USER MOD reduce.3.24.130724 H: found=0, std=0, add=366, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 349 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 39 CYS SG : rot -92:sc= 0.642 USER MOD Set 1.2: A 41 CYS SG : rot 170:sc= 1.46 USER MOD Set 1.3: A 46 CYS SG : rot -3:sc= 1.13 USER MOD Set 1.4: A 48 CYS SG : rot -109:sc= -2.05! USER MOD Set 1.5: A 52 CYS SG : rot -154:sc= 0.631 USER MOD Set 1.6: A 58 CYS SG : rot 54:sc= 0.713! USER MOD Set 1.7: A 60 CYS SG : rot -170:sc= 0.474 USER MOD Set 1.8: A 64 CYS SG : rot -140:sc= -1.57 USER MOD Set 1.9: A 66 CYS SG : rot 180:sc= 0.786 USER MOD Set 1.10: A 67 LYS NZ :NH3+ -168:sc= 2.8 (180deg=1.27) USER MOD Set 2.1: A 10 CYS SG : rot 180:sc= -0.317 USER MOD Set 2.2: A 11 THR OG1 : rot -153:sc= 0.679 USER MOD Set 2.3: A 14 CYS SG : rot -25:sc= 0.116 USER MOD Set 2.4: A 19 CYS SG : rot 180:sc= -0.603 USER MOD Set 2.5: A 21 CYS SG : rot -150:sc= -3.51! USER MOD Set 2.6: A 27 CYS SG : rot -119:sc= -2.15! USER MOD Set 2.7: A 31 CYS SG : rot 180:sc= 0.176 USER MOD Set 2.8: A 33 CYS SG : rot 180:sc= -1.35 USER MOD Set 2.9: A 36 CYS SG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ -137:sc= 0.534 (180deg=0.0122) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 69:sc= 0.998 USER MOD Single : A 20 GLN : amide:sc= 0.172 K(o=0.17,f=-0.59) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00444) USER MOD Single : A 25 CYS SG : rot 80:sc= -1.1 USER MOD Single : A 26 GLN : amide:sc= -0.643 K(o=-0.64,f=-4.2!) USER MOD Single : A 32 THR OG1 : rot -45:sc= 0.721 USER MOD Single : A 37 LYS NZ :NH3+ -133:sc= 2 (180deg=0.995) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= 1.16 K(o=1.2,f=-0.058) USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0575 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -149:sc= -1.41 (180deg=-2.9!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 57:sc= 0.002 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 172:sc= -0.0129 (180deg=-0.124) USER MOD Single : A 62 SER OG : rot 180:sc= 0.0621 USER MOD Single : A 63 SER OG : rot -34:sc= 0.414 USER MOD Single : A 65 SER OG : rot 180:sc= 0.00209 USER MOD ----------------------------------------------------------------- ATOM 98 N LYS A 9 15.260 -7.086 -16.958 1.00 0.00 N ATOM 99 CA LYS A 9 16.703 -6.950 -16.844 1.00 0.00 C ATOM 100 C LYS A 9 17.183 -7.641 -15.589 1.00 0.00 C ATOM 101 O LYS A 9 18.368 -7.925 -15.441 1.00 0.00 O ATOM 102 CB LYS A 9 17.113 -5.487 -16.814 1.00 0.00 C ATOM 103 CG LYS A 9 18.132 -5.112 -17.891 1.00 0.00 C ATOM 104 CD LYS A 9 19.440 -5.881 -17.710 1.00 0.00 C ATOM 105 CE LYS A 9 20.494 -5.462 -18.724 1.00 0.00 C ATOM 106 NZ LYS A 9 21.762 -6.228 -18.555 1.00 0.00 N ATOM 0 HA LYS A 9 17.161 -7.416 -17.717 1.00 0.00 H new ATOM 0 HB2 LYS A 9 16.225 -4.867 -16.935 1.00 0.00 H new ATOM 0 HB3 LYS A 9 17.531 -5.256 -15.834 1.00 0.00 H new ATOM 0 HG2 LYS A 9 17.717 -5.323 -18.877 1.00 0.00 H new ATOM 0 HG3 LYS A 9 18.329 -4.041 -17.851 1.00 0.00 H new ATOM 0 HD2 LYS A 9 19.821 -5.716 -16.702 1.00 0.00 H new ATOM 0 HD3 LYS A 9 19.248 -6.950 -17.807 1.00 0.00 H new ATOM 0 HE2 LYS A 9 20.109 -5.615 -19.732 1.00 0.00 H new ATOM 0 HE3 LYS A 9 20.697 -4.396 -18.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 22.572 -5.581 -18.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 21.773 -6.678 -17.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 21.826 -6.960 -19.291 1.00 0.00 H new ATOM 120 N CYS A 10 16.254 -7.901 -14.680 1.00 0.00 N ATOM 121 CA CYS A 10 16.579 -8.586 -13.459 1.00 0.00 C ATOM 122 C CYS A 10 17.021 -10.000 -13.743 1.00 0.00 C ATOM 123 O CYS A 10 16.543 -10.645 -14.690 1.00 0.00 O ATOM 124 CB CYS A 10 15.402 -8.601 -12.490 1.00 0.00 C ATOM 125 SG CYS A 10 15.073 -7.024 -11.702 1.00 0.00 S ATOM 0 H CYS A 10 15.272 -7.644 -14.775 1.00 0.00 H new ATOM 0 HA CYS A 10 17.398 -8.039 -12.992 1.00 0.00 H new ATOM 0 HB2 CYS A 10 14.508 -8.919 -13.027 1.00 0.00 H new ATOM 0 HB3 CYS A 10 15.592 -9.347 -11.718 1.00 0.00 H new ATOM 0 HG CYS A 10 14.055 -7.143 -10.902 1.00 0.00 H new ATOM 130 N THR A 11 17.913 -10.480 -12.932 1.00 0.00 N ATOM 131 CA THR A 11 18.448 -11.798 -13.078 1.00 0.00 C ATOM 132 C THR A 11 17.591 -12.787 -12.320 1.00 0.00 C ATOM 133 O THR A 11 16.701 -12.389 -11.563 1.00 0.00 O ATOM 134 CB THR A 11 19.858 -11.848 -12.507 1.00 0.00 C ATOM 135 OG1 THR A 11 19.797 -11.603 -11.098 1.00 0.00 O ATOM 136 CG2 THR A 11 20.725 -10.799 -13.166 1.00 0.00 C ATOM 0 H THR A 11 18.294 -9.961 -12.141 1.00 0.00 H new ATOM 0 HA THR A 11 18.464 -12.052 -14.138 1.00 0.00 H new ATOM 0 HB THR A 11 20.291 -12.830 -12.697 1.00 0.00 H new ATOM 0 HG1 THR A 11 20.646 -11.217 -10.796 1.00 0.00 H new ATOM 0 HG21 THR A 11 21.731 -10.844 -12.749 1.00 0.00 H new ATOM 0 HG22 THR A 11 20.768 -10.984 -14.239 1.00 0.00 H new ATOM 0 HG23 THR A 11 20.302 -9.811 -12.985 1.00 0.00 H new ATOM 144 N SER A 12 17.851 -14.064 -12.507 1.00 0.00 N ATOM 145 CA SER A 12 17.141 -15.085 -11.775 1.00 0.00 C ATOM 146 C SER A 12 17.514 -15.007 -10.291 1.00 0.00 C ATOM 147 O SER A 12 16.723 -15.356 -9.410 1.00 0.00 O ATOM 148 CB SER A 12 17.481 -16.462 -12.346 1.00 0.00 C ATOM 149 OG SER A 12 17.194 -16.517 -13.735 1.00 0.00 O ATOM 0 H SER A 12 18.550 -14.417 -13.161 1.00 0.00 H new ATOM 0 HA SER A 12 16.067 -14.926 -11.873 1.00 0.00 H new ATOM 0 HB2 SER A 12 18.536 -16.679 -12.179 1.00 0.00 H new ATOM 0 HB3 SER A 12 16.911 -17.229 -11.822 1.00 0.00 H new ATOM 0 HG SER A 12 17.420 -17.406 -14.081 1.00 0.00 H new ATOM 155 N ALA A 13 18.714 -14.500 -10.032 1.00 0.00 N ATOM 156 CA ALA A 13 19.224 -14.364 -8.683 1.00 0.00 C ATOM 157 C ALA A 13 18.470 -13.281 -7.909 1.00 0.00 C ATOM 158 O ALA A 13 18.166 -13.453 -6.729 1.00 0.00 O ATOM 159 CB ALA A 13 20.711 -14.062 -8.723 1.00 0.00 C ATOM 0 H ALA A 13 19.356 -14.173 -10.754 1.00 0.00 H new ATOM 0 HA ALA A 13 19.068 -15.307 -8.159 1.00 0.00 H new ATOM 0 HB1 ALA A 13 21.089 -13.961 -7.706 1.00 0.00 H new ATOM 0 HB2 ALA A 13 21.234 -14.876 -9.225 1.00 0.00 H new ATOM 0 HB3 ALA A 13 20.879 -13.132 -9.267 1.00 0.00 H new ATOM 165 N CYS A 14 18.161 -12.173 -8.578 1.00 0.00 N ATOM 166 CA CYS A 14 17.430 -11.074 -7.940 1.00 0.00 C ATOM 167 C CYS A 14 15.962 -11.439 -7.767 1.00 0.00 C ATOM 168 O CYS A 14 15.251 -10.864 -6.940 1.00 0.00 O ATOM 169 CB CYS A 14 17.561 -9.779 -8.755 1.00 0.00 C ATOM 170 SG CYS A 14 16.734 -8.341 -8.012 1.00 0.00 S ATOM 0 H CYS A 14 18.402 -12.010 -9.556 1.00 0.00 H new ATOM 0 HA CYS A 14 17.869 -10.905 -6.957 1.00 0.00 H new ATOM 0 HB2 CYS A 14 18.619 -9.549 -8.883 1.00 0.00 H new ATOM 0 HB3 CYS A 14 17.149 -9.946 -9.750 1.00 0.00 H new ATOM 0 HG CYS A 14 15.763 -8.746 -7.249 1.00 0.00 H new ATOM 175 N ARG A 15 15.508 -12.405 -8.546 1.00 0.00 N ATOM 176 CA ARG A 15 14.131 -12.865 -8.454 1.00 0.00 C ATOM 177 C ARG A 15 14.002 -13.903 -7.343 1.00 0.00 C ATOM 178 O ARG A 15 12.927 -14.435 -7.093 1.00 0.00 O ATOM 179 CB ARG A 15 13.662 -13.440 -9.798 1.00 0.00 C ATOM 180 CG ARG A 15 13.804 -12.459 -10.953 1.00 0.00 C ATOM 181 CD ARG A 15 13.413 -13.081 -12.284 1.00 0.00 C ATOM 182 NE ARG A 15 13.993 -12.344 -13.415 1.00 0.00 N ATOM 183 CZ ARG A 15 13.525 -12.370 -14.668 1.00 0.00 C ATOM 184 NH1 ARG A 15 12.409 -13.029 -14.955 1.00 0.00 N ATOM 185 NH2 ARG A 15 14.171 -11.716 -15.628 1.00 0.00 N ATOM 0 H ARG A 15 16.070 -12.886 -9.248 1.00 0.00 H new ATOM 0 HA ARG A 15 13.491 -12.016 -8.212 1.00 0.00 H new ATOM 0 HB2 ARG A 15 14.236 -14.339 -10.021 1.00 0.00 H new ATOM 0 HB3 ARG A 15 12.618 -13.741 -9.712 1.00 0.00 H new ATOM 0 HG2 ARG A 15 13.180 -11.585 -10.765 1.00 0.00 H new ATOM 0 HG3 ARG A 15 14.835 -12.109 -11.006 1.00 0.00 H new ATOM 0 HD2 ARG A 15 13.748 -14.118 -12.314 1.00 0.00 H new ATOM 0 HD3 ARG A 15 12.327 -13.094 -12.376 1.00 0.00 H new ATOM 0 HE ARG A 15 14.815 -11.769 -13.231 1.00 0.00 H new ATOM 0 HH11 ARG A 15 11.903 -13.520 -14.218 1.00 0.00 H new ATOM 0 HH12 ARG A 15 12.058 -13.045 -15.913 1.00 0.00 H new ATOM 0 HH21 ARG A 15 15.021 -11.196 -15.408 1.00 0.00 H new ATOM 0 HH22 ARG A 15 13.817 -11.734 -16.584 1.00 0.00 H new ATOM 199 N SER A 16 15.113 -14.171 -6.680 1.00 0.00 N ATOM 200 CA SER A 16 15.152 -15.105 -5.579 1.00 0.00 C ATOM 201 C SER A 16 15.195 -14.337 -4.261 1.00 0.00 C ATOM 202 O SER A 16 15.564 -13.161 -4.238 1.00 0.00 O ATOM 203 CB SER A 16 16.377 -16.004 -5.712 1.00 0.00 C ATOM 204 OG SER A 16 16.390 -16.654 -6.981 1.00 0.00 O ATOM 0 H SER A 16 16.014 -13.743 -6.894 1.00 0.00 H new ATOM 0 HA SER A 16 14.258 -15.728 -5.595 1.00 0.00 H new ATOM 0 HB2 SER A 16 17.284 -15.411 -5.592 1.00 0.00 H new ATOM 0 HB3 SER A 16 16.376 -16.749 -4.916 1.00 0.00 H new ATOM 0 HG SER A 16 16.552 -15.993 -7.686 1.00 0.00 H new ATOM 210 N GLU A 17 14.812 -14.986 -3.176 1.00 0.00 N ATOM 211 CA GLU A 17 14.809 -14.337 -1.876 1.00 0.00 C ATOM 212 C GLU A 17 15.554 -15.177 -0.832 1.00 0.00 C ATOM 213 O GLU A 17 15.247 -16.362 -0.637 1.00 0.00 O ATOM 214 CB GLU A 17 13.378 -14.043 -1.422 1.00 0.00 C ATOM 215 CG GLU A 17 12.453 -15.249 -1.449 1.00 0.00 C ATOM 216 CD GLU A 17 11.075 -14.926 -0.929 1.00 0.00 C ATOM 217 OE1 GLU A 17 10.836 -15.108 0.284 1.00 0.00 O ATOM 218 OE2 GLU A 17 10.221 -14.479 -1.725 1.00 0.00 O ATOM 0 H GLU A 17 14.500 -15.957 -3.168 1.00 0.00 H new ATOM 0 HA GLU A 17 15.338 -13.389 -1.974 1.00 0.00 H new ATOM 0 HB2 GLU A 17 13.406 -13.644 -0.408 1.00 0.00 H new ATOM 0 HB3 GLU A 17 12.960 -13.264 -2.060 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.375 -15.621 -2.470 1.00 0.00 H new ATOM 0 HG3 GLU A 17 12.886 -16.050 -0.850 1.00 0.00 H new ATOM 225 N PRO A 18 16.571 -14.589 -0.165 1.00 0.00 N ATOM 226 CA PRO A 18 17.004 -13.201 -0.410 1.00 0.00 C ATOM 227 C PRO A 18 17.731 -13.066 -1.746 1.00 0.00 C ATOM 228 O PRO A 18 17.877 -14.053 -2.477 1.00 0.00 O ATOM 229 CB PRO A 18 17.965 -12.927 0.747 1.00 0.00 C ATOM 230 CG PRO A 18 18.501 -14.265 1.112 1.00 0.00 C ATOM 231 CD PRO A 18 17.378 -15.237 0.882 1.00 0.00 C ATOM 0 HA PRO A 18 16.166 -12.505 -0.460 1.00 0.00 H new ATOM 0 HB2 PRO A 18 18.763 -12.248 0.447 1.00 0.00 H new ATOM 0 HB3 PRO A 18 17.451 -12.463 1.588 1.00 0.00 H new ATOM 0 HG2 PRO A 18 19.368 -14.518 0.501 1.00 0.00 H new ATOM 0 HG3 PRO A 18 18.827 -14.284 2.152 1.00 0.00 H new ATOM 0 HD2 PRO A 18 17.749 -16.210 0.558 1.00 0.00 H new ATOM 0 HD3 PRO A 18 16.799 -15.403 1.790 1.00 0.00 H new ATOM 239 N CYS A 19 18.191 -11.862 -2.059 1.00 0.00 N ATOM 240 CA CYS A 19 18.863 -11.622 -3.319 1.00 0.00 C ATOM 241 C CYS A 19 20.132 -12.465 -3.423 1.00 0.00 C ATOM 242 O CYS A 19 20.909 -12.557 -2.473 1.00 0.00 O ATOM 243 CB CYS A 19 19.201 -10.147 -3.481 1.00 0.00 C ATOM 244 SG CYS A 19 19.547 -9.681 -5.183 1.00 0.00 S ATOM 0 H CYS A 19 18.109 -11.042 -1.457 1.00 0.00 H new ATOM 0 HA CYS A 19 18.184 -11.912 -4.121 1.00 0.00 H new ATOM 0 HB2 CYS A 19 18.370 -9.548 -3.109 1.00 0.00 H new ATOM 0 HB3 CYS A 19 20.067 -9.910 -2.863 1.00 0.00 H new ATOM 0 HG CYS A 19 19.823 -8.412 -5.238 1.00 0.00 H new ATOM 249 N GLN A 20 20.331 -13.077 -4.575 1.00 0.00 N ATOM 250 CA GLN A 20 21.477 -13.947 -4.790 1.00 0.00 C ATOM 251 C GLN A 20 22.444 -13.331 -5.800 1.00 0.00 C ATOM 252 O GLN A 20 23.319 -14.009 -6.337 1.00 0.00 O ATOM 253 CB GLN A 20 20.994 -15.317 -5.281 1.00 0.00 C ATOM 254 CG GLN A 20 19.979 -15.969 -4.353 1.00 0.00 C ATOM 255 CD GLN A 20 20.556 -16.280 -2.987 1.00 0.00 C ATOM 256 OE1 GLN A 20 21.748 -16.558 -2.850 1.00 0.00 O ATOM 257 NE2 GLN A 20 19.727 -16.217 -1.971 1.00 0.00 N ATOM 0 H GLN A 20 19.712 -12.989 -5.381 1.00 0.00 H new ATOM 0 HA GLN A 20 22.009 -14.069 -3.846 1.00 0.00 H new ATOM 0 HB2 GLN A 20 20.551 -15.204 -6.270 1.00 0.00 H new ATOM 0 HB3 GLN A 20 21.853 -15.979 -5.390 1.00 0.00 H new ATOM 0 HG2 GLN A 20 19.120 -15.308 -4.239 1.00 0.00 H new ATOM 0 HG3 GLN A 20 19.615 -16.890 -4.808 1.00 0.00 H new ATOM 0 HE21 GLN A 20 18.746 -15.983 -2.127 1.00 0.00 H new ATOM 0 HE22 GLN A 20 20.064 -16.402 -1.026 1.00 0.00 H new ATOM 266 N CYS A 21 22.298 -12.039 -6.033 1.00 0.00 N ATOM 267 CA CYS A 21 23.115 -11.328 -7.011 1.00 0.00 C ATOM 268 C CYS A 21 24.432 -10.826 -6.428 1.00 0.00 C ATOM 269 O CYS A 21 25.009 -9.866 -6.933 1.00 0.00 O ATOM 270 CB CYS A 21 22.326 -10.171 -7.581 1.00 0.00 C ATOM 271 SG CYS A 21 20.915 -10.684 -8.559 1.00 0.00 S ATOM 0 H CYS A 21 21.615 -11.452 -5.555 1.00 0.00 H new ATOM 0 HA CYS A 21 23.370 -12.036 -7.799 1.00 0.00 H new ATOM 0 HB2 CYS A 21 21.981 -9.538 -6.763 1.00 0.00 H new ATOM 0 HB3 CYS A 21 22.985 -9.561 -8.199 1.00 0.00 H new ATOM 0 HG CYS A 21 20.682 -9.799 -9.482 1.00 0.00 H new ATOM 276 N GLY A 22 24.919 -11.490 -5.390 1.00 0.00 N ATOM 277 CA GLY A 22 26.189 -11.103 -4.795 1.00 0.00 C ATOM 278 C GLY A 22 27.329 -11.201 -5.796 1.00 0.00 C ATOM 279 O GLY A 22 28.181 -10.315 -5.875 1.00 0.00 O ATOM 0 H GLY A 22 24.462 -12.288 -4.948 1.00 0.00 H new ATOM 0 HA2 GLY A 22 26.120 -10.082 -4.420 1.00 0.00 H new ATOM 0 HA3 GLY A 22 26.400 -11.743 -3.938 1.00 0.00 H new ATOM 283 N SER A 23 27.331 -12.280 -6.562 1.00 0.00 N ATOM 284 CA SER A 23 28.336 -12.504 -7.588 1.00 0.00 C ATOM 285 C SER A 23 27.690 -13.090 -8.846 1.00 0.00 C ATOM 286 O SER A 23 28.361 -13.677 -9.696 1.00 0.00 O ATOM 287 CB SER A 23 29.413 -13.446 -7.050 1.00 0.00 C ATOM 288 OG SER A 23 28.826 -14.530 -6.337 1.00 0.00 O ATOM 0 H SER A 23 26.637 -13.024 -6.490 1.00 0.00 H new ATOM 0 HA SER A 23 28.796 -11.552 -7.854 1.00 0.00 H new ATOM 0 HB2 SER A 23 30.012 -13.830 -7.876 1.00 0.00 H new ATOM 0 HB3 SER A 23 30.088 -12.897 -6.394 1.00 0.00 H new ATOM 0 HG SER A 23 29.532 -15.122 -6.002 1.00 0.00 H new ATOM 294 N LYS A 24 26.381 -12.907 -8.960 1.00 0.00 N ATOM 295 CA LYS A 24 25.613 -13.448 -10.081 1.00 0.00 C ATOM 296 C LYS A 24 24.720 -12.362 -10.667 1.00 0.00 C ATOM 297 O LYS A 24 23.645 -12.649 -11.197 1.00 0.00 O ATOM 298 CB LYS A 24 24.727 -14.602 -9.590 1.00 0.00 C ATOM 299 CG LYS A 24 25.460 -15.688 -8.820 1.00 0.00 C ATOM 300 CD LYS A 24 24.479 -16.673 -8.201 1.00 0.00 C ATOM 301 CE LYS A 24 25.181 -17.688 -7.317 1.00 0.00 C ATOM 302 NZ LYS A 24 26.043 -18.612 -8.097 1.00 0.00 N ATOM 0 H LYS A 24 25.822 -12.384 -8.285 1.00 0.00 H new ATOM 0 HA LYS A 24 26.305 -13.807 -10.842 1.00 0.00 H new ATOM 0 HB2 LYS A 24 23.942 -14.193 -8.954 1.00 0.00 H new ATOM 0 HB3 LYS A 24 24.236 -15.056 -10.451 1.00 0.00 H new ATOM 0 HG2 LYS A 24 26.140 -16.217 -9.488 1.00 0.00 H new ATOM 0 HG3 LYS A 24 26.070 -15.236 -8.038 1.00 0.00 H new ATOM 0 HD2 LYS A 24 23.740 -16.129 -7.613 1.00 0.00 H new ATOM 0 HD3 LYS A 24 23.938 -17.192 -8.992 1.00 0.00 H new ATOM 0 HE2 LYS A 24 25.788 -17.165 -6.578 1.00 0.00 H new ATOM 0 HE3 LYS A 24 24.437 -18.265 -6.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 26.475 -19.308 -7.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 25.467 -19.107 -8.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 26.791 -18.069 -8.574 1.00 0.00 H new ATOM 316 N CYS A 25 25.172 -11.125 -10.594 1.00 0.00 N ATOM 317 CA CYS A 25 24.348 -10.009 -11.011 1.00 0.00 C ATOM 318 C CYS A 25 24.551 -9.630 -12.474 1.00 0.00 C ATOM 319 O CYS A 25 25.653 -9.723 -13.012 1.00 0.00 O ATOM 320 CB CYS A 25 24.599 -8.801 -10.133 1.00 0.00 C ATOM 321 SG CYS A 25 23.379 -7.500 -10.360 1.00 0.00 S ATOM 0 H CYS A 25 26.098 -10.869 -10.252 1.00 0.00 H new ATOM 0 HA CYS A 25 23.314 -10.338 -10.902 1.00 0.00 H new ATOM 0 HB2 CYS A 25 24.600 -9.112 -9.088 1.00 0.00 H new ATOM 0 HB3 CYS A 25 25.591 -8.403 -10.348 1.00 0.00 H new ATOM 0 HG CYS A 25 22.302 -7.795 -9.695 1.00 0.00 H new ATOM 326 N GLN A 26 23.457 -9.195 -13.094 1.00 0.00 N ATOM 327 CA GLN A 26 23.421 -8.741 -14.488 1.00 0.00 C ATOM 328 C GLN A 26 22.222 -7.809 -14.683 1.00 0.00 C ATOM 329 O GLN A 26 21.806 -7.536 -15.813 1.00 0.00 O ATOM 330 CB GLN A 26 23.296 -9.941 -15.449 1.00 0.00 C ATOM 331 CG GLN A 26 24.596 -10.690 -15.709 1.00 0.00 C ATOM 332 CD GLN A 26 25.566 -9.914 -16.588 1.00 0.00 C ATOM 333 OE1 GLN A 26 25.580 -8.681 -16.598 1.00 0.00 O ATOM 334 NE2 GLN A 26 26.382 -10.632 -17.330 1.00 0.00 N ATOM 0 H GLN A 26 22.548 -9.146 -12.633 1.00 0.00 H new ATOM 0 HA GLN A 26 24.348 -8.212 -14.709 1.00 0.00 H new ATOM 0 HB2 GLN A 26 22.566 -10.640 -15.041 1.00 0.00 H new ATOM 0 HB3 GLN A 26 22.901 -9.586 -16.401 1.00 0.00 H new ATOM 0 HG2 GLN A 26 25.077 -10.913 -14.756 1.00 0.00 H new ATOM 0 HG3 GLN A 26 24.370 -11.645 -16.183 1.00 0.00 H new ATOM 0 HE21 GLN A 26 26.341 -11.651 -17.295 1.00 0.00 H new ATOM 0 HE22 GLN A 26 27.056 -10.170 -17.940 1.00 0.00 H new ATOM 343 N CYS A 27 21.679 -7.316 -13.565 1.00 0.00 N ATOM 344 CA CYS A 27 20.482 -6.476 -13.581 1.00 0.00 C ATOM 345 C CYS A 27 20.704 -5.142 -14.282 1.00 0.00 C ATOM 346 O CYS A 27 21.840 -4.715 -14.513 1.00 0.00 O ATOM 347 CB CYS A 27 19.964 -6.243 -12.161 1.00 0.00 C ATOM 348 SG CYS A 27 19.264 -7.714 -11.386 1.00 0.00 S ATOM 0 H CYS A 27 22.055 -7.487 -12.632 1.00 0.00 H new ATOM 0 HA CYS A 27 19.732 -7.020 -14.155 1.00 0.00 H new ATOM 0 HB2 CYS A 27 20.782 -5.873 -11.543 1.00 0.00 H new ATOM 0 HB3 CYS A 27 19.205 -5.461 -12.186 1.00 0.00 H new ATOM 0 HG CYS A 27 18.014 -7.501 -11.101 1.00 0.00 H new ATOM 353 N GLY A 28 19.603 -4.497 -14.612 1.00 0.00 N ATOM 354 CA GLY A 28 19.636 -3.224 -15.298 1.00 0.00 C ATOM 355 C GLY A 28 18.487 -2.337 -14.869 1.00 0.00 C ATOM 356 O GLY A 28 18.075 -2.374 -13.707 1.00 0.00 O ATOM 0 H GLY A 28 18.664 -4.841 -14.412 1.00 0.00 H new ATOM 0 HA2 GLY A 28 20.582 -2.722 -15.092 1.00 0.00 H new ATOM 0 HA3 GLY A 28 19.589 -3.388 -16.375 1.00 0.00 H new ATOM 360 N GLU A 29 17.955 -1.547 -15.793 1.00 0.00 N ATOM 361 CA GLU A 29 16.817 -0.694 -15.480 1.00 0.00 C ATOM 362 C GLU A 29 15.579 -1.539 -15.220 1.00 0.00 C ATOM 363 O GLU A 29 15.466 -2.664 -15.710 1.00 0.00 O ATOM 364 CB GLU A 29 16.563 0.327 -16.585 1.00 0.00 C ATOM 365 CG GLU A 29 16.305 -0.272 -17.950 1.00 0.00 C ATOM 366 CD GLU A 29 16.192 0.788 -19.009 1.00 0.00 C ATOM 367 OE1 GLU A 29 17.236 1.197 -19.555 1.00 0.00 O ATOM 368 OE2 GLU A 29 15.061 1.234 -19.295 1.00 0.00 O ATOM 0 H GLU A 29 18.289 -1.479 -16.754 1.00 0.00 H new ATOM 0 HA GLU A 29 17.052 -0.137 -14.573 1.00 0.00 H new ATOM 0 HB2 GLU A 29 15.707 0.941 -16.305 1.00 0.00 H new ATOM 0 HB3 GLU A 29 17.424 0.992 -16.652 1.00 0.00 H new ATOM 0 HG2 GLU A 29 17.113 -0.957 -18.206 1.00 0.00 H new ATOM 0 HG3 GLU A 29 15.387 -0.859 -17.923 1.00 0.00 H new ATOM 375 N GLY A 30 14.663 -1.004 -14.446 1.00 0.00 N ATOM 376 CA GLY A 30 13.501 -1.763 -14.044 1.00 0.00 C ATOM 377 C GLY A 30 13.723 -2.339 -12.674 1.00 0.00 C ATOM 378 O GLY A 30 12.795 -2.463 -11.870 1.00 0.00 O ATOM 0 H GLY A 30 14.699 -0.051 -14.084 1.00 0.00 H new ATOM 0 HA2 GLY A 30 12.619 -1.122 -14.041 1.00 0.00 H new ATOM 0 HA3 GLY A 30 13.312 -2.563 -14.759 1.00 0.00 H new ATOM 382 N CYS A 31 14.972 -2.682 -12.408 1.00 0.00 N ATOM 383 CA CYS A 31 15.380 -3.175 -11.120 1.00 0.00 C ATOM 384 C CYS A 31 15.424 -2.021 -10.131 1.00 0.00 C ATOM 385 O CYS A 31 15.718 -0.882 -10.504 1.00 0.00 O ATOM 386 CB CYS A 31 16.756 -3.840 -11.224 1.00 0.00 C ATOM 387 SG CYS A 31 17.487 -4.299 -9.638 1.00 0.00 S ATOM 0 H CYS A 31 15.729 -2.623 -13.089 1.00 0.00 H new ATOM 0 HA CYS A 31 14.663 -3.919 -10.771 1.00 0.00 H new ATOM 0 HB2 CYS A 31 16.668 -4.734 -11.841 1.00 0.00 H new ATOM 0 HB3 CYS A 31 17.435 -3.162 -11.740 1.00 0.00 H new ATOM 0 HG CYS A 31 18.645 -4.854 -9.838 1.00 0.00 H new ATOM 392 N THR A 32 15.131 -2.308 -8.888 1.00 0.00 N ATOM 393 CA THR A 32 15.112 -1.294 -7.857 1.00 0.00 C ATOM 394 C THR A 32 15.600 -1.891 -6.535 1.00 0.00 C ATOM 395 O THR A 32 15.268 -1.411 -5.451 1.00 0.00 O ATOM 396 CB THR A 32 13.676 -0.712 -7.700 1.00 0.00 C ATOM 397 OG1 THR A 32 13.666 0.361 -6.753 1.00 0.00 O ATOM 398 CG2 THR A 32 12.685 -1.791 -7.268 1.00 0.00 C ATOM 0 H THR A 32 14.899 -3.246 -8.560 1.00 0.00 H new ATOM 0 HA THR A 32 15.780 -0.481 -8.142 1.00 0.00 H new ATOM 0 HB THR A 32 13.369 -0.331 -8.674 1.00 0.00 H new ATOM 0 HG1 THR A 32 14.188 0.106 -5.964 1.00 0.00 H new ATOM 0 HG21 THR A 32 11.692 -1.353 -7.167 1.00 0.00 H new ATOM 0 HG22 THR A 32 12.659 -2.582 -8.018 1.00 0.00 H new ATOM 0 HG23 THR A 32 12.996 -2.209 -6.311 1.00 0.00 H new ATOM 406 N CYS A 33 16.429 -2.913 -6.637 1.00 0.00 N ATOM 407 CA CYS A 33 16.907 -3.614 -5.468 1.00 0.00 C ATOM 408 C CYS A 33 18.254 -3.071 -5.011 1.00 0.00 C ATOM 409 O CYS A 33 19.235 -3.132 -5.739 1.00 0.00 O ATOM 410 CB CYS A 33 17.011 -5.103 -5.757 1.00 0.00 C ATOM 411 SG CYS A 33 17.452 -6.086 -4.319 1.00 0.00 S ATOM 0 H CYS A 33 16.784 -3.274 -7.522 1.00 0.00 H new ATOM 0 HA CYS A 33 16.190 -3.456 -4.662 1.00 0.00 H new ATOM 0 HB2 CYS A 33 16.057 -5.456 -6.149 1.00 0.00 H new ATOM 0 HB3 CYS A 33 17.755 -5.262 -6.537 1.00 0.00 H new ATOM 0 HG CYS A 33 17.516 -7.340 -4.654 1.00 0.00 H new ATOM 416 N ALA A 34 18.296 -2.564 -3.790 1.00 0.00 N ATOM 417 CA ALA A 34 19.514 -1.989 -3.232 1.00 0.00 C ATOM 418 C ALA A 34 20.554 -3.065 -2.915 1.00 0.00 C ATOM 419 O ALA A 34 21.696 -2.750 -2.579 1.00 0.00 O ATOM 420 CB ALA A 34 19.187 -1.182 -1.982 1.00 0.00 C ATOM 0 H ALA A 34 17.494 -2.538 -3.160 1.00 0.00 H new ATOM 0 HA ALA A 34 19.945 -1.327 -3.983 1.00 0.00 H new ATOM 0 HB1 ALA A 34 20.104 -0.757 -1.573 1.00 0.00 H new ATOM 0 HB2 ALA A 34 18.497 -0.378 -2.238 1.00 0.00 H new ATOM 0 HB3 ALA A 34 18.726 -1.833 -1.239 1.00 0.00 H new ATOM 426 N ALA A 35 20.160 -4.327 -3.032 1.00 0.00 N ATOM 427 CA ALA A 35 21.058 -5.440 -2.752 1.00 0.00 C ATOM 428 C ALA A 35 22.088 -5.621 -3.866 1.00 0.00 C ATOM 429 O ALA A 35 23.196 -6.106 -3.623 1.00 0.00 O ATOM 430 CB ALA A 35 20.265 -6.726 -2.545 1.00 0.00 C ATOM 0 H ALA A 35 19.222 -4.606 -3.320 1.00 0.00 H new ATOM 0 HA ALA A 35 21.598 -5.209 -1.834 1.00 0.00 H new ATOM 0 HB1 ALA A 35 20.951 -7.547 -2.337 1.00 0.00 H new ATOM 0 HB2 ALA A 35 19.583 -6.601 -1.704 1.00 0.00 H new ATOM 0 HB3 ALA A 35 19.694 -6.950 -3.446 1.00 0.00 H new ATOM 436 N CYS A 36 21.733 -5.218 -5.078 1.00 0.00 N ATOM 437 CA CYS A 36 22.617 -5.395 -6.225 1.00 0.00 C ATOM 438 C CYS A 36 22.704 -4.131 -7.096 1.00 0.00 C ATOM 439 O CYS A 36 23.258 -4.160 -8.195 1.00 0.00 O ATOM 440 CB CYS A 36 22.123 -6.572 -7.050 1.00 0.00 C ATOM 441 SG CYS A 36 20.374 -6.459 -7.472 1.00 0.00 S ATOM 0 H CYS A 36 20.843 -4.768 -5.294 1.00 0.00 H new ATOM 0 HA CYS A 36 23.623 -5.589 -5.853 1.00 0.00 H new ATOM 0 HB2 CYS A 36 22.708 -6.635 -7.967 1.00 0.00 H new ATOM 0 HB3 CYS A 36 22.298 -7.494 -6.496 1.00 0.00 H new ATOM 0 HG CYS A 36 20.030 -7.496 -8.176 1.00 0.00 H new ATOM 446 N LYS A 37 22.189 -3.023 -6.593 1.00 0.00 N ATOM 447 CA LYS A 37 22.222 -1.770 -7.331 1.00 0.00 C ATOM 448 C LYS A 37 23.470 -1.005 -6.981 1.00 0.00 C ATOM 449 O LYS A 37 23.876 -0.968 -5.821 1.00 0.00 O ATOM 450 CB LYS A 37 20.986 -0.914 -7.031 1.00 0.00 C ATOM 451 CG LYS A 37 19.808 -1.144 -7.963 1.00 0.00 C ATOM 452 CD LYS A 37 20.135 -0.727 -9.388 1.00 0.00 C ATOM 453 CE LYS A 37 18.879 -0.627 -10.233 1.00 0.00 C ATOM 454 NZ LYS A 37 17.989 0.476 -9.771 1.00 0.00 N ATOM 0 H LYS A 37 21.743 -2.964 -5.678 1.00 0.00 H new ATOM 0 HA LYS A 37 22.222 -2.004 -8.396 1.00 0.00 H new ATOM 0 HB2 LYS A 37 20.665 -1.111 -6.008 1.00 0.00 H new ATOM 0 HB3 LYS A 37 21.269 0.137 -7.080 1.00 0.00 H new ATOM 0 HG2 LYS A 37 19.530 -2.198 -7.946 1.00 0.00 H new ATOM 0 HG3 LYS A 37 18.946 -0.581 -7.607 1.00 0.00 H new ATOM 0 HD2 LYS A 37 20.648 0.235 -9.379 1.00 0.00 H new ATOM 0 HD3 LYS A 37 20.819 -1.449 -9.833 1.00 0.00 H new ATOM 0 HE2 LYS A 37 19.154 -0.461 -11.275 1.00 0.00 H new ATOM 0 HE3 LYS A 37 18.338 -1.572 -10.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 17.011 0.128 -9.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 18.303 0.807 -8.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 18.031 1.263 -10.449 1.00 0.00 H new ATOM 468 N THR A 38 24.091 -0.412 -7.971 1.00 0.00 N ATOM 469 CA THR A 38 25.297 0.333 -7.740 1.00 0.00 C ATOM 470 C THR A 38 25.272 1.661 -8.494 1.00 0.00 C ATOM 471 O THR A 38 24.908 1.712 -9.671 1.00 0.00 O ATOM 472 CB THR A 38 26.528 -0.481 -8.162 1.00 0.00 C ATOM 473 OG1 THR A 38 26.227 -1.887 -8.074 1.00 0.00 O ATOM 474 CG2 THR A 38 27.688 -0.177 -7.243 1.00 0.00 C ATOM 0 H THR A 38 23.779 -0.433 -8.942 1.00 0.00 H new ATOM 0 HA THR A 38 25.359 0.539 -6.672 1.00 0.00 H new ATOM 0 HB THR A 38 26.792 -0.216 -9.186 1.00 0.00 H new ATOM 0 HG1 THR A 38 27.012 -2.407 -8.345 1.00 0.00 H new ATOM 0 HG21 THR A 38 28.557 -0.759 -7.550 1.00 0.00 H new ATOM 0 HG22 THR A 38 27.925 0.886 -7.296 1.00 0.00 H new ATOM 0 HG23 THR A 38 27.419 -0.438 -6.219 1.00 0.00 H new ATOM 482 N CYS A 39 25.633 2.732 -7.808 1.00 0.00 N ATOM 483 CA CYS A 39 25.664 4.059 -8.402 1.00 0.00 C ATOM 484 C CYS A 39 26.717 4.911 -7.724 1.00 0.00 C ATOM 485 O CYS A 39 26.956 4.770 -6.526 1.00 0.00 O ATOM 486 CB CYS A 39 24.291 4.728 -8.286 1.00 0.00 C ATOM 487 SG CYS A 39 24.252 6.464 -8.792 1.00 0.00 S ATOM 0 H CYS A 39 25.912 2.707 -6.827 1.00 0.00 H new ATOM 0 HA CYS A 39 25.916 3.961 -9.458 1.00 0.00 H new ATOM 0 HB2 CYS A 39 23.578 4.170 -8.893 1.00 0.00 H new ATOM 0 HB3 CYS A 39 23.953 4.657 -7.252 1.00 0.00 H new ATOM 0 HG CYS A 39 24.471 7.222 -7.759 1.00 0.00 H new ATOM 492 N ASN A 40 27.358 5.782 -8.488 1.00 0.00 N ATOM 493 CA ASN A 40 28.372 6.655 -7.935 1.00 0.00 C ATOM 494 C ASN A 40 27.841 8.058 -7.705 1.00 0.00 C ATOM 495 O ASN A 40 28.410 8.814 -6.919 1.00 0.00 O ATOM 496 CB ASN A 40 29.625 6.676 -8.810 1.00 0.00 C ATOM 497 CG ASN A 40 30.529 5.483 -8.545 1.00 0.00 C ATOM 498 OD1 ASN A 40 31.447 5.558 -7.731 1.00 0.00 O ATOM 499 ND2 ASN A 40 30.274 4.376 -9.218 1.00 0.00 N ATOM 0 H ASN A 40 27.193 5.900 -9.488 1.00 0.00 H new ATOM 0 HA ASN A 40 28.651 6.249 -6.963 1.00 0.00 H new ATOM 0 HB2 ASN A 40 29.333 6.682 -9.860 1.00 0.00 H new ATOM 0 HB3 ASN A 40 30.179 7.597 -8.627 1.00 0.00 H new ATOM 0 HD21 ASN A 40 30.848 3.546 -9.070 1.00 0.00 H new ATOM 0 HD22 ASN A 40 29.503 4.351 -9.886 1.00 0.00 H new ATOM 506 N CYS A 41 26.746 8.413 -8.372 1.00 0.00 N ATOM 507 CA CYS A 41 26.149 9.720 -8.169 1.00 0.00 C ATOM 508 C CYS A 41 25.434 9.728 -6.820 1.00 0.00 C ATOM 509 O CYS A 41 24.714 8.790 -6.483 1.00 0.00 O ATOM 510 CB CYS A 41 25.180 10.086 -9.310 1.00 0.00 C ATOM 511 SG CYS A 41 25.954 10.193 -10.971 1.00 0.00 S ATOM 0 H CYS A 41 26.263 7.820 -9.047 1.00 0.00 H new ATOM 0 HA CYS A 41 26.936 10.475 -8.173 1.00 0.00 H new ATOM 0 HB2 CYS A 41 24.383 9.344 -9.343 1.00 0.00 H new ATOM 0 HB3 CYS A 41 24.714 11.044 -9.079 1.00 0.00 H new ATOM 0 HG CYS A 41 25.026 10.293 -11.876 1.00 0.00 H new ATOM 516 N THR A 42 25.654 10.760 -6.049 1.00 0.00 N ATOM 517 CA THR A 42 25.105 10.837 -4.711 1.00 0.00 C ATOM 518 C THR A 42 24.015 11.889 -4.629 1.00 0.00 C ATOM 519 O THR A 42 23.633 12.477 -5.639 1.00 0.00 O ATOM 520 CB THR A 42 26.208 11.173 -3.694 1.00 0.00 C ATOM 521 OG1 THR A 42 26.853 12.396 -4.070 1.00 0.00 O ATOM 522 CG2 THR A 42 27.238 10.054 -3.628 1.00 0.00 C ATOM 0 H THR A 42 26.214 11.568 -6.323 1.00 0.00 H new ATOM 0 HA THR A 42 24.676 9.863 -4.475 1.00 0.00 H new ATOM 0 HB THR A 42 25.751 11.285 -2.711 1.00 0.00 H new ATOM 0 HG1 THR A 42 27.554 12.609 -3.420 1.00 0.00 H new ATOM 0 HG21 THR A 42 28.010 10.312 -2.903 1.00 0.00 H new ATOM 0 HG22 THR A 42 26.750 9.128 -3.325 1.00 0.00 H new ATOM 0 HG23 THR A 42 27.693 9.920 -4.609 1.00 0.00 H new ATOM 530 N SER A 43 23.529 12.136 -3.420 1.00 0.00 N ATOM 531 CA SER A 43 22.493 13.128 -3.199 1.00 0.00 C ATOM 532 C SER A 43 23.046 14.535 -3.419 1.00 0.00 C ATOM 533 O SER A 43 22.289 15.499 -3.549 1.00 0.00 O ATOM 534 CB SER A 43 21.930 12.992 -1.789 1.00 0.00 C ATOM 535 OG SER A 43 21.500 11.660 -1.543 1.00 0.00 O ATOM 0 H SER A 43 23.840 11.658 -2.574 1.00 0.00 H new ATOM 0 HA SER A 43 21.689 12.959 -3.915 1.00 0.00 H new ATOM 0 HB2 SER A 43 22.690 13.274 -1.060 1.00 0.00 H new ATOM 0 HB3 SER A 43 21.094 13.679 -1.659 1.00 0.00 H new ATOM 0 HG SER A 43 21.144 11.594 -0.632 1.00 0.00 H new ATOM 541 N ASP A 44 24.375 14.639 -3.460 1.00 0.00 N ATOM 542 CA ASP A 44 25.045 15.903 -3.726 1.00 0.00 C ATOM 543 C ASP A 44 24.683 16.398 -5.115 1.00 0.00 C ATOM 544 O ASP A 44 24.443 17.590 -5.325 1.00 0.00 O ATOM 545 CB ASP A 44 26.564 15.740 -3.606 1.00 0.00 C ATOM 546 CG ASP A 44 27.324 16.972 -4.062 1.00 0.00 C ATOM 547 OD1 ASP A 44 27.426 17.939 -3.279 1.00 0.00 O ATOM 548 OD2 ASP A 44 27.825 16.977 -5.203 1.00 0.00 O ATOM 0 H ASP A 44 25.009 13.854 -3.311 1.00 0.00 H new ATOM 0 HA ASP A 44 24.715 16.635 -2.989 1.00 0.00 H new ATOM 0 HB2 ASP A 44 26.821 15.523 -2.569 1.00 0.00 H new ATOM 0 HB3 ASP A 44 26.881 14.882 -4.199 1.00 0.00 H new ATOM 553 N GLY A 45 24.620 15.476 -6.054 1.00 0.00 N ATOM 554 CA GLY A 45 24.277 15.826 -7.397 1.00 0.00 C ATOM 555 C GLY A 45 24.624 14.741 -8.379 1.00 0.00 C ATOM 556 O GLY A 45 25.507 13.917 -8.123 1.00 0.00 O ATOM 0 H GLY A 45 24.803 14.484 -5.902 1.00 0.00 H new ATOM 0 HA2 GLY A 45 23.209 16.035 -7.453 1.00 0.00 H new ATOM 0 HA3 GLY A 45 24.797 16.743 -7.675 1.00 0.00 H new ATOM 560 N CYS A 46 23.927 14.730 -9.492 1.00 0.00 N ATOM 561 CA CYS A 46 24.172 13.765 -10.541 1.00 0.00 C ATOM 562 C CYS A 46 25.418 14.169 -11.338 1.00 0.00 C ATOM 563 O CYS A 46 25.546 15.327 -11.763 1.00 0.00 O ATOM 564 CB CYS A 46 22.960 13.691 -11.468 1.00 0.00 C ATOM 565 SG CYS A 46 23.148 12.538 -12.843 1.00 0.00 S ATOM 0 H CYS A 46 23.175 15.388 -9.696 1.00 0.00 H new ATOM 0 HA CYS A 46 24.339 12.784 -10.095 1.00 0.00 H new ATOM 0 HB2 CYS A 46 22.087 13.402 -10.883 1.00 0.00 H new ATOM 0 HB3 CYS A 46 22.761 14.686 -11.867 1.00 0.00 H new ATOM 0 HG CYS A 46 24.341 12.022 -12.817 1.00 0.00 H new ATOM 570 N LYS A 47 26.333 13.232 -11.536 1.00 0.00 N ATOM 571 CA LYS A 47 27.564 13.527 -12.261 1.00 0.00 C ATOM 572 C LYS A 47 27.559 12.940 -13.663 1.00 0.00 C ATOM 573 O LYS A 47 28.229 13.457 -14.557 1.00 0.00 O ATOM 574 CB LYS A 47 28.791 13.029 -11.495 1.00 0.00 C ATOM 575 CG LYS A 47 29.059 13.776 -10.198 1.00 0.00 C ATOM 576 CD LYS A 47 30.349 13.307 -9.520 1.00 0.00 C ATOM 577 CE LYS A 47 31.608 13.947 -10.121 1.00 0.00 C ATOM 578 NZ LYS A 47 31.874 13.516 -11.522 1.00 0.00 N ATOM 0 H LYS A 47 26.250 12.269 -11.209 1.00 0.00 H new ATOM 0 HA LYS A 47 27.618 14.612 -12.350 1.00 0.00 H new ATOM 0 HB2 LYS A 47 28.661 11.970 -11.272 1.00 0.00 H new ATOM 0 HB3 LYS A 47 29.667 13.114 -12.138 1.00 0.00 H new ATOM 0 HG2 LYS A 47 29.125 14.845 -10.403 1.00 0.00 H new ATOM 0 HG3 LYS A 47 28.220 13.633 -9.518 1.00 0.00 H new ATOM 0 HD2 LYS A 47 30.301 13.542 -8.457 1.00 0.00 H new ATOM 0 HD3 LYS A 47 30.424 12.223 -9.604 1.00 0.00 H new ATOM 0 HE2 LYS A 47 31.504 15.032 -10.095 1.00 0.00 H new ATOM 0 HE3 LYS A 47 32.468 13.694 -9.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 32.899 13.516 -11.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 31.498 12.558 -11.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 31.411 14.174 -12.181 1.00 0.00 H new ATOM 592 N CYS A 48 26.813 11.871 -13.867 1.00 0.00 N ATOM 593 CA CYS A 48 26.790 11.227 -15.167 1.00 0.00 C ATOM 594 C CYS A 48 25.891 11.993 -16.134 1.00 0.00 C ATOM 595 O CYS A 48 26.233 12.180 -17.301 1.00 0.00 O ATOM 596 CB CYS A 48 26.346 9.772 -15.042 1.00 0.00 C ATOM 597 SG CYS A 48 24.571 9.549 -14.899 1.00 0.00 S ATOM 0 H CYS A 48 26.222 11.434 -13.160 1.00 0.00 H new ATOM 0 HA CYS A 48 27.803 11.236 -15.571 1.00 0.00 H new ATOM 0 HB2 CYS A 48 26.700 9.221 -15.913 1.00 0.00 H new ATOM 0 HB3 CYS A 48 26.827 9.332 -14.169 1.00 0.00 H new ATOM 0 HG CYS A 48 24.277 9.172 -13.690 1.00 0.00 H new ATOM 602 N GLY A 49 24.749 12.454 -15.639 1.00 0.00 N ATOM 603 CA GLY A 49 23.838 13.212 -16.468 1.00 0.00 C ATOM 604 C GLY A 49 22.525 12.496 -16.715 1.00 0.00 C ATOM 605 O GLY A 49 21.758 12.891 -17.590 1.00 0.00 O ATOM 0 H GLY A 49 24.439 12.315 -14.677 1.00 0.00 H new ATOM 0 HA2 GLY A 49 23.638 14.173 -15.993 1.00 0.00 H new ATOM 0 HA3 GLY A 49 24.316 13.423 -17.425 1.00 0.00 H new ATOM 609 N LYS A 50 22.267 11.439 -15.963 1.00 0.00 N ATOM 610 CA LYS A 50 21.015 10.701 -16.096 1.00 0.00 C ATOM 611 C LYS A 50 19.999 11.182 -15.068 1.00 0.00 C ATOM 612 O LYS A 50 18.898 10.634 -14.962 1.00 0.00 O ATOM 613 CB LYS A 50 21.251 9.197 -15.950 1.00 0.00 C ATOM 614 CG LYS A 50 22.183 8.610 -17.003 1.00 0.00 C ATOM 615 CD LYS A 50 21.662 8.849 -18.406 1.00 0.00 C ATOM 616 CE LYS A 50 22.608 8.286 -19.447 1.00 0.00 C ATOM 617 NZ LYS A 50 22.140 8.566 -20.827 1.00 0.00 N ATOM 0 H LYS A 50 22.903 11.071 -15.256 1.00 0.00 H new ATOM 0 HA LYS A 50 20.616 10.888 -17.093 1.00 0.00 H new ATOM 0 HB2 LYS A 50 21.666 8.999 -14.962 1.00 0.00 H new ATOM 0 HB3 LYS A 50 20.291 8.682 -16.002 1.00 0.00 H new ATOM 0 HG2 LYS A 50 23.173 9.054 -16.902 1.00 0.00 H new ATOM 0 HG3 LYS A 50 22.295 7.539 -16.834 1.00 0.00 H new ATOM 0 HD2 LYS A 50 20.681 8.387 -18.516 1.00 0.00 H new ATOM 0 HD3 LYS A 50 21.531 9.919 -18.571 1.00 0.00 H new ATOM 0 HE2 LYS A 50 23.600 8.715 -19.306 1.00 0.00 H new ATOM 0 HE3 LYS A 50 22.703 7.209 -19.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 22.814 8.165 -21.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 21.204 8.136 -20.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 22.074 9.594 -20.969 1.00 0.00 H new ATOM 631 N GLU A 51 20.392 12.210 -14.310 1.00 0.00 N ATOM 632 CA GLU A 51 19.543 12.827 -13.287 1.00 0.00 C ATOM 633 C GLU A 51 19.268 11.847 -12.139 1.00 0.00 C ATOM 634 O GLU A 51 18.234 11.906 -11.473 1.00 0.00 O ATOM 635 CB GLU A 51 18.233 13.338 -13.905 1.00 0.00 C ATOM 636 CG GLU A 51 17.431 14.249 -12.991 1.00 0.00 C ATOM 637 CD GLU A 51 16.126 14.669 -13.601 1.00 0.00 C ATOM 638 OE1 GLU A 51 16.065 15.768 -14.195 1.00 0.00 O ATOM 639 OE2 GLU A 51 15.145 13.904 -13.494 1.00 0.00 O ATOM 0 H GLU A 51 21.314 12.640 -14.390 1.00 0.00 H new ATOM 0 HA GLU A 51 20.076 13.683 -12.873 1.00 0.00 H new ATOM 0 HB2 GLU A 51 18.463 13.875 -14.825 1.00 0.00 H new ATOM 0 HB3 GLU A 51 17.616 12.483 -14.181 1.00 0.00 H new ATOM 0 HG2 GLU A 51 17.240 13.736 -12.049 1.00 0.00 H new ATOM 0 HG3 GLU A 51 18.021 15.135 -12.757 1.00 0.00 H new ATOM 646 N CYS A 52 20.202 10.964 -11.905 1.00 0.00 N ATOM 647 CA CYS A 52 20.080 10.011 -10.836 1.00 0.00 C ATOM 648 C CYS A 52 20.933 10.452 -9.663 1.00 0.00 C ATOM 649 O CYS A 52 21.939 11.140 -9.839 1.00 0.00 O ATOM 650 CB CYS A 52 20.521 8.642 -11.309 1.00 0.00 C ATOM 651 SG CYS A 52 22.214 8.607 -11.895 1.00 0.00 S ATOM 0 H CYS A 52 21.063 10.885 -12.446 1.00 0.00 H new ATOM 0 HA CYS A 52 19.038 9.956 -10.522 1.00 0.00 H new ATOM 0 HB2 CYS A 52 20.412 7.930 -10.491 1.00 0.00 H new ATOM 0 HB3 CYS A 52 19.860 8.311 -12.110 1.00 0.00 H new ATOM 0 HG CYS A 52 22.355 7.645 -12.758 1.00 0.00 H new ATOM 656 N THR A 53 20.524 10.087 -8.478 1.00 0.00 N ATOM 657 CA THR A 53 21.263 10.430 -7.289 1.00 0.00 C ATOM 658 C THR A 53 21.246 9.261 -6.298 1.00 0.00 C ATOM 659 O THR A 53 20.635 9.334 -5.225 1.00 0.00 O ATOM 660 CB THR A 53 20.686 11.697 -6.617 1.00 0.00 C ATOM 661 OG1 THR A 53 19.253 11.616 -6.567 1.00 0.00 O ATOM 662 CG2 THR A 53 21.091 12.959 -7.370 1.00 0.00 C ATOM 0 H THR A 53 19.675 9.547 -8.308 1.00 0.00 H new ATOM 0 HA THR A 53 22.292 10.638 -7.583 1.00 0.00 H new ATOM 0 HB THR A 53 21.092 11.751 -5.607 1.00 0.00 H new ATOM 0 HG1 THR A 53 18.988 10.802 -6.089 1.00 0.00 H new ATOM 0 HG21 THR A 53 20.669 13.831 -6.871 1.00 0.00 H new ATOM 0 HG22 THR A 53 22.178 13.040 -7.386 1.00 0.00 H new ATOM 0 HG23 THR A 53 20.716 12.909 -8.392 1.00 0.00 H new ATOM 670 N GLY A 54 21.880 8.169 -6.683 1.00 0.00 N ATOM 671 CA GLY A 54 21.941 7.011 -5.826 1.00 0.00 C ATOM 672 C GLY A 54 21.341 5.775 -6.473 1.00 0.00 C ATOM 673 O GLY A 54 20.472 5.889 -7.333 1.00 0.00 O ATOM 0 H GLY A 54 22.356 8.064 -7.579 1.00 0.00 H new ATOM 0 HA2 GLY A 54 22.980 6.812 -5.564 1.00 0.00 H new ATOM 0 HA3 GLY A 54 21.413 7.223 -4.896 1.00 0.00 H new ATOM 677 N PRO A 55 21.781 4.573 -6.049 1.00 0.00 N ATOM 678 CA PRO A 55 21.357 3.280 -6.632 1.00 0.00 C ATOM 679 C PRO A 55 19.838 3.060 -6.690 1.00 0.00 C ATOM 680 O PRO A 55 19.342 2.387 -7.602 1.00 0.00 O ATOM 681 CB PRO A 55 22.008 2.236 -5.704 1.00 0.00 C ATOM 682 CG PRO A 55 22.408 2.995 -4.485 1.00 0.00 C ATOM 683 CD PRO A 55 22.743 4.371 -4.958 1.00 0.00 C ATOM 0 HA PRO A 55 21.662 3.222 -7.677 1.00 0.00 H new ATOM 0 HB2 PRO A 55 21.309 1.436 -5.459 1.00 0.00 H new ATOM 0 HB3 PRO A 55 22.871 1.770 -6.179 1.00 0.00 H new ATOM 0 HG2 PRO A 55 21.599 3.018 -3.755 1.00 0.00 H new ATOM 0 HG3 PRO A 55 23.264 2.529 -3.997 1.00 0.00 H new ATOM 0 HD2 PRO A 55 22.623 5.112 -4.168 1.00 0.00 H new ATOM 0 HD3 PRO A 55 23.773 4.441 -5.307 1.00 0.00 H new ATOM 691 N ASP A 56 19.107 3.613 -5.735 1.00 0.00 N ATOM 692 CA ASP A 56 17.651 3.426 -5.690 1.00 0.00 C ATOM 693 C ASP A 56 16.969 4.150 -6.837 1.00 0.00 C ATOM 694 O ASP A 56 16.066 3.613 -7.473 1.00 0.00 O ATOM 695 CB ASP A 56 17.061 3.910 -4.362 1.00 0.00 C ATOM 696 CG ASP A 56 17.547 3.122 -3.167 1.00 0.00 C ATOM 697 OD1 ASP A 56 17.050 1.999 -2.942 1.00 0.00 O ATOM 698 OD2 ASP A 56 18.416 3.641 -2.428 1.00 0.00 O ATOM 0 H ASP A 56 19.486 4.191 -4.984 1.00 0.00 H new ATOM 0 HA ASP A 56 17.468 2.356 -5.784 1.00 0.00 H new ATOM 0 HB2 ASP A 56 17.314 4.961 -4.222 1.00 0.00 H new ATOM 0 HB3 ASP A 56 15.974 3.847 -4.412 1.00 0.00 H new ATOM 703 N SER A 57 17.423 5.357 -7.113 1.00 0.00 N ATOM 704 CA SER A 57 16.820 6.180 -8.150 1.00 0.00 C ATOM 705 C SER A 57 17.592 6.055 -9.457 1.00 0.00 C ATOM 706 O SER A 57 17.243 6.673 -10.465 1.00 0.00 O ATOM 707 CB SER A 57 16.787 7.633 -7.692 1.00 0.00 C ATOM 708 OG SER A 57 16.253 7.732 -6.378 1.00 0.00 O ATOM 0 H SER A 57 18.210 5.793 -6.633 1.00 0.00 H new ATOM 0 HA SER A 57 15.801 5.834 -8.326 1.00 0.00 H new ATOM 0 HB2 SER A 57 17.794 8.050 -7.713 1.00 0.00 H new ATOM 0 HB3 SER A 57 16.183 8.223 -8.381 1.00 0.00 H new ATOM 0 HG SER A 57 16.241 8.672 -6.100 1.00 0.00 H new ATOM 714 N CYS A 58 18.633 5.256 -9.432 1.00 0.00 N ATOM 715 CA CYS A 58 19.468 5.051 -10.589 1.00 0.00 C ATOM 716 C CYS A 58 18.996 3.858 -11.398 1.00 0.00 C ATOM 717 O CYS A 58 18.837 2.756 -10.869 1.00 0.00 O ATOM 718 CB CYS A 58 20.916 4.846 -10.159 1.00 0.00 C ATOM 719 SG CYS A 58 22.010 4.301 -11.478 1.00 0.00 S ATOM 0 H CYS A 58 18.924 4.730 -8.608 1.00 0.00 H new ATOM 0 HA CYS A 58 19.400 5.939 -11.218 1.00 0.00 H new ATOM 0 HB2 CYS A 58 21.297 5.782 -9.750 1.00 0.00 H new ATOM 0 HB3 CYS A 58 20.943 4.112 -9.354 1.00 0.00 H new ATOM 0 HG CYS A 58 21.923 5.123 -12.481 1.00 0.00 H new ATOM 724 N LYS A 59 18.766 4.084 -12.671 1.00 0.00 N ATOM 725 CA LYS A 59 18.362 3.032 -13.580 1.00 0.00 C ATOM 726 C LYS A 59 19.396 2.890 -14.686 1.00 0.00 C ATOM 727 O LYS A 59 19.155 2.244 -15.711 1.00 0.00 O ATOM 728 CB LYS A 59 16.980 3.333 -14.165 1.00 0.00 C ATOM 729 CG LYS A 59 15.867 3.352 -13.128 1.00 0.00 C ATOM 730 CD LYS A 59 14.526 3.681 -13.757 1.00 0.00 C ATOM 731 CE LYS A 59 13.401 3.620 -12.735 1.00 0.00 C ATOM 732 NZ LYS A 59 13.576 4.613 -11.639 1.00 0.00 N ATOM 0 H LYS A 59 18.853 5.002 -13.107 1.00 0.00 H new ATOM 0 HA LYS A 59 18.298 2.091 -13.034 1.00 0.00 H new ATOM 0 HB2 LYS A 59 17.011 4.299 -14.669 1.00 0.00 H new ATOM 0 HB3 LYS A 59 16.746 2.585 -14.923 1.00 0.00 H new ATOM 0 HG2 LYS A 59 15.811 2.381 -12.636 1.00 0.00 H new ATOM 0 HG3 LYS A 59 16.099 4.087 -12.357 1.00 0.00 H new ATOM 0 HD2 LYS A 59 14.564 4.677 -14.198 1.00 0.00 H new ATOM 0 HD3 LYS A 59 14.321 2.981 -14.567 1.00 0.00 H new ATOM 0 HE2 LYS A 59 12.449 3.799 -13.235 1.00 0.00 H new ATOM 0 HE3 LYS A 59 13.354 2.618 -12.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 12.723 4.628 -11.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 14.398 4.349 -11.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 13.730 5.557 -12.047 1.00 0.00 H new ATOM 746 N CYS A 60 20.551 3.497 -14.461 1.00 0.00 N ATOM 747 CA CYS A 60 21.646 3.460 -15.407 1.00 0.00 C ATOM 748 C CYS A 60 22.242 2.056 -15.475 1.00 0.00 C ATOM 749 O CYS A 60 22.215 1.311 -14.485 1.00 0.00 O ATOM 750 CB CYS A 60 22.718 4.460 -14.986 1.00 0.00 C ATOM 751 SG CYS A 60 22.078 6.101 -14.578 1.00 0.00 S ATOM 0 H CYS A 60 20.752 4.029 -13.614 1.00 0.00 H new ATOM 0 HA CYS A 60 21.270 3.726 -16.395 1.00 0.00 H new ATOM 0 HB2 CYS A 60 23.249 4.064 -14.121 1.00 0.00 H new ATOM 0 HB3 CYS A 60 23.446 4.556 -15.791 1.00 0.00 H new ATOM 0 HG CYS A 60 23.069 6.931 -14.438 1.00 0.00 H new ATOM 756 N GLY A 61 22.776 1.700 -16.632 1.00 0.00 N ATOM 757 CA GLY A 61 23.354 0.386 -16.806 1.00 0.00 C ATOM 758 C GLY A 61 24.638 0.210 -16.016 1.00 0.00 C ATOM 759 O GLY A 61 25.242 1.186 -15.579 1.00 0.00 O ATOM 0 H GLY A 61 22.819 2.300 -17.456 1.00 0.00 H new ATOM 0 HA2 GLY A 61 22.633 -0.369 -16.495 1.00 0.00 H new ATOM 0 HA3 GLY A 61 23.555 0.218 -17.864 1.00 0.00 H new ATOM 763 N SER A 62 25.069 -1.028 -15.862 1.00 0.00 N ATOM 764 CA SER A 62 26.273 -1.341 -15.101 1.00 0.00 C ATOM 765 C SER A 62 27.545 -0.935 -15.862 1.00 0.00 C ATOM 766 O SER A 62 28.664 -1.054 -15.349 1.00 0.00 O ATOM 767 CB SER A 62 26.286 -2.831 -14.758 1.00 0.00 C ATOM 768 OG SER A 62 25.845 -3.609 -15.864 1.00 0.00 O ATOM 0 H SER A 62 24.600 -1.844 -16.257 1.00 0.00 H new ATOM 0 HA SER A 62 26.261 -0.763 -14.177 1.00 0.00 H new ATOM 0 HB2 SER A 62 27.294 -3.134 -14.473 1.00 0.00 H new ATOM 0 HB3 SER A 62 25.642 -3.016 -13.898 1.00 0.00 H new ATOM 0 HG SER A 62 25.863 -4.559 -15.624 1.00 0.00 H new ATOM 774 N SER A 63 27.363 -0.446 -17.076 1.00 0.00 N ATOM 775 CA SER A 63 28.466 0.007 -17.900 1.00 0.00 C ATOM 776 C SER A 63 28.393 1.531 -18.074 1.00 0.00 C ATOM 777 O SER A 63 29.093 2.116 -18.907 1.00 0.00 O ATOM 778 CB SER A 63 28.408 -0.700 -19.264 1.00 0.00 C ATOM 779 OG SER A 63 29.556 -0.422 -20.051 1.00 0.00 O ATOM 0 H SER A 63 26.448 -0.353 -17.516 1.00 0.00 H new ATOM 0 HA SER A 63 29.412 -0.239 -17.417 1.00 0.00 H new ATOM 0 HB2 SER A 63 28.323 -1.776 -19.112 1.00 0.00 H new ATOM 0 HB3 SER A 63 27.514 -0.382 -19.800 1.00 0.00 H new ATOM 0 HG SER A 63 29.860 0.493 -19.874 1.00 0.00 H new ATOM 785 N CYS A 64 27.554 2.166 -17.262 1.00 0.00 N ATOM 786 CA CYS A 64 27.342 3.606 -17.338 1.00 0.00 C ATOM 787 C CYS A 64 28.534 4.389 -16.771 1.00 0.00 C ATOM 788 O CYS A 64 29.428 3.820 -16.140 1.00 0.00 O ATOM 789 CB CYS A 64 26.053 3.984 -16.606 1.00 0.00 C ATOM 790 SG CYS A 64 25.588 5.722 -16.748 1.00 0.00 S ATOM 0 H CYS A 64 27.006 1.701 -16.538 1.00 0.00 H new ATOM 0 HA CYS A 64 27.249 3.876 -18.390 1.00 0.00 H new ATOM 0 HB2 CYS A 64 25.239 3.371 -16.992 1.00 0.00 H new ATOM 0 HB3 CYS A 64 26.165 3.737 -15.550 1.00 0.00 H new ATOM 0 HG CYS A 64 25.131 6.144 -15.606 1.00 0.00 H new ATOM 795 N SER A 65 28.519 5.692 -16.992 1.00 0.00 N ATOM 796 CA SER A 65 29.582 6.583 -16.565 1.00 0.00 C ATOM 797 C SER A 65 29.708 6.628 -15.035 1.00 0.00 C ATOM 798 O SER A 65 30.810 6.734 -14.496 1.00 0.00 O ATOM 799 CB SER A 65 29.310 7.983 -17.112 1.00 0.00 C ATOM 800 OG SER A 65 28.986 7.933 -18.500 1.00 0.00 O ATOM 0 H SER A 65 27.759 6.166 -17.479 1.00 0.00 H new ATOM 0 HA SER A 65 30.526 6.205 -16.957 1.00 0.00 H new ATOM 0 HB2 SER A 65 28.490 8.441 -16.559 1.00 0.00 H new ATOM 0 HB3 SER A 65 30.187 8.613 -16.962 1.00 0.00 H new ATOM 0 HG SER A 65 28.814 8.840 -18.829 1.00 0.00 H new ATOM 806 N CYS A 66 28.582 6.521 -14.341 1.00 0.00 N ATOM 807 CA CYS A 66 28.578 6.584 -12.882 1.00 0.00 C ATOM 808 C CYS A 66 28.812 5.204 -12.265 1.00 0.00 C ATOM 809 O CYS A 66 28.415 4.948 -11.128 1.00 0.00 O ATOM 810 CB CYS A 66 27.254 7.166 -12.387 1.00 0.00 C ATOM 811 SG CYS A 66 25.829 6.101 -12.646 1.00 0.00 S ATOM 0 H CYS A 66 27.662 6.391 -14.762 1.00 0.00 H new ATOM 0 HA CYS A 66 29.395 7.234 -12.569 1.00 0.00 H new ATOM 0 HB2 CYS A 66 27.342 7.382 -11.322 1.00 0.00 H new ATOM 0 HB3 CYS A 66 27.078 8.116 -12.891 1.00 0.00 H new ATOM 0 HG CYS A 66 24.761 6.686 -12.190 1.00 0.00 H new ATOM 816 N LYS A 67 29.467 4.317 -13.006 1.00 0.00 N ATOM 817 CA LYS A 67 29.747 2.973 -12.504 1.00 0.00 C ATOM 818 C LYS A 67 31.248 2.750 -12.357 1.00 0.00 C ATOM 819 O LYS A 67 31.922 2.505 -13.406 1.00 0.00 O ATOM 820 CB LYS A 67 29.145 1.900 -13.422 1.00 0.00 C ATOM 821 CG LYS A 67 27.683 2.132 -13.775 1.00 0.00 C ATOM 822 CD LYS A 67 26.836 2.393 -12.542 1.00 0.00 C ATOM 823 CE LYS A 67 25.407 2.727 -12.918 1.00 0.00 C ATOM 824 NZ LYS A 67 24.682 3.346 -11.794 1.00 0.00 N ATOM 0 H LYS A 67 29.812 4.500 -13.948 1.00 0.00 H new ATOM 0 HA LYS A 67 29.281 2.887 -11.522 1.00 0.00 H new ATOM 0 HB2 LYS A 67 29.727 1.857 -14.342 1.00 0.00 H new ATOM 0 HB3 LYS A 67 29.241 0.928 -12.938 1.00 0.00 H new ATOM 0 HG2 LYS A 67 27.604 2.980 -14.455 1.00 0.00 H new ATOM 0 HG3 LYS A 67 27.295 1.262 -14.304 1.00 0.00 H new ATOM 0 HD2 LYS A 67 26.849 1.515 -11.896 1.00 0.00 H new ATOM 0 HD3 LYS A 67 27.266 3.215 -11.970 1.00 0.00 H new ATOM 0 HE2 LYS A 67 25.403 3.405 -13.772 1.00 0.00 H new ATOM 0 HE3 LYS A 67 24.890 1.819 -13.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 23.665 3.376 -12.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 24.836 2.786 -10.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 25.033 4.314 -11.646 1.00 0.00 H new