USER MOD reduce.3.24.130724 H: found=0, std=0, add=259, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 260 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 NoAdj-H: A 263 HIS HE2 : A 263 HIS NE2 : A 201 ZNZN :(H bumps) USER MOD Set 1.1: A 273 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 274 SER OG : rot 180:sc= 0 USER MOD Single : A 235 SER OG : rot 180:sc= 0 USER MOD Single : A 236 SER OG : rot 180:sc= -0.0315 USER MOD Single : A 238 SER OG : rot -65:sc= 0.383 USER MOD Single : A 239 SER OG : rot 180:sc= 0 USER MOD Single : A 243 THR OG1 : rot 180:sc= 0.00262 USER MOD Single : A 245 TYR OH : rot 180:sc= 0 USER MOD Single : A 249 GLN : amide:sc= -0.112 K(o=-0.11,f=-1.6!) USER MOD Single : A 252 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 253 SER OG : rot 180:sc= 0.00291 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0 USER MOD Single : A 256 GLN : amide:sc=-0.00444 K(o=-0.0044,f=-1.5) USER MOD Single : A 259 SER OG : rot 180:sc= 0 USER MOD Single : A 264 GLN : amide:sc= -0.0561 K(o=-0.056,f=-1.6!) USER MOD Single : A 266 SER OG : rot 180:sc= 0 USER MOD Single : A 268 SER OG : rot 180:sc= 0 USER MOD Single : A 269 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 270 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 234 15.444 -10.455 -21.961 1.00 0.00 N ATOM 2 CA GLY A 234 15.294 -9.018 -21.828 1.00 0.00 C ATOM 3 C GLY A 234 14.198 -8.637 -20.853 1.00 0.00 C ATOM 4 O GLY A 234 13.156 -9.288 -20.795 1.00 0.00 O ATOM 0 HA2 GLY A 234 16.238 -8.587 -21.495 1.00 0.00 H new ATOM 0 HA3 GLY A 234 15.073 -8.587 -22.805 1.00 0.00 H new ATOM 8 N SER A 235 14.435 -7.579 -20.083 1.00 0.00 N ATOM 9 CA SER A 235 13.461 -7.115 -19.102 1.00 0.00 C ATOM 10 C SER A 235 13.000 -5.697 -19.423 1.00 0.00 C ATOM 11 O SER A 235 13.607 -5.005 -20.240 1.00 0.00 O ATOM 12 CB SER A 235 14.062 -7.162 -17.695 1.00 0.00 C ATOM 13 OG SER A 235 14.469 -8.477 -17.359 1.00 0.00 O ATOM 0 H SER A 235 15.292 -7.028 -20.120 1.00 0.00 H new ATOM 0 HA SER A 235 12.596 -7.777 -19.143 1.00 0.00 H new ATOM 0 HB2 SER A 235 14.916 -6.488 -17.638 1.00 0.00 H new ATOM 0 HB3 SER A 235 13.328 -6.809 -16.971 1.00 0.00 H new ATOM 0 HG SER A 235 14.851 -8.481 -16.457 1.00 0.00 H new ATOM 19 N SER A 236 11.921 -5.271 -18.773 1.00 0.00 N ATOM 20 CA SER A 236 11.375 -3.937 -18.991 1.00 0.00 C ATOM 21 C SER A 236 10.806 -3.364 -17.696 1.00 0.00 C ATOM 22 O SER A 236 10.695 -4.064 -16.691 1.00 0.00 O ATOM 23 CB SER A 236 10.286 -3.978 -20.065 1.00 0.00 C ATOM 24 OG SER A 236 10.610 -4.907 -21.085 1.00 0.00 O ATOM 0 H SER A 236 11.408 -5.831 -18.092 1.00 0.00 H new ATOM 0 HA SER A 236 12.185 -3.291 -19.329 1.00 0.00 H new ATOM 0 HB2 SER A 236 9.333 -4.250 -19.611 1.00 0.00 H new ATOM 0 HB3 SER A 236 10.161 -2.986 -20.499 1.00 0.00 H new ATOM 0 HG SER A 236 9.898 -4.915 -21.758 1.00 0.00 H new ATOM 30 N GLY A 237 10.448 -2.084 -17.729 1.00 0.00 N ATOM 31 CA GLY A 237 9.896 -1.438 -16.553 1.00 0.00 C ATOM 32 C GLY A 237 10.353 0.001 -16.413 1.00 0.00 C ATOM 33 O GLY A 237 11.536 0.265 -16.197 1.00 0.00 O ATOM 0 H GLY A 237 10.530 -1.483 -18.549 1.00 0.00 H new ATOM 0 HA2 GLY A 237 8.808 -1.467 -16.604 1.00 0.00 H new ATOM 0 HA3 GLY A 237 10.189 -1.997 -15.664 1.00 0.00 H new ATOM 37 N SER A 238 9.415 0.934 -16.539 1.00 0.00 N ATOM 38 CA SER A 238 9.729 2.353 -16.431 1.00 0.00 C ATOM 39 C SER A 238 9.160 2.939 -15.143 1.00 0.00 C ATOM 40 O SER A 238 8.102 3.569 -15.148 1.00 0.00 O ATOM 41 CB SER A 238 9.176 3.113 -17.638 1.00 0.00 C ATOM 42 OG SER A 238 9.197 4.512 -17.414 1.00 0.00 O ATOM 0 H SER A 238 8.431 0.732 -16.716 1.00 0.00 H new ATOM 0 HA SER A 238 10.814 2.459 -16.410 1.00 0.00 H new ATOM 0 HB2 SER A 238 9.766 2.875 -18.523 1.00 0.00 H new ATOM 0 HB3 SER A 238 8.155 2.789 -17.839 1.00 0.00 H new ATOM 0 HG SER A 238 8.589 4.735 -16.678 1.00 0.00 H new ATOM 48 N SER A 239 9.869 2.726 -14.039 1.00 0.00 N ATOM 49 CA SER A 239 9.434 3.229 -12.741 1.00 0.00 C ATOM 50 C SER A 239 10.355 4.344 -12.254 1.00 0.00 C ATOM 51 O SER A 239 11.264 4.769 -12.965 1.00 0.00 O ATOM 52 CB SER A 239 9.401 2.094 -11.716 1.00 0.00 C ATOM 53 OG SER A 239 10.711 1.729 -11.317 1.00 0.00 O ATOM 0 H SER A 239 10.748 2.208 -14.017 1.00 0.00 H new ATOM 0 HA SER A 239 8.429 3.636 -12.854 1.00 0.00 H new ATOM 0 HB2 SER A 239 8.825 2.404 -10.844 1.00 0.00 H new ATOM 0 HB3 SER A 239 8.893 1.229 -12.143 1.00 0.00 H new ATOM 0 HG SER A 239 10.663 1.003 -10.660 1.00 0.00 H new ATOM 59 N GLY A 240 10.112 4.813 -11.034 1.00 0.00 N ATOM 60 CA GLY A 240 10.927 5.873 -10.470 1.00 0.00 C ATOM 61 C GLY A 240 10.111 6.865 -9.665 1.00 0.00 C ATOM 62 O GLY A 240 10.373 7.079 -8.482 1.00 0.00 O ATOM 0 H GLY A 240 9.365 4.478 -10.426 1.00 0.00 H new ATOM 0 HA2 GLY A 240 11.695 5.436 -9.832 1.00 0.00 H new ATOM 0 HA3 GLY A 240 11.442 6.398 -11.274 1.00 0.00 H new ATOM 66 N GLY A 241 9.120 7.475 -10.308 1.00 0.00 N ATOM 67 CA GLY A 241 8.280 8.444 -9.629 1.00 0.00 C ATOM 68 C GLY A 241 6.987 7.836 -9.121 1.00 0.00 C ATOM 69 O GLY A 241 6.816 6.618 -9.146 1.00 0.00 O ATOM 0 H GLY A 241 8.884 7.315 -11.287 1.00 0.00 H new ATOM 0 HA2 GLY A 241 8.830 8.873 -8.791 1.00 0.00 H new ATOM 0 HA3 GLY A 241 8.050 9.262 -10.312 1.00 0.00 H new ATOM 73 N GLU A 242 6.076 8.687 -8.659 1.00 0.00 N ATOM 74 CA GLU A 242 4.794 8.225 -8.142 1.00 0.00 C ATOM 75 C GLU A 242 3.831 7.904 -9.281 1.00 0.00 C ATOM 76 O GLU A 242 3.486 8.774 -10.082 1.00 0.00 O ATOM 77 CB GLU A 242 4.179 9.282 -7.222 1.00 0.00 C ATOM 78 CG GLU A 242 3.222 8.710 -6.191 1.00 0.00 C ATOM 79 CD GLU A 242 2.652 9.772 -5.271 1.00 0.00 C ATOM 80 OE1 GLU A 242 3.395 10.712 -4.919 1.00 0.00 O ATOM 81 OE2 GLU A 242 1.464 9.663 -4.902 1.00 0.00 O ATOM 0 H GLU A 242 6.202 9.699 -8.632 1.00 0.00 H new ATOM 0 HA GLU A 242 4.969 7.314 -7.570 1.00 0.00 H new ATOM 0 HB2 GLU A 242 4.980 9.813 -6.707 1.00 0.00 H new ATOM 0 HB3 GLU A 242 3.649 10.016 -7.829 1.00 0.00 H new ATOM 0 HG2 GLU A 242 2.405 8.201 -6.702 1.00 0.00 H new ATOM 0 HG3 GLU A 242 3.742 7.960 -5.595 1.00 0.00 H new ATOM 88 N THR A 243 3.400 6.648 -9.349 1.00 0.00 N ATOM 89 CA THR A 243 2.479 6.210 -10.390 1.00 0.00 C ATOM 90 C THR A 243 1.121 5.842 -9.803 1.00 0.00 C ATOM 91 O THR A 243 0.980 5.603 -8.604 1.00 0.00 O ATOM 92 CB THR A 243 3.038 5.000 -11.161 1.00 0.00 C ATOM 93 OG1 THR A 243 3.858 4.205 -10.298 1.00 0.00 O ATOM 94 CG2 THR A 243 3.850 5.453 -12.365 1.00 0.00 C ATOM 0 H THR A 243 3.675 5.916 -8.694 1.00 0.00 H new ATOM 0 HA THR A 243 2.359 7.046 -11.079 1.00 0.00 H new ATOM 0 HB THR A 243 2.197 4.403 -11.514 1.00 0.00 H new ATOM 0 HG1 THR A 243 4.208 3.437 -10.796 1.00 0.00 H new ATOM 0 HG21 THR A 243 4.234 4.581 -12.894 1.00 0.00 H new ATOM 0 HG22 THR A 243 3.215 6.033 -13.035 1.00 0.00 H new ATOM 0 HG23 THR A 243 4.683 6.071 -12.030 1.00 0.00 H new ATOM 102 N PRO A 244 0.096 5.795 -10.667 1.00 0.00 N ATOM 103 CA PRO A 244 -1.269 5.455 -10.257 1.00 0.00 C ATOM 104 C PRO A 244 -1.319 4.204 -9.386 1.00 0.00 C ATOM 105 O PRO A 244 -0.615 3.227 -9.646 1.00 0.00 O ATOM 106 CB PRO A 244 -1.989 5.210 -11.586 1.00 0.00 C ATOM 107 CG PRO A 244 -1.231 6.020 -12.581 1.00 0.00 C ATOM 108 CD PRO A 244 0.192 6.068 -12.111 1.00 0.00 C ATOM 0 HA PRO A 244 -1.719 6.241 -9.651 1.00 0.00 H new ATOM 0 HB2 PRO A 244 -1.984 4.152 -11.850 1.00 0.00 H new ATOM 0 HB3 PRO A 244 -3.032 5.521 -11.534 1.00 0.00 H new ATOM 0 HG2 PRO A 244 -1.295 5.572 -13.573 1.00 0.00 H new ATOM 0 HG3 PRO A 244 -1.646 7.025 -12.658 1.00 0.00 H new ATOM 0 HD2 PRO A 244 0.806 5.324 -12.619 1.00 0.00 H new ATOM 0 HD3 PRO A 244 0.644 7.041 -12.305 1.00 0.00 H new ATOM 116 N TYR A 245 -2.154 4.240 -8.354 1.00 0.00 N ATOM 117 CA TYR A 245 -2.293 3.109 -7.444 1.00 0.00 C ATOM 118 C TYR A 245 -3.546 2.301 -7.768 1.00 0.00 C ATOM 119 O TYR A 245 -4.467 2.795 -8.419 1.00 0.00 O ATOM 120 CB TYR A 245 -2.347 3.597 -5.995 1.00 0.00 C ATOM 121 CG TYR A 245 -0.996 3.975 -5.433 1.00 0.00 C ATOM 122 CD1 TYR A 245 -0.035 3.007 -5.169 1.00 0.00 C ATOM 123 CD2 TYR A 245 -0.679 5.302 -5.167 1.00 0.00 C ATOM 124 CE1 TYR A 245 1.200 3.348 -4.654 1.00 0.00 C ATOM 125 CE2 TYR A 245 0.555 5.652 -4.653 1.00 0.00 C ATOM 126 CZ TYR A 245 1.491 4.672 -4.398 1.00 0.00 C ATOM 127 OH TYR A 245 2.721 5.016 -3.887 1.00 0.00 O ATOM 0 H TYR A 245 -2.745 5.040 -8.126 1.00 0.00 H new ATOM 0 HA TYR A 245 -1.424 2.464 -7.570 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -3.010 4.460 -5.936 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -2.784 2.816 -5.373 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -0.258 1.970 -5.370 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -1.409 6.072 -5.365 1.00 0.00 H new ATOM 0 HE1 TYR A 245 1.934 2.582 -4.453 1.00 0.00 H new ATOM 0 HE2 TYR A 245 0.785 6.688 -4.452 1.00 0.00 H new ATOM 0 HH TYR A 245 2.765 5.987 -3.766 1.00 0.00 H new ATOM 137 N LEU A 246 -3.574 1.055 -7.307 1.00 0.00 N ATOM 138 CA LEU A 246 -4.713 0.176 -7.545 1.00 0.00 C ATOM 139 C LEU A 246 -4.807 -0.898 -6.467 1.00 0.00 C ATOM 140 O LEU A 246 -3.889 -1.700 -6.292 1.00 0.00 O ATOM 141 CB LEU A 246 -4.599 -0.478 -8.923 1.00 0.00 C ATOM 142 CG LEU A 246 -5.029 0.382 -10.112 1.00 0.00 C ATOM 143 CD1 LEU A 246 -4.825 -0.370 -11.418 1.00 0.00 C ATOM 144 CD2 LEU A 246 -6.482 0.810 -9.963 1.00 0.00 C ATOM 0 H LEU A 246 -2.820 0.631 -6.766 1.00 0.00 H new ATOM 0 HA LEU A 246 -5.619 0.780 -7.510 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -3.563 -0.780 -9.075 1.00 0.00 H new ATOM 0 HB3 LEU A 246 -5.200 -1.388 -8.922 1.00 0.00 H new ATOM 0 HG LEU A 246 -4.407 1.277 -10.131 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -5.137 0.258 -12.252 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -3.771 -0.625 -11.530 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -5.421 -1.283 -11.409 1.00 0.00 H new ATOM 0 HD21 LEU A 246 -6.771 1.421 -10.818 1.00 0.00 H new ATOM 0 HD22 LEU A 246 -7.119 -0.074 -9.917 1.00 0.00 H new ATOM 0 HD23 LEU A 246 -6.599 1.389 -9.047 1.00 0.00 H new ATOM 156 N CYS A 247 -5.924 -0.910 -5.746 1.00 0.00 N ATOM 157 CA CYS A 247 -6.140 -1.886 -4.686 1.00 0.00 C ATOM 158 C CYS A 247 -6.147 -3.306 -5.246 1.00 0.00 C ATOM 159 O CYS A 247 -6.701 -3.560 -6.315 1.00 0.00 O ATOM 160 CB CYS A 247 -7.460 -1.604 -3.965 1.00 0.00 C ATOM 161 SG CYS A 247 -7.726 -2.619 -2.476 1.00 0.00 S ATOM 0 H CYS A 247 -6.694 -0.254 -5.878 1.00 0.00 H new ATOM 0 HA CYS A 247 -5.319 -1.799 -3.974 1.00 0.00 H new ATOM 0 HB2 CYS A 247 -7.490 -0.551 -3.684 1.00 0.00 H new ATOM 0 HB3 CYS A 247 -8.284 -1.773 -4.659 1.00 0.00 H new ATOM 166 N GLY A 248 -5.527 -4.228 -4.515 1.00 0.00 N ATOM 167 CA GLY A 248 -5.474 -5.610 -4.955 1.00 0.00 C ATOM 168 C GLY A 248 -6.591 -6.449 -4.367 1.00 0.00 C ATOM 169 O GLY A 248 -6.460 -7.666 -4.242 1.00 0.00 O ATOM 0 H GLY A 248 -5.061 -4.043 -3.627 1.00 0.00 H new ATOM 0 HA2 GLY A 248 -5.532 -5.644 -6.043 1.00 0.00 H new ATOM 0 HA3 GLY A 248 -4.513 -6.041 -4.674 1.00 0.00 H new ATOM 173 N GLN A 249 -7.691 -5.797 -4.005 1.00 0.00 N ATOM 174 CA GLN A 249 -8.834 -6.492 -3.425 1.00 0.00 C ATOM 175 C GLN A 249 -10.122 -6.126 -4.156 1.00 0.00 C ATOM 176 O GLN A 249 -10.981 -6.978 -4.385 1.00 0.00 O ATOM 177 CB GLN A 249 -8.964 -6.152 -1.939 1.00 0.00 C ATOM 178 CG GLN A 249 -7.868 -6.759 -1.078 1.00 0.00 C ATOM 179 CD GLN A 249 -8.168 -8.189 -0.674 1.00 0.00 C ATOM 180 OE1 GLN A 249 -9.329 -8.590 -0.583 1.00 0.00 O ATOM 181 NE2 GLN A 249 -7.121 -8.968 -0.429 1.00 0.00 N ATOM 0 H GLN A 249 -7.815 -4.789 -4.103 1.00 0.00 H new ATOM 0 HA GLN A 249 -8.668 -7.564 -3.533 1.00 0.00 H new ATOM 0 HB2 GLN A 249 -8.950 -5.069 -1.820 1.00 0.00 H new ATOM 0 HB3 GLN A 249 -9.932 -6.500 -1.579 1.00 0.00 H new ATOM 0 HG2 GLN A 249 -6.925 -6.730 -1.623 1.00 0.00 H new ATOM 0 HG3 GLN A 249 -7.737 -6.152 -0.182 1.00 0.00 H new ATOM 0 HE21 GLN A 249 -6.176 -8.595 -0.517 1.00 0.00 H new ATOM 0 HE22 GLN A 249 -7.262 -9.940 -0.153 1.00 0.00 H new ATOM 190 N CYS A 250 -10.249 -4.855 -4.521 1.00 0.00 N ATOM 191 CA CYS A 250 -11.431 -4.375 -5.226 1.00 0.00 C ATOM 192 C CYS A 250 -11.057 -3.806 -6.591 1.00 0.00 C ATOM 193 O CYS A 250 -11.789 -3.971 -7.566 1.00 0.00 O ATOM 194 CB CYS A 250 -12.148 -3.309 -4.395 1.00 0.00 C ATOM 195 SG CYS A 250 -11.064 -1.966 -3.814 1.00 0.00 S ATOM 0 H CYS A 250 -9.547 -4.138 -4.340 1.00 0.00 H new ATOM 0 HA CYS A 250 -12.102 -5.221 -5.377 1.00 0.00 H new ATOM 0 HB2 CYS A 250 -12.953 -2.879 -4.991 1.00 0.00 H new ATOM 0 HB3 CYS A 250 -12.611 -3.787 -3.532 1.00 0.00 H new ATOM 200 N GLY A 251 -9.911 -3.134 -6.652 1.00 0.00 N ATOM 201 CA GLY A 251 -9.459 -2.550 -7.902 1.00 0.00 C ATOM 202 C GLY A 251 -9.731 -1.061 -7.977 1.00 0.00 C ATOM 203 O GLY A 251 -9.882 -0.504 -9.065 1.00 0.00 O ATOM 0 H GLY A 251 -9.288 -2.984 -5.859 1.00 0.00 H new ATOM 0 HA2 GLY A 251 -8.390 -2.727 -8.017 1.00 0.00 H new ATOM 0 HA3 GLY A 251 -9.956 -3.049 -8.734 1.00 0.00 H new ATOM 207 N LYS A 252 -9.794 -0.413 -6.819 1.00 0.00 N ATOM 208 CA LYS A 252 -10.049 1.021 -6.757 1.00 0.00 C ATOM 209 C LYS A 252 -8.776 1.813 -7.036 1.00 0.00 C ATOM 210 O LYS A 252 -7.676 1.378 -6.696 1.00 0.00 O ATOM 211 CB LYS A 252 -10.608 1.401 -5.384 1.00 0.00 C ATOM 212 CG LYS A 252 -11.442 2.671 -5.397 1.00 0.00 C ATOM 213 CD LYS A 252 -12.060 2.946 -4.036 1.00 0.00 C ATOM 214 CE LYS A 252 -12.707 4.321 -3.986 1.00 0.00 C ATOM 215 NZ LYS A 252 -13.039 4.727 -2.592 1.00 0.00 N ATOM 0 H LYS A 252 -9.672 -0.859 -5.910 1.00 0.00 H new ATOM 0 HA LYS A 252 -10.784 1.267 -7.523 1.00 0.00 H new ATOM 0 HB2 LYS A 252 -11.218 0.579 -5.009 1.00 0.00 H new ATOM 0 HB3 LYS A 252 -9.780 1.527 -4.686 1.00 0.00 H new ATOM 0 HG2 LYS A 252 -10.818 3.515 -5.691 1.00 0.00 H new ATOM 0 HG3 LYS A 252 -12.230 2.582 -6.144 1.00 0.00 H new ATOM 0 HD2 LYS A 252 -12.806 2.183 -3.813 1.00 0.00 H new ATOM 0 HD3 LYS A 252 -11.292 2.876 -3.266 1.00 0.00 H new ATOM 0 HE2 LYS A 252 -12.034 5.056 -4.428 1.00 0.00 H new ATOM 0 HE3 LYS A 252 -13.615 4.317 -4.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 252 -13.478 5.670 -2.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 252 -13.701 4.040 -2.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 252 -12.169 4.755 -2.022 1.00 0.00 H new ATOM 229 N SER A 253 -8.933 2.978 -7.656 1.00 0.00 N ATOM 230 CA SER A 253 -7.796 3.830 -7.983 1.00 0.00 C ATOM 231 C SER A 253 -7.666 4.972 -6.980 1.00 0.00 C ATOM 232 O SER A 253 -8.660 5.582 -6.585 1.00 0.00 O ATOM 233 CB SER A 253 -7.943 4.392 -9.398 1.00 0.00 C ATOM 234 OG SER A 253 -9.257 4.873 -9.622 1.00 0.00 O ATOM 0 H SER A 253 -9.837 3.354 -7.942 1.00 0.00 H new ATOM 0 HA SER A 253 -6.892 3.222 -7.934 1.00 0.00 H new ATOM 0 HB2 SER A 253 -7.226 5.199 -9.548 1.00 0.00 H new ATOM 0 HB3 SER A 253 -7.707 3.617 -10.127 1.00 0.00 H new ATOM 0 HG SER A 253 -9.324 5.228 -10.533 1.00 0.00 H new ATOM 240 N PHE A 254 -6.434 5.257 -6.572 1.00 0.00 N ATOM 241 CA PHE A 254 -6.173 6.325 -5.615 1.00 0.00 C ATOM 242 C PHE A 254 -5.073 7.253 -6.122 1.00 0.00 C ATOM 243 O PHE A 254 -4.345 6.920 -7.057 1.00 0.00 O ATOM 244 CB PHE A 254 -5.776 5.738 -4.259 1.00 0.00 C ATOM 245 CG PHE A 254 -6.767 4.746 -3.722 1.00 0.00 C ATOM 246 CD1 PHE A 254 -7.829 5.164 -2.936 1.00 0.00 C ATOM 247 CD2 PHE A 254 -6.638 3.395 -4.003 1.00 0.00 C ATOM 248 CE1 PHE A 254 -8.743 4.253 -2.440 1.00 0.00 C ATOM 249 CE2 PHE A 254 -7.549 2.480 -3.509 1.00 0.00 C ATOM 250 CZ PHE A 254 -8.603 2.910 -2.728 1.00 0.00 C ATOM 0 H PHE A 254 -5.600 4.763 -6.890 1.00 0.00 H new ATOM 0 HA PHE A 254 -7.088 6.905 -5.498 1.00 0.00 H new ATOM 0 HB2 PHE A 254 -4.804 5.254 -4.352 1.00 0.00 H new ATOM 0 HB3 PHE A 254 -5.661 6.550 -3.541 1.00 0.00 H new ATOM 0 HD1 PHE A 254 -7.944 6.213 -2.708 1.00 0.00 H new ATOM 0 HD2 PHE A 254 -5.816 3.053 -4.615 1.00 0.00 H new ATOM 0 HE1 PHE A 254 -9.566 4.592 -1.828 1.00 0.00 H new ATOM 0 HE2 PHE A 254 -7.436 1.430 -3.734 1.00 0.00 H new ATOM 0 HZ PHE A 254 -9.317 2.197 -2.343 1.00 0.00 H new ATOM 260 N THR A 255 -4.958 8.421 -5.497 1.00 0.00 N ATOM 261 CA THR A 255 -3.949 9.399 -5.885 1.00 0.00 C ATOM 262 C THR A 255 -2.858 9.513 -4.826 1.00 0.00 C ATOM 263 O THR A 255 -1.712 9.837 -5.135 1.00 0.00 O ATOM 264 CB THR A 255 -4.572 10.789 -6.115 1.00 0.00 C ATOM 265 OG1 THR A 255 -5.891 10.650 -6.655 1.00 0.00 O ATOM 266 CG2 THR A 255 -3.715 11.616 -7.061 1.00 0.00 C ATOM 0 H THR A 255 -5.551 8.712 -4.720 1.00 0.00 H new ATOM 0 HA THR A 255 -3.511 9.047 -6.819 1.00 0.00 H new ATOM 0 HB THR A 255 -4.625 11.303 -5.156 1.00 0.00 H new ATOM 0 HG1 THR A 255 -6.282 11.538 -6.797 1.00 0.00 H new ATOM 0 HG21 THR A 255 -4.175 12.593 -7.208 1.00 0.00 H new ATOM 0 HG22 THR A 255 -2.721 11.744 -6.633 1.00 0.00 H new ATOM 0 HG23 THR A 255 -3.635 11.105 -8.020 1.00 0.00 H new ATOM 274 N GLN A 256 -3.222 9.243 -3.576 1.00 0.00 N ATOM 275 CA GLN A 256 -2.273 9.316 -2.472 1.00 0.00 C ATOM 276 C GLN A 256 -2.006 7.931 -1.891 1.00 0.00 C ATOM 277 O GLN A 256 -2.915 7.107 -1.784 1.00 0.00 O ATOM 278 CB GLN A 256 -2.801 10.247 -1.379 1.00 0.00 C ATOM 279 CG GLN A 256 -3.259 11.599 -1.901 1.00 0.00 C ATOM 280 CD GLN A 256 -2.140 12.381 -2.560 1.00 0.00 C ATOM 281 OE1 GLN A 256 -1.960 12.323 -3.776 1.00 0.00 O ATOM 282 NE2 GLN A 256 -1.380 13.117 -1.758 1.00 0.00 N ATOM 0 H GLN A 256 -4.167 8.972 -3.303 1.00 0.00 H new ATOM 0 HA GLN A 256 -1.335 9.715 -2.858 1.00 0.00 H new ATOM 0 HB2 GLN A 256 -3.634 9.762 -0.871 1.00 0.00 H new ATOM 0 HB3 GLN A 256 -2.020 10.400 -0.635 1.00 0.00 H new ATOM 0 HG2 GLN A 256 -4.066 11.452 -2.619 1.00 0.00 H new ATOM 0 HG3 GLN A 256 -3.668 12.183 -1.076 1.00 0.00 H new ATOM 0 HE21 GLN A 256 -1.565 13.136 -0.755 1.00 0.00 H new ATOM 0 HE22 GLN A 256 -0.611 13.664 -2.145 1.00 0.00 H new ATOM 291 N ARG A 257 -0.755 7.682 -1.519 1.00 0.00 N ATOM 292 CA ARG A 257 -0.368 6.396 -0.951 1.00 0.00 C ATOM 293 C ARG A 257 -1.049 6.170 0.396 1.00 0.00 C ATOM 294 O ARG A 257 -1.361 5.039 0.763 1.00 0.00 O ATOM 295 CB ARG A 257 1.151 6.324 -0.786 1.00 0.00 C ATOM 296 CG ARG A 257 1.629 5.055 -0.100 1.00 0.00 C ATOM 297 CD ARG A 257 3.064 4.723 -0.479 1.00 0.00 C ATOM 298 NE ARG A 257 3.969 4.825 0.663 1.00 0.00 N ATOM 299 CZ ARG A 257 4.466 5.974 1.105 1.00 0.00 C ATOM 300 NH1 ARG A 257 4.148 7.113 0.506 1.00 0.00 N ATOM 301 NH2 ARG A 257 5.284 5.986 2.150 1.00 0.00 N ATOM 0 H ARG A 257 0.008 8.354 -1.601 1.00 0.00 H new ATOM 0 HA ARG A 257 -0.689 5.612 -1.637 1.00 0.00 H new ATOM 0 HB2 ARG A 257 1.618 6.394 -1.768 1.00 0.00 H new ATOM 0 HB3 ARG A 257 1.487 7.187 -0.211 1.00 0.00 H new ATOM 0 HG2 ARG A 257 1.555 5.175 0.981 1.00 0.00 H new ATOM 0 HG3 ARG A 257 0.978 4.225 -0.374 1.00 0.00 H new ATOM 0 HD2 ARG A 257 3.107 3.713 -0.887 1.00 0.00 H new ATOM 0 HD3 ARG A 257 3.397 5.399 -1.267 1.00 0.00 H new ATOM 0 HE ARG A 257 4.233 3.967 1.147 1.00 0.00 H new ATOM 0 HH11 ARG A 257 3.519 7.109 -0.297 1.00 0.00 H new ATOM 0 HH12 ARG A 257 4.532 7.994 0.848 1.00 0.00 H new ATOM 0 HH21 ARG A 257 5.531 5.112 2.614 1.00 0.00 H new ATOM 0 HH22 ARG A 257 5.665 6.869 2.489 1.00 0.00 H new ATOM 315 N GLY A 258 -1.274 7.257 1.129 1.00 0.00 N ATOM 316 CA GLY A 258 -1.915 7.156 2.427 1.00 0.00 C ATOM 317 C GLY A 258 -3.339 6.644 2.333 1.00 0.00 C ATOM 318 O GLY A 258 -3.808 5.928 3.217 1.00 0.00 O ATOM 0 H GLY A 258 -1.024 8.205 0.847 1.00 0.00 H new ATOM 0 HA2 GLY A 258 -1.334 6.490 3.065 1.00 0.00 H new ATOM 0 HA3 GLY A 258 -1.915 8.135 2.906 1.00 0.00 H new ATOM 322 N SER A 259 -4.029 7.014 1.258 1.00 0.00 N ATOM 323 CA SER A 259 -5.410 6.593 1.054 1.00 0.00 C ATOM 324 C SER A 259 -5.487 5.093 0.789 1.00 0.00 C ATOM 325 O SER A 259 -6.363 4.402 1.311 1.00 0.00 O ATOM 326 CB SER A 259 -6.033 7.361 -0.113 1.00 0.00 C ATOM 327 OG SER A 259 -5.956 8.760 0.099 1.00 0.00 O ATOM 0 H SER A 259 -3.654 7.604 0.515 1.00 0.00 H new ATOM 0 HA SER A 259 -5.969 6.813 1.964 1.00 0.00 H new ATOM 0 HB2 SER A 259 -5.520 7.101 -1.039 1.00 0.00 H new ATOM 0 HB3 SER A 259 -7.075 7.065 -0.233 1.00 0.00 H new ATOM 0 HG SER A 259 -6.359 9.229 -0.661 1.00 0.00 H new ATOM 333 N LEU A 260 -4.563 4.594 -0.026 1.00 0.00 N ATOM 334 CA LEU A 260 -4.524 3.175 -0.362 1.00 0.00 C ATOM 335 C LEU A 260 -4.299 2.326 0.885 1.00 0.00 C ATOM 336 O LEU A 260 -4.921 1.279 1.056 1.00 0.00 O ATOM 337 CB LEU A 260 -3.420 2.903 -1.385 1.00 0.00 C ATOM 338 CG LEU A 260 -3.138 1.432 -1.693 1.00 0.00 C ATOM 339 CD1 LEU A 260 -4.333 0.792 -2.381 1.00 0.00 C ATOM 340 CD2 LEU A 260 -1.890 1.297 -2.552 1.00 0.00 C ATOM 0 H LEU A 260 -3.831 5.151 -0.466 1.00 0.00 H new ATOM 0 HA LEU A 260 -5.487 2.903 -0.795 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -3.684 3.404 -2.316 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -2.499 3.361 -1.026 1.00 0.00 H new ATOM 0 HG LEU A 260 -2.965 0.910 -0.752 1.00 0.00 H new ATOM 0 HD11 LEU A 260 -4.114 -0.255 -2.592 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -5.205 0.856 -1.730 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -4.538 1.315 -3.315 1.00 0.00 H new ATOM 0 HD21 LEU A 260 -1.705 0.243 -2.761 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -2.034 1.833 -3.490 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -1.036 1.717 -2.021 1.00 0.00 H new ATOM 352 N ALA A 261 -3.405 2.787 1.754 1.00 0.00 N ATOM 353 CA ALA A 261 -3.100 2.073 2.988 1.00 0.00 C ATOM 354 C ALA A 261 -4.320 2.008 3.901 1.00 0.00 C ATOM 355 O ALA A 261 -4.790 0.925 4.249 1.00 0.00 O ATOM 356 CB ALA A 261 -1.934 2.735 3.707 1.00 0.00 C ATOM 0 H ALA A 261 -2.879 3.652 1.626 1.00 0.00 H new ATOM 0 HA ALA A 261 -2.819 1.052 2.728 1.00 0.00 H new ATOM 0 HB1 ALA A 261 -1.718 2.191 4.627 1.00 0.00 H new ATOM 0 HB2 ALA A 261 -1.055 2.723 3.063 1.00 0.00 H new ATOM 0 HB3 ALA A 261 -2.193 3.766 3.948 1.00 0.00 H new ATOM 362 N VAL A 262 -4.828 3.174 4.285 1.00 0.00 N ATOM 363 CA VAL A 262 -5.994 3.250 5.158 1.00 0.00 C ATOM 364 C VAL A 262 -7.161 2.453 4.586 1.00 0.00 C ATOM 365 O VAL A 262 -8.021 1.973 5.325 1.00 0.00 O ATOM 366 CB VAL A 262 -6.439 4.708 5.375 1.00 0.00 C ATOM 367 CG1 VAL A 262 -7.649 4.766 6.294 1.00 0.00 C ATOM 368 CG2 VAL A 262 -5.293 5.537 5.935 1.00 0.00 C ATOM 0 H VAL A 262 -4.451 4.080 4.006 1.00 0.00 H new ATOM 0 HA VAL A 262 -5.700 2.822 6.116 1.00 0.00 H new ATOM 0 HB VAL A 262 -6.725 5.130 4.411 1.00 0.00 H new ATOM 0 HG11 VAL A 262 -7.949 5.804 6.436 1.00 0.00 H new ATOM 0 HG12 VAL A 262 -8.472 4.208 5.847 1.00 0.00 H new ATOM 0 HG13 VAL A 262 -7.395 4.327 7.259 1.00 0.00 H new ATOM 0 HG21 VAL A 262 -5.625 6.565 6.082 1.00 0.00 H new ATOM 0 HG22 VAL A 262 -4.974 5.119 6.890 1.00 0.00 H new ATOM 0 HG23 VAL A 262 -4.458 5.523 5.235 1.00 0.00 H new ATOM 378 N HIS A 263 -7.185 2.316 3.264 1.00 0.00 N ATOM 379 CA HIS A 263 -8.246 1.576 2.591 1.00 0.00 C ATOM 380 C HIS A 263 -8.070 0.073 2.788 1.00 0.00 C ATOM 381 O HIS A 263 -9.001 -0.622 3.194 1.00 0.00 O ATOM 382 CB HIS A 263 -8.262 1.908 1.099 1.00 0.00 C ATOM 383 CG HIS A 263 -9.212 1.063 0.307 1.00 0.00 C ATOM 384 ND1 HIS A 263 -10.582 1.178 0.404 1.00 0.00 N ATOM 385 CD2 HIS A 263 -8.981 0.086 -0.602 1.00 0.00 C ATOM 386 CE1 HIS A 263 -11.154 0.307 -0.409 1.00 0.00 C ATOM 387 NE2 HIS A 263 -10.204 -0.368 -1.031 1.00 0.00 N ATOM 0 H HIS A 263 -6.482 2.708 2.638 1.00 0.00 H new ATOM 0 HA HIS A 263 -9.198 1.873 3.032 1.00 0.00 H new ATOM 0 HB2 HIS A 263 -8.529 2.957 0.972 1.00 0.00 H new ATOM 0 HB3 HIS A 263 -7.257 1.784 0.697 1.00 0.00 H new ATOM 0 HD1 HIS A 263 -11.077 1.833 1.009 1.00 0.00 H new ATOM 0 HD2 HIS A 263 -8.015 -0.270 -0.929 1.00 0.00 H new ATOM 0 HE1 HIS A 263 -12.217 0.170 -0.542 1.00 0.00 H new ATOM 395 N GLN A 264 -6.871 -0.420 2.497 1.00 0.00 N ATOM 396 CA GLN A 264 -6.574 -1.841 2.641 1.00 0.00 C ATOM 397 C GLN A 264 -6.872 -2.318 4.058 1.00 0.00 C ATOM 398 O GLN A 264 -7.157 -3.495 4.280 1.00 0.00 O ATOM 399 CB GLN A 264 -5.110 -2.115 2.295 1.00 0.00 C ATOM 400 CG GLN A 264 -4.879 -2.426 0.825 1.00 0.00 C ATOM 401 CD GLN A 264 -3.526 -3.058 0.567 1.00 0.00 C ATOM 402 OE1 GLN A 264 -2.843 -3.492 1.496 1.00 0.00 O ATOM 403 NE2 GLN A 264 -3.129 -3.113 -0.699 1.00 0.00 N ATOM 0 H GLN A 264 -6.090 0.143 2.160 1.00 0.00 H new ATOM 0 HA GLN A 264 -7.212 -2.392 1.950 1.00 0.00 H new ATOM 0 HB2 GLN A 264 -4.511 -1.247 2.572 1.00 0.00 H new ATOM 0 HB3 GLN A 264 -4.754 -2.953 2.895 1.00 0.00 H new ATOM 0 HG2 GLN A 264 -5.662 -3.097 0.472 1.00 0.00 H new ATOM 0 HG3 GLN A 264 -4.962 -1.506 0.246 1.00 0.00 H new ATOM 0 HE21 GLN A 264 -3.727 -2.741 -1.437 1.00 0.00 H new ATOM 0 HE22 GLN A 264 -2.227 -3.527 -0.933 1.00 0.00 H new ATOM 412 N ARG A 265 -6.805 -1.397 5.014 1.00 0.00 N ATOM 413 CA ARG A 265 -7.066 -1.725 6.410 1.00 0.00 C ATOM 414 C ARG A 265 -8.446 -2.356 6.572 1.00 0.00 C ATOM 415 O ARG A 265 -8.597 -3.380 7.237 1.00 0.00 O ATOM 416 CB ARG A 265 -6.963 -0.470 7.279 1.00 0.00 C ATOM 417 CG ARG A 265 -5.546 0.064 7.410 1.00 0.00 C ATOM 418 CD ARG A 265 -5.375 0.885 8.680 1.00 0.00 C ATOM 419 NE ARG A 265 -3.990 0.897 9.141 1.00 0.00 N ATOM 420 CZ ARG A 265 -3.587 1.526 10.240 1.00 0.00 C ATOM 421 NH1 ARG A 265 -4.460 2.190 10.985 1.00 0.00 N ATOM 422 NH2 ARG A 265 -2.309 1.491 10.595 1.00 0.00 N ATOM 0 H ARG A 265 -6.572 -0.418 4.847 1.00 0.00 H new ATOM 0 HA ARG A 265 -6.315 -2.446 6.734 1.00 0.00 H new ATOM 0 HB2 ARG A 265 -7.598 0.308 6.856 1.00 0.00 H new ATOM 0 HB3 ARG A 265 -7.352 -0.693 8.273 1.00 0.00 H new ATOM 0 HG2 ARG A 265 -4.842 -0.768 7.416 1.00 0.00 H new ATOM 0 HG3 ARG A 265 -5.306 0.679 6.543 1.00 0.00 H new ATOM 0 HD2 ARG A 265 -5.705 1.908 8.498 1.00 0.00 H new ATOM 0 HD3 ARG A 265 -6.014 0.478 9.463 1.00 0.00 H new ATOM 0 HE ARG A 265 -3.294 0.395 8.590 1.00 0.00 H new ATOM 0 HH11 ARG A 265 -5.443 2.219 10.715 1.00 0.00 H new ATOM 0 HH12 ARG A 265 -4.148 2.672 11.828 1.00 0.00 H new ATOM 0 HH21 ARG A 265 -1.635 0.981 10.024 1.00 0.00 H new ATOM 0 HH22 ARG A 265 -2.001 1.974 11.439 1.00 0.00 H new ATOM 436 N SER A 266 -9.450 -1.737 5.958 1.00 0.00 N ATOM 437 CA SER A 266 -10.818 -2.235 6.037 1.00 0.00 C ATOM 438 C SER A 266 -11.116 -3.189 4.885 1.00 0.00 C ATOM 439 O SER A 266 -11.714 -4.248 5.079 1.00 0.00 O ATOM 440 CB SER A 266 -11.809 -1.070 6.019 1.00 0.00 C ATOM 441 OG SER A 266 -11.749 -0.331 7.227 1.00 0.00 O ATOM 0 H SER A 266 -9.341 -0.890 5.400 1.00 0.00 H new ATOM 0 HA SER A 266 -10.926 -2.780 6.975 1.00 0.00 H new ATOM 0 HB2 SER A 266 -11.589 -0.414 5.177 1.00 0.00 H new ATOM 0 HB3 SER A 266 -12.820 -1.450 5.871 1.00 0.00 H new ATOM 0 HG SER A 266 -12.390 0.409 7.190 1.00 0.00 H new ATOM 447 N CYS A 267 -10.695 -2.806 3.684 1.00 0.00 N ATOM 448 CA CYS A 267 -10.916 -3.625 2.498 1.00 0.00 C ATOM 449 C CYS A 267 -10.426 -5.052 2.724 1.00 0.00 C ATOM 450 O CYS A 267 -10.972 -6.003 2.166 1.00 0.00 O ATOM 451 CB CYS A 267 -10.204 -3.014 1.291 1.00 0.00 C ATOM 452 SG CYS A 267 -10.809 -3.622 -0.316 1.00 0.00 S ATOM 0 H CYS A 267 -10.198 -1.933 3.506 1.00 0.00 H new ATOM 0 HA CYS A 267 -11.988 -3.655 2.302 1.00 0.00 H new ATOM 0 HB2 CYS A 267 -10.320 -1.931 1.324 1.00 0.00 H new ATOM 0 HB3 CYS A 267 -9.137 -3.223 1.368 1.00 0.00 H new ATOM 457 N SER A 268 -9.391 -5.193 3.546 1.00 0.00 N ATOM 458 CA SER A 268 -8.824 -6.503 3.843 1.00 0.00 C ATOM 459 C SER A 268 -9.861 -7.408 4.502 1.00 0.00 C ATOM 460 O SER A 268 -10.276 -7.170 5.636 1.00 0.00 O ATOM 461 CB SER A 268 -7.603 -6.359 4.755 1.00 0.00 C ATOM 462 OG SER A 268 -7.406 -7.528 5.532 1.00 0.00 O ATOM 0 H SER A 268 -8.928 -4.416 4.018 1.00 0.00 H new ATOM 0 HA SER A 268 -8.515 -6.959 2.902 1.00 0.00 H new ATOM 0 HB2 SER A 268 -6.716 -6.165 4.152 1.00 0.00 H new ATOM 0 HB3 SER A 268 -7.735 -5.500 5.412 1.00 0.00 H new ATOM 0 HG SER A 268 -6.619 -7.411 6.105 1.00 0.00 H new ATOM 468 N GLN A 269 -10.274 -8.445 3.782 1.00 0.00 N ATOM 469 CA GLN A 269 -11.264 -9.385 4.296 1.00 0.00 C ATOM 470 C GLN A 269 -10.622 -10.380 5.257 1.00 0.00 C ATOM 471 O GLN A 269 -11.193 -10.712 6.295 1.00 0.00 O ATOM 472 CB GLN A 269 -11.935 -10.133 3.142 1.00 0.00 C ATOM 473 CG GLN A 269 -13.223 -10.836 3.541 1.00 0.00 C ATOM 474 CD GLN A 269 -13.969 -11.405 2.350 1.00 0.00 C ATOM 475 OE1 GLN A 269 -13.739 -12.546 1.947 1.00 0.00 O ATOM 476 NE2 GLN A 269 -14.869 -10.612 1.781 1.00 0.00 N ATOM 0 H GLN A 269 -9.939 -8.656 2.842 1.00 0.00 H new ATOM 0 HA GLN A 269 -12.019 -8.818 4.840 1.00 0.00 H new ATOM 0 HB2 GLN A 269 -12.149 -9.428 2.339 1.00 0.00 H new ATOM 0 HB3 GLN A 269 -11.237 -10.869 2.743 1.00 0.00 H new ATOM 0 HG2 GLN A 269 -12.992 -11.641 4.239 1.00 0.00 H new ATOM 0 HG3 GLN A 269 -13.868 -10.133 4.067 1.00 0.00 H new ATOM 0 HE21 GLN A 269 -15.027 -9.674 2.148 1.00 0.00 H new ATOM 0 HE22 GLN A 269 -15.403 -10.941 0.976 1.00 0.00 H new ATOM 485 N SER A 270 -9.431 -10.852 4.904 1.00 0.00 N ATOM 486 CA SER A 270 -8.712 -11.813 5.733 1.00 0.00 C ATOM 487 C SER A 270 -8.277 -11.175 7.049 1.00 0.00 C ATOM 488 O SER A 270 -8.838 -11.461 8.106 1.00 0.00 O ATOM 489 CB SER A 270 -7.491 -12.352 4.986 1.00 0.00 C ATOM 490 OG SER A 270 -6.800 -13.313 5.764 1.00 0.00 O ATOM 0 H SER A 270 -8.943 -10.585 4.049 1.00 0.00 H new ATOM 0 HA SER A 270 -9.386 -12.640 5.955 1.00 0.00 H new ATOM 0 HB2 SER A 270 -7.806 -12.801 4.044 1.00 0.00 H new ATOM 0 HB3 SER A 270 -6.820 -11.529 4.738 1.00 0.00 H new ATOM 0 HG SER A 270 -6.025 -13.643 5.263 1.00 0.00 H new ATOM 496 N GLY A 271 -7.271 -10.309 6.976 1.00 0.00 N ATOM 497 CA GLY A 271 -6.775 -9.644 8.167 1.00 0.00 C ATOM 498 C GLY A 271 -5.262 -9.656 8.251 1.00 0.00 C ATOM 499 O GLY A 271 -4.569 -10.012 7.297 1.00 0.00 O ATOM 0 H GLY A 271 -6.790 -10.056 6.113 1.00 0.00 H new ATOM 0 HA2 GLY A 271 -7.128 -8.613 8.177 1.00 0.00 H new ATOM 0 HA3 GLY A 271 -7.189 -10.131 9.050 1.00 0.00 H new ATOM 503 N PRO A 272 -4.727 -9.258 9.414 1.00 0.00 N ATOM 504 CA PRO A 272 -3.280 -9.215 9.647 1.00 0.00 C ATOM 505 C PRO A 272 -2.678 -10.605 9.815 1.00 0.00 C ATOM 506 O PRO A 272 -3.349 -11.532 10.268 1.00 0.00 O ATOM 507 CB PRO A 272 -3.153 -8.416 10.946 1.00 0.00 C ATOM 508 CG PRO A 272 -4.450 -8.627 11.648 1.00 0.00 C ATOM 509 CD PRO A 272 -5.493 -8.821 10.593 1.00 0.00 C ATOM 0 HA PRO A 272 -2.745 -8.774 8.806 1.00 0.00 H new ATOM 0 HB2 PRO A 272 -2.315 -8.769 11.548 1.00 0.00 H new ATOM 0 HB3 PRO A 272 -2.979 -7.359 10.745 1.00 0.00 H new ATOM 0 HG2 PRO A 272 -4.397 -9.497 12.302 1.00 0.00 H new ATOM 0 HG3 PRO A 272 -4.692 -7.770 12.276 1.00 0.00 H new ATOM 0 HD2 PRO A 272 -6.229 -9.568 10.891 1.00 0.00 H new ATOM 0 HD3 PRO A 272 -6.038 -7.898 10.396 1.00 0.00 H new ATOM 517 N SER A 273 -1.408 -10.743 9.448 1.00 0.00 N ATOM 518 CA SER A 273 -0.716 -12.022 9.555 1.00 0.00 C ATOM 519 C SER A 273 0.506 -11.905 10.462 1.00 0.00 C ATOM 520 O SER A 273 0.653 -12.658 11.424 1.00 0.00 O ATOM 521 CB SER A 273 -0.292 -12.515 8.171 1.00 0.00 C ATOM 522 OG SER A 273 0.524 -13.669 8.268 1.00 0.00 O ATOM 0 H SER A 273 -0.837 -9.985 9.074 1.00 0.00 H new ATOM 0 HA SER A 273 -1.405 -12.743 9.994 1.00 0.00 H new ATOM 0 HB2 SER A 273 -1.177 -12.740 7.575 1.00 0.00 H new ATOM 0 HB3 SER A 273 0.250 -11.725 7.651 1.00 0.00 H new ATOM 0 HG SER A 273 0.780 -13.965 7.370 1.00 0.00 H new ATOM 528 N SER A 274 1.380 -10.954 10.146 1.00 0.00 N ATOM 529 CA SER A 274 2.591 -10.739 10.929 1.00 0.00 C ATOM 530 C SER A 274 2.565 -9.372 11.605 1.00 0.00 C ATOM 531 O SER A 274 1.903 -8.447 11.137 1.00 0.00 O ATOM 532 CB SER A 274 3.828 -10.856 10.035 1.00 0.00 C ATOM 533 OG SER A 274 3.920 -12.146 9.457 1.00 0.00 O ATOM 0 H SER A 274 1.272 -10.321 9.354 1.00 0.00 H new ATOM 0 HA SER A 274 2.636 -11.506 11.702 1.00 0.00 H new ATOM 0 HB2 SER A 274 3.784 -10.104 9.247 1.00 0.00 H new ATOM 0 HB3 SER A 274 4.724 -10.652 10.621 1.00 0.00 H new ATOM 0 HG SER A 274 4.717 -12.194 8.889 1.00 0.00 H new ATOM 539 N GLY A 275 3.293 -9.253 12.712 1.00 0.00 N ATOM 540 CA GLY A 275 3.340 -7.996 13.437 1.00 0.00 C ATOM 541 C GLY A 275 4.708 -7.718 14.026 1.00 0.00 C ATOM 542 O GLY A 275 5.096 -8.387 14.982 1.00 0.00 O ATOM 0 H GLY A 275 3.850 -10.004 13.119 1.00 0.00 H new ATOM 0 HA2 GLY A 275 3.065 -7.182 12.766 1.00 0.00 H new ATOM 0 HA3 GLY A 275 2.600 -8.014 14.237 1.00 0.00 H new TER 546 GLY A 275 HETATM 547 ZN ZN A 201 -9.966 -2.201 -1.902 1.00 0.00 ZN