ ARG A 69 8.576 -3.613 -2.474 1.00 0.00 C ATOM 1080 NH1 ARG A 69 9.730 -3.187 -1.978 1.00 0.00 N ATOM 1081 NH2 ARG A 69 7.435 -3.205 -1.934 1.00 0.00 N ATOM 0 H ARG A 69 10.737 -8.722 -4.510 1.00 0.00 H new ATOM 0 HA ARG A 69 9.969 -6.915 -2.488 1.00 0.00 H new ATOM 0 HB2 ARG A 69 8.564 -8.084 -4.914 1.00 0.00 H new ATOM 0 HB3 ARG A 69 7.821 -6.868 -3.895 1.00 0.00 H new ATOM 0 HG2 ARG A 69 10.426 -6.547 -5.428 1.00 0.00 H new ATOM 0 HG3 ARG A 69 8.877 -5.866 -5.883 1.00 0.00 H new ATOM 0 HD2 ARG A 69 10.512 -5.199 -3.407 1.00 0.00 H new ATOM 0 HD3 ARG A 69 10.202 -4.151 -4.777 1.00 0.00 H new ATOM 0 HE ARG A 69 7.659 -4.753 -3.869 1.00 0.00 H new ATOM 0 HH11 ARG A 69 10.609 -3.498 -2.392 1.00 0.00 H new ATOM 0 HH12 ARG A 69 9.739 -2.548 -1.183 1.00 0.00 H new ATOM 0 HH21 ARG A 69 6.546 -3.530 -2.314 1.00 0.00 H new ATOM 0 HH22 ARG A 69 7.447 -2.566 -1.139 1.00 0.00 H new ATOM 1095 N PHE A 70 7.962 -9.539 -2.703 1.00 0.00 N ATOM 1096 CA PHE A 70 7.056 -10.385 -1.934 1.00 0.00 C ATOM 1097 C PHE A 70 7.832 -11.272 -0.964 1.00 0.00 C ATOM 1098 O PHE A 70 7.571 -11.269 0.238 1.00 0.00 O ATOM 1099 CB PHE A 70 6.213 -11.251 -2.873 1.00 0.00 C ATOM 1100 CG PHE A 70 5.333 -10.456 -3.794 1.00 0.00 C ATOM 1101 CD1 PHE A 70 4.318 -9.660 -3.288 1.00 0.00 C ATOM 1102 CD2 PHE A 70 5.521 -10.504 -5.166 1.00 0.00 C ATOM 1103 CE1 PHE A 70 3.506 -8.926 -4.133 1.00 0.00 C ATOM 1104 CE2 PHE A 70 4.713 -9.772 -6.015 1.00 0.00 C ATOM 1105 CZ PHE A 70 3.704 -8.984 -5.498 1.00 0.00 C ATOM 0 H PHE A 70 7.996 -9.754 -3.700 1.00 0.00 H new ATOM 0 HA PHE A 70 6.395 -9.738 -1.357 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.876 -11.878 -3.469 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.592 -11.920 -2.277 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.159 -9.612 -2.221 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.307 -11.120 -5.576 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.719 -8.309 -3.726 1.00 0.00 H new ATOM 0 HE2 PHE A 70 4.871 -9.816 -7.083 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.070 -8.414 -6.161 1.00 0.00 H new ATOM 1115 N GLU A 71 8.785 -12.029 -1.498 1.00 0.00 N ATOM 1116 CA GLU A 71 9.597 -12.922 -0.680 1.00 0.00 C ATOM 1117 C GLU A 71 10.118 -12.201 0.560 1.00 0.00 C ATOM 1118 O GLU A 71 10.123 -10.972 0.620 1.00 0.00 O ATOM 1119 CB GLU A 71 10.771 -13.470 -1.495 1.00 0.00 C ATOM 1120 CG GLU A 71 11.405 -14.711 -0.890 1.00 0.00 C ATOM 1121 CD GLU A 71 10.397 -15.814 -0.629 1.00 0.00 C ATOM 1122 OE1 GLU A 71 9.946 -16.449 -1.605 1.00 0.00 O ATOM 1123 OE2 GLU A 71 10.059 -16.041 0.552 1.00 0.00 O ATOM 0 H GLU A 71 9.014 -12.042 -2.492 1.00 0.00 H new ATOM 0 HA GLU A 71 8.967 -13.752 -0.359 1.00 0.00 H new ATOM 0 HB2 GLU A 71 10.426 -13.703 -2.502 1.00 0.00 H new ATOM 0 HB3 GLU A 71 11.530 -12.694 -1.590 1.00 0.00 H new ATOM 0 HG2 GLU A 71 12.179 -15.083 -1.561 1.00 0.00 H new ATOM 0 HG3 GLU A 71 11.896 -14.444 0.046 1.00 0.00 H new ATOM 1130 N SER A 72 10.554 -12.976 1.548 1.00 0.00 N ATOM 1131 CA SER A 72 11.072 -12.412 2.789 1.00 0.00 C ATOM 1132 C SER A 72 12.368 -11.647 2.539 1.00 0.00 C ATOM 1133 O SER A 72 12.552 -10.537 3.035 1.00 0.00 O ATOM 1134 CB SER A 72 11.312 -13.521 3.817 1.00 0.00 C ATOM 1135 OG SER A 72 11.687 -12.980 5.072 1.00 0.00 O ATOM 0 H SER A 72 10.559 -13.995 1.513 1.00 0.00 H new ATOM 0 HA SER A 72 10.330 -11.717 3.181 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.407 -14.118 3.930 1.00 0.00 H new ATOM 0 HB3 SER A 72 12.093 -14.191 3.458 1.00 0.00 H new ATOM 0 HG SER A 72 11.833 -13.708 5.712 1.00 0.00 H new ATOM 1141 N GLY A 73 13.265 -12.251 1.765 1.00 0.00 N ATOM 1142 CA GLY A 73 14.532 -11.613 1.461 1.00 0.00 C ATOM 1143 C GLY A 73 15.252 -12.275 0.302 1.00 0.00 C ATOM 1144 O GLY A 73 16.371 -12.762 0.455 1.00 0.00 O ATOM 0 H GLY A 73 13.136 -13.171 1.343 1.00 0.00 H new ATOM 0 HA2 GLY A 73 14.359 -10.563 1.225 1.00 0.00 H new ATOM 0 HA3 GLY A 73 15.170 -11.640 2.344 1.00 0.00 H new ATOM 1148 N ALA A 74 14.606 -12.294 -0.859 1.00 0.00 N ATOM 1149 CA ALA A 74 15.191 -12.900 -2.048 1.00 0.00 C ATOM 1150 C ALA A 74 16.505 -12.221 -2.421 1.00 0.00 C ATOM 1151 O ALA A 74 16.967 -11.317 -1.725 1.00 0.00 O ATOM 1152 CB ALA A 74 14.212 -12.834 -3.211 1.00 0.00 C ATOM 0 H ALA A 74 13.677 -11.897 -1.001 1.00 0.00 H new ATOM 0 HA ALA A 74 15.403 -13.946 -1.825 1.00 0.00 H new ATOM 0 HB1 ALA A 74 14.663 -13.290 -4.092 1.00 0.00 H new ATOM 0 HB2 ALA A 74 13.300 -13.371 -2.950 1.00 0.00 H new ATOM 0 HB3 ALA A 74 13.971 -11.793 -3.425 1.00 0.00 H new ATOM 1158 N ARG A 75 17.101 -12.662 -3.524 1.00 0.00 N ATOM 1159 CA ARG A 75 18.363 -12.097 -3.988 1.00 0.00 C ATOM 1160 C ARG A 75 18.301 -11.782 -5.480 1.00 0.00 C ATOM 1161 O ARG A 75 18.263 -10.618 -5.879 1.00 0.00 O ATOM 1162 CB ARG A 75 19.513 -13.065 -3.707 1.00 0.00 C ATOM 1163 CG ARG A 75 19.082 -14.521 -3.643 1.00 0.00 C ATOM 1164 CD ARG A 75 20.168 -15.448 -4.168 1.00 0.00 C ATOM 1165 NE ARG A 75 20.133 -16.755 -3.519 1.00 0.00 N ATOM 1166 CZ ARG A 75 20.429 -16.948 -2.238 1.00 0.00 C ATOM 1167 NH1 ARG A 75 20.779 -15.923 -1.473 1.00 0.00 N ATOM 1168 NH2 ARG A 75 20.374 -18.169 -1.720 1.00 0.00 N ATOM 0 H ARG A 75 16.731 -13.408 -4.113 1.00 0.00 H new ATOM 0 HA ARG A 75 18.539 -11.168 -3.445 1.00 0.00 H new ATOM 0 HB2 ARG A 75 20.269 -12.953 -4.484 1.00 0.00 H new ATOM 0 HB3 ARG A 75 19.984 -12.792 -2.762 1.00 0.00 H new ATOM 0 HG2 ARG A 75 18.843 -14.786 -2.613 1.00 0.00 H new ATOM 0 HG3 ARG A 75 18.172 -14.658 -4.227 1.00 0.00 H new ATOM 0 HD2 ARG A 75 20.048 -15.574 -5.244 1.00 0.00 H new ATOM 0 HD3 ARG A 75 21.144 -14.990 -4.008 1.00 0.00 H new ATOM 0 HE ARG A 75 19.867 -17.565 -4.079 1.00 0.00 H new ATOM 0 HH11 ARG A 75 20.822 -14.983 -1.867 1.00 0.00 H new ATOM 0 HH12 ARG A 75 21.006 -16.074 -0.490 1.00 0.00 H new ATOM 0 HH21 ARG A 75 20.104 -18.960 -2.305 1.00 0.00 H new ATOM 0 HH22 ARG A 75 20.601 -18.317 -0.737 1.00 0.00 H new ATOM 1182 N VAL A 76 18.293 -12.828 -6.300 1.00 0.00 N ATOM 1183 CA VAL A 76 18.236 -12.664 -7.748 1.00 0.00 C ATOM 1184 C VAL A 76 17.456 -13.800 -8.400 1.00 0.00 C ATOM 1185 O VAL A 76 17.223 -14.841 -7.784 1.00 0.00 O ATOM 1186 CB VAL A 76 19.647 -12.606 -8.362 1.00 0.00 C ATOM 1187 CG1 VAL A 76 19.615 -11.899 -9.709 1.00 0.00 C ATOM 1188 CG2 VAL A 76 20.614 -11.917 -7.411 1.00 0.00 C ATOM 0 H VAL A 76 18.325 -13.798 -5.986 1.00 0.00 H new ATOM 0 HA VAL A 76 17.725 -11.720 -7.940 1.00 0.00 H new ATOM 0 HB VAL A 76 19.997 -13.626 -8.523 1.00 0.00 H new ATOM 0 HG11 VAL A 76 20.621 -11.868 -10.127 1.00 0.00 H new ATOM 0 HG12 VAL A 76 18.956 -12.440 -10.388 1.00 0.00 H new ATOM 0 HG13 VAL A 76 19.245 -10.882 -9.578 1.00 0.00 H new ATOM 0 HG21 VAL A 76 21.606 -11.885 -7.861 1.00 0.00 H new ATOM 0 HG22 VAL A 76 20.271 -10.901 -7.216 1.00 0.00 H new ATOM 0 HG23 VAL A 76 20.659 -12.471 -6.473 1.00 0.00 H new ATOM 1198 N LEU A 77 17.055 -13.595 -9.649 1.00 0.00 N ATOM 1199 CA LEU A 77 16.301 -14.602 -10.387 1.00 0.00 C ATOM 1200 C LEU A 77 17.190 -15.312 -11.403 1.00 0.00 C ATOM 1201 O LEU A 77 18.396 -15.070 -11.466 1.00 0.00 O ATOM 1202 CB LEU A 77 15.109 -13.958 -11.096 1.00 0.00 C ATOM 1203 CG LEU A 77 13.822 -13.846 -10.279 1.00 0.00 C ATOM 1204 CD1 LEU A 77 13.202 -12.467 -10.447 1.00 0.00 C ATOM 1205 CD2 LEU A 77 12.835 -14.930 -10.687 1.00 0.00 C ATOM 0 H LEU A 77 17.240 -12.739 -10.173 1.00 0.00 H new ATOM 0 HA LEU A 77 15.935 -15.341 -9.674 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.400 -12.958 -11.417 1.00 0.00 H new ATOM 0 HB3 LEU A 77 14.895 -14.532 -11.997 1.00 0.00 H new ATOM 0 HG LEU A 77 14.069 -13.985 -9.227 1.00 0.00 H new ATOM 0 HD11 LEU A 77 12.287 -12.405 -9.858 1.00 0.00 H new ATOM 0 HD12 LEU A 77 13.905 -11.708 -10.105 1.00 0.00 H new ATOM 0 HD13 LEU A 77 12.969 -12.298 -11.498 1.00 0.00 H new ATOM 0 HD21 LEU A 77 11.925 -14.835 -10.095 1.00 0.00 H new ATOM 0 HD22 LEU A 77 12.593 -14.823 -11.744 1.00 0.00 H new ATOM 0 HD23 LEU A 77 13.279 -15.910 -10.514 1.00 0.00 H new ATOM 1217 N THR A 78 16.586 -16.189 -12.199 1.00 0.00 N ATOM 1218 CA THR A 78 17.322 -16.933 -13.214 1.00 0.00 C ATOM 1219 C THR A 78 17.032 -16.393 -14.610 1.00 0.00 C ATOM 1220 O THR A 78 16.265 -15.445 -14.772 1.00 0.00 O ATOM 1221 CB THR A 78 16.973 -18.433 -13.173 1.00 0.00 C ATOM 1222 OG1 THR A 78 15.590 -18.623 -13.493 1.00 0.00 O ATOM 1223 CG2 THR A 78 17.268 -19.020 -11.801 1.00 0.00 C ATOM 0 H THR A 78 15.589 -16.401 -12.160 1.00 0.00 H new ATOM 0 HA THR A 78 18.382 -16.807 -12.992 1.00 0.00 H new ATOM 0 HB THR A 78 17.589 -18.948 -13.910 1.00 0.00 H new ATOM 0 HG1 THR A 78 15.376 -19.579 -13.467 1.00 0.00 H new ATOM 0 HG21 THR A 78 17.014 -20.080 -11.796 1.00 0.00 H new ATOM 0 HG22 THR A 78 18.327 -18.900 -11.574 1.00 0.00 H new ATOM 0 HG23 THR A 78 16.675 -18.501 -11.048 1.00 0.00 H new ATOM 1231 N ALA A 79 17.651 -17.004 -15.615 1.00 0.00 N ATOM 1232 CA ALA A 79 17.457 -16.585 -16.998 1.00 0.00 C ATOM 1233 C ALA A 79 16.193 -17.203 -17.586 1.00 0.00 C ATOM 1234 O ALA A 79 15.886 -17.011 -18.763 1.00 0.00 O ATOM 1235 CB ALA A 79 18.670 -16.959 -17.837 1.00 0.00 C ATOM 0 H ALA A 79 18.290 -17.790 -15.498 1.00 0.00 H new ATOM 0 HA ALA A 79 17.340 -15.501 -17.011 1.00 0.00 H new ATOM 0 HB1 ALA A 79 18.512 -16.640 -18.867 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.556 -16.466 -17.436 1.00 0.00 H new ATOM 0 HB3 ALA A 79 18.813 -18.039 -17.809 1.00 0.00 H new ATOM 1241 N SER A 80 15.464 -17.947 -16.761 1.00 0.00 N ATOM 1242 CA SER A 80 14.235 -18.597 -17.201 1.00 0.00 C ATOM 1243 C SER A 80 13.011 -17.902 -16.613 1.00 0.00 C ATOM 1244 O SER A 80 12.048 -17.613 -17.322 1.00 0.00 O ATOM 1245 CB SER A 80 14.241 -20.073 -16.796 1.00 0.00 C ATOM 1246 OG SER A 80 14.862 -20.871 -17.788 1.00 0.00 O ATOM 0 H SER A 80 15.703 -18.115 -15.784 1.00 0.00 H new ATOM 0 HA SER A 80 14.184 -18.525 -18.287 1.00 0.00 H new ATOM 0 HB2 SER A 80 14.766 -20.191 -15.848 1.00 0.00 H new ATOM 0 HB3 SER A 80 13.218 -20.414 -16.638 1.00 0.00 H new ATOM 0 HG SER A 80 14.855 -21.809 -17.505 1.00 0.00 H new ATOM 1252 N GLU A 81 13.058 -17.636 -15.311 1.00 0.00 N ATOM 1253 CA GLU A 81 11.953 -16.975 -14.627 1.00 0.00 C ATOM 1254 C GLU A 81 11.732 -15.570 -15.180 1.00 0.00 C ATOM 1255 O GLU A 81 10.605 -15.180 -15.487 1.00 0.00 O ATOM 1256 CB GLU A 81 12.224 -16.905 -13.122 1.00 0.00 C ATOM 1257 CG GLU A 81 12.561 -18.250 -12.502 1.00 0.00 C ATOM 1258 CD GLU A 81 11.364 -19.179 -12.436 1.00 0.00 C ATOM 1259 OE1 GLU A 81 10.698 -19.362 -13.476 1.00 0.00 O ATOM 1260 OE2 GLU A 81 11.094 -19.723 -11.345 1.00 0.00 O ATOM 0 H GLU A 81 13.849 -17.868 -14.710 1.00 0.00 H new ATOM 0 HA GLU A 81 11.050 -17.561 -14.800 1.00 0.00 H new ATOM 0 HB2 GLU A 81 13.048 -16.214 -12.941 1.00 0.00 H new ATOM 0 HB3 GLU A 81 11.347 -16.493 -12.622 1.00 0.00 H new ATOM 0 HG2 GLU A 81 13.353 -18.725 -13.081 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.951 -18.095 -11.496 1.00 0.00 H new ATOM 1267 N THR A 82 12.818 -14.813 -15.306 1.00 0.00 N ATOM 1268 CA THR A 82 12.744 -13.451 -15.820 1.00 0.00 C ATOM 1269 C THR A 82 12.463 -13.444 -17.319 1.00 0.00 C ATOM 1270 O THR A 82 11.745 -12.579 -17.822 1.00 0.00 O ATOM 1271 CB THR A 82 14.049 -12.677 -15.551 1.00 0.00 C ATOM 1272 OG1 THR A 82 15.171 -13.430 -16.023 1.00 0.00 O ATOM 1273 CG2 THR A 82 14.212 -12.392 -14.065 1.00 0.00 C ATOM 0 H THR A 82 13.759 -15.120 -15.059 1.00 0.00 H new ATOM 0 HA THR A 82 11.924 -12.960 -15.296 1.00 0.00 H new ATOM 0 HB THR A 82 13.999 -11.727 -16.084 1.00 0.00 H new ATOM 0 HG1 THR A 82 15.618 -13.862 -15.265 1.00 0.00 H new ATOM 0 HG21 THR A 82 15.140 -11.845 -13.899 1.00 0.00 H new ATOM 0 HG22 THR A 82 13.371 -11.794 -13.715 1.00 0.00 H new ATOM 0 HG23 THR A 82 14.242 -13.333 -13.515 1.00 0.00 H new ATOM 1281 N LYS A 83 13.032 -14.413 -18.027 1.00 0.00 N ATOM 1282 CA LYS A 83 12.842 -14.521 -19.469 1.00 0.00 C ATOM 1283 C LYS A 83 11.363 -14.674 -19.812 1.00 0.00 C ATOM 1284 O LYS A 83 10.937 -14.358 -20.923 1.00 0.00 O ATOM 1285 CB LYS A 83 13.630 -15.710 -20.021 1.00 0.00 C ATOM 1286 CG LYS A 83 13.280 -16.058 -21.457 1.00 0.00 C ATOM 1287 CD LYS A 83 14.343 -16.938 -22.093 1.00 0.00 C ATOM 1288 CE LYS A 83 14.164 -18.398 -21.704 1.00 0.00 C ATOM 1289 NZ LYS A 83 12.890 -18.960 -22.231 1.00 0.00 N ATOM 0 H LYS A 83 13.629 -15.136 -17.626 1.00 0.00 H new ATOM 0 HA LYS A 83 13.211 -13.604 -19.929 1.00 0.00 H new ATOM 0 HB2 LYS A 83 14.696 -15.489 -19.959 1.00 0.00 H new ATOM 0 HB3 LYS A 83 13.448 -16.580 -19.390 1.00 0.00 H new ATOM 0 HG2 LYS A 83 12.318 -16.570 -21.484 1.00 0.00 H new ATOM 0 HG3 LYS A 83 13.170 -15.142 -22.038 1.00 0.00 H new ATOM 0 HD2 LYS A 83 14.296 -16.841 -23.178 1.00 0.00 H new ATOM 0 HD3 LYS A 83 15.331 -16.597 -21.785 1.00 0.00 H new ATOM 0 HE2 LYS A 83 15.003 -18.981 -22.085 1.00 0.00 H new ATOM 0 HE3 LYS A 83 14.179 -18.489 -20.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 12.980 -19.991 -22.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 12.115 -18.742 -21.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 12.683 -18.540 -23.160 1.00 0.00 H new ATOM 1303 N THR A 84 10.584 -15.160 -18.851 1.00 0.00 N ATOM 1304 CA THR A 84 9.154 -15.355 -19.051 1.00 0.00 C ATOM 1305 C THR A 84 8.347 -14.274 -18.342 1.00 0.00 C ATOM 1306 O THR A 84 7.227 -14.516 -17.892 1.00 0.00 O ATOM 1307 CB THR A 84 8.698 -16.736 -18.544 1.00 0.00 C ATOM 1308 OG1 THR A 84 7.323 -16.952 -18.877 1.00 0.00 O ATOM 1309 CG2 THR A 84 8.884 -16.847 -17.038 1.00 0.00 C ATOM 0 H THR A 84 10.920 -15.426 -17.925 1.00 0.00 H new ATOM 0 HA THR A 84 8.974 -15.293 -20.124 1.00 0.00 H new ATOM 0 HB THR A 84 9.311 -17.496 -19.028 1.00 0.00 H new ATOM 0 HG1 THR A 84 6.801 -16.157 -18.641 1.00 0.00 H new ATOM 0 HG21 THR A 84 8.555 -17.831 -16.702 1.00 0.00 H new ATOM 0 HG22 THR A 84 9.937 -16.712 -16.791 1.00 0.00 H new ATOM 0 HG23 THR A 84 8.293 -16.078 -16.541 1.00 0.00 H new ATOM 1317 N PHE A 85 8.923 -13.080 -18.245 1.00 0.00 N ATOM 1318 CA PHE A 85 8.256 -11.961 -17.589 1.00 0.00 C ATOM 1319 C PHE A 85 7.829 -10.909 -18.608 1.00 0.00 C ATOM 1320 O PHE A 85 6.691 -10.438 -18.591 1.00 0.00 O ATOM 1321 CB PHE A 85 9.181 -11.330 -16.546 1.00 0.00 C ATOM 1322 CG PHE A 85 8.535 -11.154 -15.201 1.00 0.00 C ATOM 1323 CD1 PHE A 85 8.317 -12.244 -14.374 1.00 0.00 C ATOM 1324 CD2 PHE A 85 8.147 -9.898 -14.763 1.00 0.00 C ATOM 1325 CE1 PHE A 85 7.722 -12.085 -13.137 1.00 0.00 C ATOM 1326 CE2 PHE A 85 7.552 -9.732 -13.526 1.00 0.00 C ATOM 1327 CZ PHE A 85 7.340 -10.827 -12.712 1.00 0.00 C ATOM 0 H PHE A 85 9.849 -12.863 -18.612 1.00 0.00 H new ATOM 0 HA PHE A 85 7.364 -12.343 -17.092 1.00 0.00 H new ATOM 0 HB2 PHE A 85 10.069 -11.953 -16.435 1.00 0.00 H new ATOM 0 HB3 PHE A 85 9.516 -10.359 -16.909 1.00 0.00 H new ATOM 0 HD1 PHE A 85 8.616 -13.229 -14.700 1.00 0.00 H new ATOM 0 HD2 PHE A 85 8.311 -9.038 -15.396 1.00 0.00 H new ATOM 0 HE1 PHE A 85 7.556 -12.943 -12.503 1.00 0.00 H new ATOM 0 HE2 PHE A 85 7.254 -8.748 -13.197 1.00 0.00 H new ATOM 0 HZ PHE A 85 6.876 -10.700 -11.745 1.00 0.00 H new ATOM 1337 N LEU A 86 8.748 -10.546 -19.495 1.00 0.00 N ATOM 1338 CA LEU A 86 8.468 -9.549 -20.523 1.00 0.00 C ATOM 1339 C LEU A 86 8.584 -10.157 -21.917 1.00 0.00 C ATOM 1340 O LEU A 86 8.003 -9.651 -22.876 1.00 0.00 O ATOM 1341 CB LEU A 86 9.428 -8.366 -20.389 1.00 0.00 C ATOM 1342 CG LEU A 86 10.916 -8.690 -20.526 1.00 0.00 C ATOM 1343 CD1 LEU A 86 11.282 -8.912 -21.985 1.00 0.00 C ATOM 1344 CD2 LEU A 86 11.762 -7.576 -19.925 1.00 0.00 C ATOM 0 H LEU A 86 9.694 -10.927 -19.524 1.00 0.00 H new ATOM 0 HA LEU A 86 7.446 -9.197 -20.384 1.00 0.00 H new ATOM 0 HB2 LEU A 86 9.167 -7.625 -21.144 1.00 0.00 H new ATOM 0 HB3 LEU A 86 9.266 -7.901 -19.417 1.00 0.00 H new ATOM 0 HG LEU A 86 11.120 -9.610 -19.978 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.345 -9.141 -22.063 1.00 0.00 H new ATOM 0 HD12 LEU A 86 10.701 -9.744 -22.383 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.063 -8.010 -22.556 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.818 -7.823 -20.031 1.00 0.00 H new ATOM 0 HD22 LEU A 86 11.554 -6.641 -20.445 1.00 0.00 H new ATOM 0 HD23 LEU A 86 11.520 -7.465 -18.868 1.00 0.00 H new ATOM 1356 N ALA A 87 9.337 -11.248 -22.021 1.00 0.00 N ATOM 1357 CA ALA A 87 9.526 -11.927 -23.296 1.00 0.00 C ATOM 1358 C ALA A 87 8.358 -12.860 -23.599 1.00 0.00 C ATOM 1359 O ALA A 87 8.147 -13.252 -24.746 1.00 0.00 O ATOM 1360 CB ALA A 87 10.835 -12.702 -23.292 1.00 0.00 C ATOM 0 H ALA A 87 9.826 -11.680 -21.237 1.00 0.00 H new ATOM 0 HA ALA A 87 9.566 -11.171 -24.080 1.00 0.00 H new ATOM 0 HB1 ALA A 87 10.963 -13.204 -24.251 1.00 0.00 H new ATOM 0 HB2 ALA A 87 11.665 -12.014 -23.129 1.00 0.00 H new ATOM 0 HB3 ALA A 87 10.816 -13.444 -22.493 1.00 0.00 H new ATOM 1366 N ALA A 88 7.603 -13.211 -22.563 1.00 0.00 N ATOM 1367 CA ALA A 88 6.456 -14.097 -22.720 1.00 0.00 C ATOM 1368 C ALA A 88 5.189 -13.305 -23.023 1.00 0.00 C ATOM 1369 O ALA A 88 4.362 -13.724 -23.832 1.00 0.00 O ATOM 1370 CB ALA A 88 6.266 -14.941 -21.468 1.00 0.00 C ATOM 0 H ALA A 88 7.765 -12.896 -21.607 1.00 0.00 H new ATOM 0 HA ALA A 88 6.651 -14.758 -23.564 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.406 -15.598 -21.599 1.00 0.00 H new ATOM 0 HB2 ALA A 88 7.159 -15.542 -21.295 1.00 0.00 H new ATOM 0 HB3 ALA A 88 6.097 -14.288 -20.611 1.00 0.00 H new ATOM 1376 N ALA A 89 5.042 -12.157 -22.369 1.00 0.00 N ATOM 1377 CA ALA A 89 3.876 -11.306 -22.570 1.00 0.00 C ATOM 1378 C ALA A 89 3.648 -11.029 -24.052 1.00 0.00 C ATOM 1379 O ALA A 89 2.515 -11.064 -24.532 1.00 0.00 O ATOM 1380 CB ALA A 89 4.038 -10.000 -21.805 1.00 0.00 C ATOM 0 H ALA A 89 5.717 -11.795 -21.695 1.00 0.00 H new ATOM 0 HA ALA A 89 3.002 -11.832 -22.187 1.00 0.00 H new ATOM 0 HB1 ALA A 89 3.160 -9.374 -21.964 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.145 -10.212 -20.741 1.00 0.00 H new ATOM 0 HB3 ALA A 89 4.926 -9.477 -22.161 1.00 0.00 H new ATOM 1386 N ASP A 90 4.730 -10.753 -24.771 1.00 0.00 N ATOM 1387 CA ASP A 90 4.648 -10.470 -26.199 1.00 0.00 C ATOM 1388 C ASP A 90 5.947 -10.847 -26.904 1.00 0.00 C ATOM 1389 O ASP A 90 6.964 -11.103 -26.258 1.00 0.00 O ATOM 1390 CB ASP A 90 4.338 -8.991 -26.430 1.00 0.00 C ATOM 1391 CG ASP A 90 5.566 -8.113 -26.291 1.00 0.00 C ATOM 1392 OD1 ASP A 90 6.167 -8.105 -25.196 1.00 0.00 O ATOM 1393 OD2 ASP A 90 5.926 -7.434 -27.275 1.00 0.00 O ATOM 0 H ASP A 90 5.675 -10.719 -24.388 1.00 0.00 H new ATOM 0 HA ASP A 90 3.841 -11.072 -26.618 1.00 0.00 H new ATOM 0 HB2 ASP A 90 3.914 -8.863 -27.426 1.00 0.00 H new ATOM 0 HB3 ASP A 90 3.580 -8.666 -25.717 1.00 0.00 H new ATOM 1453 N LYS A 96 9.532 -6.166 -25.275 1.00 0.00 N ATOM 1454 CA LYS A 96 9.310 -4.838 -24.716 1.00 0.00 C ATOM 1455 C LYS A 96 7.826 -4.597 -24.459 1.00 0.00 C ATOM 1456 O LYS A 96 7.033 -4.493 -25.396 1.00 0.00 O ATOM 1457 CB LYS A 96 9.855 -3.766 -25.662 1.00 0.00 C ATOM 1458 CG LYS A 96 9.380 -3.922 -27.096 1.00 0.00 C ATOM 1459 CD LYS A 96 10.527 -4.275 -28.028 1.00 0.00 C ATOM 1460 CE LYS A 96 10.367 -3.609 -29.386 1.00 0.00 C ATOM 1461 NZ LYS A 96 9.024 -3.869 -29.976 1.00 0.00 N ATOM 0 HA LYS A 96 9.840 -4.778 -23.765 1.00 0.00 H new ATOM 0 HB2 LYS A 96 9.558 -2.784 -25.294 1.00 0.00 H new ATOM 0 HB3 LYS A 96 10.944 -3.797 -25.644 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.618 -4.699 -27.145 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.912 -2.995 -27.428 1.00 0.00 H new ATOM 0 HD2 LYS A 96 11.471 -3.965 -27.579 1.00 0.00 H new ATOM 0 HD3 LYS A 96 10.574 -5.357 -28.155 1.00 0.00 H new ATOM 0 HE2 LYS A 96 10.517 -2.534 -29.283 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.138 -3.975 -30.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 9.026 -3.594 -30.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 8.799 -4.881 -29.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 8.307 -3.314 -29.466 1.00 0.00 H new ATOM 1475 N ILE A 97 7.457 -4.508 -23.186 1.00 0.00 N ATOM 1476 CA ILE A 97 6.068 -4.276 -22.807 1.00 0.00 C ATOM 1477 C ILE A 97 5.679 -2.816 -23.011 1.00 0.00 C ATOM 1478 O ILE A 97 6.530 -1.927 -22.993 1.00 0.00 O ATOM 1479 CB ILE A 97 5.813 -4.664 -21.339 1.00 0.00 C ATOM 1480 CG1 ILE A 97 6.456 -6.016 -21.026 1.00 0.00 C ATOM 1481 CG2 ILE A 97 4.319 -4.703 -21.054 1.00 0.00 C ATOM 1482 CD1 ILE A 97 5.933 -7.147 -21.883 1.00 0.00 C ATOM 0 H ILE A 97 8.100 -4.593 -22.399 1.00 0.00 H new ATOM 0 HA ILE A 97 5.455 -4.906 -23.452 1.00 0.00 H new ATOM 0 HB ILE A 97 6.267 -3.910 -20.695 1.00 0.00 H new ATOM 0 HG12 ILE A 97 7.535 -5.936 -21.162 1.00 0.00 H new ATOM 0 HG13 ILE A 97 6.284 -6.257 -19.977 1.00 0.00 H new ATOM 0 HG21 ILE A 97 4.154 -4.979 -20.012 1.00 0.00 H new ATOM 0 HG22 ILE A 97 3.887 -3.720 -21.242 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.844 -5.438 -21.703 1.00 0.00 H new ATOM 0 HD11 ILE A 97 6.433 -8.075 -21.606 1.00 0.00 H new ATOM 0 HD12 ILE A 97 4.859 -7.254 -21.729 1.00 0.00 H new ATOM 0 HD13 ILE A 97 6.129 -6.929 -22.933 1.00 0.00 H new ATOM 1494 N GLY A 98 4.386 -2.575 -23.203 1.00 0.00 N ATOM 1495 CA GLY A 98 3.906 -1.220 -23.406 1.00 0.00 C ATOM 1496 C GLY A 98 2.527 -1.000 -22.816 1.00 0.00 C ATOM 1497 O GLY A 98 1.606 -0.579 -23.515 1.00 0.00 O ATOM 0 H GLY A 98 3.662 -3.293 -23.222 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.607 -0.518 -22.955 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.880 -1.003 -24.474 1.00 0.00 H new ATOM 1501 N ALA A 99 2.383 -1.287 -21.527 1.00 0.00 N ATOM 1502 CA ALA A 99 1.107 -1.117 -20.844 1.00 0.00 C ATOM 1503 C ALA A 99 -0.017 -1.818 -21.598 1.00 0.00 C ATOM 1504 O ALA A 99 -1.175 -1.407 -21.527 1.00 0.00 O ATOM 1505 CB ALA A 99 0.790 0.362 -20.676 1.00 0.00 C ATOM 0 H ALA A 99 3.135 -1.639 -20.934 1.00 0.00 H new ATOM 0 HA ALA A 99 1.188 -1.574 -19.858 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.166 0.473 -20.164 1.00 0.00 H new ATOM 0 HB2 ALA A 99 1.574 0.838 -20.087 1.00 0.00 H new ATOM 0 HB3 ALA A 99 0.734 0.836 -21.656 1.00 0.00 H new ATOM 1511 N GLU A 100 0.332 -2.878 -22.321 1.00 0.00 N ATOM 1512 CA GLU A 100 -0.648 -3.635 -23.090 1.00 0.00 C ATOM 1513 C GLU A 100 -0.425 -5.136 -22.930 1.00 0.00 C ATOM 1514 O GLU A 100 -1.377 -5.913 -22.870 1.00 0.00 O ATOM 1515 CB GLU A 100 -0.575 -3.252 -24.569 1.00 0.00 C ATOM 1516 CG GLU A 100 -1.136 -1.873 -24.870 1.00 0.00 C ATOM 1517 CD GLU A 100 -0.493 -1.233 -26.085 1.00 0.00 C ATOM 1518 OE1 GLU A 100 -0.693 -1.751 -27.204 1.00 0.00 O ATOM 1519 OE2 GLU A 100 0.210 -0.215 -25.917 1.00 0.00 O ATOM 0 H GLU A 100 1.286 -3.232 -22.390 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.639 -3.390 -22.707 1.00 0.00 H new ATOM 0 HB2 GLU A 100 0.465 -3.291 -24.895 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -1.120 -3.992 -25.154 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -2.211 -1.950 -25.031 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -0.989 -1.228 -24.004 1.00 0.00 H new ATOM 1526 N GLU A 101 0.841 -5.536 -22.861 1.00 0.00 N ATOM 1527 CA GLU A 101 1.190 -6.943 -22.709 1.00 0.00 C ATOM 1528 C GLU A 101 0.953 -7.411 -21.276 1.00 0.00 C ATOM 1529 O GLU A 101 0.197 -8.353 -21.036 1.00 0.00 O ATOM 1530 CB GLU A 101 2.652 -7.174 -23.097 1.00 0.00 C ATOM 1531 CG GLU A 101 3.067 -6.448 -24.366 1.00 0.00 C ATOM 1532 CD GLU A 101 2.072 -6.632 -25.495 1.00 0.00 C ATOM 1533 OE1 GLU A 101 1.427 -7.700 -25.551 1.00 0.00 O ATOM 1534 OE2 GLU A 101 1.938 -5.707 -26.324 1.00 0.00 O ATOM 0 H GLU A 101 1.641 -4.905 -22.908 1.00 0.00 H new ATOM 0 HA GLU A 101 0.549 -7.523 -23.373 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.292 -6.849 -22.277 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.820 -8.243 -23.229 1.00 0.00 H new ATOM 0 HG2 GLU A 101 3.176 -5.385 -24.153 1.00 0.00 H new ATOM 0 HG3 GLU A 101 4.044 -6.811 -24.685 1.00 0.00 H new ATOM 1541 N PHE A 102 1.605 -6.747 -20.327 1.00 0.00 N ATOM 1542 CA PHE A 102 1.467 -7.095 -18.918 1.00 0.00 C ATOM 1543 C PHE A 102 -0.003 -7.136 -18.509 1.00 0.00 C ATOM 1544 O PHE A 102 -0.411 -7.978 -17.710 1.00 0.00 O ATOM 1545 CB PHE A 102 2.222 -6.089 -18.046 1.00 0.00 C ATOM 1546 CG PHE A 102 3.059 -6.732 -16.977 1.00 0.00 C ATOM 1547 CD1 PHE A 102 2.481 -7.570 -16.037 1.00 0.00 C ATOM 1548 CD2 PHE A 102 4.423 -6.499 -16.913 1.00 0.00 C ATOM 1549 CE1 PHE A 102 3.248 -8.164 -15.052 1.00 0.00 C ATOM 1550 CE2 PHE A 102 5.195 -7.090 -15.931 1.00 0.00 C ATOM 1551 CZ PHE A 102 4.607 -7.922 -14.999 1.00 0.00 C ATOM 0 H PHE A 102 2.234 -5.965 -20.508 1.00 0.00 H new ATOM 0 HA PHE A 102 1.895 -8.087 -18.771 1.00 0.00 H new ATOM 0 HB2 PHE A 102 2.864 -5.479 -18.682 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.504 -5.415 -17.578 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.419 -7.761 -16.074 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.888 -5.848 -17.639 1.00 0.00 H new ATOM 0 HE1 PHE A 102 2.786 -8.816 -14.326 1.00 0.00 H new ATOM 0 HE2 PHE A 102 6.258 -6.901 -15.893 1.00 0.00 H new ATOM 0 HZ PHE A 102 5.209 -8.383 -14.230 1.00 0.00 H new ATOM 1561 N GLN A 103 -0.791 -6.220 -19.063 1.00 0.00 N ATOM 1562 CA GLN A 103 -2.214 -6.151 -18.756 1.00 0.00 C ATOM 1563 C GLN A 103 -2.973 -7.289 -19.430 1.00 0.00 C ATOM 1564 O GLN A 103 -3.602 -8.109 -18.763 1.00 0.00 O ATOM 1565 CB GLN A 103 -2.789 -4.805 -19.200 1.00 0.00 C ATOM 1566 CG GLN A 103 -2.503 -3.671 -18.229 1.00 0.00 C ATOM 1567 CD GLN A 103 -1.019 -3.438 -18.025 1.00 0.00 C ATOM 1568 OE1 GLN A 103 -0.550 -3.301 -16.894 1.00 0.00 O ATOM 1569 NE2 GLN A 103 -0.271 -3.391 -19.121 1.00 0.00 N ATOM 0 H GLN A 103 -0.468 -5.516 -19.726 1.00 0.00 H new ATOM 0 HA GLN A 103 -2.332 -6.250 -17.677 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -2.378 -4.548 -20.176 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -3.868 -4.903 -19.324 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -2.963 -2.755 -18.600 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -2.967 -3.894 -17.268 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -0.702 -3.510 -20.038 1.00 0.00 H new ATOM 0 HE22 GLN A 103 0.734 -3.236 -19.046 1.00 0.00 H new ATOM 1578 N GLU A 104 -2.909 -7.331 -20.757 1.00 0.00 N ATOM 1579 CA GLU A 104 -3.592 -8.368 -21.522 1.00 0.00 C ATOM 1580 C GLU A 104 -3.232 -9.756 -20.999 1.00 0.00 C ATOM 1581 O GLU A 104 -4.026 -10.692 -21.093 1.00 0.00 O ATOM 1582 CB GLU A 104 -3.231 -8.261 -23.005 1.00 0.00 C ATOM 1583 CG GLU A 104 -3.931 -7.118 -23.720 1.00 0.00 C ATOM 1584 CD GLU A 104 -3.499 -6.984 -25.168 1.00 0.00 C ATOM 1585 OE1 GLU A 104 -2.307 -7.220 -25.457 1.00 0.00 O ATOM 1586 OE2 GLU A 104 -4.354 -6.644 -26.012 1.00 0.00 O ATOM 0 H GLU A 104 -2.392 -6.660 -21.324 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.666 -8.221 -21.405 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -2.153 -8.132 -23.100 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -3.484 -9.198 -23.501 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -5.009 -7.275 -23.679 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -3.724 -6.185 -23.195 1.00 0.00 H new ATOM 1593 N MET A 105 -2.029 -9.880 -20.447 1.00 0.00 N ATOM 1594 CA MET A 105 -1.563 -11.153 -19.909 1.00 0.00 C ATOM 1595 C MET A 105 -2.403 -11.574 -18.707 1.00 0.00 C ATOM 1596 O MET A 105 -3.162 -12.540 -18.775 1.00 0.00 O ATOM 1597 CB MET A 105 -0.090 -11.053 -19.507 1.00 0.00 C ATOM 1598 CG MET A 105 0.458 -12.327 -18.885 1.00 0.00 C ATOM 1599 SD MET A 105 1.924 -12.033 -17.877 1.00 0.00 S ATOM 1600 CE MET A 105 3.067 -11.421 -19.112 1.00 0.00 C ATOM 0 H MET A 105 -1.360 -9.115 -20.361 1.00 0.00 H new ATOM 0 HA MET A 105 -1.669 -11.909 -20.687 1.00 0.00 H new ATOM 0 HB2 MET A 105 0.502 -10.804 -20.388 1.00 0.00 H new ATOM 0 HB3 MET A 105 0.030 -10.232 -18.800 1.00 0.00 H new ATOM 0 HG2 MET A 105 -0.315 -12.788 -18.270 1.00 0.00 H new ATOM 0 HG3 MET A 105 0.702 -13.037 -19.675 1.00 0.00 H new ATOM 0 HE1 MET A 105 4.018 -11.177 -18.638 1.00 0.00 H new ATOM 0 HE2 MET A 105 3.226 -12.186 -19.872 1.00 0.00 H new ATOM 0 HE3 MET A 105 2.654 -10.527 -19.579 1.00 0.00 H new ATOM 1610 N VAL A 106 -2.261 -10.842 -17.606 1.00 0.00 N ATOM 1611 CA VAL A 106 -3.007 -11.140 -16.389 1.00 0.00 C ATOM 1612 C VAL A 106 -4.510 -11.105 -16.643 1.00 0.00 C ATOM 1613 O VAL A 106 -5.262 -11.901 -16.081 1.00 0.00 O ATOM 1614 CB VAL A 106 -2.665 -10.145 -15.264 1.00 0.00 C ATOM 1615 CG1 VAL A 106 -3.284 -10.593 -13.948 1.00 0.00 C ATOM 1616 CG2 VAL A 106 -1.157 -9.992 -15.128 1.00 0.00 C ATOM 0 H VAL A 106 -1.637 -10.039 -17.532 1.00 0.00 H new ATOM 0 HA VAL A 106 -2.717 -12.144 -16.078 1.00 0.00 H new ATOM 0 HB VAL A 106 -3.084 -9.173 -15.523 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -3.032 -9.878 -13.165 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -4.367 -10.646 -14.055 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -2.897 -11.576 -13.680 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -0.934 -9.285 -14.329 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -0.713 -10.959 -14.892 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -0.743 -9.622 -16.066 1.00 0.00 H new ATOM 1626 N GLN A 107 -4.939 -10.179 -17.494 1.00 0.00 N ATOM 1627 CA GLN A 107 -6.353 -10.041 -17.822 1.00 0.00 C ATOM 1628 C GLN A 107 -6.917 -11.351 -18.362 1.00 0.00 C ATOM 1629 O GLN A 107 -8.091 -11.662 -18.164 1.00 0.00 O ATOM 1630 CB GLN A 107 -6.553 -8.925 -18.849 1.00 0.00 C ATOM 1631 CG GLN A 107 -6.546 -7.531 -18.241 1.00 0.00 C ATOM 1632 CD GLN A 107 -7.523 -7.391 -17.090 1.00 0.00 C ATOM 1633 OE1 GLN A 107 -8.705 -7.112 -17.293 1.00 0.00 O ATOM 1634 NE2 GLN A 107 -7.033 -7.585 -15.871 1.00 0.00 N ATOM 0 H GLN A 107 -4.329 -9.514 -17.968 1.00 0.00 H new ATOM 0 HA GLN A 107 -6.889 -9.785 -16.908 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -5.766 -8.989 -19.601 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -7.500 -9.083 -19.365 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -5.541 -7.297 -17.890 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -6.792 -6.801 -19.012 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -6.047 -7.815 -15.748 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -7.643 -7.504 -15.057 1.00 0.00 H new ATOM 1643 N SER A 108 -6.072 -12.116 -19.046 1.00 0.00 N ATOM 1644 CA SER A 108 -6.487 -13.391 -19.619 1.00 0.00 C ATOM 1645 C SER A 108 -7.680 -13.206 -20.551 1.00 0.00 C ATOM 1646 O SER A 108 -8.502 -14.107 -20.711 1.00 0.00 O ATOM 1647 CB SER A 108 -6.842 -14.382 -18.508 1.00 0.00 C ATOM 1648 OG SER A 108 -7.031 -15.686 -19.029 1.00 0.00 O ATOM 0 H SER A 108 -5.096 -11.875 -19.217 1.00 0.00 H new ATOM 0 HA SER A 108 -5.654 -13.789 -20.199 1.00 0.00 H new ATOM 0 HB2 SER A 108 -6.047 -14.397 -17.762 1.00 0.00 H new ATOM 0 HB3 SER A 108 -7.750 -14.055 -18.001 1.00 0.00 H new ATOM 0 HG SER A 108 -7.616 -15.643 -19.814 1.00 0.00 H new