USER MOD reduce.3.24.130724 H: found=0, std=0, add=1095, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1093 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HD1:sc= -4.46! C(o=-4.5!,f=-17!) USER MOD Single : A 20 LYS NZ :NH3+ 150:sc= -0.0286 (180deg=-0.586) USER MOD Single : A 23 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0279) USER MOD Single : A 30 SER OG : rot 48:sc= 0.295 USER MOD Single : A 33 HIS : no HD1:sc= -2.45 K(o=-2.4,f=-7.7!) USER MOD Single : A 36 ASN : amide:sc= -3.12! C(o=-3.1!,f=-3.9!) USER MOD Single : A 37 THR OG1 : rot -160:sc= -0.465 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0.0274 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.661 F(o=-1.9!,f=-0.66) USER MOD Single : B 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 13 TYR OH : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 HIS : no HD1:sc= -4.31! C(o=-4.3!,f=-17!) USER MOD Single : B 20 LYS NZ :NH3+ 155:sc= -0.0186 (180deg=-0.471) USER MOD Single : B 23 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.022) USER MOD Single : B 30 SER OG : rot 51:sc= 0.312 USER MOD Single : B 33 HIS : no HD1:sc= -2.48 K(o=-2.5,f=-7.8!) USER MOD Single : B 36 ASN : amide:sc= -3.14! C(o=-3.1!,f=-3.8!) USER MOD Single : B 37 THR OG1 : rot -160:sc= -0.457 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 SER OG : rot 180:sc= 0.0285 USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 ASN :FLIP amide:sc= -0.725 F(o=-1.9!,f=-0.73) USER MOD Single : B 72 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 93 N CYS A 7 14.912 1.552 1.605 1.00 0.00 N ATOM 94 CA CYS A 7 13.540 1.005 1.833 1.00 0.00 C ATOM 95 C CYS A 7 12.853 0.721 0.491 1.00 0.00 C ATOM 96 O CYS A 7 13.162 1.341 -0.507 1.00 0.00 O ATOM 97 CB CYS A 7 12.722 2.029 2.618 1.00 0.00 C ATOM 98 SG CYS A 7 13.072 2.191 4.387 1.00 0.00 S ATOM 0 HA CYS A 7 13.611 0.074 2.395 1.00 0.00 H new ATOM 0 HB2 CYS A 7 12.868 3.005 2.154 1.00 0.00 H new ATOM 0 HB3 CYS A 7 11.668 1.777 2.504 1.00 0.00 H new ATOM 103 N GLN A 8 11.930 -0.211 0.492 1.00 0.00 N ATOM 104 CA GLN A 8 11.219 -0.529 -0.787 1.00 0.00 C ATOM 105 C GLN A 8 10.411 0.681 -1.268 1.00 0.00 C ATOM 106 O GLN A 8 10.199 0.849 -2.453 1.00 0.00 O ATOM 107 CB GLN A 8 10.271 -1.710 -0.564 1.00 0.00 C ATOM 108 CG GLN A 8 11.060 -3.020 -0.633 1.00 0.00 C ATOM 109 CD GLN A 8 10.949 -3.601 -2.044 1.00 0.00 C ATOM 110 OE1 GLN A 8 11.776 -3.350 -2.898 1.00 0.00 O ATOM 111 NE2 GLN A 8 9.944 -4.383 -2.329 1.00 0.00 N ATOM 0 H GLN A 8 11.642 -0.756 1.305 1.00 0.00 H new ATOM 0 HA GLN A 8 11.961 -0.783 -1.544 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.782 -1.619 0.406 1.00 0.00 H new ATOM 0 HB3 GLN A 8 9.485 -1.707 -1.319 1.00 0.00 H new ATOM 0 HG2 GLN A 8 12.106 -2.842 -0.381 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.673 -3.731 0.097 1.00 0.00 H new ATOM 0 HE21 GLN A 8 9.247 -4.597 -1.616 1.00 0.00 H new ATOM 0 HE22 GLN A 8 9.856 -4.780 -3.264 1.00 0.00 H new ATOM 120 N CYS A 9 9.980 1.498 -0.338 1.00 0.00 N ATOM 121 CA CYS A 9 9.178 2.703 -0.723 1.00 0.00 C ATOM 122 C CYS A 9 9.770 3.968 -0.096 1.00 0.00 C ATOM 123 O CYS A 9 9.851 4.088 1.111 1.00 0.00 O ATOM 124 CB CYS A 9 7.744 2.523 -0.233 1.00 0.00 C ATOM 125 SG CYS A 9 6.717 1.311 -1.097 1.00 0.00 S ATOM 0 H CYS A 9 10.146 1.385 0.662 1.00 0.00 H new ATOM 0 HA CYS A 9 9.197 2.809 -1.808 1.00 0.00 H new ATOM 0 HB2 CYS A 9 7.780 2.245 0.820 1.00 0.00 H new ATOM 0 HB3 CYS A 9 7.244 3.490 -0.290 1.00 0.00 H new ATOM 130 N ILE A 10 10.173 4.886 -0.934 1.00 0.00 N ATOM 131 CA ILE A 10 10.752 6.157 -0.410 1.00 0.00 C ATOM 132 C ILE A 10 9.669 7.241 -0.381 1.00 0.00 C ATOM 133 O ILE A 10 9.494 7.922 0.610 1.00 0.00 O ATOM 134 CB ILE A 10 11.898 6.603 -1.321 1.00 0.00 C ATOM 135 CG1 ILE A 10 12.994 5.533 -1.311 1.00 0.00 C ATOM 136 CG2 ILE A 10 12.473 7.920 -0.800 1.00 0.00 C ATOM 137 CD1 ILE A 10 13.407 5.222 -2.751 1.00 0.00 C ATOM 0 H ILE A 10 10.127 4.812 -1.950 1.00 0.00 H new ATOM 0 HA ILE A 10 11.129 5.997 0.600 1.00 0.00 H new ATOM 0 HB ILE A 10 11.528 6.741 -2.337 1.00 0.00 H new ATOM 0 HG12 ILE A 10 13.855 5.882 -0.741 1.00 0.00 H new ATOM 0 HG13 ILE A 10 12.632 4.629 -0.821 1.00 0.00 H new ATOM 0 HG21 ILE A 10 13.290 8.241 -1.446 1.00 0.00 H new ATOM 0 HG22 ILE A 10 11.693 8.681 -0.796 1.00 0.00 H new ATOM 0 HG23 ILE A 10 12.847 7.778 0.214 1.00 0.00 H new ATOM 0 HD11 ILE A 10 14.187 4.461 -2.749 1.00 0.00 H new ATOM 0 HD12 ILE A 10 12.543 4.856 -3.306 1.00 0.00 H new ATOM 0 HD13 ILE A 10 13.785 6.128 -3.225 1.00 0.00 H new ATOM 149 N LYS A 11 8.964 7.371 -1.475 1.00 0.00 N ATOM 150 CA LYS A 11 7.879 8.395 -1.539 1.00 0.00 C ATOM 151 C LYS A 11 6.515 7.724 -1.329 1.00 0.00 C ATOM 152 O LYS A 11 6.417 6.513 -1.318 1.00 0.00 O ATOM 153 CB LYS A 11 7.911 9.069 -2.912 1.00 0.00 C ATOM 154 CG LYS A 11 9.195 9.893 -3.037 1.00 0.00 C ATOM 155 CD LYS A 11 8.832 11.378 -3.108 1.00 0.00 C ATOM 156 CE LYS A 11 10.114 12.213 -3.051 1.00 0.00 C ATOM 157 NZ LYS A 11 9.802 13.662 -3.204 1.00 0.00 N ATOM 0 H LYS A 11 9.091 6.816 -2.322 1.00 0.00 H new ATOM 0 HA LYS A 11 8.033 9.139 -0.757 1.00 0.00 H new ATOM 0 HB2 LYS A 11 7.868 8.318 -3.701 1.00 0.00 H new ATOM 0 HB3 LYS A 11 7.039 9.711 -3.036 1.00 0.00 H new ATOM 0 HG2 LYS A 11 9.847 9.706 -2.184 1.00 0.00 H new ATOM 0 HG3 LYS A 11 9.746 9.597 -3.930 1.00 0.00 H new ATOM 0 HD2 LYS A 11 8.288 11.588 -4.029 1.00 0.00 H new ATOM 0 HD3 LYS A 11 8.174 11.644 -2.281 1.00 0.00 H new ATOM 0 HE2 LYS A 11 10.623 12.043 -2.102 1.00 0.00 H new ATOM 0 HE3 LYS A 11 10.796 11.897 -3.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 10.683 14.213 -3.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 9.336 13.822 -4.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 9.169 13.964 -2.436 1.00 0.00 H new ATOM 171 N THR A 12 5.493 8.527 -1.167 1.00 0.00 N ATOM 172 CA THR A 12 4.127 7.952 -0.955 1.00 0.00 C ATOM 173 C THR A 12 3.093 8.704 -1.801 1.00 0.00 C ATOM 174 O THR A 12 3.419 9.648 -2.493 1.00 0.00 O ATOM 175 CB THR A 12 3.757 8.069 0.527 1.00 0.00 C ATOM 176 OG1 THR A 12 4.117 9.399 0.888 1.00 0.00 O ATOM 177 CG2 THR A 12 4.630 7.164 1.396 1.00 0.00 C ATOM 0 H THR A 12 5.543 9.546 -1.172 1.00 0.00 H new ATOM 0 HA THR A 12 4.131 6.905 -1.257 1.00 0.00 H new ATOM 0 HB THR A 12 2.708 7.808 0.670 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.906 9.550 1.833 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.340 7.273 2.441 1.00 0.00 H new ATOM 0 HG22 THR A 12 4.498 6.127 1.089 1.00 0.00 H new ATOM 0 HG23 THR A 12 5.676 7.446 1.279 1.00 0.00 H new ATOM 185 N TYR A 13 1.866 8.265 -1.724 1.00 0.00 N ATOM 186 CA TYR A 13 0.790 8.932 -2.517 1.00 0.00 C ATOM 187 C TYR A 13 0.162 10.071 -1.701 1.00 0.00 C ATOM 188 O TYR A 13 -0.013 9.951 -0.504 1.00 0.00 O ATOM 189 CB TYR A 13 -0.282 7.895 -2.858 1.00 0.00 C ATOM 190 CG TYR A 13 -0.720 8.060 -4.317 1.00 0.00 C ATOM 191 CD1 TYR A 13 0.185 7.883 -5.343 1.00 0.00 C ATOM 192 CD2 TYR A 13 -2.026 8.384 -4.627 1.00 0.00 C ATOM 193 CE1 TYR A 13 -0.209 8.029 -6.659 1.00 0.00 C ATOM 194 CE2 TYR A 13 -2.419 8.530 -5.942 1.00 0.00 C ATOM 195 CZ TYR A 13 -1.514 8.353 -6.968 1.00 0.00 C ATOM 196 OH TYR A 13 -1.909 8.497 -8.282 1.00 0.00 O ATOM 0 H TYR A 13 1.562 7.478 -1.150 1.00 0.00 H new ATOM 0 HA TYR A 13 1.214 9.348 -3.431 1.00 0.00 H new ATOM 0 HB2 TYR A 13 0.108 6.890 -2.697 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -1.140 8.014 -2.196 1.00 0.00 H new ATOM 0 HD1 TYR A 13 1.210 7.628 -5.116 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.746 8.524 -3.834 1.00 0.00 H new ATOM 0 HE1 TYR A 13 0.510 7.888 -7.452 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -3.444 8.785 -6.170 1.00 0.00 H new ATOM 0 HH TYR A 13 -2.862 8.725 -8.314 1.00 0.00 H new ATOM 206 N SER A 14 -0.160 11.151 -2.373 1.00 0.00 N ATOM 207 CA SER A 14 -0.782 12.317 -1.663 1.00 0.00 C ATOM 208 C SER A 14 -2.143 12.647 -2.284 1.00 0.00 C ATOM 209 O SER A 14 -2.531 13.795 -2.367 1.00 0.00 O ATOM 210 CB SER A 14 0.142 13.527 -1.789 1.00 0.00 C ATOM 211 OG SER A 14 0.356 13.659 -3.186 1.00 0.00 O ATOM 0 H SER A 14 -0.021 11.276 -3.376 1.00 0.00 H new ATOM 0 HA SER A 14 -0.925 12.065 -0.612 1.00 0.00 H new ATOM 0 HB2 SER A 14 -0.316 14.423 -1.370 1.00 0.00 H new ATOM 0 HB3 SER A 14 1.080 13.369 -1.256 1.00 0.00 H new ATOM 0 HG SER A 14 0.945 14.424 -3.356 1.00 0.00 H new ATOM 217 N LYS A 15 -2.838 11.627 -2.706 1.00 0.00 N ATOM 218 CA LYS A 15 -4.178 11.848 -3.325 1.00 0.00 C ATOM 219 C LYS A 15 -5.132 10.686 -2.926 1.00 0.00 C ATOM 220 O LYS A 15 -5.042 9.615 -3.485 1.00 0.00 O ATOM 221 CB LYS A 15 -4.013 11.855 -4.845 1.00 0.00 C ATOM 222 CG LYS A 15 -5.174 12.629 -5.472 1.00 0.00 C ATOM 223 CD LYS A 15 -5.457 12.064 -6.866 1.00 0.00 C ATOM 224 CE LYS A 15 -6.512 12.932 -7.555 1.00 0.00 C ATOM 225 NZ LYS A 15 -5.880 14.134 -8.168 1.00 0.00 N ATOM 0 H LYS A 15 -2.539 10.653 -2.650 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.595 12.795 -2.982 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -3.063 12.315 -5.118 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.993 10.834 -5.226 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -6.062 12.547 -4.846 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -4.927 13.689 -5.539 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -4.541 12.046 -7.457 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -5.808 11.035 -6.790 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -7.024 12.352 -8.323 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -7.267 13.240 -6.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -6.610 14.712 -8.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -5.412 14.695 -7.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -5.176 13.835 -8.873 1.00 0.00 H new ATOM 239 N PRO A 16 -6.035 10.912 -1.966 1.00 0.00 N ATOM 240 CA PRO A 16 -6.950 9.846 -1.523 1.00 0.00 C ATOM 241 C PRO A 16 -7.801 9.309 -2.683 1.00 0.00 C ATOM 242 O PRO A 16 -8.397 10.067 -3.424 1.00 0.00 O ATOM 243 CB PRO A 16 -7.838 10.491 -0.452 1.00 0.00 C ATOM 244 CG PRO A 16 -7.298 11.931 -0.208 1.00 0.00 C ATOM 245 CD PRO A 16 -6.218 12.202 -1.270 1.00 0.00 C ATOM 0 HA PRO A 16 -6.398 8.989 -1.137 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -8.877 10.521 -0.781 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -7.812 9.910 0.470 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -8.104 12.661 -0.284 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -6.881 12.020 0.795 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -6.532 12.983 -1.962 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -5.288 12.538 -0.811 1.00 0.00 H new ATOM 253 N PHE A 17 -7.829 8.000 -2.807 1.00 0.00 N ATOM 254 CA PHE A 17 -8.635 7.364 -3.899 1.00 0.00 C ATOM 255 C PHE A 17 -9.676 6.411 -3.291 1.00 0.00 C ATOM 256 O PHE A 17 -9.953 6.472 -2.114 1.00 0.00 O ATOM 257 CB PHE A 17 -7.699 6.589 -4.834 1.00 0.00 C ATOM 258 CG PHE A 17 -6.719 5.755 -4.007 1.00 0.00 C ATOM 259 CD1 PHE A 17 -5.523 6.302 -3.576 1.00 0.00 C ATOM 260 CD2 PHE A 17 -7.013 4.444 -3.679 1.00 0.00 C ATOM 261 CE1 PHE A 17 -4.640 5.550 -2.831 1.00 0.00 C ATOM 262 CE2 PHE A 17 -6.128 3.697 -2.934 1.00 0.00 C ATOM 263 CZ PHE A 17 -4.944 4.249 -2.510 1.00 0.00 C ATOM 0 H PHE A 17 -7.330 7.348 -2.201 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.154 8.137 -4.466 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.280 5.941 -5.490 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -7.152 7.282 -5.473 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -5.280 7.324 -3.825 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -7.942 4.003 -4.009 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -3.708 5.984 -2.499 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.366 2.674 -2.682 1.00 0.00 H new ATOM 0 HZ PHE A 17 -4.252 3.661 -1.925 1.00 0.00 H new ATOM 273 N HIS A 18 -10.230 5.560 -4.114 1.00 0.00 N ATOM 274 CA HIS A 18 -11.267 4.592 -3.613 1.00 0.00 C ATOM 275 C HIS A 18 -10.739 3.133 -3.745 1.00 0.00 C ATOM 276 O HIS A 18 -10.082 2.816 -4.717 1.00 0.00 O ATOM 277 CB HIS A 18 -12.510 4.756 -4.502 1.00 0.00 C ATOM 278 CG HIS A 18 -13.720 4.109 -3.841 1.00 0.00 C ATOM 279 ND1 HIS A 18 -13.992 2.814 -3.870 1.00 0.00 N ATOM 280 CD2 HIS A 18 -14.738 4.702 -3.102 1.00 0.00 C ATOM 281 CE1 HIS A 18 -15.089 2.614 -3.206 1.00 0.00 C ATOM 282 NE2 HIS A 18 -15.523 3.730 -2.757 1.00 0.00 N ATOM 0 H HIS A 18 -10.015 5.488 -5.108 1.00 0.00 H new ATOM 0 HA HIS A 18 -11.498 4.788 -2.566 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -12.704 5.814 -4.676 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -12.332 4.300 -5.476 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -14.851 5.750 -2.866 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -15.562 1.655 -3.056 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -16.372 3.840 -2.202 1.00 0.00 H new ATOM 290 N PRO A 19 -11.027 2.259 -2.767 1.00 0.00 N ATOM 291 CA PRO A 19 -10.572 0.866 -2.856 1.00 0.00 C ATOM 292 C PRO A 19 -11.177 0.214 -4.097 1.00 0.00 C ATOM 293 O PRO A 19 -10.708 -0.800 -4.574 1.00 0.00 O ATOM 294 CB PRO A 19 -11.091 0.181 -1.589 1.00 0.00 C ATOM 295 CG PRO A 19 -11.927 1.232 -0.805 1.00 0.00 C ATOM 296 CD PRO A 19 -11.802 2.571 -1.547 1.00 0.00 C ATOM 0 HA PRO A 19 -9.488 0.789 -2.934 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -11.703 -0.685 -1.843 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -10.262 -0.182 -0.981 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -12.971 0.924 -0.745 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -11.563 1.325 0.218 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -12.782 2.978 -1.795 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -11.293 3.316 -0.935 1.00 0.00 H new ATOM 304 N LYS A 20 -12.218 0.828 -4.585 1.00 0.00 N ATOM 305 CA LYS A 20 -12.897 0.305 -5.801 1.00 0.00 C ATOM 306 C LYS A 20 -11.873 0.097 -6.922 1.00 0.00 C ATOM 307 O LYS A 20 -12.174 -0.490 -7.943 1.00 0.00 O ATOM 308 CB LYS A 20 -13.946 1.327 -6.219 1.00 0.00 C ATOM 309 CG LYS A 20 -14.437 1.052 -7.639 1.00 0.00 C ATOM 310 CD LYS A 20 -15.667 1.926 -7.901 1.00 0.00 C ATOM 311 CE LYS A 20 -15.532 2.590 -9.272 1.00 0.00 C ATOM 312 NZ LYS A 20 -15.300 1.566 -10.330 1.00 0.00 N ATOM 0 H LYS A 20 -12.629 1.674 -4.191 1.00 0.00 H new ATOM 0 HA LYS A 20 -13.369 -0.656 -5.597 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -14.787 1.295 -5.526 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -13.525 2.331 -6.163 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.652 1.275 -8.362 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -14.688 -0.002 -7.756 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -16.572 1.320 -7.865 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -15.760 2.685 -7.124 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -16.435 3.156 -9.498 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.705 3.300 -9.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -15.699 1.900 -11.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -14.278 1.408 -10.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.760 0.674 -10.057 1.00 0.00 H new ATOM 326 N PHE A 21 -10.684 0.588 -6.695 1.00 0.00 N ATOM 327 CA PHE A 21 -9.604 0.440 -7.716 1.00 0.00 C ATOM 328 C PHE A 21 -8.550 -0.558 -7.223 1.00 0.00 C ATOM 329 O PHE A 21 -7.807 -1.125 -8.002 1.00 0.00 O ATOM 330 CB PHE A 21 -8.942 1.801 -7.922 1.00 0.00 C ATOM 331 CG PHE A 21 -9.896 2.721 -8.684 1.00 0.00 C ATOM 332 CD1 PHE A 21 -9.989 2.656 -10.063 1.00 0.00 C ATOM 333 CD2 PHE A 21 -10.679 3.633 -8.001 1.00 0.00 C ATOM 334 CE1 PHE A 21 -10.852 3.490 -10.745 1.00 0.00 C ATOM 335 CE2 PHE A 21 -11.541 4.465 -8.684 1.00 0.00 C ATOM 336 CZ PHE A 21 -11.627 4.393 -10.054 1.00 0.00 C ATOM 0 H PHE A 21 -10.413 1.085 -5.847 1.00 0.00 H new ATOM 0 HA PHE A 21 -10.031 0.076 -8.650 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -8.686 2.242 -6.959 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -8.011 1.684 -8.477 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -9.383 1.948 -10.609 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -10.615 3.694 -6.925 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -10.919 3.434 -11.821 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -12.149 5.174 -8.142 1.00 0.00 H new ATOM 0 HZ PHE A 21 -12.303 5.045 -10.588 1.00 0.00 H new ATOM 346 N ILE A 22 -8.515 -0.750 -5.933 1.00 0.00 N ATOM 347 CA ILE A 22 -7.512 -1.685 -5.350 1.00 0.00 C ATOM 348 C ILE A 22 -8.061 -3.109 -5.321 1.00 0.00 C ATOM 349 O ILE A 22 -9.196 -3.332 -4.946 1.00 0.00 O ATOM 350 CB ILE A 22 -7.189 -1.236 -3.924 1.00 0.00 C ATOM 351 CG1 ILE A 22 -6.254 -0.008 -3.946 1.00 0.00 C ATOM 352 CG2 ILE A 22 -6.493 -2.379 -3.185 1.00 0.00 C ATOM 353 CD1 ILE A 22 -6.748 1.028 -4.970 1.00 0.00 C ATOM 0 H ILE A 22 -9.136 -0.301 -5.259 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.611 -1.672 -5.964 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.117 -0.968 -3.418 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -6.213 0.443 -2.955 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -5.240 -0.320 -4.196 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.260 -2.066 -2.167 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.151 -3.247 -3.155 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -5.571 -2.640 -3.705 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -6.077 1.887 -4.972 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -6.765 0.579 -5.963 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -7.753 1.354 -4.702 1.00 0.00 H new ATOM 365 N LYS A 23 -7.235 -4.042 -5.722 1.00 0.00 N ATOM 366 CA LYS A 23 -7.666 -5.462 -5.723 1.00 0.00 C ATOM 367 C LYS A 23 -6.613 -6.332 -5.033 1.00 0.00 C ATOM 368 O LYS A 23 -6.868 -7.480 -4.723 1.00 0.00 O ATOM 369 CB LYS A 23 -7.861 -5.934 -7.167 1.00 0.00 C ATOM 370 CG LYS A 23 -9.074 -5.222 -7.792 1.00 0.00 C ATOM 371 CD LYS A 23 -9.774 -6.187 -8.754 1.00 0.00 C ATOM 372 CE LYS A 23 -10.866 -5.436 -9.519 1.00 0.00 C ATOM 373 NZ LYS A 23 -12.010 -5.118 -8.618 1.00 0.00 N ATOM 0 H LYS A 23 -6.283 -3.876 -6.047 1.00 0.00 H new ATOM 0 HA LYS A 23 -8.607 -5.551 -5.180 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -6.965 -5.725 -7.751 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -8.011 -7.013 -7.189 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.765 -4.899 -7.013 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -8.753 -4.326 -8.324 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -9.052 -6.611 -9.451 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -10.209 -7.019 -8.200 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -10.458 -4.516 -9.937 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -11.213 -6.041 -10.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -12.770 -4.669 -9.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -12.366 -5.995 -8.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -11.693 -4.468 -7.871 1.00 0.00 H new ATOM 387 N GLU A 24 -5.447 -5.772 -4.808 1.00 0.00 N ATOM 388 CA GLU A 24 -4.380 -6.563 -4.118 1.00 0.00 C ATOM 389 C GLU A 24 -3.638 -5.675 -3.109 1.00 0.00 C ATOM 390 O GLU A 24 -3.073 -4.661 -3.471 1.00 0.00 O ATOM 391 CB GLU A 24 -3.398 -7.102 -5.156 1.00 0.00 C ATOM 392 CG GLU A 24 -2.086 -7.473 -4.460 1.00 0.00 C ATOM 393 CD GLU A 24 -1.307 -8.454 -5.338 1.00 0.00 C ATOM 394 OE1 GLU A 24 -1.705 -8.588 -6.484 1.00 0.00 O ATOM 395 OE2 GLU A 24 -0.358 -9.013 -4.815 1.00 0.00 O ATOM 0 H GLU A 24 -5.192 -4.819 -5.067 1.00 0.00 H new ATOM 0 HA GLU A 24 -4.837 -7.396 -3.584 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -3.819 -7.975 -5.654 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -3.216 -6.352 -5.926 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -1.491 -6.578 -4.279 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -2.291 -7.921 -3.488 1.00 0.00 H new ATOM 402 N LEU A 25 -3.654 -6.078 -1.863 1.00 0.00 N ATOM 403 CA LEU A 25 -2.967 -5.263 -0.819 1.00 0.00 C ATOM 404 C LEU A 25 -1.570 -5.822 -0.540 1.00 0.00 C ATOM 405 O LEU A 25 -1.326 -7.002 -0.698 1.00 0.00 O ATOM 406 CB LEU A 25 -3.794 -5.296 0.468 1.00 0.00 C ATOM 407 CG LEU A 25 -3.360 -4.142 1.376 1.00 0.00 C ATOM 408 CD1 LEU A 25 -4.359 -2.992 1.252 1.00 0.00 C ATOM 409 CD2 LEU A 25 -3.332 -4.630 2.825 1.00 0.00 C ATOM 0 H LEU A 25 -4.108 -6.927 -1.527 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.870 -4.237 -1.175 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.855 -5.211 0.235 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.655 -6.249 0.979 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.369 -3.797 1.081 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.050 -2.170 1.898 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.391 -2.648 0.218 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.349 -3.336 1.551 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.024 -3.814 3.478 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.327 -4.970 3.114 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.626 -5.455 2.917 1.00 0.00 H new ATOM 421 N ARG A 26 -0.682 -4.960 -0.130 1.00 0.00 N ATOM 422 CA ARG A 26 0.703 -5.418 0.164 1.00 0.00 C ATOM 423 C ARG A 26 1.281 -4.645 1.352 1.00 0.00 C ATOM 424 O ARG A 26 1.152 -3.442 1.435 1.00 0.00 O ATOM 425 CB ARG A 26 1.567 -5.185 -1.062 1.00 0.00 C ATOM 426 CG ARG A 26 1.325 -6.307 -2.074 1.00 0.00 C ATOM 427 CD ARG A 26 2.225 -6.094 -3.292 1.00 0.00 C ATOM 428 NE ARG A 26 3.650 -6.118 -2.853 1.00 0.00 N ATOM 429 CZ ARG A 26 4.593 -5.935 -3.736 1.00 0.00 C ATOM 430 NH1 ARG A 26 4.536 -4.887 -4.511 1.00 0.00 N ATOM 431 NH2 ARG A 26 5.561 -6.807 -3.816 1.00 0.00 N ATOM 0 H ARG A 26 -0.854 -3.965 0.013 1.00 0.00 H new ATOM 0 HA ARG A 26 0.685 -6.478 0.415 1.00 0.00 H new ATOM 0 HB2 ARG A 26 1.330 -4.220 -1.509 1.00 0.00 H new ATOM 0 HB3 ARG A 26 2.619 -5.156 -0.779 1.00 0.00 H new ATOM 0 HG2 ARG A 26 1.534 -7.275 -1.618 1.00 0.00 H new ATOM 0 HG3 ARG A 26 0.278 -6.318 -2.379 1.00 0.00 H new ATOM 0 HD2 ARG A 26 2.046 -6.873 -4.033 1.00 0.00 H new ATOM 0 HD3 ARG A 26 1.994 -5.141 -3.769 1.00 0.00 H new ATOM 0 HE ARG A 26 3.885 -6.276 -1.873 1.00 0.00 H new ATOM 0 HH11 ARG A 26 3.763 -4.227 -4.421 1.00 0.00 H new ATOM 0 HH12 ARG A 26 5.264 -4.727 -5.207 1.00 0.00 H new ATOM 0 HH21 ARG A 26 5.572 -7.615 -3.194 1.00 0.00 H new ATOM 0 HH22 ARG A 26 6.307 -6.680 -4.500 1.00 0.00 H new ATOM 445 N VAL A 27 1.905 -5.358 2.246 1.00 0.00 N ATOM 446 CA VAL A 27 2.506 -4.690 3.437 1.00 0.00 C ATOM 447 C VAL A 27 3.878 -5.290 3.725 1.00 0.00 C ATOM 448 O VAL A 27 4.055 -6.488 3.657 1.00 0.00 O ATOM 449 CB VAL A 27 1.592 -4.899 4.642 1.00 0.00 C ATOM 450 CG1 VAL A 27 2.056 -4.006 5.798 1.00 0.00 C ATOM 451 CG2 VAL A 27 0.161 -4.518 4.257 1.00 0.00 C ATOM 0 H VAL A 27 2.026 -6.370 2.206 1.00 0.00 H new ATOM 0 HA VAL A 27 2.617 -3.624 3.241 1.00 0.00 H new ATOM 0 HB VAL A 27 1.629 -5.944 4.951 1.00 0.00 H new ATOM 0 HG11 VAL A 27 1.403 -4.156 6.658 1.00 0.00 H new ATOM 0 HG12 VAL A 27 3.079 -4.265 6.070 1.00 0.00 H new ATOM 0 HG13 VAL A 27 2.016 -2.961 5.489 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.497 -4.665 5.113 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.132 -3.472 3.952 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.173 -5.146 3.431 1.00 0.00 H new ATOM 461 N ILE A 28 4.820 -4.439 4.035 1.00 0.00 N ATOM 462 CA ILE A 28 6.201 -4.937 4.334 1.00 0.00 C ATOM 463 C ILE A 28 6.716 -4.328 5.639 1.00 0.00 C ATOM 464 O ILE A 28 6.825 -3.126 5.769 1.00 0.00 O ATOM 465 CB ILE A 28 7.126 -4.542 3.176 1.00 0.00 C ATOM 466 CG1 ILE A 28 6.610 -5.201 1.889 1.00 0.00 C ATOM 467 CG2 ILE A 28 8.560 -5.023 3.459 1.00 0.00 C ATOM 468 CD1 ILE A 28 7.451 -4.737 0.694 1.00 0.00 C ATOM 0 H ILE A 28 4.698 -3.428 4.095 1.00 0.00 H new ATOM 0 HA ILE A 28 6.181 -6.021 4.445 1.00 0.00 H new ATOM 0 HB ILE A 28 7.134 -3.458 3.067 1.00 0.00 H new ATOM 0 HG12 ILE A 28 6.659 -6.286 1.980 1.00 0.00 H new ATOM 0 HG13 ILE A 28 5.563 -4.941 1.731 1.00 0.00 H new ATOM 0 HG21 ILE A 28 9.209 -4.738 2.631 1.00 0.00 H new ATOM 0 HG22 ILE A 28 8.923 -4.565 4.379 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.565 -6.108 3.567 1.00 0.00 H new ATOM 0 HD11 ILE A 28 7.080 -5.208 -0.216 1.00 0.00 H new ATOM 0 HD12 ILE A 28 7.379 -3.654 0.597 1.00 0.00 H new ATOM 0 HD13 ILE A 28 8.492 -5.019 0.850 1.00 0.00 H new ATOM 480 N GLU A 29 7.024 -5.178 6.576 1.00 0.00 N ATOM 481 CA GLU A 29 7.541 -4.679 7.877 1.00 0.00 C ATOM 482 C GLU A 29 9.039 -4.390 7.763 1.00 0.00 C ATOM 483 O GLU A 29 9.692 -4.856 6.851 1.00 0.00 O ATOM 484 CB GLU A 29 7.304 -5.746 8.947 1.00 0.00 C ATOM 485 CG GLU A 29 8.094 -5.385 10.208 1.00 0.00 C ATOM 486 CD GLU A 29 7.567 -6.205 11.387 1.00 0.00 C ATOM 487 OE1 GLU A 29 7.038 -7.269 11.113 1.00 0.00 O ATOM 488 OE2 GLU A 29 7.726 -5.721 12.496 1.00 0.00 O ATOM 0 H GLU A 29 6.941 -6.192 6.498 1.00 0.00 H new ATOM 0 HA GLU A 29 7.022 -3.760 8.150 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.241 -5.816 9.178 1.00 0.00 H new ATOM 0 HB3 GLU A 29 7.615 -6.723 8.577 1.00 0.00 H new ATOM 0 HG2 GLU A 29 9.155 -5.585 10.056 1.00 0.00 H new ATOM 0 HG3 GLU A 29 7.998 -4.320 10.419 1.00 0.00 H new ATOM 495 N SER A 30 9.541 -3.614 8.688 1.00 0.00 N ATOM 496 CA SER A 30 11.001 -3.280 8.673 1.00 0.00 C ATOM 497 C SER A 30 11.826 -4.502 8.259 1.00 0.00 C ATOM 498 O SER A 30 11.759 -5.539 8.891 1.00 0.00 O ATOM 499 CB SER A 30 11.424 -2.846 10.074 1.00 0.00 C ATOM 500 OG SER A 30 10.820 -3.803 10.930 1.00 0.00 O ATOM 0 H SER A 30 9.008 -3.197 9.451 1.00 0.00 H new ATOM 0 HA SER A 30 11.174 -2.477 7.956 1.00 0.00 H new ATOM 0 HB2 SER A 30 12.509 -2.845 10.180 1.00 0.00 H new ATOM 0 HB3 SER A 30 11.080 -1.836 10.299 1.00 0.00 H new ATOM 0 HG SER A 30 10.993 -4.704 10.587 1.00 0.00 H new ATOM 506 N GLY A 31 12.585 -4.347 7.204 1.00 0.00 N ATOM 507 CA GLY A 31 13.430 -5.478 6.719 1.00 0.00 C ATOM 508 C GLY A 31 14.910 -5.078 6.747 1.00 0.00 C ATOM 509 O GLY A 31 15.267 -4.037 7.264 1.00 0.00 O ATOM 0 H GLY A 31 12.656 -3.488 6.659 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.270 -6.356 7.345 1.00 0.00 H new ATOM 0 HA3 GLY A 31 13.138 -5.752 5.705 1.00 0.00 H new ATOM 513 N PRO A 32 15.743 -5.923 6.181 1.00 0.00 N ATOM 514 CA PRO A 32 17.188 -5.670 6.138 1.00 0.00 C ATOM 515 C PRO A 32 17.473 -4.444 5.272 1.00 0.00 C ATOM 516 O PRO A 32 18.610 -4.057 5.085 1.00 0.00 O ATOM 517 CB PRO A 32 17.798 -6.929 5.511 1.00 0.00 C ATOM 518 CG PRO A 32 16.621 -7.899 5.180 1.00 0.00 C ATOM 519 CD PRO A 32 15.312 -7.174 5.543 1.00 0.00 C ATOM 0 HA PRO A 32 17.605 -5.471 7.125 1.00 0.00 H new ATOM 0 HB2 PRO A 32 18.354 -6.678 4.608 1.00 0.00 H new ATOM 0 HB3 PRO A 32 18.501 -7.399 6.199 1.00 0.00 H new ATOM 0 HG2 PRO A 32 16.631 -8.168 4.124 1.00 0.00 H new ATOM 0 HG3 PRO A 32 16.716 -8.826 5.746 1.00 0.00 H new ATOM 0 HD2 PRO A 32 14.708 -6.979 4.657 1.00 0.00 H new ATOM 0 HD3 PRO A 32 14.702 -7.773 6.219 1.00 0.00 H new ATOM 527 N HIS A 33 16.418 -3.865 4.766 1.00 0.00 N ATOM 528 CA HIS A 33 16.563 -2.662 3.899 1.00 0.00 C ATOM 529 C HIS A 33 15.817 -1.479 4.520 1.00 0.00 C ATOM 530 O HIS A 33 16.154 -0.336 4.283 1.00 0.00 O ATOM 531 CB HIS A 33 15.950 -2.973 2.540 1.00 0.00 C ATOM 532 CG HIS A 33 14.432 -3.076 2.701 1.00 0.00 C ATOM 533 ND1 HIS A 33 13.828 -3.766 3.616 1.00 0.00 N ATOM 534 CD2 HIS A 33 13.413 -2.471 1.965 1.00 0.00 C ATOM 535 CE1 HIS A 33 12.557 -3.643 3.515 1.00 0.00 C ATOM 536 NE2 HIS A 33 12.275 -2.857 2.515 1.00 0.00 N ATOM 0 H HIS A 33 15.458 -4.175 4.917 1.00 0.00 H new ATOM 0 HA HIS A 33 17.618 -2.407 3.797 1.00 0.00 H new ATOM 0 HB2 HIS A 33 16.202 -2.191 1.823 1.00 0.00 H new ATOM 0 HB3 HIS A 33 16.353 -3.907 2.148 1.00 0.00 H new ATOM 0 HD2 HIS A 33 13.531 -1.817 1.114 1.00 0.00 H new ATOM 0 HE1 HIS A 33 11.831 -4.117 4.159 1.00 0.00 H new ATOM 0 HE2 HIS A 33 11.340 -2.587 2.210 1.00 0.00 H new ATOM 544 N CYS A 34 14.814 -1.789 5.304 1.00 0.00 N ATOM 545 CA CYS A 34 14.009 -0.705 5.948 1.00 0.00 C ATOM 546 C CYS A 34 13.851 -0.974 7.448 1.00 0.00 C ATOM 547 O CYS A 34 13.543 -2.077 7.855 1.00 0.00 O ATOM 548 CB CYS A 34 12.628 -0.662 5.293 1.00 0.00 C ATOM 549 SG CYS A 34 11.765 0.929 5.269 1.00 0.00 S ATOM 0 H CYS A 34 14.519 -2.740 5.525 1.00 0.00 H new ATOM 0 HA CYS A 34 14.521 0.248 5.817 1.00 0.00 H new ATOM 0 HB2 CYS A 34 12.733 -1.003 4.263 1.00 0.00 H new ATOM 0 HB3 CYS A 34 11.990 -1.383 5.804 1.00 0.00 H new ATOM 554 N ALA A 35 14.067 0.044 8.237 1.00 0.00 N ATOM 555 CA ALA A 35 13.927 -0.125 9.711 1.00 0.00 C ATOM 556 C ALA A 35 12.545 0.363 10.163 1.00 0.00 C ATOM 557 O ALA A 35 12.345 0.689 11.316 1.00 0.00 O ATOM 558 CB ALA A 35 15.010 0.692 10.414 1.00 0.00 C ATOM 0 H ALA A 35 14.332 0.979 7.927 1.00 0.00 H new ATOM 0 HA ALA A 35 14.034 -1.179 9.967 1.00 0.00 H new ATOM 0 HB1 ALA A 35 14.913 0.573 11.493 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.993 0.343 10.097 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.898 1.745 10.154 1.00 0.00 H new ATOM 564 N ASN A 36 11.620 0.397 9.238 1.00 0.00 N ATOM 565 CA ASN A 36 10.241 0.867 9.582 1.00 0.00 C ATOM 566 C ASN A 36 9.194 -0.035 8.935 1.00 0.00 C ATOM 567 O ASN A 36 9.404 -1.210 8.756 1.00 0.00 O ATOM 568 CB ASN A 36 10.063 2.297 9.073 1.00 0.00 C ATOM 569 CG ASN A 36 11.221 3.162 9.577 1.00 0.00 C ATOM 570 OD1 ASN A 36 11.822 2.882 10.594 1.00 0.00 O ATOM 571 ND2 ASN A 36 11.564 4.221 8.895 1.00 0.00 N ATOM 0 H ASN A 36 11.757 0.122 8.265 1.00 0.00 H new ATOM 0 HA ASN A 36 10.111 0.833 10.664 1.00 0.00 H new ATOM 0 HB2 ASN A 36 10.035 2.306 7.983 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.113 2.703 9.420 1.00 0.00 H new ATOM 0 HD21 ASN A 36 12.333 4.808 9.217 1.00 0.00 H new ATOM 0 HD22 ASN A 36 11.063 4.461 8.040 1.00 0.00 H new ATOM 578 N THR A 37 8.084 0.542 8.614 1.00 0.00 N ATOM 579 CA THR A 37 6.994 -0.250 7.968 1.00 0.00 C ATOM 580 C THR A 37 6.348 0.561 6.843 1.00 0.00 C ATOM 581 O THR A 37 6.241 1.768 6.927 1.00 0.00 O ATOM 582 CB THR A 37 5.945 -0.606 9.014 1.00 0.00 C ATOM 583 OG1 THR A 37 6.265 -1.936 9.409 1.00 0.00 O ATOM 584 CG2 THR A 37 4.543 -0.692 8.412 1.00 0.00 C ATOM 0 H THR A 37 7.874 1.528 8.767 1.00 0.00 H new ATOM 0 HA THR A 37 7.415 -1.162 7.545 1.00 0.00 H new ATOM 0 HB THR A 37 5.949 0.142 9.807 1.00 0.00 H new ATOM 0 HG1 THR A 37 5.482 -2.351 9.827 1.00 0.00 H new ATOM 0 HG21 THR A 37 3.827 -0.948 9.193 1.00 0.00 H new ATOM 0 HG22 THR A 37 4.275 0.270 7.975 1.00 0.00 H new ATOM 0 HG23 THR A 37 4.526 -1.459 7.638 1.00 0.00 H new ATOM 592 N GLU A 38 5.930 -0.123 5.814 1.00 0.00 N ATOM 593 CA GLU A 38 5.286 0.592 4.670 1.00 0.00 C ATOM 594 C GLU A 38 4.137 -0.245 4.095 1.00 0.00 C ATOM 595 O GLU A 38 4.314 -1.400 3.760 1.00 0.00 O ATOM 596 CB GLU A 38 6.332 0.838 3.582 1.00 0.00 C ATOM 597 CG GLU A 38 7.254 -0.380 3.486 1.00 0.00 C ATOM 598 CD GLU A 38 8.483 -0.155 4.368 1.00 0.00 C ATOM 599 OE1 GLU A 38 9.406 0.462 3.862 1.00 0.00 O ATOM 600 OE2 GLU A 38 8.430 -0.613 5.498 1.00 0.00 O ATOM 0 H GLU A 38 6.004 -1.135 5.713 1.00 0.00 H new ATOM 0 HA GLU A 38 4.884 1.542 5.023 1.00 0.00 H new ATOM 0 HB2 GLU A 38 5.843 1.015 2.624 1.00 0.00 H new ATOM 0 HB3 GLU A 38 6.912 1.731 3.814 1.00 0.00 H new ATOM 0 HG2 GLU A 38 6.724 -1.278 3.804 1.00 0.00 H new ATOM 0 HG3 GLU A 38 7.559 -0.539 2.452 1.00 0.00 H new ATOM 607 N ILE A 39 2.982 0.358 3.994 1.00 0.00 N ATOM 608 CA ILE A 39 1.812 -0.386 3.439 1.00 0.00 C ATOM 609 C ILE A 39 1.730 -0.172 1.923 1.00 0.00 C ATOM 610 O ILE A 39 1.344 0.883 1.463 1.00 0.00 O ATOM 611 CB ILE A 39 0.525 0.125 4.105 1.00 0.00 C ATOM 612 CG1 ILE A 39 0.338 -0.591 5.449 1.00 0.00 C ATOM 613 CG2 ILE A 39 -0.674 -0.183 3.203 1.00 0.00 C ATOM 614 CD1 ILE A 39 -0.546 0.257 6.371 1.00 0.00 C ATOM 0 H ILE A 39 2.798 1.323 4.268 1.00 0.00 H new ATOM 0 HA ILE A 39 1.930 -1.451 3.641 1.00 0.00 H new ATOM 0 HB ILE A 39 0.597 1.201 4.262 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -0.118 -1.568 5.290 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.307 -0.764 5.917 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.587 0.179 3.675 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.542 0.312 2.241 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.747 -1.260 3.050 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.675 -0.256 7.324 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -0.072 1.224 6.541 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.520 0.407 5.905 1.00 0.00 H new ATOM 626 N ILE A 40 2.106 -1.177 1.178 1.00 0.00 N ATOM 627 CA ILE A 40 2.046 -1.043 -0.312 1.00 0.00 C ATOM 628 C ILE A 40 0.684 -1.524 -0.833 1.00 0.00 C ATOM 629 O ILE A 40 -0.058 -2.174 -0.126 1.00 0.00 O ATOM 630 CB ILE A 40 3.166 -1.882 -0.938 1.00 0.00 C ATOM 631 CG1 ILE A 40 4.516 -1.274 -0.553 1.00 0.00 C ATOM 632 CG2 ILE A 40 3.029 -1.867 -2.463 1.00 0.00 C ATOM 633 CD1 ILE A 40 5.546 -2.392 -0.396 1.00 0.00 C ATOM 0 H ILE A 40 2.447 -2.073 1.527 1.00 0.00 H new ATOM 0 HA ILE A 40 2.174 0.004 -0.585 1.00 0.00 H new ATOM 0 HB ILE A 40 3.099 -2.908 -0.577 1.00 0.00 H new ATOM 0 HG12 ILE A 40 4.842 -0.568 -1.317 1.00 0.00 H new ATOM 0 HG13 ILE A 40 4.424 -0.715 0.378 1.00 0.00 H new ATOM 0 HG21 ILE A 40 3.826 -2.464 -2.906 1.00 0.00 H new ATOM 0 HG22 ILE A 40 2.063 -2.285 -2.746 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.100 -0.841 -2.825 1.00 0.00 H new ATOM 0 HD11 ILE A 40 6.510 -1.963 -0.122 1.00 0.00 H new ATOM 0 HD12 ILE A 40 5.220 -3.080 0.384 1.00 0.00 H new ATOM 0 HD13 ILE A 40 5.644 -2.931 -1.338 1.00 0.00 H new ATOM 645 N VAL A 41 0.379 -1.185 -2.055 1.00 0.00 N ATOM 646 CA VAL A 41 -0.929 -1.622 -2.626 1.00 0.00 C ATOM 647 C VAL A 41 -0.820 -1.789 -4.146 1.00 0.00 C ATOM 648 O VAL A 41 0.083 -1.261 -4.764 1.00 0.00 O ATOM 649 CB VAL A 41 -1.990 -0.573 -2.300 1.00 0.00 C ATOM 650 CG1 VAL A 41 -1.920 0.554 -3.332 1.00 0.00 C ATOM 651 CG2 VAL A 41 -3.372 -1.226 -2.357 1.00 0.00 C ATOM 0 H VAL A 41 0.969 -0.632 -2.677 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.207 -2.581 -2.190 1.00 0.00 H new ATOM 0 HB VAL A 41 -1.814 -0.167 -1.304 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -2.676 1.305 -3.103 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.932 1.013 -3.303 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -2.102 0.148 -4.327 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.135 -0.483 -2.125 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -3.545 -1.625 -3.357 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -3.422 -2.036 -1.630 1.00 0.00 H new ATOM 661 N LYS A 42 -1.747 -2.528 -4.714 1.00 0.00 N ATOM 662 CA LYS A 42 -1.715 -2.744 -6.195 1.00 0.00 C ATOM 663 C LYS A 42 -3.113 -2.544 -6.797 1.00 0.00 C ATOM 664 O LYS A 42 -4.099 -3.088 -6.309 1.00 0.00 O ATOM 665 CB LYS A 42 -1.238 -4.165 -6.488 1.00 0.00 C ATOM 666 CG LYS A 42 0.020 -4.112 -7.358 1.00 0.00 C ATOM 667 CD LYS A 42 0.392 -5.535 -7.780 1.00 0.00 C ATOM 668 CE LYS A 42 1.661 -5.490 -8.632 1.00 0.00 C ATOM 669 NZ LYS A 42 1.976 -6.845 -9.167 1.00 0.00 N ATOM 0 H LYS A 42 -2.515 -2.985 -4.222 1.00 0.00 H new ATOM 0 HA LYS A 42 -1.032 -2.021 -6.642 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -1.026 -4.688 -5.556 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -2.022 -4.725 -6.997 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -0.156 -3.492 -8.237 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.841 -3.656 -6.805 1.00 0.00 H new ATOM 0 HD2 LYS A 42 0.552 -6.158 -6.900 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -0.424 -5.985 -8.345 1.00 0.00 H new ATOM 0 HE2 LYS A 42 1.529 -4.789 -9.456 1.00 0.00 H new ATOM 0 HE3 LYS A 42 2.496 -5.125 -8.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 2.840 -6.798 -9.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 2.122 -7.505 -8.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 1.185 -7.179 -9.755 1.00 0.00 H new ATOM 683 N LEU A 43 -3.160 -1.774 -7.855 1.00 0.00 N ATOM 684 CA LEU A 43 -4.466 -1.507 -8.522 1.00 0.00 C ATOM 685 C LEU A 43 -4.641 -2.443 -9.724 1.00 0.00 C ATOM 686 O LEU A 43 -3.696 -2.722 -10.438 1.00 0.00 O ATOM 687 CB LEU A 43 -4.503 -0.049 -8.992 1.00 0.00 C ATOM 688 CG LEU A 43 -4.016 0.868 -7.856 1.00 0.00 C ATOM 689 CD1 LEU A 43 -2.522 1.172 -8.029 1.00 0.00 C ATOM 690 CD2 LEU A 43 -4.794 2.184 -7.908 1.00 0.00 C ATOM 0 H LEU A 43 -2.352 -1.321 -8.283 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.277 -1.685 -7.815 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -3.872 0.077 -9.872 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -5.517 0.224 -9.285 1.00 0.00 H new ATOM 0 HG LEU A 43 -4.176 0.369 -6.901 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.187 1.822 -7.220 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.956 0.241 -8.005 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.360 1.670 -8.985 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.455 2.839 -7.106 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.624 2.669 -8.869 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -5.858 1.983 -7.786 1.00 0.00 H new ATOM 702 N SER A 44 -5.852 -2.902 -9.922 1.00 0.00 N ATOM 703 CA SER A 44 -6.118 -3.837 -11.065 1.00 0.00 C ATOM 704 C SER A 44 -5.592 -3.270 -12.387 1.00 0.00 C ATOM 705 O SER A 44 -5.200 -4.012 -13.264 1.00 0.00 O ATOM 706 CB SER A 44 -7.622 -4.067 -11.186 1.00 0.00 C ATOM 707 OG SER A 44 -8.193 -2.792 -10.929 1.00 0.00 O ATOM 0 H SER A 44 -6.664 -2.674 -9.348 1.00 0.00 H new ATOM 0 HA SER A 44 -5.601 -4.775 -10.864 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.890 -4.431 -12.178 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.970 -4.811 -10.469 1.00 0.00 H new ATOM 0 HG SER A 44 -9.169 -2.853 -10.989 1.00 0.00 H new ATOM 713 N ASP A 45 -5.594 -1.974 -12.509 1.00 0.00 N ATOM 714 CA ASP A 45 -5.101 -1.369 -13.781 1.00 0.00 C ATOM 715 C ASP A 45 -3.643 -1.781 -14.026 1.00 0.00 C ATOM 716 O ASP A 45 -3.090 -1.525 -15.077 1.00 0.00 O ATOM 717 CB ASP A 45 -5.197 0.151 -13.684 1.00 0.00 C ATOM 718 CG ASP A 45 -4.306 0.636 -12.546 1.00 0.00 C ATOM 719 OD1 ASP A 45 -3.121 0.371 -12.642 1.00 0.00 O ATOM 720 OD2 ASP A 45 -4.859 1.244 -11.645 1.00 0.00 O ATOM 0 H ASP A 45 -5.909 -1.314 -11.798 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.712 -1.723 -14.611 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -4.888 0.608 -14.624 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -6.230 0.452 -13.507 1.00 0.00 H new ATOM 725 N GLY A 46 -3.055 -2.413 -13.045 1.00 0.00 N ATOM 726 CA GLY A 46 -1.640 -2.859 -13.198 1.00 0.00 C ATOM 727 C GLY A 46 -0.670 -1.802 -12.660 1.00 0.00 C ATOM 728 O GLY A 46 0.420 -1.647 -13.174 1.00 0.00 O ATOM 0 H GLY A 46 -3.490 -2.638 -12.150 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -1.492 -3.799 -12.666 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -1.427 -3.051 -14.250 1.00 0.00 H new ATOM 732 N ARG A 47 -1.089 -1.096 -11.634 1.00 0.00 N ATOM 733 CA ARG A 47 -0.197 -0.041 -11.044 1.00 0.00 C ATOM 734 C ARG A 47 0.207 -0.414 -9.614 1.00 0.00 C ATOM 735 O ARG A 47 -0.370 -1.296 -9.011 1.00 0.00 O ATOM 736 CB ARG A 47 -0.947 1.288 -11.014 1.00 0.00 C ATOM 737 CG ARG A 47 -0.857 1.950 -12.394 1.00 0.00 C ATOM 738 CD ARG A 47 -1.957 3.009 -12.522 1.00 0.00 C ATOM 739 NE ARG A 47 -1.380 4.234 -13.143 1.00 0.00 N ATOM 740 CZ ARG A 47 -1.176 4.262 -14.433 1.00 0.00 C ATOM 741 NH1 ARG A 47 -0.193 3.563 -14.932 1.00 0.00 N ATOM 742 NH2 ARG A 47 -1.962 4.988 -15.180 1.00 0.00 N ATOM 0 H ARG A 47 -1.998 -1.202 -11.184 1.00 0.00 H new ATOM 0 HA ARG A 47 0.701 0.041 -11.656 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -1.990 1.124 -10.743 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -0.520 1.943 -10.255 1.00 0.00 H new ATOM 0 HG2 ARG A 47 0.123 2.409 -12.526 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.966 1.200 -13.177 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -2.777 2.629 -13.131 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -2.370 3.243 -11.541 1.00 0.00 H new ATOM 0 HE ARG A 47 -1.147 5.043 -12.567 1.00 0.00 H new ATOM 0 HH11 ARG A 47 0.401 3.007 -14.317 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -0.019 3.573 -15.937 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -2.720 5.521 -14.755 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -1.818 5.022 -16.189 1.00 0.00 H new ATOM 756 N GLU A 48 1.195 0.275 -9.108 1.00 0.00 N ATOM 757 CA GLU A 48 1.658 0.002 -7.714 1.00 0.00 C ATOM 758 C GLU A 48 1.913 1.330 -6.996 1.00 0.00 C ATOM 759 O GLU A 48 2.638 2.170 -7.491 1.00 0.00 O ATOM 760 CB GLU A 48 2.951 -0.812 -7.761 1.00 0.00 C ATOM 761 CG GLU A 48 3.238 -1.377 -6.368 1.00 0.00 C ATOM 762 CD GLU A 48 4.731 -1.236 -6.062 1.00 0.00 C ATOM 763 OE1 GLU A 48 5.480 -1.982 -6.671 1.00 0.00 O ATOM 764 OE2 GLU A 48 5.037 -0.390 -5.238 1.00 0.00 O ATOM 0 H GLU A 48 1.701 1.013 -9.597 1.00 0.00 H new ATOM 0 HA GLU A 48 0.895 -0.560 -7.176 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.859 -1.623 -8.484 1.00 0.00 H new ATOM 0 HB3 GLU A 48 3.779 -0.184 -8.090 1.00 0.00 H new ATOM 0 HG2 GLU A 48 2.650 -0.846 -5.619 1.00 0.00 H new ATOM 0 HG3 GLU A 48 2.943 -2.425 -6.320 1.00 0.00 H new ATOM 771 N LEU A 49 1.311 1.490 -5.843 1.00 0.00 N ATOM 772 CA LEU A 49 1.495 2.769 -5.084 1.00 0.00 C ATOM 773 C LEU A 49 1.825 2.490 -3.613 1.00 0.00 C ATOM 774 O LEU A 49 1.308 1.563 -3.022 1.00 0.00 O ATOM 775 CB LEU A 49 0.198 3.576 -5.159 1.00 0.00 C ATOM 776 CG LEU A 49 -0.137 3.868 -6.629 1.00 0.00 C ATOM 777 CD1 LEU A 49 -1.514 4.531 -6.705 1.00 0.00 C ATOM 778 CD2 LEU A 49 0.912 4.817 -7.227 1.00 0.00 C ATOM 0 H LEU A 49 0.707 0.800 -5.397 1.00 0.00 H new ATOM 0 HA LEU A 49 2.322 3.325 -5.526 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.616 3.021 -4.692 1.00 0.00 H new ATOM 0 HB3 LEU A 49 0.305 4.510 -4.607 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.138 2.934 -7.191 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.759 4.742 -7.746 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -2.264 3.862 -6.284 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.501 5.463 -6.140 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.667 5.019 -8.270 1.00 0.00 H new ATOM 0 HD22 LEU A 49 0.917 5.752 -6.668 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.897 4.354 -7.169 1.00 0.00 H new ATOM 790 N CYS A 50 2.683 3.307 -3.058 1.00 0.00 N ATOM 791 CA CYS A 50 3.050 3.130 -1.622 1.00 0.00 C ATOM 792 C CYS A 50 2.251 4.125 -0.773 1.00 0.00 C ATOM 793 O CYS A 50 2.372 5.322 -0.940 1.00 0.00 O ATOM 794 CB CYS A 50 4.547 3.391 -1.447 1.00 0.00 C ATOM 795 SG CYS A 50 5.688 2.405 -2.449 1.00 0.00 S ATOM 0 H CYS A 50 3.142 4.084 -3.534 1.00 0.00 H new ATOM 0 HA CYS A 50 2.821 2.113 -1.304 1.00 0.00 H new ATOM 0 HB2 CYS A 50 4.733 4.443 -1.662 1.00 0.00 H new ATOM 0 HB3 CYS A 50 4.796 3.232 -0.398 1.00 0.00 H new ATOM 800 N LEU A 51 1.453 3.611 0.121 1.00 0.00 N ATOM 801 CA LEU A 51 0.624 4.519 0.970 1.00 0.00 C ATOM 802 C LEU A 51 1.320 4.810 2.304 1.00 0.00 C ATOM 803 O LEU A 51 2.070 3.998 2.808 1.00 0.00 O ATOM 804 CB LEU A 51 -0.722 3.849 1.239 1.00 0.00 C ATOM 805 CG LEU A 51 -1.250 3.241 -0.063 1.00 0.00 C ATOM 806 CD1 LEU A 51 -2.670 2.717 0.164 1.00 0.00 C ATOM 807 CD2 LEU A 51 -1.276 4.317 -1.150 1.00 0.00 C ATOM 0 H LEU A 51 1.338 2.614 0.301 1.00 0.00 H new ATOM 0 HA LEU A 51 0.483 5.463 0.443 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.611 3.074 1.998 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -1.433 4.577 1.629 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.602 2.422 -0.374 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -3.050 2.283 -0.761 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.656 1.955 0.943 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -3.316 3.539 0.471 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.652 3.887 -2.079 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.928 5.133 -0.838 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -0.267 4.698 -1.309 1.00 0.00 H new ATOM 819 N ASP A 52 1.047 5.970 2.843 1.00 0.00 N ATOM 820 CA ASP A 52 1.666 6.344 4.148 1.00 0.00 C ATOM 821 C ASP A 52 0.615 6.173 5.288 1.00 0.00 C ATOM 822 O ASP A 52 -0.375 6.877 5.303 1.00 0.00 O ATOM 823 CB ASP A 52 2.091 7.812 4.085 1.00 0.00 C ATOM 824 CG ASP A 52 2.890 8.162 5.343 1.00 0.00 C ATOM 825 OD1 ASP A 52 2.793 7.385 6.278 1.00 0.00 O ATOM 826 OD2 ASP A 52 3.552 9.186 5.297 1.00 0.00 O ATOM 0 H ASP A 52 0.426 6.670 2.438 1.00 0.00 H new ATOM 0 HA ASP A 52 2.528 5.707 4.345 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.695 7.990 3.195 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.213 8.454 4.008 1.00 0.00 H new ATOM 831 N PRO A 53 0.835 5.243 6.229 1.00 0.00 N ATOM 832 CA PRO A 53 -0.132 5.037 7.322 1.00 0.00 C ATOM 833 C PRO A 53 -0.238 6.288 8.206 1.00 0.00 C ATOM 834 O PRO A 53 -0.889 6.270 9.232 1.00 0.00 O ATOM 835 CB PRO A 53 0.419 3.859 8.136 1.00 0.00 C ATOM 836 CG PRO A 53 1.784 3.454 7.506 1.00 0.00 C ATOM 837 CD PRO A 53 2.015 4.354 6.281 1.00 0.00 C ATOM 0 HA PRO A 53 -1.132 4.840 6.936 1.00 0.00 H new ATOM 0 HB2 PRO A 53 0.548 4.142 9.181 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -0.277 3.020 8.116 1.00 0.00 H new ATOM 0 HG2 PRO A 53 2.591 3.576 8.229 1.00 0.00 H new ATOM 0 HG3 PRO A 53 1.774 2.404 7.214 1.00 0.00 H new ATOM 0 HD2 PRO A 53 2.937 4.927 6.381 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.104 3.764 5.369 1.00 0.00 H new ATOM 845 N LYS A 54 0.402 7.346 7.789 1.00 0.00 N ATOM 846 CA LYS A 54 0.355 8.592 8.592 1.00 0.00 C ATOM 847 C LYS A 54 -0.852 9.457 8.201 1.00 0.00 C ATOM 848 O LYS A 54 -1.106 10.471 8.821 1.00 0.00 O ATOM 849 CB LYS A 54 1.642 9.382 8.360 1.00 0.00 C ATOM 850 CG LYS A 54 1.923 10.256 9.583 1.00 0.00 C ATOM 851 CD LYS A 54 2.785 9.470 10.574 1.00 0.00 C ATOM 852 CE LYS A 54 2.842 10.228 11.902 1.00 0.00 C ATOM 853 NZ LYS A 54 3.686 9.495 12.887 1.00 0.00 N ATOM 0 H LYS A 54 0.952 7.398 6.931 1.00 0.00 H new ATOM 0 HA LYS A 54 0.257 8.325 9.644 1.00 0.00 H new ATOM 0 HB2 LYS A 54 2.475 8.701 8.186 1.00 0.00 H new ATOM 0 HB3 LYS A 54 1.546 10.002 7.469 1.00 0.00 H new ATOM 0 HG2 LYS A 54 2.435 11.170 9.282 1.00 0.00 H new ATOM 0 HG3 LYS A 54 0.987 10.555 10.054 1.00 0.00 H new ATOM 0 HD2 LYS A 54 2.368 8.475 10.727 1.00 0.00 H new ATOM 0 HD3 LYS A 54 3.790 9.337 10.174 1.00 0.00 H new ATOM 0 HE2 LYS A 54 3.247 11.227 11.740 1.00 0.00 H new ATOM 0 HE3 LYS A 54 1.835 10.353 12.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 3.713 10.024 13.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 3.283 8.551 13.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 4.651 9.398 12.513 1.00 0.00 H new ATOM 867 N GLU A 55 -1.574 9.040 7.183 1.00 0.00 N ATOM 868 CA GLU A 55 -2.764 9.844 6.749 1.00 0.00 C ATOM 869 C GLU A 55 -4.064 9.153 7.175 1.00 0.00 C ATOM 870 O GLU A 55 -4.216 7.957 7.027 1.00 0.00 O ATOM 871 CB GLU A 55 -2.740 10.006 5.233 1.00 0.00 C ATOM 872 CG GLU A 55 -1.340 10.436 4.798 1.00 0.00 C ATOM 873 CD GLU A 55 -1.448 11.328 3.559 1.00 0.00 C ATOM 874 OE1 GLU A 55 -1.957 12.424 3.725 1.00 0.00 O ATOM 875 OE2 GLU A 55 -1.015 10.862 2.518 1.00 0.00 O ATOM 0 H GLU A 55 -1.395 8.193 6.643 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.720 10.824 7.224 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -3.012 9.067 4.750 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.475 10.749 4.923 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -0.845 10.974 5.606 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -0.730 9.560 4.578 1.00 0.00 H new ATOM 882 N ASN A 56 -4.976 9.930 7.685 1.00 0.00 N ATOM 883 CA ASN A 56 -6.270 9.347 8.148 1.00 0.00 C ATOM 884 C ASN A 56 -7.064 8.743 6.981 1.00 0.00 C ATOM 885 O ASN A 56 -7.658 7.693 7.120 1.00 0.00 O ATOM 886 CB ASN A 56 -7.098 10.449 8.807 1.00 0.00 C ATOM 887 CG ASN A 56 -7.543 9.989 10.197 1.00 0.00 C ATOM 888 OD1 ASN A 56 -6.892 10.253 11.188 1.00 0.00 O ATOM 889 ND2 ASN A 56 -8.645 9.299 10.313 1.00 0.00 N ATOM 0 H ASN A 56 -4.885 10.939 7.802 1.00 0.00 H new ATOM 0 HA ASN A 56 -6.056 8.548 8.858 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -6.510 11.363 8.886 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -7.968 10.682 8.193 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -8.955 8.984 11.232 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -9.196 9.074 9.484 1.00 0.00 H new ATOM 896 N TRP A 57 -7.064 9.408 5.855 1.00 0.00 N ATOM 897 CA TRP A 57 -7.842 8.859 4.704 1.00 0.00 C ATOM 898 C TRP A 57 -7.291 7.497 4.279 1.00 0.00 C ATOM 899 O TRP A 57 -8.004 6.692 3.722 1.00 0.00 O ATOM 900 CB TRP A 57 -7.807 9.838 3.518 1.00 0.00 C ATOM 901 CG TRP A 57 -6.361 10.148 3.101 1.00 0.00 C ATOM 902 CD1 TRP A 57 -5.679 11.213 3.511 1.00 0.00 C ATOM 903 CD2 TRP A 57 -5.649 9.443 2.236 1.00 0.00 C ATOM 904 NE1 TRP A 57 -4.515 11.123 2.849 1.00 0.00 N ATOM 905 CE2 TRP A 57 -4.414 10.034 2.020 1.00 0.00 C ATOM 906 CE3 TRP A 57 -5.970 8.276 1.569 1.00 0.00 C ATOM 907 CZ2 TRP A 57 -3.512 9.464 1.146 1.00 0.00 C ATOM 908 CZ3 TRP A 57 -5.064 7.705 0.695 1.00 0.00 C ATOM 909 CH2 TRP A 57 -3.837 8.299 0.483 1.00 0.00 C ATOM 0 H TRP A 57 -6.573 10.285 5.683 1.00 0.00 H new ATOM 0 HA TRP A 57 -8.876 8.729 5.023 1.00 0.00 H new ATOM 0 HB2 TRP A 57 -8.349 9.411 2.674 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -8.317 10.762 3.790 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -5.989 11.973 4.213 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -3.767 11.808 2.953 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -6.930 7.809 1.731 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -2.552 9.930 0.981 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -5.317 6.792 0.177 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -3.131 7.852 -0.202 1.00 0.00 H new ATOM 920 N VAL A 58 -6.044 7.256 4.562 1.00 0.00 N ATOM 921 CA VAL A 58 -5.452 5.942 4.167 1.00 0.00 C ATOM 922 C VAL A 58 -6.007 4.833 5.056 1.00 0.00 C ATOM 923 O VAL A 58 -6.241 3.729 4.606 1.00 0.00 O ATOM 924 CB VAL A 58 -3.930 6.011 4.328 1.00 0.00 C ATOM 925 CG1 VAL A 58 -3.367 4.599 4.482 1.00 0.00 C ATOM 926 CG2 VAL A 58 -3.320 6.667 3.093 1.00 0.00 C ATOM 0 H VAL A 58 -5.414 7.898 5.042 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.707 5.727 3.129 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.685 6.598 5.213 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -2.284 4.650 4.596 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.803 4.127 5.362 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -3.611 4.011 3.597 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -2.237 6.717 3.205 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -3.566 6.078 2.209 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.720 7.675 2.981 1.00 0.00 H new ATOM 936 N GLN A 59 -6.207 5.150 6.299 1.00 0.00 N ATOM 937 CA GLN A 59 -6.745 4.128 7.233 1.00 0.00 C ATOM 938 C GLN A 59 -8.188 3.780 6.859 1.00 0.00 C ATOM 939 O GLN A 59 -8.684 2.734 7.211 1.00 0.00 O ATOM 940 CB GLN A 59 -6.710 4.688 8.654 1.00 0.00 C ATOM 941 CG GLN A 59 -6.766 3.530 9.651 1.00 0.00 C ATOM 942 CD GLN A 59 -7.413 4.014 10.949 1.00 0.00 C ATOM 943 OE1 GLN A 59 -6.746 4.258 11.935 1.00 0.00 O ATOM 944 NE2 GLN A 59 -8.708 4.166 10.992 1.00 0.00 N ATOM 0 H GLN A 59 -6.023 6.066 6.708 1.00 0.00 H new ATOM 0 HA GLN A 59 -6.137 3.226 7.171 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.802 5.271 8.806 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -7.552 5.362 8.813 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -7.338 2.702 9.233 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -5.761 3.156 9.849 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -9.273 3.963 10.167 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -9.155 4.488 11.850 1.00 0.00 H new ATOM 953 N ARG A 60 -8.829 4.664 6.143 1.00 0.00 N ATOM 954 CA ARG A 60 -10.246 4.402 5.759 1.00 0.00 C ATOM 955 C ARG A 60 -10.337 3.602 4.451 1.00 0.00 C ATOM 956 O ARG A 60 -10.938 2.547 4.416 1.00 0.00 O ATOM 957 CB ARG A 60 -10.970 5.735 5.587 1.00 0.00 C ATOM 958 CG ARG A 60 -11.195 6.365 6.963 1.00 0.00 C ATOM 959 CD ARG A 60 -11.987 7.663 6.796 1.00 0.00 C ATOM 960 NE ARG A 60 -11.344 8.731 7.611 1.00 0.00 N ATOM 961 CZ ARG A 60 -12.005 9.827 7.865 1.00 0.00 C ATOM 962 NH1 ARG A 60 -12.049 10.763 6.957 1.00 0.00 N ATOM 963 NH2 ARG A 60 -12.603 9.949 9.019 1.00 0.00 N ATOM 0 H ARG A 60 -8.439 5.546 5.811 1.00 0.00 H new ATOM 0 HA ARG A 60 -10.712 3.812 6.549 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -10.382 6.404 4.959 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -11.924 5.582 5.083 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -11.737 5.674 7.609 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -10.238 6.568 7.445 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -12.014 7.955 5.746 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -13.020 7.518 7.113 1.00 0.00 H new ATOM 0 HE ARG A 60 -10.396 8.607 7.967 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -11.571 10.631 6.065 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -12.561 11.626 7.139 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -12.549 9.195 9.704 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -13.125 10.798 9.236 1.00 0.00 H new ATOM 977 N VAL A 61 -9.742 4.110 3.400 1.00 0.00 N ATOM 978 CA VAL A 61 -9.823 3.380 2.105 1.00 0.00 C ATOM 979 C VAL A 61 -9.262 1.964 2.270 1.00 0.00 C ATOM 980 O VAL A 61 -9.755 1.023 1.679 1.00 0.00 O ATOM 981 CB VAL A 61 -9.034 4.153 1.043 1.00 0.00 C ATOM 982 CG1 VAL A 61 -9.408 5.633 1.123 1.00 0.00 C ATOM 983 CG2 VAL A 61 -7.533 3.995 1.303 1.00 0.00 C ATOM 0 H VAL A 61 -9.214 4.982 3.384 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.863 3.302 1.789 1.00 0.00 H new ATOM 0 HB VAL A 61 -9.272 3.763 0.053 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -8.851 6.190 0.370 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -10.477 5.748 0.943 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -9.164 6.017 2.113 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -6.973 4.545 0.547 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -7.292 4.388 2.291 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -7.265 2.940 1.257 1.00 0.00 H new ATOM 993 N VAL A 62 -8.247 1.840 3.074 1.00 0.00 N ATOM 994 CA VAL A 62 -7.664 0.490 3.298 1.00 0.00 C ATOM 995 C VAL A 62 -8.617 -0.340 4.163 1.00 0.00 C ATOM 996 O VAL A 62 -8.878 -1.490 3.873 1.00 0.00 O ATOM 997 CB VAL A 62 -6.316 0.631 4.003 1.00 0.00 C ATOM 998 CG1 VAL A 62 -5.845 -0.747 4.469 1.00 0.00 C ATOM 999 CG2 VAL A 62 -5.293 1.208 3.023 1.00 0.00 C ATOM 0 H VAL A 62 -7.800 2.604 3.581 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.520 -0.011 2.341 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.418 1.295 4.862 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -4.883 -0.652 4.973 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -6.576 -1.167 5.160 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -5.739 -1.406 3.607 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -4.329 1.311 3.522 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -5.190 0.539 2.169 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -5.630 2.186 2.680 1.00 0.00 H new ATOM 1009 N GLU A 63 -9.121 0.262 5.212 1.00 0.00 N ATOM 1010 CA GLU A 63 -10.071 -0.486 6.087 1.00 0.00 C ATOM 1011 C GLU A 63 -11.214 -1.036 5.238 1.00 0.00 C ATOM 1012 O GLU A 63 -11.745 -2.093 5.512 1.00 0.00 O ATOM 1013 CB GLU A 63 -10.638 0.458 7.148 1.00 0.00 C ATOM 1014 CG GLU A 63 -11.671 -0.293 7.992 1.00 0.00 C ATOM 1015 CD GLU A 63 -13.073 0.202 7.631 1.00 0.00 C ATOM 1016 OE1 GLU A 63 -13.456 1.207 8.208 1.00 0.00 O ATOM 1017 OE2 GLU A 63 -13.681 -0.451 6.800 1.00 0.00 O ATOM 0 H GLU A 63 -8.920 1.221 5.495 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.547 -1.308 6.574 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -9.836 0.834 7.783 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -11.100 1.323 6.672 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -11.594 -1.365 7.813 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.478 -0.132 9.053 1.00 0.00 H new ATOM 1024 N LYS A 64 -11.566 -0.301 4.219 1.00 0.00 N ATOM 1025 CA LYS A 64 -12.670 -0.759 3.335 1.00 0.00 C ATOM 1026 C LYS A 64 -12.247 -2.021 2.577 1.00 0.00 C ATOM 1027 O LYS A 64 -12.985 -2.983 2.513 1.00 0.00 O ATOM 1028 CB LYS A 64 -12.999 0.349 2.345 1.00 0.00 C ATOM 1029 CG LYS A 64 -14.360 0.950 2.696 1.00 0.00 C ATOM 1030 CD LYS A 64 -14.610 2.177 1.815 1.00 0.00 C ATOM 1031 CE LYS A 64 -14.364 3.446 2.635 1.00 0.00 C ATOM 1032 NZ LYS A 64 -14.592 4.658 1.800 1.00 0.00 N ATOM 0 H LYS A 64 -11.140 0.590 3.963 1.00 0.00 H new ATOM 0 HA LYS A 64 -13.548 -0.991 3.938 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -12.229 1.120 2.375 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -13.014 -0.047 1.330 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -15.147 0.212 2.544 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -14.386 1.232 3.749 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -13.950 2.157 0.948 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -15.633 2.166 1.438 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -15.028 3.462 3.499 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -13.343 3.447 3.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -14.421 5.510 2.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -13.941 4.648 0.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -15.573 4.663 1.456 1.00 0.00 H new ATOM 1046 N PHE A 65 -11.065 -1.993 2.012 1.00 0.00 N ATOM 1047 CA PHE A 65 -10.593 -3.197 1.267 1.00 0.00 C ATOM 1048 C PHE A 65 -10.655 -4.426 2.173 1.00 0.00 C ATOM 1049 O PHE A 65 -11.013 -5.503 1.741 1.00 0.00 O ATOM 1050 CB PHE A 65 -9.159 -2.990 0.807 1.00 0.00 C ATOM 1051 CG PHE A 65 -8.704 -4.231 0.026 1.00 0.00 C ATOM 1052 CD1 PHE A 65 -9.266 -4.538 -1.204 1.00 0.00 C ATOM 1053 CD2 PHE A 65 -7.726 -5.064 0.542 1.00 0.00 C ATOM 1054 CE1 PHE A 65 -8.855 -5.661 -1.903 1.00 0.00 C ATOM 1055 CE2 PHE A 65 -7.317 -6.183 -0.157 1.00 0.00 C ATOM 1056 CZ PHE A 65 -7.881 -6.483 -1.378 1.00 0.00 C ATOM 0 H PHE A 65 -10.419 -1.204 2.034 1.00 0.00 H new ATOM 0 HA PHE A 65 -11.237 -3.349 0.401 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -9.089 -2.102 0.178 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -8.508 -2.825 1.665 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -10.029 -3.897 -1.620 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -7.279 -4.837 1.499 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -9.298 -5.893 -2.860 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -6.552 -6.825 0.255 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.561 -7.359 -1.922 1.00 0.00 H new ATOM 1066 N LEU A 66 -10.304 -4.237 3.416 1.00 0.00 N ATOM 1067 CA LEU A 66 -10.337 -5.383 4.367 1.00 0.00 C ATOM 1068 C LEU A 66 -11.779 -5.848 4.576 1.00 0.00 C ATOM 1069 O LEU A 66 -12.078 -7.019 4.471 1.00 0.00 O ATOM 1070 CB LEU A 66 -9.752 -4.940 5.708 1.00 0.00 C ATOM 1071 CG LEU A 66 -8.234 -5.129 5.686 1.00 0.00 C ATOM 1072 CD1 LEU A 66 -7.587 -4.101 6.617 1.00 0.00 C ATOM 1073 CD2 LEU A 66 -7.894 -6.538 6.179 1.00 0.00 C ATOM 0 H LEU A 66 -9.999 -3.347 3.811 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.751 -6.206 3.958 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.997 -3.895 5.897 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.191 -5.522 6.519 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.861 -4.995 4.671 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.505 -4.230 6.606 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -7.836 -3.095 6.278 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -7.959 -4.244 7.632 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -6.813 -6.677 6.165 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -8.263 -6.666 7.196 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.363 -7.275 5.527 1.00 0.00 H new ATOM 1085 N LYS A 67 -12.643 -4.915 4.866 1.00 0.00 N ATOM 1086 CA LYS A 67 -14.070 -5.282 5.091 1.00 0.00 C ATOM 1087 C LYS A 67 -14.677 -5.878 3.815 1.00 0.00 C ATOM 1088 O LYS A 67 -15.539 -6.732 3.877 1.00 0.00 O ATOM 1089 CB LYS A 67 -14.850 -4.031 5.488 1.00 0.00 C ATOM 1090 CG LYS A 67 -16.290 -4.424 5.825 1.00 0.00 C ATOM 1091 CD LYS A 67 -17.243 -3.720 4.858 1.00 0.00 C ATOM 1092 CE LYS A 67 -18.665 -4.225 5.103 1.00 0.00 C ATOM 1093 NZ LYS A 67 -19.617 -3.083 5.193 1.00 0.00 N ATOM 0 H LYS A 67 -12.426 -3.922 4.956 1.00 0.00 H new ATOM 0 HA LYS A 67 -14.126 -6.026 5.886 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -14.380 -3.552 6.347 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -14.839 -3.307 4.674 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -16.411 -5.505 5.752 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -16.525 -4.146 6.853 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -17.197 -2.641 5.003 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -16.946 -3.916 3.828 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -18.964 -4.892 4.295 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -18.697 -4.806 6.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -20.578 -3.444 5.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -19.340 -2.461 5.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -19.599 -2.545 4.303 1.00 0.00 H new ATOM 1107 N ARG A 68 -14.218 -5.412 2.686 1.00 0.00 N ATOM 1108 CA ARG A 68 -14.763 -5.944 1.403 1.00 0.00 C ATOM 1109 C ARG A 68 -14.183 -7.332 1.115 1.00 0.00 C ATOM 1110 O ARG A 68 -14.893 -8.234 0.717 1.00 0.00 O ATOM 1111 CB ARG A 68 -14.396 -4.991 0.267 1.00 0.00 C ATOM 1112 CG ARG A 68 -15.382 -5.186 -0.887 1.00 0.00 C ATOM 1113 CD ARG A 68 -14.866 -4.444 -2.121 1.00 0.00 C ATOM 1114 NE ARG A 68 -15.824 -4.647 -3.244 1.00 0.00 N ATOM 1115 CZ ARG A 68 -15.383 -5.078 -4.394 1.00 0.00 C ATOM 1116 NH1 ARG A 68 -14.891 -4.218 -5.243 1.00 0.00 N ATOM 1117 NH2 ARG A 68 -15.447 -6.355 -4.655 1.00 0.00 N ATOM 0 H ARG A 68 -13.498 -4.695 2.595 1.00 0.00 H new ATOM 0 HA ARG A 68 -15.847 -6.026 1.482 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -14.426 -3.959 0.617 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -13.378 -5.183 -0.071 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -15.497 -6.247 -1.108 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -16.366 -4.810 -0.607 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -14.760 -3.381 -1.904 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -13.878 -4.813 -2.397 1.00 0.00 H new ATOM 0 HE ARG A 68 -16.817 -4.451 -3.115 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -14.856 -3.227 -5.003 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -14.542 -4.536 -6.147 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -15.837 -6.998 -3.965 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -15.107 -6.711 -5.549 1.00 0.00 H new ATOM 1131 N ALA A 69 -12.903 -7.476 1.324 1.00 0.00 N ATOM 1132 CA ALA A 69 -12.268 -8.799 1.067 1.00 0.00 C ATOM 1133 C ALA A 69 -12.679 -9.799 2.157 1.00 0.00 C ATOM 1134 O ALA A 69 -12.600 -10.996 1.966 1.00 0.00 O ATOM 1135 CB ALA A 69 -10.745 -8.632 1.059 1.00 0.00 C ATOM 0 H ALA A 69 -12.276 -6.744 1.658 1.00 0.00 H new ATOM 0 HA ALA A 69 -12.599 -9.180 0.101 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -10.274 -9.597 0.871 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.460 -7.931 0.275 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -10.416 -8.249 2.025 1.00 0.00 H new ATOM 1141 N GLU A 70 -13.117 -9.285 3.275 1.00 0.00 N ATOM 1142 CA GLU A 70 -13.539 -10.193 4.384 1.00 0.00 C ATOM 1143 C GLU A 70 -14.967 -10.698 4.139 1.00 0.00 C ATOM 1144 O GLU A 70 -15.266 -11.854 4.363 1.00 0.00 O ATOM 1145 CB GLU A 70 -13.489 -9.427 5.707 1.00 0.00 C ATOM 1146 CG GLU A 70 -13.629 -10.412 6.871 1.00 0.00 C ATOM 1147 CD GLU A 70 -14.402 -9.742 8.009 1.00 0.00 C ATOM 1148 OE1 GLU A 70 -15.611 -9.664 7.869 1.00 0.00 O ATOM 1149 OE2 GLU A 70 -13.739 -9.345 8.953 1.00 0.00 O ATOM 0 H GLU A 70 -13.201 -8.287 3.469 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.864 -11.048 4.425 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.549 -8.882 5.789 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -14.290 -8.689 5.743 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.150 -11.311 6.541 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.644 -10.724 7.219 1.00 0.00 H new ATOM 1156 N ASN A 71 -15.819 -9.818 3.684 1.00 0.00 N ATOM 1157 CA ASN A 71 -17.232 -10.230 3.424 1.00 0.00 C ATOM 1158 C ASN A 71 -17.327 -10.998 2.102 1.00 0.00 C ATOM 1159 O ASN A 71 -17.983 -12.017 2.018 1.00 0.00 O ATOM 1160 CB ASN A 71 -18.113 -8.983 3.354 1.00 0.00 C ATOM 1161 CG ASN A 71 -19.582 -9.403 3.259 1.00 0.00 C ATOM 1162 OD1 ASN A 71 -19.877 -10.674 3.229 1.00 0.00 O flip ATOM 1163 ND2 ASN A 71 -20.473 -8.578 3.211 1.00 0.00 N flip ATOM 0 H ASN A 71 -15.603 -8.842 3.483 1.00 0.00 H new ATOM 0 HA ASN A 71 -17.570 -10.879 4.232 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -17.957 -8.364 4.237 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -17.839 -8.379 2.489 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -20.249 -7.583 3.234 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -21.445 -8.880 3.148 1.00 0.00 H new ATOM 1275 N CYS B 7 -7.582 -19.859 -9.389 1.00 0.00 N ATOM 1276 CA CYS B 7 -7.247 -18.904 -8.290 1.00 0.00 C ATOM 1277 C CYS B 7 -5.742 -18.942 -7.995 1.00 0.00 C ATOM 1278 O CYS B 7 -5.089 -19.940 -8.229 1.00 0.00 O ATOM 1279 CB CYS B 7 -8.022 -19.302 -7.035 1.00 0.00 C ATOM 1280 SG CYS B 7 -9.788 -18.907 -6.990 1.00 0.00 S ATOM 0 HA CYS B 7 -7.520 -17.893 -8.594 1.00 0.00 H new ATOM 0 HB2 CYS B 7 -7.913 -20.378 -6.898 1.00 0.00 H new ATOM 0 HB3 CYS B 7 -7.547 -18.823 -6.179 1.00 0.00 H new ATOM 1285 N GLN B 8 -5.219 -17.853 -7.486 1.00 0.00 N ATOM 1286 CA GLN B 8 -3.755 -17.830 -7.170 1.00 0.00 C ATOM 1287 C GLN B 8 -3.425 -18.854 -6.079 1.00 0.00 C ATOM 1288 O GLN B 8 -2.325 -19.370 -6.031 1.00 0.00 O ATOM 1289 CB GLN B 8 -3.357 -16.433 -6.687 1.00 0.00 C ATOM 1290 CG GLN B 8 -3.150 -15.514 -7.895 1.00 0.00 C ATOM 1291 CD GLN B 8 -1.662 -15.473 -8.248 1.00 0.00 C ATOM 1292 OE1 GLN B 8 -1.185 -16.238 -9.064 1.00 0.00 O ATOM 1293 NE2 GLN B 8 -0.895 -14.599 -7.658 1.00 0.00 N ATOM 0 H GLN B 8 -5.730 -16.995 -7.279 1.00 0.00 H new ATOM 0 HA GLN B 8 -3.200 -18.083 -8.073 1.00 0.00 H new ATOM 0 HB2 GLN B 8 -4.132 -16.027 -6.037 1.00 0.00 H new ATOM 0 HB3 GLN B 8 -2.442 -16.488 -6.097 1.00 0.00 H new ATOM 0 HG2 GLN B 8 -3.728 -15.876 -8.745 1.00 0.00 H new ATOM 0 HG3 GLN B 8 -3.510 -14.510 -7.669 1.00 0.00 H new ATOM 0 HE21 GLN B 8 -1.289 -13.955 -6.973 1.00 0.00 H new ATOM 0 HE22 GLN B 8 0.099 -14.560 -7.882 1.00 0.00 H new ATOM 1302 N CYS B 9 -4.383 -19.121 -5.226 1.00 0.00 N ATOM 1303 CA CYS B 9 -4.141 -20.107 -4.124 1.00 0.00 C ATOM 1304 C CYS B 9 -5.240 -21.173 -4.102 1.00 0.00 C ATOM 1305 O CYS B 9 -6.403 -20.868 -3.923 1.00 0.00 O ATOM 1306 CB CYS B 9 -4.132 -19.367 -2.789 1.00 0.00 C ATOM 1307 SG CYS B 9 -2.707 -18.311 -2.435 1.00 0.00 S ATOM 0 H CYS B 9 -5.314 -18.704 -5.243 1.00 0.00 H new ATOM 0 HA CYS B 9 -3.182 -20.597 -4.293 1.00 0.00 H new ATOM 0 HB2 CYS B 9 -5.029 -18.750 -2.739 1.00 0.00 H new ATOM 0 HB3 CYS B 9 -4.209 -20.107 -1.993 1.00 0.00 H new ATOM 1312 N ILE B 10 -4.844 -22.405 -4.286 1.00 0.00 N ATOM 1313 CA ILE B 10 -5.846 -23.510 -4.267 1.00 0.00 C ATOM 1314 C ILE B 10 -5.870 -24.158 -2.879 1.00 0.00 C ATOM 1315 O ILE B 10 -6.920 -24.358 -2.301 1.00 0.00 O ATOM 1316 CB ILE B 10 -5.463 -24.556 -5.315 1.00 0.00 C ATOM 1317 CG1 ILE B 10 -5.483 -23.910 -6.704 1.00 0.00 C ATOM 1318 CG2 ILE B 10 -6.474 -25.702 -5.278 1.00 0.00 C ATOM 1319 CD1 ILE B 10 -4.192 -24.268 -7.445 1.00 0.00 C ATOM 0 H ILE B 10 -3.879 -22.692 -4.447 1.00 0.00 H new ATOM 0 HA ILE B 10 -6.835 -23.111 -4.494 1.00 0.00 H new ATOM 0 HB ILE B 10 -4.465 -24.940 -5.102 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -6.348 -24.258 -7.268 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -5.576 -22.828 -6.613 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -6.204 -26.450 -6.024 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -6.470 -26.159 -4.288 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -7.470 -25.316 -5.495 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -4.201 -23.810 -8.434 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -3.335 -23.898 -6.882 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -4.119 -25.351 -7.547 1.00 0.00 H new ATOM 1331 N LYS B 11 -4.704 -24.469 -2.377 1.00 0.00 N ATOM 1332 CA LYS B 11 -4.624 -25.098 -1.024 1.00 0.00 C ATOM 1333 C LYS B 11 -4.240 -24.042 0.020 1.00 0.00 C ATOM 1334 O LYS B 11 -3.882 -22.933 -0.324 1.00 0.00 O ATOM 1335 CB LYS B 11 -3.565 -26.201 -1.050 1.00 0.00 C ATOM 1336 CG LYS B 11 -4.046 -27.341 -1.951 1.00 0.00 C ATOM 1337 CD LYS B 11 -4.295 -28.585 -1.096 1.00 0.00 C ATOM 1338 CE LYS B 11 -4.946 -29.667 -1.960 1.00 0.00 C ATOM 1339 NZ LYS B 11 -5.125 -30.924 -1.178 1.00 0.00 N ATOM 0 H LYS B 11 -3.809 -24.316 -2.841 1.00 0.00 H new ATOM 0 HA LYS B 11 -5.593 -25.521 -0.760 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -2.619 -25.805 -1.419 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -3.384 -26.571 -0.041 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -4.961 -27.051 -2.468 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -3.301 -27.555 -2.717 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -3.355 -28.950 -0.682 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -4.941 -28.338 -0.253 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -5.912 -29.317 -2.324 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -4.327 -29.862 -2.836 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -5.568 -31.647 -1.780 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -4.198 -31.265 -0.852 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -5.734 -30.738 -0.356 1.00 0.00 H new ATOM 1353 N THR B 12 -4.324 -24.410 1.275 1.00 0.00 N ATOM 1354 CA THR B 12 -3.968 -23.438 2.356 1.00 0.00 C ATOM 1355 C THR B 12 -3.110 -24.121 3.428 1.00 0.00 C ATOM 1356 O THR B 12 -2.834 -25.301 3.349 1.00 0.00 O ATOM 1357 CB THR B 12 -5.255 -22.904 2.994 1.00 0.00 C ATOM 1358 OG1 THR B 12 -6.062 -24.059 3.207 1.00 0.00 O ATOM 1359 CG2 THR B 12 -6.045 -22.032 2.020 1.00 0.00 C ATOM 0 H THR B 12 -4.621 -25.332 1.596 1.00 0.00 H new ATOM 0 HA THR B 12 -3.397 -22.616 1.923 1.00 0.00 H new ATOM 0 HB THR B 12 -5.015 -22.324 3.885 1.00 0.00 H new ATOM 0 HG1 THR B 12 -6.911 -23.794 3.619 1.00 0.00 H new ATOM 0 HG21 THR B 12 -6.951 -21.671 2.507 1.00 0.00 H new ATOM 0 HG22 THR B 12 -5.434 -21.182 1.715 1.00 0.00 H new ATOM 0 HG23 THR B 12 -6.314 -22.619 1.142 1.00 0.00 H new ATOM 1367 N TYR B 13 -2.709 -23.357 4.407 1.00 0.00 N ATOM 1368 CA TYR B 13 -1.864 -23.933 5.496 1.00 0.00 C ATOM 1369 C TYR B 13 -2.753 -24.475 6.624 1.00 0.00 C ATOM 1370 O TYR B 13 -3.766 -23.889 6.949 1.00 0.00 O ATOM 1371 CB TYR B 13 -0.955 -22.832 6.046 1.00 0.00 C ATOM 1372 CG TYR B 13 0.461 -23.380 6.253 1.00 0.00 C ATOM 1373 CD1 TYR B 13 1.194 -23.848 5.181 1.00 0.00 C ATOM 1374 CD2 TYR B 13 1.025 -23.413 7.513 1.00 0.00 C ATOM 1375 CE1 TYR B 13 2.471 -24.340 5.367 1.00 0.00 C ATOM 1376 CE2 TYR B 13 2.301 -23.905 7.698 1.00 0.00 C ATOM 1377 CZ TYR B 13 3.034 -24.372 6.626 1.00 0.00 C ATOM 1378 OH TYR B 13 4.311 -24.862 6.812 1.00 0.00 O ATOM 0 H TYR B 13 -2.927 -22.365 4.502 1.00 0.00 H new ATOM 0 HA TYR B 13 -1.264 -24.752 5.098 1.00 0.00 H new ATOM 0 HB2 TYR B 13 -0.931 -21.989 5.355 1.00 0.00 H new ATOM 0 HB3 TYR B 13 -1.352 -22.459 6.990 1.00 0.00 H new ATOM 0 HD1 TYR B 13 0.766 -23.829 4.190 1.00 0.00 H new ATOM 0 HD2 TYR B 13 0.463 -23.051 8.361 1.00 0.00 H new ATOM 0 HE1 TYR B 13 3.034 -24.703 4.520 1.00 0.00 H new ATOM 0 HE2 TYR B 13 2.729 -23.925 8.689 1.00 0.00 H new ATOM 0 HH TYR B 13 4.547 -24.808 7.762 1.00 0.00 H new ATOM 1388 N SER B 14 -2.348 -25.587 7.192 1.00 0.00 N ATOM 1389 CA SER B 14 -3.151 -26.194 8.304 1.00 0.00 C ATOM 1390 C SER B 14 -2.287 -26.328 9.564 1.00 0.00 C ATOM 1391 O SER B 14 -2.424 -27.270 10.318 1.00 0.00 O ATOM 1392 CB SER B 14 -3.638 -27.576 7.873 1.00 0.00 C ATOM 1393 OG SER B 14 -2.455 -28.256 7.481 1.00 0.00 O ATOM 0 H SER B 14 -1.503 -26.098 6.937 1.00 0.00 H new ATOM 0 HA SER B 14 -4.004 -25.552 8.525 1.00 0.00 H new ATOM 0 HB2 SER B 14 -4.142 -28.093 8.689 1.00 0.00 H new ATOM 0 HB3 SER B 14 -4.350 -27.509 7.050 1.00 0.00 H new ATOM 0 HG SER B 14 -2.681 -29.163 7.188 1.00 0.00 H new ATOM 1399 N LYS B 15 -1.417 -25.377 9.759 1.00 0.00 N ATOM 1400 CA LYS B 15 -0.530 -25.420 10.959 1.00 0.00 C ATOM 1401 C LYS B 15 -0.299 -23.974 11.485 1.00 0.00 C ATOM 1402 O LYS B 15 0.490 -23.248 10.920 1.00 0.00 O ATOM 1403 CB LYS B 15 0.814 -26.019 10.547 1.00 0.00 C ATOM 1404 CG LYS B 15 1.502 -26.607 11.781 1.00 0.00 C ATOM 1405 CD LYS B 15 3.018 -26.527 11.594 1.00 0.00 C ATOM 1406 CE LYS B 15 3.706 -27.250 12.755 1.00 0.00 C ATOM 1407 NZ LYS B 15 3.750 -28.718 12.502 1.00 0.00 N ATOM 0 H LYS B 15 -1.281 -24.575 9.144 1.00 0.00 H new ATOM 0 HA LYS B 15 -0.992 -26.022 11.741 1.00 0.00 H new ATOM 0 HB2 LYS B 15 0.665 -26.794 9.795 1.00 0.00 H new ATOM 0 HB3 LYS B 15 1.444 -25.253 10.095 1.00 0.00 H new ATOM 0 HG2 LYS B 15 1.204 -26.059 12.675 1.00 0.00 H new ATOM 0 HG3 LYS B 15 1.195 -27.643 11.925 1.00 0.00 H new ATOM 0 HD2 LYS B 15 3.304 -26.982 10.646 1.00 0.00 H new ATOM 0 HD3 LYS B 15 3.338 -25.486 11.557 1.00 0.00 H new ATOM 0 HE2 LYS B 15 4.718 -26.866 12.882 1.00 0.00 H new ATOM 0 HE3 LYS B 15 3.171 -27.051 13.684 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 4.220 -29.194 13.299 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 2.781 -29.083 12.404 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 4.280 -28.904 11.627 1.00 0.00 H new ATOM 1421 N PRO B 16 -0.985 -23.575 12.561 1.00 0.00 N ATOM 1422 CA PRO B 16 -0.832 -22.210 13.092 1.00 0.00 C ATOM 1423 C PRO B 16 0.625 -21.911 13.477 1.00 0.00 C ATOM 1424 O PRO B 16 1.260 -22.684 14.168 1.00 0.00 O ATOM 1425 CB PRO B 16 -1.742 -22.148 14.324 1.00 0.00 C ATOM 1426 CG PRO B 16 -2.524 -23.493 14.391 1.00 0.00 C ATOM 1427 CD PRO B 16 -1.934 -24.421 13.314 1.00 0.00 C ATOM 0 HA PRO B 16 -1.102 -21.464 12.344 1.00 0.00 H new ATOM 0 HB2 PRO B 16 -1.153 -22.000 15.229 1.00 0.00 H new ATOM 0 HB3 PRO B 16 -2.431 -21.306 14.251 1.00 0.00 H new ATOM 0 HG2 PRO B 16 -2.430 -23.943 15.379 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -3.587 -23.328 14.216 1.00 0.00 H new ATOM 0 HD2 PRO B 16 -1.430 -25.277 13.763 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -2.714 -24.816 12.663 1.00 0.00 H new ATOM 1435 N PHE B 17 1.115 -20.783 13.010 1.00 0.00 N ATOM 1436 CA PHE B 17 2.524 -20.384 13.330 1.00 0.00 C ATOM 1437 C PHE B 17 2.530 -19.024 14.045 1.00 0.00 C ATOM 1438 O PHE B 17 1.513 -18.577 14.526 1.00 0.00 O ATOM 1439 CB PHE B 17 3.332 -20.294 12.029 1.00 0.00 C ATOM 1440 CG PHE B 17 2.530 -19.531 10.975 1.00 0.00 C ATOM 1441 CD1 PHE B 17 1.642 -20.198 10.150 1.00 0.00 C ATOM 1442 CD2 PHE B 17 2.681 -18.163 10.829 1.00 0.00 C ATOM 1443 CE1 PHE B 17 0.918 -19.510 9.200 1.00 0.00 C ATOM 1444 CE2 PHE B 17 1.957 -17.480 9.878 1.00 0.00 C ATOM 1445 CZ PHE B 17 1.077 -18.151 9.065 1.00 0.00 C ATOM 0 H PHE B 17 0.601 -20.125 12.424 1.00 0.00 H new ATOM 0 HA PHE B 17 2.974 -21.129 13.986 1.00 0.00 H new ATOM 0 HB2 PHE B 17 4.281 -19.790 12.213 1.00 0.00 H new ATOM 0 HB3 PHE B 17 3.568 -21.294 11.666 1.00 0.00 H new ATOM 0 HD1 PHE B 17 1.515 -21.266 10.251 1.00 0.00 H new ATOM 0 HD2 PHE B 17 3.371 -17.628 11.465 1.00 0.00 H new ATOM 0 HE1 PHE B 17 0.226 -20.039 8.562 1.00 0.00 H new ATOM 0 HE2 PHE B 17 2.082 -16.413 9.771 1.00 0.00 H new ATOM 0 HZ PHE B 17 0.510 -17.612 8.320 1.00 0.00 H new ATOM 1455 N HIS B 18 3.681 -18.407 14.104 1.00 0.00 N ATOM 1456 CA HIS B 18 3.789 -17.074 14.793 1.00 0.00 C ATOM 1457 C HIS B 18 4.169 -15.973 13.760 1.00 0.00 C ATOM 1458 O HIS B 18 4.963 -16.226 12.875 1.00 0.00 O ATOM 1459 CB HIS B 18 4.910 -17.191 15.837 1.00 0.00 C ATOM 1460 CG HIS B 18 4.831 -16.036 16.827 1.00 0.00 C ATOM 1461 ND1 HIS B 18 5.299 -14.819 16.605 1.00 0.00 N ATOM 1462 CD2 HIS B 18 4.276 -16.012 18.102 1.00 0.00 C ATOM 1463 CE1 HIS B 18 5.059 -14.093 17.653 1.00 0.00 C ATOM 1464 NE2 HIS B 18 4.456 -14.802 18.532 1.00 0.00 N ATOM 0 H HIS B 18 4.552 -18.762 13.708 1.00 0.00 H new ATOM 0 HA HIS B 18 2.840 -16.806 15.258 1.00 0.00 H new ATOM 0 HB2 HIS B 18 4.826 -18.140 16.367 1.00 0.00 H new ATOM 0 HB3 HIS B 18 5.880 -17.188 15.341 1.00 0.00 H new ATOM 0 HD2 HIS B 18 3.797 -16.828 18.623 1.00 0.00 H new ATOM 0 HE1 HIS B 18 5.326 -13.053 17.766 1.00 0.00 H new ATOM 0 HE2 HIS B 18 4.158 -14.461 19.446 1.00 0.00 H new ATOM 1472 N PRO B 19 3.601 -14.762 13.879 1.00 0.00 N ATOM 1473 CA PRO B 19 3.944 -13.683 12.944 1.00 0.00 C ATOM 1474 C PRO B 19 5.437 -13.380 13.049 1.00 0.00 C ATOM 1475 O PRO B 19 6.026 -12.781 12.170 1.00 0.00 O ATOM 1476 CB PRO B 19 3.123 -12.472 13.393 1.00 0.00 C ATOM 1477 CG PRO B 19 2.347 -12.889 14.674 1.00 0.00 C ATOM 1478 CD PRO B 19 2.615 -14.382 14.913 1.00 0.00 C ATOM 0 HA PRO B 19 3.729 -13.947 11.909 1.00 0.00 H new ATOM 0 HB2 PRO B 19 3.773 -11.621 13.597 1.00 0.00 H new ATOM 0 HB3 PRO B 19 2.432 -12.164 12.608 1.00 0.00 H new ATOM 0 HG2 PRO B 19 2.675 -12.299 15.530 1.00 0.00 H new ATOM 0 HG3 PRO B 19 1.279 -12.706 14.552 1.00 0.00 H new ATOM 0 HD2 PRO B 19 3.006 -14.558 15.915 1.00 0.00 H new ATOM 0 HD3 PRO B 19 1.700 -14.967 14.821 1.00 0.00 H new ATOM 1486 N LYS B 20 6.008 -13.808 14.139 1.00 0.00 N ATOM 1487 CA LYS B 20 7.463 -13.590 14.362 1.00 0.00 C ATOM 1488 C LYS B 20 8.257 -14.096 13.154 1.00 0.00 C ATOM 1489 O LYS B 20 9.444 -13.858 13.040 1.00 0.00 O ATOM 1490 CB LYS B 20 7.856 -14.354 15.619 1.00 0.00 C ATOM 1491 CG LYS B 20 9.375 -14.483 15.723 1.00 0.00 C ATOM 1492 CD LYS B 20 9.719 -15.009 17.120 1.00 0.00 C ATOM 1493 CE LYS B 20 10.751 -16.131 16.997 1.00 0.00 C ATOM 1494 NZ LYS B 20 11.942 -15.667 16.232 1.00 0.00 N ATOM 0 H LYS B 20 5.526 -14.303 14.890 1.00 0.00 H new ATOM 0 HA LYS B 20 7.681 -12.529 14.485 1.00 0.00 H new ATOM 0 HB2 LYS B 20 7.469 -13.839 16.499 1.00 0.00 H new ATOM 0 HB3 LYS B 20 7.403 -15.345 15.604 1.00 0.00 H new ATOM 0 HG2 LYS B 20 9.752 -15.162 14.958 1.00 0.00 H new ATOM 0 HG3 LYS B 20 9.851 -13.517 15.553 1.00 0.00 H new ATOM 0 HD2 LYS B 20 10.114 -14.202 17.738 1.00 0.00 H new ATOM 0 HD3 LYS B 20 8.820 -15.378 17.614 1.00 0.00 H new ATOM 0 HE2 LYS B 20 11.056 -16.462 17.990 1.00 0.00 H new ATOM 0 HE3 LYS B 20 10.304 -16.991 16.498 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 12.771 -16.235 16.502 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 11.764 -15.776 15.213 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 12.124 -14.666 16.446 1.00 0.00 H new ATOM 1508 N PHE B 21 7.573 -14.787 12.280 1.00 0.00 N ATOM 1509 CA PHE B 21 8.244 -15.327 11.059 1.00 0.00 C ATOM 1510 C PHE B 21 7.772 -14.558 9.820 1.00 0.00 C ATOM 1511 O PHE B 21 8.436 -14.544 8.799 1.00 0.00 O ATOM 1512 CB PHE B 21 7.862 -16.798 10.908 1.00 0.00 C ATOM 1513 CG PHE B 21 8.573 -17.622 11.981 1.00 0.00 C ATOM 1514 CD1 PHE B 21 9.882 -18.034 11.803 1.00 0.00 C ATOM 1515 CD2 PHE B 21 7.913 -17.967 13.146 1.00 0.00 C ATOM 1516 CE1 PHE B 21 10.517 -18.779 12.776 1.00 0.00 C ATOM 1517 CE2 PHE B 21 8.550 -18.710 14.117 1.00 0.00 C ATOM 1518 CZ PHE B 21 9.851 -19.115 13.931 1.00 0.00 C ATOM 0 H PHE B 21 6.579 -15.001 12.358 1.00 0.00 H new ATOM 0 HA PHE B 21 9.324 -15.220 11.156 1.00 0.00 H new ATOM 0 HB2 PHE B 21 6.782 -16.916 11.000 1.00 0.00 H new ATOM 0 HB3 PHE B 21 8.138 -17.157 9.916 1.00 0.00 H new ATOM 0 HD1 PHE B 21 10.410 -17.771 10.898 1.00 0.00 H new ATOM 0 HD2 PHE B 21 6.891 -17.652 13.296 1.00 0.00 H new ATOM 0 HE1 PHE B 21 11.538 -19.098 12.630 1.00 0.00 H new ATOM 0 HE2 PHE B 21 8.027 -18.974 15.024 1.00 0.00 H new ATOM 0 HZ PHE B 21 10.350 -19.697 14.692 1.00 0.00 H new ATOM 1528 N ILE B 22 6.635 -13.933 9.942 1.00 0.00 N ATOM 1529 CA ILE B 22 6.078 -13.173 8.787 1.00 0.00 C ATOM 1530 C ILE B 22 6.607 -11.742 8.782 1.00 0.00 C ATOM 1531 O ILE B 22 6.649 -11.088 9.807 1.00 0.00 O ATOM 1532 CB ILE B 22 4.552 -13.150 8.901 1.00 0.00 C ATOM 1533 CG1 ILE B 22 3.962 -14.513 8.482 1.00 0.00 C ATOM 1534 CG2 ILE B 22 3.999 -12.063 7.980 1.00 0.00 C ATOM 1535 CD1 ILE B 22 4.750 -15.664 9.131 1.00 0.00 C ATOM 0 H ILE B 22 6.068 -13.915 10.789 1.00 0.00 H new ATOM 0 HA ILE B 22 6.381 -13.659 7.860 1.00 0.00 H new ATOM 0 HB ILE B 22 4.276 -12.946 9.936 1.00 0.00 H new ATOM 0 HG12 ILE B 22 2.915 -14.569 8.778 1.00 0.00 H new ATOM 0 HG13 ILE B 22 3.992 -14.611 7.397 1.00 0.00 H new ATOM 0 HG21 ILE B 22 2.912 -12.040 8.056 1.00 0.00 H new ATOM 0 HG22 ILE B 22 4.404 -11.095 8.276 1.00 0.00 H new ATOM 0 HG23 ILE B 22 4.287 -12.277 6.951 1.00 0.00 H new ATOM 0 HD11 ILE B 22 4.320 -16.618 8.824 1.00 0.00 H new ATOM 0 HD12 ILE B 22 5.792 -15.617 8.813 1.00 0.00 H new ATOM 0 HD13 ILE B 22 4.698 -15.574 10.216 1.00 0.00 H new ATOM 1547 N LYS B 23 7.002 -11.289 7.620 1.00 0.00 N ATOM 1548 CA LYS B 23 7.525 -9.905 7.503 1.00 0.00 C ATOM 1549 C LYS B 23 6.838 -9.179 6.344 1.00 0.00 C ATOM 1550 O LYS B 23 6.949 -7.975 6.219 1.00 0.00 O ATOM 1551 CB LYS B 23 9.038 -9.950 7.261 1.00 0.00 C ATOM 1552 CG LYS B 23 9.755 -10.467 8.521 1.00 0.00 C ATOM 1553 CD LYS B 23 11.107 -9.758 8.647 1.00 0.00 C ATOM 1554 CE LYS B 23 11.907 -10.394 9.786 1.00 0.00 C ATOM 1555 NZ LYS B 23 11.317 -10.031 11.105 1.00 0.00 N ATOM 0 H LYS B 23 6.983 -11.821 6.750 1.00 0.00 H new ATOM 0 HA LYS B 23 7.320 -9.366 8.428 1.00 0.00 H new ATOM 0 HB2 LYS B 23 9.260 -10.598 6.414 1.00 0.00 H new ATOM 0 HB3 LYS B 23 9.404 -8.955 7.006 1.00 0.00 H new ATOM 0 HG2 LYS B 23 9.146 -10.279 9.405 1.00 0.00 H new ATOM 0 HG3 LYS B 23 9.899 -11.546 8.457 1.00 0.00 H new ATOM 0 HD2 LYS B 23 11.660 -9.836 7.711 1.00 0.00 H new ATOM 0 HD3 LYS B 23 10.957 -8.696 8.841 1.00 0.00 H new ATOM 0 HE2 LYS B 23 11.916 -11.478 9.671 1.00 0.00 H new ATOM 0 HE3 LYS B 23 12.944 -10.060 9.741 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 11.920 -10.400 11.868 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 11.253 -8.996 11.184 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 10.366 -10.444 11.185 1.00 0.00 H new ATOM 1569 N GLU B 24 6.143 -9.924 5.517 1.00 0.00 N ATOM 1570 CA GLU B 24 5.430 -9.272 4.373 1.00 0.00 C ATOM 1571 C GLU B 24 4.044 -9.908 4.189 1.00 0.00 C ATOM 1572 O GLU B 24 3.930 -11.098 3.973 1.00 0.00 O ATOM 1573 CB GLU B 24 6.253 -9.443 3.099 1.00 0.00 C ATOM 1574 CG GLU B 24 5.347 -9.231 1.884 1.00 0.00 C ATOM 1575 CD GLU B 24 6.206 -8.895 0.664 1.00 0.00 C ATOM 1576 OE1 GLU B 24 7.407 -9.076 0.782 1.00 0.00 O ATOM 1577 OE2 GLU B 24 5.614 -8.476 -0.317 1.00 0.00 O ATOM 0 H GLU B 24 6.039 -10.937 5.582 1.00 0.00 H new ATOM 0 HA GLU B 24 5.305 -8.210 4.583 1.00 0.00 H new ATOM 0 HB2 GLU B 24 7.075 -8.728 3.084 1.00 0.00 H new ATOM 0 HB3 GLU B 24 6.696 -10.439 3.068 1.00 0.00 H new ATOM 0 HG2 GLU B 24 4.760 -10.129 1.693 1.00 0.00 H new ATOM 0 HG3 GLU B 24 4.641 -8.424 2.079 1.00 0.00 H new ATOM 1584 N LEU B 25 3.020 -9.096 4.275 1.00 0.00 N ATOM 1585 CA LEU B 25 1.638 -9.638 4.120 1.00 0.00 C ATOM 1586 C LEU B 25 1.143 -9.434 2.687 1.00 0.00 C ATOM 1587 O LEU B 25 1.550 -8.510 2.011 1.00 0.00 O ATOM 1588 CB LEU B 25 0.703 -8.912 5.090 1.00 0.00 C ATOM 1589 CG LEU B 25 -0.577 -9.734 5.266 1.00 0.00 C ATOM 1590 CD1 LEU B 25 -0.502 -10.521 6.574 1.00 0.00 C ATOM 1591 CD2 LEU B 25 -1.776 -8.786 5.315 1.00 0.00 C ATOM 0 H LEU B 25 3.081 -8.092 4.444 1.00 0.00 H new ATOM 0 HA LEU B 25 1.647 -10.706 4.339 1.00 0.00 H new ATOM 0 HB2 LEU B 25 1.195 -8.773 6.053 1.00 0.00 H new ATOM 0 HB3 LEU B 25 0.463 -7.920 4.708 1.00 0.00 H new ATOM 0 HG LEU B 25 -0.686 -10.427 4.432 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -1.413 -11.106 6.699 1.00 0.00 H new ATOM 0 HD12 LEU B 25 0.358 -11.190 6.547 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -0.397 -9.829 7.410 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -2.692 -9.364 5.440 1.00 0.00 H new ATOM 0 HD22 LEU B 25 -1.663 -8.099 6.154 1.00 0.00 H new ATOM 0 HD23 LEU B 25 -1.829 -8.218 4.386 1.00 0.00 H new ATOM 1603 N ARG B 26 0.273 -10.303 2.255 1.00 0.00 N ATOM 1604 CA ARG B 26 -0.262 -10.179 0.871 1.00 0.00 C ATOM 1605 C ARG B 26 -1.733 -10.602 0.827 1.00 0.00 C ATOM 1606 O ARG B 26 -2.110 -11.605 1.393 1.00 0.00 O ATOM 1607 CB ARG B 26 0.551 -11.071 -0.050 1.00 0.00 C ATOM 1608 CG ARG B 26 1.862 -10.370 -0.408 1.00 0.00 C ATOM 1609 CD ARG B 26 2.663 -11.251 -1.368 1.00 0.00 C ATOM 1610 NE ARG B 26 1.863 -11.472 -2.605 1.00 0.00 N ATOM 1611 CZ ARG B 26 2.352 -12.218 -3.558 1.00 0.00 C ATOM 1612 NH1 ARG B 26 2.784 -13.413 -3.262 1.00 0.00 N ATOM 1613 NH2 ARG B 26 2.395 -11.744 -4.773 1.00 0.00 N ATOM 0 H ARG B 26 -0.089 -11.089 2.796 1.00 0.00 H new ATOM 0 HA ARG B 26 -0.190 -9.140 0.548 1.00 0.00 H new ATOM 0 HB2 ARG B 26 0.757 -12.024 0.437 1.00 0.00 H new ATOM 0 HB3 ARG B 26 -0.016 -11.291 -0.955 1.00 0.00 H new ATOM 0 HG2 ARG B 26 1.657 -9.404 -0.869 1.00 0.00 H new ATOM 0 HG3 ARG B 26 2.442 -10.176 0.494 1.00 0.00 H new ATOM 0 HD2 ARG B 26 3.612 -10.774 -1.613 1.00 0.00 H new ATOM 0 HD3 ARG B 26 2.898 -12.205 -0.896 1.00 0.00 H new ATOM 0 HE ARG B 26 0.942 -11.045 -2.706 1.00 0.00 H new ATOM 0 HH11 ARG B 26 2.736 -13.749 -2.300 1.00 0.00 H new ATOM 0 HH12 ARG B 26 3.170 -14.011 -3.993 1.00 0.00 H new ATOM 0 HH21 ARG B 26 2.050 -10.804 -4.966 1.00 0.00 H new ATOM 0 HH22 ARG B 26 2.774 -12.314 -5.530 1.00 0.00 H new ATOM 1627 N VAL B 27 -2.529 -9.821 0.153 1.00 0.00 N ATOM 1628 CA VAL B 27 -3.979 -10.156 0.050 1.00 0.00 C ATOM 1629 C VAL B 27 -4.465 -9.904 -1.374 1.00 0.00 C ATOM 1630 O VAL B 27 -4.116 -8.913 -1.979 1.00 0.00 O ATOM 1631 CB VAL B 27 -4.765 -9.279 1.022 1.00 0.00 C ATOM 1632 CG1 VAL B 27 -6.208 -9.787 1.119 1.00 0.00 C ATOM 1633 CG2 VAL B 27 -4.113 -9.353 2.403 1.00 0.00 C ATOM 0 H VAL B 27 -2.242 -8.969 -0.329 1.00 0.00 H new ATOM 0 HA VAL B 27 -4.130 -11.207 0.298 1.00 0.00 H new ATOM 0 HB VAL B 27 -4.765 -8.249 0.666 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -6.768 -9.161 1.813 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -6.675 -9.746 0.135 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -6.208 -10.816 1.478 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -4.670 -8.729 3.102 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -4.120 -10.385 2.754 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -3.084 -8.998 2.339 1.00 0.00 H new ATOM 1643 N ILE B 28 -5.256 -10.815 -1.876 1.00 0.00 N ATOM 1644 CA ILE B 28 -5.783 -10.652 -3.270 1.00 0.00 C ATOM 1645 C ILE B 28 -7.296 -10.870 -3.296 1.00 0.00 C ATOM 1646 O ILE B 28 -7.785 -11.923 -2.939 1.00 0.00 O ATOM 1647 CB ILE B 28 -5.095 -11.682 -4.177 1.00 0.00 C ATOM 1648 CG1 ILE B 28 -3.583 -11.413 -4.164 1.00 0.00 C ATOM 1649 CG2 ILE B 28 -5.627 -11.555 -5.615 1.00 0.00 C ATOM 1650 CD1 ILE B 28 -2.858 -12.493 -4.976 1.00 0.00 C ATOM 0 H ILE B 28 -5.560 -11.658 -1.390 1.00 0.00 H new ATOM 0 HA ILE B 28 -5.575 -9.642 -3.623 1.00 0.00 H new ATOM 0 HB ILE B 28 -5.302 -12.689 -3.813 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -3.376 -10.429 -4.584 1.00 0.00 H new ATOM 0 HG13 ILE B 28 -3.214 -11.407 -3.138 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -5.134 -12.289 -6.252 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -6.702 -11.733 -5.622 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -5.422 -10.553 -5.991 1.00 0.00 H new ATOM 0 HD11 ILE B 28 -1.786 -12.298 -4.964 1.00 0.00 H new ATOM 0 HD12 ILE B 28 -3.054 -13.471 -4.537 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -3.218 -12.478 -6.005 1.00 0.00 H new ATOM 1662 N GLU B 29 -8.004 -9.863 -3.722 1.00 0.00 N ATOM 1663 CA GLU B 29 -9.483 -9.984 -3.789 1.00 0.00 C ATOM 1664 C GLU B 29 -9.886 -10.703 -5.077 1.00 0.00 C ATOM 1665 O GLU B 29 -9.105 -10.802 -6.003 1.00 0.00 O ATOM 1666 CB GLU B 29 -10.097 -8.583 -3.770 1.00 0.00 C ATOM 1667 CG GLU B 29 -11.579 -8.673 -4.145 1.00 0.00 C ATOM 1668 CD GLU B 29 -12.279 -7.370 -3.754 1.00 0.00 C ATOM 1669 OE1 GLU B 29 -11.578 -6.373 -3.699 1.00 0.00 O ATOM 1670 OE2 GLU B 29 -13.477 -7.446 -3.532 1.00 0.00 O ATOM 0 H GLU B 29 -7.624 -8.966 -4.025 1.00 0.00 H new ATOM 0 HA GLU B 29 -9.843 -10.558 -2.935 1.00 0.00 H new ATOM 0 HB2 GLU B 29 -9.987 -8.139 -2.781 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -9.572 -7.934 -4.471 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -11.685 -8.849 -5.215 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -12.044 -9.517 -3.635 1.00 0.00 H new ATOM 1677 N SER B 30 -11.094 -11.202 -5.097 1.00 0.00 N ATOM 1678 CA SER B 30 -11.590 -11.915 -6.318 1.00 0.00 C ATOM 1679 C SER B 30 -11.102 -11.209 -7.587 1.00 0.00 C ATOM 1680 O SER B 30 -11.371 -10.041 -7.789 1.00 0.00 O ATOM 1681 CB SER B 30 -13.116 -11.916 -6.306 1.00 0.00 C ATOM 1682 OG SER B 30 -13.461 -10.586 -5.949 1.00 0.00 O ATOM 0 H SER B 30 -11.759 -11.149 -4.325 1.00 0.00 H new ATOM 0 HA SER B 30 -11.208 -12.936 -6.312 1.00 0.00 H new ATOM 0 HB2 SER B 30 -13.522 -12.185 -7.281 1.00 0.00 H new ATOM 0 HB3 SER B 30 -13.508 -12.636 -5.588 1.00 0.00 H new ATOM 0 HG SER B 30 -12.978 -9.957 -6.525 1.00 0.00 H new ATOM 1688 N GLY B 31 -10.394 -11.941 -8.410 1.00 0.00 N ATOM 1689 CA GLY B 31 -9.872 -11.347 -9.676 1.00 0.00 C ATOM 1690 C GLY B 31 -10.431 -12.109 -10.883 1.00 0.00 C ATOM 1691 O GLY B 31 -11.299 -12.949 -10.746 1.00 0.00 O ATOM 0 H GLY B 31 -10.156 -12.921 -8.260 1.00 0.00 H new ATOM 0 HA2 GLY B 31 -10.154 -10.296 -9.737 1.00 0.00 H new ATOM 0 HA3 GLY B 31 -8.783 -11.386 -9.684 1.00 0.00 H new ATOM 1695 N PRO B 32 -9.911 -11.796 -12.050 1.00 0.00 N ATOM 1696 CA PRO B 32 -10.353 -12.444 -13.290 1.00 0.00 C ATOM 1697 C PRO B 32 -9.985 -13.926 -13.260 1.00 0.00 C ATOM 1698 O PRO B 32 -10.246 -14.657 -14.195 1.00 0.00 O ATOM 1699 CB PRO B 32 -9.598 -11.721 -14.412 1.00 0.00 C ATOM 1700 CG PRO B 32 -8.688 -10.646 -13.740 1.00 0.00 C ATOM 1701 CD PRO B 32 -8.852 -10.792 -12.216 1.00 0.00 C ATOM 0 HA PRO B 32 -11.432 -12.384 -13.429 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -8.999 -12.426 -14.988 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -10.296 -11.254 -15.106 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -7.647 -10.789 -14.030 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -8.974 -9.645 -14.063 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -7.923 -11.115 -11.747 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -9.129 -9.844 -11.755 1.00 0.00 H new ATOM 1709 N HIS B 33 -9.385 -14.326 -12.173 1.00 0.00 N ATOM 1710 CA HIS B 33 -8.969 -15.749 -12.023 1.00 0.00 C ATOM 1711 C HIS B 33 -9.658 -16.367 -10.805 1.00 0.00 C ATOM 1712 O HIS B 33 -9.858 -17.565 -10.743 1.00 0.00 O ATOM 1713 CB HIS B 33 -7.462 -15.789 -11.809 1.00 0.00 C ATOM 1714 CG HIS B 33 -7.149 -15.212 -10.427 1.00 0.00 C ATOM 1715 ND1 HIS B 33 -7.621 -14.100 -9.963 1.00 0.00 N ATOM 1716 CD2 HIS B 33 -6.355 -15.729 -9.402 1.00 0.00 C ATOM 1717 CE1 HIS B 33 -7.202 -13.887 -8.772 1.00 0.00 C ATOM 1718 NE2 HIS B 33 -6.427 -14.867 -8.403 1.00 0.00 N ATOM 0 H HIS B 33 -9.164 -13.726 -11.379 1.00 0.00 H new ATOM 0 HA HIS B 33 -9.247 -16.309 -12.916 1.00 0.00 H new ATOM 0 HB2 HIS B 33 -7.097 -16.813 -11.883 1.00 0.00 H new ATOM 0 HB3 HIS B 33 -6.955 -15.213 -12.583 1.00 0.00 H new ATOM 0 HD2 HIS B 33 -5.793 -16.651 -9.422 1.00 0.00 H new ATOM 0 HE1 HIS B 33 -7.452 -13.028 -8.167 1.00 0.00 H new ATOM 0 HE2 HIS B 33 -5.958 -14.954 -7.501 1.00 0.00 H new ATOM 1726 N CYS B 34 -10.005 -15.528 -9.861 1.00 0.00 N ATOM 1727 CA CYS B 34 -10.671 -16.034 -8.621 1.00 0.00 C ATOM 1728 C CYS B 34 -11.926 -15.210 -8.312 1.00 0.00 C ATOM 1729 O CYS B 34 -11.901 -13.995 -8.356 1.00 0.00 O ATOM 1730 CB CYS B 34 -9.690 -15.919 -7.454 1.00 0.00 C ATOM 1731 SG CYS B 34 -9.870 -17.100 -6.093 1.00 0.00 S ATOM 0 H CYS B 34 -9.857 -14.519 -9.894 1.00 0.00 H new ATOM 0 HA CYS B 34 -10.964 -17.073 -8.769 1.00 0.00 H new ATOM 0 HB2 CYS B 34 -8.680 -16.016 -7.852 1.00 0.00 H new ATOM 0 HB3 CYS B 34 -9.775 -14.914 -7.041 1.00 0.00 H new ATOM 1736 N ALA B 35 -12.996 -15.892 -8.006 1.00 0.00 N ATOM 1737 CA ALA B 35 -14.260 -15.172 -7.682 1.00 0.00 C ATOM 1738 C ALA B 35 -14.419 -15.053 -6.161 1.00 0.00 C ATOM 1739 O ALA B 35 -15.511 -14.872 -5.661 1.00 0.00 O ATOM 1740 CB ALA B 35 -15.442 -15.950 -8.259 1.00 0.00 C ATOM 0 H ALA B 35 -13.050 -16.910 -7.966 1.00 0.00 H new ATOM 0 HA ALA B 35 -14.228 -14.172 -8.115 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -16.370 -15.428 -8.025 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -15.333 -16.029 -9.341 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -15.468 -16.949 -7.823 1.00 0.00 H new ATOM 1746 N ASN B 36 -13.317 -15.157 -5.462 1.00 0.00 N ATOM 1747 CA ASN B 36 -13.373 -15.062 -3.970 1.00 0.00 C ATOM 1748 C ASN B 36 -12.228 -14.198 -3.447 1.00 0.00 C ATOM 1749 O ASN B 36 -11.794 -13.277 -4.094 1.00 0.00 O ATOM 1750 CB ASN B 36 -13.258 -16.468 -3.379 1.00 0.00 C ATOM 1751 CG ASN B 36 -14.292 -17.382 -4.042 1.00 0.00 C ATOM 1752 OD1 ASN B 36 -15.317 -16.936 -4.517 1.00 0.00 O ATOM 1753 ND2 ASN B 36 -14.062 -18.666 -4.093 1.00 0.00 N ATOM 0 H ASN B 36 -12.387 -15.302 -5.855 1.00 0.00 H new ATOM 0 HA ASN B 36 -14.318 -14.605 -3.676 1.00 0.00 H new ATOM 0 HB2 ASN B 36 -12.254 -16.861 -3.538 1.00 0.00 H new ATOM 0 HB3 ASN B 36 -13.421 -16.437 -2.302 1.00 0.00 H new ATOM 0 HD21 ASN B 36 -14.741 -19.289 -4.530 1.00 0.00 H new ATOM 0 HD22 ASN B 36 -13.203 -19.046 -3.696 1.00 0.00 H new ATOM 1760 N THR B 37 -11.781 -14.515 -2.278 1.00 0.00 N ATOM 1761 CA THR B 37 -10.656 -13.737 -1.676 1.00 0.00 C ATOM 1762 C THR B 37 -9.670 -14.681 -0.987 1.00 0.00 C ATOM 1763 O THR B 37 -10.056 -15.695 -0.440 1.00 0.00 O ATOM 1764 CB THR B 37 -11.217 -12.748 -0.661 1.00 0.00 C ATOM 1765 OG1 THR B 37 -11.297 -11.513 -1.365 1.00 0.00 O ATOM 1766 CG2 THR B 37 -10.242 -12.494 0.488 1.00 0.00 C ATOM 0 H THR B 37 -12.139 -15.278 -1.704 1.00 0.00 H new ATOM 0 HA THR B 37 -10.131 -13.197 -2.464 1.00 0.00 H new ATOM 0 HB THR B 37 -12.155 -13.128 -0.257 1.00 0.00 H new ATOM 0 HG1 THR B 37 -11.341 -10.773 -0.724 1.00 0.00 H new ATOM 0 HG21 THR B 37 -10.682 -11.784 1.188 1.00 0.00 H new ATOM 0 HG22 THR B 37 -10.036 -13.432 1.004 1.00 0.00 H new ATOM 0 HG23 THR B 37 -9.312 -12.085 0.093 1.00 0.00 H new ATOM 1774 N GLU B 38 -8.416 -14.326 -1.030 1.00 0.00 N ATOM 1775 CA GLU B 38 -7.385 -15.192 -0.381 1.00 0.00 C ATOM 1776 C GLU B 38 -6.296 -14.331 0.271 1.00 0.00 C ATOM 1777 O GLU B 38 -5.715 -13.474 -0.366 1.00 0.00 O ATOM 1778 CB GLU B 38 -6.754 -16.097 -1.440 1.00 0.00 C ATOM 1779 CG GLU B 38 -6.585 -15.308 -2.740 1.00 0.00 C ATOM 1780 CD GLU B 38 -7.807 -15.537 -3.632 1.00 0.00 C ATOM 1781 OE1 GLU B 38 -7.779 -16.527 -4.344 1.00 0.00 O ATOM 1782 OE2 GLU B 38 -8.698 -14.707 -3.552 1.00 0.00 O ATOM 0 H GLU B 38 -8.060 -13.483 -1.481 1.00 0.00 H new ATOM 0 HA GLU B 38 -7.861 -15.796 0.391 1.00 0.00 H new ATOM 0 HB2 GLU B 38 -5.787 -16.462 -1.094 1.00 0.00 H new ATOM 0 HB3 GLU B 38 -7.383 -16.971 -1.610 1.00 0.00 H new ATOM 0 HG2 GLU B 38 -6.473 -14.246 -2.522 1.00 0.00 H new ATOM 0 HG3 GLU B 38 -5.679 -15.625 -3.256 1.00 0.00 H new ATOM 1789 N ILE B 39 -6.044 -14.579 1.530 1.00 0.00 N ATOM 1790 CA ILE B 39 -4.994 -13.788 2.237 1.00 0.00 C ATOM 1791 C ILE B 39 -3.641 -14.501 2.126 1.00 0.00 C ATOM 1792 O ILE B 39 -3.406 -15.497 2.780 1.00 0.00 O ATOM 1793 CB ILE B 39 -5.382 -13.641 3.716 1.00 0.00 C ATOM 1794 CG1 ILE B 39 -6.359 -12.467 3.864 1.00 0.00 C ATOM 1795 CG2 ILE B 39 -4.128 -13.353 4.548 1.00 0.00 C ATOM 1796 CD1 ILE B 39 -7.192 -12.641 5.139 1.00 0.00 C ATOM 0 H ILE B 39 -6.514 -15.287 2.094 1.00 0.00 H new ATOM 0 HA ILE B 39 -4.913 -12.802 1.780 1.00 0.00 H new ATOM 0 HB ILE B 39 -5.849 -14.563 4.064 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -5.809 -11.527 3.904 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -7.015 -12.416 2.995 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -4.404 -13.249 5.597 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -3.422 -14.176 4.438 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -3.665 -12.429 4.201 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -7.884 -11.805 5.239 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -7.755 -13.573 5.081 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -6.530 -12.670 6.005 1.00 0.00 H new ATOM 1808 N ILE B 40 -2.782 -13.981 1.290 1.00 0.00 N ATOM 1809 CA ILE B 40 -1.437 -14.620 1.134 1.00 0.00 C ATOM 1810 C ILE B 40 -0.438 -13.996 2.119 1.00 0.00 C ATOM 1811 O ILE B 40 -0.692 -12.955 2.687 1.00 0.00 O ATOM 1812 CB ILE B 40 -0.946 -14.415 -0.303 1.00 0.00 C ATOM 1813 CG1 ILE B 40 -1.854 -15.196 -1.254 1.00 0.00 C ATOM 1814 CG2 ILE B 40 0.486 -14.938 -0.437 1.00 0.00 C ATOM 1815 CD1 ILE B 40 -1.976 -14.435 -2.574 1.00 0.00 C ATOM 0 H ILE B 40 -2.947 -13.154 0.715 1.00 0.00 H new ATOM 0 HA ILE B 40 -1.517 -15.686 1.346 1.00 0.00 H new ATOM 0 HB ILE B 40 -0.969 -13.353 -0.549 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -1.445 -16.191 -1.431 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -2.839 -15.331 -0.806 1.00 0.00 H new ATOM 0 HG21 ILE B 40 0.833 -14.791 -1.460 1.00 0.00 H new ATOM 0 HG22 ILE B 40 1.137 -14.395 0.248 1.00 0.00 H new ATOM 0 HG23 ILE B 40 0.509 -16.001 -0.195 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -2.623 -14.989 -3.255 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -2.404 -13.450 -2.388 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -0.989 -14.323 -3.022 1.00 0.00 H new ATOM 1827 N VAL B 41 0.674 -14.652 2.308 1.00 0.00 N ATOM 1828 CA VAL B 41 1.691 -14.101 3.250 1.00 0.00 C ATOM 1829 C VAL B 41 3.101 -14.530 2.826 1.00 0.00 C ATOM 1830 O VAL B 41 3.263 -15.477 2.081 1.00 0.00 O ATOM 1831 CB VAL B 41 1.400 -14.618 4.657 1.00 0.00 C ATOM 1832 CG1 VAL B 41 2.009 -16.012 4.820 1.00 0.00 C ATOM 1833 CG2 VAL B 41 2.028 -13.669 5.679 1.00 0.00 C ATOM 0 H VAL B 41 0.921 -15.534 1.858 1.00 0.00 H new ATOM 0 HA VAL B 41 1.639 -13.012 3.235 1.00 0.00 H new ATOM 0 HB VAL B 41 0.323 -14.670 4.815 1.00 0.00 H new ATOM 0 HG11 VAL B 41 1.803 -16.384 5.824 1.00 0.00 H new ATOM 0 HG12 VAL B 41 1.572 -16.688 4.085 1.00 0.00 H new ATOM 0 HG13 VAL B 41 3.087 -15.958 4.667 1.00 0.00 H new ATOM 0 HG21 VAL B 41 1.824 -14.032 6.686 1.00 0.00 H new ATOM 0 HG22 VAL B 41 3.106 -13.625 5.520 1.00 0.00 H new ATOM 0 HG23 VAL B 41 1.603 -12.673 5.560 1.00 0.00 H new ATOM 1843 N LYS B 42 4.093 -13.817 3.310 1.00 0.00 N ATOM 1844 CA LYS B 42 5.502 -14.167 2.946 1.00 0.00 C ATOM 1845 C LYS B 42 6.395 -14.169 4.195 1.00 0.00 C ATOM 1846 O LYS B 42 6.381 -13.231 4.988 1.00 0.00 O ATOM 1847 CB LYS B 42 6.035 -13.143 1.946 1.00 0.00 C ATOM 1848 CG LYS B 42 6.459 -13.857 0.661 1.00 0.00 C ATOM 1849 CD LYS B 42 7.140 -12.848 -0.266 1.00 0.00 C ATOM 1850 CE LYS B 42 7.548 -13.551 -1.561 1.00 0.00 C ATOM 1851 NZ LYS B 42 8.330 -12.628 -2.431 1.00 0.00 N ATOM 0 H LYS B 42 3.989 -13.017 3.934 1.00 0.00 H new ATOM 0 HA LYS B 42 5.514 -15.163 2.503 1.00 0.00 H new ATOM 0 HB2 LYS B 42 5.268 -12.401 1.726 1.00 0.00 H new ATOM 0 HB3 LYS B 42 6.883 -12.608 2.374 1.00 0.00 H new ATOM 0 HG2 LYS B 42 7.140 -14.676 0.892 1.00 0.00 H new ATOM 0 HG3 LYS B 42 5.590 -14.294 0.169 1.00 0.00 H new ATOM 0 HD2 LYS B 42 6.463 -12.022 -0.484 1.00 0.00 H new ATOM 0 HD3 LYS B 42 8.016 -12.421 0.222 1.00 0.00 H new ATOM 0 HE2 LYS B 42 8.143 -14.435 -1.330 1.00 0.00 H new ATOM 0 HE3 LYS B 42 6.660 -13.895 -2.091 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 8.599 -13.121 -3.306 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 7.750 -11.797 -2.666 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 9.187 -12.321 -1.929 1.00 0.00 H new ATOM 1865 N LEU B 43 7.161 -15.221 4.332 1.00 0.00 N ATOM 1866 CA LEU B 43 8.069 -15.331 5.509 1.00 0.00 C ATOM 1867 C LEU B 43 9.484 -14.882 5.124 1.00 0.00 C ATOM 1868 O LEU B 43 9.948 -15.157 4.033 1.00 0.00 O ATOM 1869 CB LEU B 43 8.101 -16.787 5.986 1.00 0.00 C ATOM 1870 CG LEU B 43 6.664 -17.330 6.068 1.00 0.00 C ATOM 1871 CD1 LEU B 43 6.312 -18.084 4.778 1.00 0.00 C ATOM 1872 CD2 LEU B 43 6.562 -18.301 7.246 1.00 0.00 C ATOM 0 H LEU B 43 7.196 -16.005 3.681 1.00 0.00 H new ATOM 0 HA LEU B 43 7.702 -14.690 6.310 1.00 0.00 H new ATOM 0 HB2 LEU B 43 8.692 -17.393 5.299 1.00 0.00 H new ATOM 0 HB3 LEU B 43 8.582 -16.851 6.962 1.00 0.00 H new ATOM 0 HG LEU B 43 5.975 -16.496 6.202 1.00 0.00 H new ATOM 0 HD11 LEU B 43 5.293 -18.465 4.846 1.00 0.00 H new ATOM 0 HD12 LEU B 43 6.391 -17.407 3.928 1.00 0.00 H new ATOM 0 HD13 LEU B 43 7.002 -18.917 4.644 1.00 0.00 H new ATOM 0 HD21 LEU B 43 5.546 -18.690 7.310 1.00 0.00 H new ATOM 0 HD22 LEU B 43 7.258 -19.127 7.098 1.00 0.00 H new ATOM 0 HD23 LEU B 43 6.810 -17.779 8.170 1.00 0.00 H new ATOM 1884 N SER B 44 10.139 -14.204 6.034 1.00 0.00 N ATOM 1885 CA SER B 44 11.525 -13.709 5.742 1.00 0.00 C ATOM 1886 C SER B 44 12.427 -14.838 5.235 1.00 0.00 C ATOM 1887 O SER B 44 13.329 -14.604 4.455 1.00 0.00 O ATOM 1888 CB SER B 44 12.128 -13.125 7.016 1.00 0.00 C ATOM 1889 OG SER B 44 11.697 -14.006 8.043 1.00 0.00 O ATOM 0 H SER B 44 9.780 -13.972 6.960 1.00 0.00 H new ATOM 0 HA SER B 44 11.458 -12.948 4.965 1.00 0.00 H new ATOM 0 HB2 SER B 44 13.216 -13.083 6.958 1.00 0.00 H new ATOM 0 HB3 SER B 44 11.778 -12.108 7.192 1.00 0.00 H new ATOM 0 HG SER B 44 12.047 -13.699 8.905 1.00 0.00 H new ATOM 1895 N ASP B 45 12.176 -16.034 5.682 1.00 0.00 N ATOM 1896 CA ASP B 45 13.032 -17.169 5.226 1.00 0.00 C ATOM 1897 C ASP B 45 12.958 -17.301 3.700 1.00 0.00 C ATOM 1898 O ASP B 45 13.691 -18.063 3.102 1.00 0.00 O ATOM 1899 CB ASP B 45 12.543 -18.459 5.879 1.00 0.00 C ATOM 1900 CG ASP B 45 11.110 -18.731 5.435 1.00 0.00 C ATOM 1901 OD1 ASP B 45 10.935 -18.864 4.237 1.00 0.00 O ATOM 1902 OD2 ASP B 45 10.271 -18.792 6.318 1.00 0.00 O ATOM 0 H ASP B 45 11.429 -16.276 6.333 1.00 0.00 H new ATOM 0 HA ASP B 45 14.066 -16.981 5.514 1.00 0.00 H new ATOM 0 HB2 ASP B 45 13.188 -19.291 5.597 1.00 0.00 H new ATOM 0 HB3 ASP B 45 12.590 -18.372 6.965 1.00 0.00 H new ATOM 1907 N GLY B 46 12.069 -16.551 3.104 1.00 0.00 N ATOM 1908 CA GLY B 46 11.932 -16.607 1.619 1.00 0.00 C ATOM 1909 C GLY B 46 10.866 -17.627 1.205 1.00 0.00 C ATOM 1910 O GLY B 46 10.984 -18.256 0.172 1.00 0.00 O ATOM 0 H GLY B 46 11.436 -15.906 3.577 1.00 0.00 H new ATOM 0 HA2 GLY B 46 11.665 -15.621 1.237 1.00 0.00 H new ATOM 0 HA3 GLY B 46 12.889 -16.874 1.171 1.00 0.00 H new ATOM 1914 N ARG B 47 9.846 -17.767 2.021 1.00 0.00 N ATOM 1915 CA ARG B 47 8.756 -18.745 1.687 1.00 0.00 C ATOM 1916 C ARG B 47 7.435 -18.012 1.430 1.00 0.00 C ATOM 1917 O ARG B 47 7.294 -16.847 1.746 1.00 0.00 O ATOM 1918 CB ARG B 47 8.568 -19.705 2.858 1.00 0.00 C ATOM 1919 CG ARG B 47 9.620 -20.815 2.774 1.00 0.00 C ATOM 1920 CD ARG B 47 9.753 -21.495 4.141 1.00 0.00 C ATOM 1921 NE ARG B 47 9.814 -22.970 3.946 1.00 0.00 N ATOM 1922 CZ ARG B 47 10.930 -23.517 3.545 1.00 0.00 C ATOM 1923 NH1 ARG B 47 11.305 -23.351 2.306 1.00 0.00 N ATOM 1924 NH2 ARG B 47 11.634 -24.210 4.397 1.00 0.00 N ATOM 0 H ARG B 47 9.720 -17.254 2.894 1.00 0.00 H new ATOM 0 HA ARG B 47 9.040 -19.292 0.788 1.00 0.00 H new ATOM 0 HB2 ARG B 47 8.663 -19.169 3.802 1.00 0.00 H new ATOM 0 HB3 ARG B 47 7.566 -20.134 2.834 1.00 0.00 H new ATOM 0 HG2 ARG B 47 9.333 -21.546 2.018 1.00 0.00 H new ATOM 0 HG3 ARG B 47 10.580 -20.399 2.468 1.00 0.00 H new ATOM 0 HD2 ARG B 47 10.651 -21.145 4.649 1.00 0.00 H new ATOM 0 HD3 ARG B 47 8.906 -21.234 4.775 1.00 0.00 H new ATOM 0 HE ARG B 47 8.992 -23.547 4.124 1.00 0.00 H new ATOM 0 HH11 ARG B 47 10.729 -22.801 1.668 1.00 0.00 H new ATOM 0 HH12 ARG B 47 12.174 -23.771 1.975 1.00 0.00 H new ATOM 0 HH21 ARG B 47 11.310 -24.317 5.358 1.00 0.00 H new ATOM 0 HH22 ARG B 47 12.508 -24.645 4.102 1.00 0.00 H new ATOM 1938 N GLU B 48 6.496 -18.720 0.861 1.00 0.00 N ATOM 1939 CA GLU B 48 5.164 -18.106 0.580 1.00 0.00 C ATOM 1940 C GLU B 48 4.059 -19.100 0.950 1.00 0.00 C ATOM 1941 O GLU B 48 4.071 -20.230 0.502 1.00 0.00 O ATOM 1942 CB GLU B 48 5.068 -17.762 -0.906 1.00 0.00 C ATOM 1943 CG GLU B 48 3.868 -16.839 -1.131 1.00 0.00 C ATOM 1944 CD GLU B 48 3.124 -17.275 -2.395 1.00 0.00 C ATOM 1945 OE1 GLU B 48 3.679 -17.041 -3.456 1.00 0.00 O ATOM 1946 OE2 GLU B 48 2.044 -17.816 -2.228 1.00 0.00 O ATOM 0 H GLU B 48 6.593 -19.695 0.579 1.00 0.00 H new ATOM 0 HA GLU B 48 5.047 -17.197 1.170 1.00 0.00 H new ATOM 0 HB2 GLU B 48 5.984 -17.275 -1.239 1.00 0.00 H new ATOM 0 HB3 GLU B 48 4.958 -18.672 -1.496 1.00 0.00 H new ATOM 0 HG2 GLU B 48 3.200 -16.876 -0.271 1.00 0.00 H new ATOM 0 HG3 GLU B 48 4.203 -15.806 -1.230 1.00 0.00 H new ATOM 1953 N LEU B 49 3.130 -18.658 1.760 1.00 0.00 N ATOM 1954 CA LEU B 49 2.021 -19.574 2.183 1.00 0.00 C ATOM 1955 C LEU B 49 0.658 -18.889 2.037 1.00 0.00 C ATOM 1956 O LEU B 49 0.523 -17.706 2.279 1.00 0.00 O ATOM 1957 CB LEU B 49 2.232 -19.953 3.650 1.00 0.00 C ATOM 1958 CG LEU B 49 3.592 -20.648 3.807 1.00 0.00 C ATOM 1959 CD1 LEU B 49 3.867 -20.878 5.294 1.00 0.00 C ATOM 1960 CD2 LEU B 49 3.576 -22.003 3.084 1.00 0.00 C ATOM 0 H LEU B 49 3.089 -17.714 2.144 1.00 0.00 H new ATOM 0 HA LEU B 49 2.034 -20.459 1.547 1.00 0.00 H new ATOM 0 HB2 LEU B 49 2.192 -19.062 4.277 1.00 0.00 H new ATOM 0 HB3 LEU B 49 1.433 -20.614 3.985 1.00 0.00 H new ATOM 0 HG LEU B 49 4.369 -20.019 3.374 1.00 0.00 H new ATOM 0 HD11 LEU B 49 4.832 -21.371 5.414 1.00 0.00 H new ATOM 0 HD12 LEU B 49 3.883 -19.920 5.814 1.00 0.00 H new ATOM 0 HD13 LEU B 49 3.083 -21.507 5.716 1.00 0.00 H new ATOM 0 HD21 LEU B 49 4.545 -22.489 3.201 1.00 0.00 H new ATOM 0 HD22 LEU B 49 2.799 -22.635 3.513 1.00 0.00 H new ATOM 0 HD23 LEU B 49 3.373 -21.848 2.024 1.00 0.00 H new ATOM 1972 N CYS B 50 -0.324 -19.657 1.640 1.00 0.00 N ATOM 1973 CA CYS B 50 -1.695 -19.086 1.490 1.00 0.00 C ATOM 1974 C CYS B 50 -2.527 -19.440 2.729 1.00 0.00 C ATOM 1975 O CYS B 50 -2.744 -20.600 3.020 1.00 0.00 O ATOM 1976 CB CYS B 50 -2.354 -19.677 0.242 1.00 0.00 C ATOM 1977 SG CYS B 50 -1.483 -19.481 -1.333 1.00 0.00 S ATOM 0 H CYS B 50 -0.237 -20.648 1.415 1.00 0.00 H new ATOM 0 HA CYS B 50 -1.636 -18.002 1.390 1.00 0.00 H new ATOM 0 HB2 CYS B 50 -2.504 -20.743 0.413 1.00 0.00 H new ATOM 0 HB3 CYS B 50 -3.342 -19.228 0.138 1.00 0.00 H new ATOM 1982 N LEU B 51 -2.974 -18.437 3.430 1.00 0.00 N ATOM 1983 CA LEU B 51 -3.772 -18.706 4.665 1.00 0.00 C ATOM 1984 C LEU B 51 -5.274 -18.680 4.363 1.00 0.00 C ATOM 1985 O LEU B 51 -5.721 -17.987 3.471 1.00 0.00 O ATOM 1986 CB LEU B 51 -3.447 -17.634 5.704 1.00 0.00 C ATOM 1987 CG LEU B 51 -1.933 -17.413 5.741 1.00 0.00 C ATOM 1988 CD1 LEU B 51 -1.590 -16.466 6.894 1.00 0.00 C ATOM 1989 CD2 LEU B 51 -1.231 -18.754 5.965 1.00 0.00 C ATOM 0 H LEU B 51 -2.826 -17.453 3.208 1.00 0.00 H new ATOM 0 HA LEU B 51 -3.515 -19.695 5.043 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -3.957 -16.703 5.455 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -3.806 -17.942 6.686 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.603 -16.979 4.797 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -0.512 -16.305 6.925 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -2.095 -15.512 6.744 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -1.918 -16.906 7.836 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -0.152 -18.600 5.992 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -1.560 -19.183 6.911 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -1.480 -19.435 5.152 1.00 0.00 H new ATOM 2001 N ASP B 52 -6.017 -19.441 5.125 1.00 0.00 N ATOM 2002 CA ASP B 52 -7.494 -19.478 4.919 1.00 0.00 C ATOM 2003 C ASP B 52 -8.192 -18.619 6.018 1.00 0.00 C ATOM 2004 O ASP B 52 -8.122 -18.962 7.182 1.00 0.00 O ATOM 2005 CB ASP B 52 -7.970 -20.926 5.047 1.00 0.00 C ATOM 2006 CG ASP B 52 -9.448 -21.009 4.660 1.00 0.00 C ATOM 2007 OD1 ASP B 52 -10.060 -19.953 4.631 1.00 0.00 O ATOM 2008 OD2 ASP B 52 -9.883 -22.122 4.414 1.00 0.00 O ATOM 0 H ASP B 52 -5.666 -20.035 5.877 1.00 0.00 H new ATOM 0 HA ASP B 52 -7.740 -19.083 3.933 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -7.377 -21.574 4.402 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -7.830 -21.278 6.069 1.00 0.00 H new ATOM 2013 N PRO B 53 -8.856 -17.516 5.646 1.00 0.00 N ATOM 2014 CA PRO B 53 -9.525 -16.666 6.647 1.00 0.00 C ATOM 2015 C PRO B 53 -10.657 -17.431 7.349 1.00 0.00 C ATOM 2016 O PRO B 53 -11.407 -16.863 8.117 1.00 0.00 O ATOM 2017 CB PRO B 53 -10.096 -15.481 5.860 1.00 0.00 C ATOM 2018 CG PRO B 53 -9.794 -15.732 4.353 1.00 0.00 C ATOM 2019 CD PRO B 53 -8.989 -17.038 4.253 1.00 0.00 C ATOM 0 HA PRO B 53 -8.832 -16.347 7.425 1.00 0.00 H new ATOM 0 HB2 PRO B 53 -11.170 -15.392 6.026 1.00 0.00 H new ATOM 0 HB3 PRO B 53 -9.643 -14.547 6.191 1.00 0.00 H new ATOM 0 HG2 PRO B 53 -10.721 -15.809 3.784 1.00 0.00 H new ATOM 0 HG3 PRO B 53 -9.229 -14.900 3.932 1.00 0.00 H new ATOM 0 HD2 PRO B 53 -9.503 -17.771 3.632 1.00 0.00 H new ATOM 0 HD3 PRO B 53 -8.013 -16.866 3.800 1.00 0.00 H new ATOM 2027 N LYS B 54 -10.754 -18.702 7.071 1.00 0.00 N ATOM 2028 CA LYS B 54 -11.827 -19.508 7.702 1.00 0.00 C ATOM 2029 C LYS B 54 -11.368 -20.079 9.053 1.00 0.00 C ATOM 2030 O LYS B 54 -12.150 -20.686 9.759 1.00 0.00 O ATOM 2031 CB LYS B 54 -12.202 -20.656 6.767 1.00 0.00 C ATOM 2032 CG LYS B 54 -13.649 -21.073 7.037 1.00 0.00 C ATOM 2033 CD LYS B 54 -14.581 -20.259 6.136 1.00 0.00 C ATOM 2034 CE LYS B 54 -16.028 -20.472 6.588 1.00 0.00 C ATOM 2035 NZ LYS B 54 -16.964 -19.702 5.721 1.00 0.00 N ATOM 0 H LYS B 54 -10.138 -19.212 6.437 1.00 0.00 H new ATOM 0 HA LYS B 54 -12.689 -18.865 7.878 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -12.088 -20.347 5.728 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -11.532 -21.502 6.923 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -13.776 -22.138 6.844 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -13.899 -20.907 8.085 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -14.323 -19.201 6.187 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -14.463 -20.567 5.097 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -16.275 -21.533 6.548 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -16.141 -20.157 7.625 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -17.941 -19.858 6.041 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -16.738 -18.689 5.780 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -16.867 -20.022 4.736 1.00 0.00 H new ATOM 2049 N GLU B 55 -10.113 -19.871 9.387 1.00 0.00 N ATOM 2050 CA GLU B 55 -9.603 -20.408 10.692 1.00 0.00 C ATOM 2051 C GLU B 55 -9.429 -19.274 11.708 1.00 0.00 C ATOM 2052 O GLU B 55 -8.914 -18.221 11.391 1.00 0.00 O ATOM 2053 CB GLU B 55 -8.266 -21.104 10.465 1.00 0.00 C ATOM 2054 CG GLU B 55 -8.385 -22.037 9.261 1.00 0.00 C ATOM 2055 CD GLU B 55 -7.470 -23.246 9.466 1.00 0.00 C ATOM 2056 OE1 GLU B 55 -7.785 -24.018 10.357 1.00 0.00 O ATOM 2057 OE2 GLU B 55 -6.508 -23.329 8.721 1.00 0.00 O ATOM 0 H GLU B 55 -9.431 -19.362 8.824 1.00 0.00 H new ATOM 0 HA GLU B 55 -10.327 -21.121 11.087 1.00 0.00 H new ATOM 0 HB2 GLU B 55 -7.483 -20.366 10.293 1.00 0.00 H new ATOM 0 HB3 GLU B 55 -7.981 -21.670 11.352 1.00 0.00 H new ATOM 0 HG2 GLU B 55 -9.418 -22.364 9.141 1.00 0.00 H new ATOM 0 HG3 GLU B 55 -8.110 -21.509 8.348 1.00 0.00 H new ATOM 2064 N ASN B 56 -9.856 -19.524 12.913 1.00 0.00 N ATOM 2065 CA ASN B 56 -9.749 -18.476 13.969 1.00 0.00 C ATOM 2066 C ASN B 56 -8.284 -18.135 14.276 1.00 0.00 C ATOM 2067 O ASN B 56 -7.947 -16.983 14.466 1.00 0.00 O ATOM 2068 CB ASN B 56 -10.427 -18.985 15.240 1.00 0.00 C ATOM 2069 CG ASN B 56 -11.445 -17.950 15.723 1.00 0.00 C ATOM 2070 OD1 ASN B 56 -12.613 -18.012 15.394 1.00 0.00 O ATOM 2071 ND2 ASN B 56 -11.045 -16.984 16.505 1.00 0.00 N ATOM 0 H ASN B 56 -10.273 -20.405 13.214 1.00 0.00 H new ATOM 0 HA ASN B 56 -10.237 -17.571 13.609 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -10.923 -19.936 15.045 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -9.682 -19.167 16.015 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -11.712 -16.287 16.836 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -10.066 -16.927 16.785 1.00 0.00 H new ATOM 2078 N TRP B 57 -7.438 -19.132 14.320 1.00 0.00 N ATOM 2079 CA TRP B 57 -6.008 -18.839 14.636 1.00 0.00 C ATOM 2080 C TRP B 57 -5.392 -17.935 13.567 1.00 0.00 C ATOM 2081 O TRP B 57 -4.453 -17.219 13.833 1.00 0.00 O ATOM 2082 CB TRP B 57 -5.206 -20.147 14.751 1.00 0.00 C ATOM 2083 CG TRP B 57 -5.322 -20.980 13.464 1.00 0.00 C ATOM 2084 CD1 TRP B 57 -6.191 -21.971 13.295 1.00 0.00 C ATOM 2085 CD2 TRP B 57 -4.533 -20.865 12.408 1.00 0.00 C ATOM 2086 NE1 TRP B 57 -5.890 -22.457 12.080 1.00 0.00 N ATOM 2087 CE2 TRP B 57 -4.853 -21.815 11.451 1.00 0.00 C ATOM 2088 CE3 TRP B 57 -3.503 -19.976 12.165 1.00 0.00 C ATOM 2089 CZ2 TRP B 57 -4.147 -21.876 10.267 1.00 0.00 C ATOM 2090 CZ3 TRP B 57 -2.799 -20.038 10.977 1.00 0.00 C ATOM 2091 CH2 TRP B 57 -3.120 -20.988 10.030 1.00 0.00 C ATOM 0 H TRP B 57 -7.667 -20.112 14.155 1.00 0.00 H new ATOM 0 HA TRP B 57 -5.970 -18.318 15.593 1.00 0.00 H new ATOM 0 HB2 TRP B 57 -4.158 -19.919 14.948 1.00 0.00 H new ATOM 0 HB3 TRP B 57 -5.570 -20.728 15.598 1.00 0.00 H new ATOM 0 HD1 TRP B 57 -6.959 -22.307 13.976 1.00 0.00 H new ATOM 0 HE1 TRP B 57 -6.391 -23.239 11.659 1.00 0.00 H new ATOM 0 HE3 TRP B 57 -3.248 -19.232 12.905 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 -4.399 -22.620 9.526 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 -1.996 -19.341 10.790 1.00 0.00 H new ATOM 0 HH2 TRP B 57 -2.567 -21.036 9.104 1.00 0.00 H new ATOM 2102 N VAL B 58 -5.938 -17.970 12.386 1.00 0.00 N ATOM 2103 CA VAL B 58 -5.375 -17.110 11.302 1.00 0.00 C ATOM 2104 C VAL B 58 -5.720 -15.647 11.565 1.00 0.00 C ATOM 2105 O VAL B 58 -4.931 -14.762 11.303 1.00 0.00 O ATOM 2106 CB VAL B 58 -5.974 -17.542 9.959 1.00 0.00 C ATOM 2107 CG1 VAL B 58 -5.879 -16.389 8.961 1.00 0.00 C ATOM 2108 CG2 VAL B 58 -5.201 -18.742 9.421 1.00 0.00 C ATOM 0 H VAL B 58 -6.738 -18.546 12.123 1.00 0.00 H new ATOM 0 HA VAL B 58 -4.291 -17.220 11.278 1.00 0.00 H new ATOM 0 HB VAL B 58 -7.020 -17.814 10.100 1.00 0.00 H new ATOM 0 HG11 VAL B 58 -6.305 -16.698 8.007 1.00 0.00 H new ATOM 0 HG12 VAL B 58 -6.430 -15.530 9.344 1.00 0.00 H new ATOM 0 HG13 VAL B 58 -4.833 -16.115 8.820 1.00 0.00 H new ATOM 0 HG21 VAL B 58 -5.626 -19.050 8.466 1.00 0.00 H new ATOM 0 HG22 VAL B 58 -4.155 -18.468 9.281 1.00 0.00 H new ATOM 0 HG23 VAL B 58 -5.268 -19.566 10.131 1.00 0.00 H new ATOM 2118 N GLN B 59 -6.892 -15.426 12.078 1.00 0.00 N ATOM 2119 CA GLN B 59 -7.308 -14.029 12.365 1.00 0.00 C ATOM 2120 C GLN B 59 -6.457 -13.448 13.498 1.00 0.00 C ATOM 2121 O GLN B 59 -6.344 -12.251 13.636 1.00 0.00 O ATOM 2122 CB GLN B 59 -8.778 -14.025 12.781 1.00 0.00 C ATOM 2123 CG GLN B 59 -9.350 -12.620 12.589 1.00 0.00 C ATOM 2124 CD GLN B 59 -10.492 -12.401 13.582 1.00 0.00 C ATOM 2125 OE1 GLN B 59 -11.654 -12.452 13.230 1.00 0.00 O ATOM 2126 NE2 GLN B 59 -10.206 -12.157 14.831 1.00 0.00 N ATOM 0 H GLN B 59 -7.577 -16.145 12.310 1.00 0.00 H new ATOM 0 HA GLN B 59 -7.170 -13.420 11.472 1.00 0.00 H new ATOM 0 HB2 GLN B 59 -9.339 -14.744 12.184 1.00 0.00 H new ATOM 0 HB3 GLN B 59 -8.875 -14.331 13.823 1.00 0.00 H new ATOM 0 HG2 GLN B 59 -8.571 -11.873 12.742 1.00 0.00 H new ATOM 0 HG3 GLN B 59 -9.712 -12.498 11.568 1.00 0.00 H new ATOM 0 HE21 GLN B 59 -9.232 -12.113 15.132 1.00 0.00 H new ATOM 0 HE22 GLN B 59 -10.956 -12.010 15.507 1.00 0.00 H new ATOM 2135 N ARG B 60 -5.867 -14.312 14.279 1.00 0.00 N ATOM 2136 CA ARG B 60 -5.039 -13.818 15.417 1.00 0.00 C ATOM 2137 C ARG B 60 -3.589 -13.552 14.984 1.00 0.00 C ATOM 2138 O ARG B 60 -3.090 -12.457 15.149 1.00 0.00 O ATOM 2139 CB ARG B 60 -5.050 -14.862 16.531 1.00 0.00 C ATOM 2140 CG ARG B 60 -6.424 -14.864 17.203 1.00 0.00 C ATOM 2141 CD ARG B 60 -6.411 -15.856 18.367 1.00 0.00 C ATOM 2142 NE ARG B 60 -7.641 -16.693 18.304 1.00 0.00 N ATOM 2143 CZ ARG B 60 -7.994 -17.390 19.350 1.00 0.00 C ATOM 2144 NH1 ARG B 60 -7.412 -18.537 19.569 1.00 0.00 N ATOM 2145 NH2 ARG B 60 -8.916 -16.915 20.142 1.00 0.00 N ATOM 0 H ARG B 60 -5.921 -15.326 14.181 1.00 0.00 H new ATOM 0 HA ARG B 60 -5.465 -12.878 15.769 1.00 0.00 H new ATOM 0 HB2 ARG B 60 -4.829 -15.849 16.124 1.00 0.00 H new ATOM 0 HB3 ARG B 60 -4.274 -14.639 17.263 1.00 0.00 H new ATOM 0 HG2 ARG B 60 -6.668 -13.865 17.564 1.00 0.00 H new ATOM 0 HG3 ARG B 60 -7.194 -15.140 16.483 1.00 0.00 H new ATOM 0 HD2 ARG B 60 -5.523 -16.487 18.314 1.00 0.00 H new ATOM 0 HD3 ARG B 60 -6.367 -15.322 19.316 1.00 0.00 H new ATOM 0 HE ARG B 60 -8.202 -16.721 17.453 1.00 0.00 H new ATOM 0 HH11 ARG B 60 -6.694 -18.875 18.928 1.00 0.00 H new ATOM 0 HH12 ARG B 60 -7.675 -19.095 20.381 1.00 0.00 H new ATOM 0 HH21 ARG B 60 -9.348 -16.013 19.939 1.00 0.00 H new ATOM 0 HH22 ARG B 60 -9.205 -17.445 20.964 1.00 0.00 H new ATOM 2159 N VAL B 61 -2.937 -14.550 14.440 1.00 0.00 N ATOM 2160 CA VAL B 61 -1.522 -14.343 14.026 1.00 0.00 C ATOM 2161 C VAL B 61 -1.435 -13.183 13.030 1.00 0.00 C ATOM 2162 O VAL B 61 -0.488 -12.420 13.040 1.00 0.00 O ATOM 2163 CB VAL B 61 -0.991 -15.636 13.397 1.00 0.00 C ATOM 2164 CG1 VAL B 61 -1.373 -16.818 14.286 1.00 0.00 C ATOM 2165 CG2 VAL B 61 -1.611 -15.824 12.009 1.00 0.00 C ATOM 0 H VAL B 61 -3.317 -15.481 14.269 1.00 0.00 H new ATOM 0 HA VAL B 61 -0.914 -14.093 14.895 1.00 0.00 H new ATOM 0 HB VAL B 61 0.093 -15.579 13.304 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -0.998 -17.741 13.844 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -0.936 -16.685 15.276 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -2.458 -16.872 14.373 1.00 0.00 H new ATOM 0 HG21 VAL B 61 -1.233 -16.744 11.563 1.00 0.00 H new ATOM 0 HG22 VAL B 61 -2.696 -15.884 12.100 1.00 0.00 H new ATOM 0 HG23 VAL B 61 -1.347 -14.978 11.375 1.00 0.00 H new ATOM 2175 N VAL B 62 -2.426 -13.069 12.195 1.00 0.00 N ATOM 2176 CA VAL B 62 -2.417 -11.951 11.213 1.00 0.00 C ATOM 2177 C VAL B 62 -2.706 -10.633 11.938 1.00 0.00 C ATOM 2178 O VAL B 62 -2.042 -9.642 11.713 1.00 0.00 O ATOM 2179 CB VAL B 62 -3.486 -12.202 10.151 1.00 0.00 C ATOM 2180 CG1 VAL B 62 -3.660 -10.941 9.304 1.00 0.00 C ATOM 2181 CG2 VAL B 62 -3.041 -13.356 9.251 1.00 0.00 C ATOM 0 H VAL B 62 -3.232 -13.692 12.148 1.00 0.00 H new ATOM 0 HA VAL B 62 -1.440 -11.891 10.734 1.00 0.00 H new ATOM 0 HB VAL B 62 -4.431 -12.455 10.633 1.00 0.00 H new ATOM 0 HG11 VAL B 62 -4.422 -11.115 8.544 1.00 0.00 H new ATOM 0 HG12 VAL B 62 -3.967 -10.113 9.943 1.00 0.00 H new ATOM 0 HG13 VAL B 62 -2.715 -10.695 8.820 1.00 0.00 H new ATOM 0 HG21 VAL B 62 -3.801 -13.539 8.491 1.00 0.00 H new ATOM 0 HG22 VAL B 62 -2.099 -13.098 8.767 1.00 0.00 H new ATOM 0 HG23 VAL B 62 -2.905 -14.255 9.852 1.00 0.00 H new ATOM 2191 N GLU B 63 -3.693 -10.649 12.799 1.00 0.00 N ATOM 2192 CA GLU B 63 -4.015 -9.401 13.552 1.00 0.00 C ATOM 2193 C GLU B 63 -2.757 -8.896 14.253 1.00 0.00 C ATOM 2194 O GLU B 63 -2.560 -7.708 14.407 1.00 0.00 O ATOM 2195 CB GLU B 63 -5.092 -9.700 14.596 1.00 0.00 C ATOM 2196 CG GLU B 63 -5.360 -8.437 15.419 1.00 0.00 C ATOM 2197 CD GLU B 63 -4.771 -8.613 16.820 1.00 0.00 C ATOM 2198 OE1 GLU B 63 -5.472 -9.191 17.633 1.00 0.00 O ATOM 2199 OE2 GLU B 63 -3.652 -8.160 16.997 1.00 0.00 O ATOM 0 H GLU B 63 -4.279 -11.457 13.010 1.00 0.00 H new ATOM 0 HA GLU B 63 -4.379 -8.641 12.861 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -6.008 -10.031 14.106 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -4.768 -10.511 15.248 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -4.915 -7.570 14.931 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -6.432 -8.251 15.483 1.00 0.00 H new ATOM 2206 N LYS B 64 -1.930 -9.817 14.665 1.00 0.00 N ATOM 2207 CA LYS B 64 -0.677 -9.418 15.357 1.00 0.00 C ATOM 2208 C LYS B 64 0.252 -8.688 14.383 1.00 0.00 C ATOM 2209 O LYS B 64 0.791 -7.647 14.702 1.00 0.00 O ATOM 2210 CB LYS B 64 0.013 -10.667 15.886 1.00 0.00 C ATOM 2211 CG LYS B 64 -0.091 -10.693 17.412 1.00 0.00 C ATOM 2212 CD LYS B 64 0.443 -12.031 17.929 1.00 0.00 C ATOM 2213 CE LYS B 64 -0.736 -12.933 18.304 1.00 0.00 C ATOM 2214 NZ LYS B 64 -0.246 -14.248 18.804 1.00 0.00 N ATOM 0 H LYS B 64 -2.068 -10.821 14.553 1.00 0.00 H new ATOM 0 HA LYS B 64 -0.914 -8.747 16.183 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -0.449 -11.559 15.463 1.00 0.00 H new ATOM 0 HB3 LYS B 64 1.059 -10.675 15.581 1.00 0.00 H new ATOM 0 HG2 LYS B 64 0.479 -9.869 17.842 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -1.128 -10.558 17.720 1.00 0.00 H new ATOM 0 HD2 LYS B 64 1.055 -12.511 17.166 1.00 0.00 H new ATOM 0 HD3 LYS B 64 1.083 -11.870 18.796 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -1.343 -12.449 19.069 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -1.378 -13.083 17.436 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -1.057 -14.848 19.054 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 0.314 -14.714 18.062 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 0.348 -14.100 19.645 1.00 0.00 H new ATOM 2228 N PHE B 65 0.426 -9.249 13.212 1.00 0.00 N ATOM 2229 CA PHE B 65 1.314 -8.579 12.216 1.00 0.00 C ATOM 2230 C PHE B 65 0.846 -7.142 11.988 1.00 0.00 C ATOM 2231 O PHE B 65 1.647 -6.238 11.853 1.00 0.00 O ATOM 2232 CB PHE B 65 1.270 -9.332 10.897 1.00 0.00 C ATOM 2233 CG PHE B 65 2.205 -8.638 9.897 1.00 0.00 C ATOM 2234 CD1 PHE B 65 3.578 -8.649 10.088 1.00 0.00 C ATOM 2235 CD2 PHE B 65 1.688 -7.987 8.789 1.00 0.00 C ATOM 2236 CE1 PHE B 65 4.417 -8.018 9.185 1.00 0.00 C ATOM 2237 CE2 PHE B 65 2.527 -7.357 7.890 1.00 0.00 C ATOM 2238 CZ PHE B 65 3.891 -7.371 8.087 1.00 0.00 C ATOM 0 H PHE B 65 0.001 -10.125 12.908 1.00 0.00 H new ATOM 0 HA PHE B 65 2.334 -8.575 12.600 1.00 0.00 H new ATOM 0 HB2 PHE B 65 1.577 -10.368 11.044 1.00 0.00 H new ATOM 0 HB3 PHE B 65 0.252 -9.353 10.509 1.00 0.00 H new ATOM 0 HD1 PHE B 65 3.996 -9.153 10.947 1.00 0.00 H new ATOM 0 HD2 PHE B 65 0.620 -7.972 8.627 1.00 0.00 H new ATOM 0 HE1 PHE B 65 5.486 -8.033 9.341 1.00 0.00 H new ATOM 0 HE2 PHE B 65 2.113 -6.852 7.030 1.00 0.00 H new ATOM 0 HZ PHE B 65 4.545 -6.877 7.384 1.00 0.00 H new ATOM 2248 N LEU B 66 -0.446 -6.962 11.950 1.00 0.00 N ATOM 2249 CA LEU B 66 -0.986 -5.590 11.733 1.00 0.00 C ATOM 2250 C LEU B 66 -0.637 -4.696 12.923 1.00 0.00 C ATOM 2251 O LEU B 66 -0.126 -3.608 12.757 1.00 0.00 O ATOM 2252 CB LEU B 66 -2.506 -5.666 11.589 1.00 0.00 C ATOM 2253 CG LEU B 66 -2.864 -5.933 10.126 1.00 0.00 C ATOM 2254 CD1 LEU B 66 -4.191 -6.694 10.065 1.00 0.00 C ATOM 2255 CD2 LEU B 66 -3.017 -4.598 9.393 1.00 0.00 C ATOM 0 H LEU B 66 -1.145 -7.697 12.059 1.00 0.00 H new ATOM 0 HA LEU B 66 -0.546 -5.170 10.829 1.00 0.00 H new ATOM 0 HB2 LEU B 66 -2.903 -6.459 12.223 1.00 0.00 H new ATOM 0 HB3 LEU B 66 -2.961 -4.733 11.922 1.00 0.00 H new ATOM 0 HG LEU B 66 -2.077 -6.523 9.656 1.00 0.00 H new ATOM 0 HD11 LEU B 66 -4.452 -6.887 9.025 1.00 0.00 H new ATOM 0 HD12 LEU B 66 -4.092 -7.641 10.596 1.00 0.00 H new ATOM 0 HD13 LEU B 66 -4.975 -6.097 10.531 1.00 0.00 H new ATOM 0 HD21 LEU B 66 -3.272 -4.783 8.350 1.00 0.00 H new ATOM 0 HD22 LEU B 66 -3.809 -4.014 9.862 1.00 0.00 H new ATOM 0 HD23 LEU B 66 -2.079 -4.045 9.445 1.00 0.00 H new ATOM 2267 N LYS B 67 -0.920 -5.178 14.101 1.00 0.00 N ATOM 2268 CA LYS B 67 -0.617 -4.369 15.316 1.00 0.00 C ATOM 2269 C LYS B 67 0.892 -4.128 15.436 1.00 0.00 C ATOM 2270 O LYS B 67 1.321 -3.103 15.928 1.00 0.00 O ATOM 2271 CB LYS B 67 -1.111 -5.119 16.551 1.00 0.00 C ATOM 2272 CG LYS B 67 -0.900 -4.243 17.788 1.00 0.00 C ATOM 2273 CD LYS B 67 0.059 -4.949 18.747 1.00 0.00 C ATOM 2274 CE LYS B 67 0.381 -4.011 19.911 1.00 0.00 C ATOM 2275 NZ LYS B 67 0.249 -4.727 21.210 1.00 0.00 N ATOM 0 H LYS B 67 -1.344 -6.089 14.275 1.00 0.00 H new ATOM 0 HA LYS B 67 -1.120 -3.405 15.237 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -2.167 -5.368 16.442 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -0.571 -6.060 16.660 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -0.494 -3.274 17.497 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -1.853 -4.054 18.282 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -0.391 -5.870 19.119 1.00 0.00 H new ATOM 0 HD3 LYS B 67 0.974 -5.229 18.225 1.00 0.00 H new ATOM 0 HE2 LYS B 67 1.394 -3.624 19.804 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -0.292 -3.154 19.892 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 0.471 -4.076 21.990 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -0.725 -5.076 21.317 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 0.909 -5.531 21.232 1.00 0.00 H new ATOM 2289 N ARG B 68 1.666 -5.077 14.987 1.00 0.00 N ATOM 2290 CA ARG B 68 3.147 -4.913 15.072 1.00 0.00 C ATOM 2291 C ARG B 68 3.636 -3.945 13.990 1.00 0.00 C ATOM 2292 O ARG B 68 4.456 -3.087 14.247 1.00 0.00 O ATOM 2293 CB ARG B 68 3.815 -6.273 14.882 1.00 0.00 C ATOM 2294 CG ARG B 68 5.208 -6.238 15.515 1.00 0.00 C ATOM 2295 CD ARG B 68 5.985 -7.487 15.094 1.00 0.00 C ATOM 2296 NE ARG B 68 7.343 -7.441 15.705 1.00 0.00 N ATOM 2297 CZ ARG B 68 8.392 -7.596 14.945 1.00 0.00 C ATOM 2298 NH1 ARG B 68 8.790 -8.805 14.656 1.00 0.00 N ATOM 2299 NH2 ARG B 68 9.010 -6.536 14.498 1.00 0.00 N ATOM 0 H ARG B 68 1.344 -5.950 14.569 1.00 0.00 H new ATOM 0 HA ARG B 68 3.407 -4.507 16.050 1.00 0.00 H new ATOM 0 HB2 ARG B 68 3.212 -7.056 15.342 1.00 0.00 H new ATOM 0 HB3 ARG B 68 3.890 -6.511 13.821 1.00 0.00 H new ATOM 0 HG2 ARG B 68 5.741 -5.341 15.200 1.00 0.00 H new ATOM 0 HG3 ARG B 68 5.126 -6.195 16.601 1.00 0.00 H new ATOM 0 HD2 ARG B 68 5.457 -8.385 15.416 1.00 0.00 H new ATOM 0 HD3 ARG B 68 6.062 -7.534 14.008 1.00 0.00 H new ATOM 0 HE ARG B 68 7.452 -7.290 16.708 1.00 0.00 H new ATOM 0 HH11 ARG B 68 8.283 -9.610 15.023 1.00 0.00 H new ATOM 0 HH12 ARG B 68 9.608 -8.945 14.063 1.00 0.00 H new ATOM 0 HH21 ARG B 68 8.671 -5.606 14.744 1.00 0.00 H new ATOM 0 HH22 ARG B 68 9.832 -6.638 13.903 1.00 0.00 H new ATOM 2313 N ALA B 69 3.121 -4.102 12.801 1.00 0.00 N ATOM 2314 CA ALA B 69 3.548 -3.196 11.698 1.00 0.00 C ATOM 2315 C ALA B 69 2.947 -1.799 11.904 1.00 0.00 C ATOM 2316 O ALA B 69 3.435 -0.825 11.368 1.00 0.00 O ATOM 2317 CB ALA B 69 3.076 -3.777 10.361 1.00 0.00 C ATOM 0 H ALA B 69 2.431 -4.810 12.548 1.00 0.00 H new ATOM 0 HA ALA B 69 4.635 -3.111 11.696 1.00 0.00 H new ATOM 0 HB1 ALA B 69 3.385 -3.119 9.549 1.00 0.00 H new ATOM 0 HB2 ALA B 69 3.517 -4.763 10.217 1.00 0.00 H new ATOM 0 HB3 ALA B 69 1.989 -3.863 10.365 1.00 0.00 H new ATOM 2323 N GLU B 70 1.901 -1.730 12.685 1.00 0.00 N ATOM 2324 CA GLU B 70 1.261 -0.405 12.938 1.00 0.00 C ATOM 2325 C GLU B 70 2.033 0.358 14.022 1.00 0.00 C ATOM 2326 O GLU B 70 2.237 1.551 13.918 1.00 0.00 O ATOM 2327 CB GLU B 70 -0.182 -0.624 13.397 1.00 0.00 C ATOM 2328 CG GLU B 70 -0.932 0.711 13.372 1.00 0.00 C ATOM 2329 CD GLU B 70 -1.943 0.742 14.520 1.00 0.00 C ATOM 2330 OE1 GLU B 70 -1.493 0.962 15.633 1.00 0.00 O ATOM 2331 OE2 GLU B 70 -3.109 0.543 14.220 1.00 0.00 O ATOM 0 H GLU B 70 1.466 -2.524 13.154 1.00 0.00 H new ATOM 0 HA GLU B 70 1.273 0.180 12.019 1.00 0.00 H new ATOM 0 HB2 GLU B 70 -0.677 -1.344 12.746 1.00 0.00 H new ATOM 0 HB3 GLU B 70 -0.196 -1.043 14.403 1.00 0.00 H new ATOM 0 HG2 GLU B 70 -0.229 1.538 13.468 1.00 0.00 H new ATOM 0 HG3 GLU B 70 -1.443 0.837 12.418 1.00 0.00 H new ATOM 2338 N ASN B 71 2.445 -0.349 15.040 1.00 0.00 N ATOM 2339 CA ASN B 71 3.201 0.322 16.142 1.00 0.00 C ATOM 2340 C ASN B 71 4.656 0.556 15.723 1.00 0.00 C ATOM 2341 O ASN B 71 5.205 1.617 15.942 1.00 0.00 O ATOM 2342 CB ASN B 71 3.165 -0.565 17.386 1.00 0.00 C ATOM 2343 CG ASN B 71 3.788 0.188 18.564 1.00 0.00 C ATOM 2344 OD1 ASN B 71 4.256 1.390 18.372 1.00 0.00 O flip ATOM 2345 ND2 ASN B 71 3.853 -0.312 19.670 1.00 0.00 N flip ATOM 0 H ASN B 71 2.294 -1.351 15.158 1.00 0.00 H new ATOM 0 HA ASN B 71 2.739 1.285 16.358 1.00 0.00 H new ATOM 0 HB2 ASN B 71 2.137 -0.842 17.620 1.00 0.00 H new ATOM 0 HB3 ASN B 71 3.710 -1.491 17.202 1.00 0.00 H new ATOM 0 HD21 ASN B 71 3.489 -1.252 19.827 1.00 0.00 H new ATOM 0 HD22 ASN B 71 4.272 0.208 20.441 1.00 0.00 H new ATOM 2352 N SER B 72 5.247 -0.442 15.130 1.00 0.00 N ATOM 2353 CA SER B 72 6.665 -0.297 14.691 1.00 0.00 C ATOM 2354 C SER B 72 6.737 0.525 13.400 1.00 0.00 C ATOM 2355 O SER B 72 7.855 0.808 13.000 1.00 0.00 O ATOM 2356 CB SER B 72 7.257 -1.684 14.446 1.00 0.00 C ATOM 2357 OG SER B 72 7.279 -2.283 15.733 1.00 0.00 O ATOM 2358 OXT SER B 72 5.671 0.823 12.888 1.00 0.00 O ATOM 0 H SER B 72 4.816 -1.345 14.931 1.00 0.00 H new ATOM 0 HA SER B 72 7.231 0.217 15.468 1.00 0.00 H new ATOM 0 HB2 SER B 72 6.648 -2.260 13.749 1.00 0.00 H new ATOM 0 HB3 SER B 72 8.258 -1.621 14.019 1.00 0.00 H new ATOM 0 HG SER B 72 7.648 -3.188 15.666 1.00 0.00 H new