USER MOD reduce.3.24.130724 H: found=0, std=0, add=691, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 692 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 248 LYS NZ :NH3+ -117:sc= 1.05 (180deg=-0.717) USER MOD Set 1.2: A 284 TYR OH : rot 47:sc= 0.325 USER MOD Set 2.1: A 234 THR OG1 : rot -55:sc= 0.418 USER MOD Set 2.2: A 270 THR OG1 : rot 180:sc= 0.392 USER MOD Set 3.1: A 218 LYS NZ :NH3+ -146:sc= 0.337 (180deg=-0.123) USER MOD Set 3.2: A 295 THR OG1 : rot -152:sc= -5.99! USER MOD Set 4.1: A 216 GLN : amide:sc= 0 K(o=-3.1,f=0.53) USER MOD Set 4.2: A 240 HIS : no HD1:sc= -3.11! K(o=-3.1!,f=0.56) USER MOD Single : A 217 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 223 TYR OH : rot -147:sc= -3.53! USER MOD Single : A 224 GLN : amide:sc= -0.717 K(o=-0.72,f=-2.7!) USER MOD Single : A 226 SER OG : rot 180:sc= 0 USER MOD Single : A 227 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0775) USER MOD Single : A 229 HIS : no HD1:sc= -0.0814 X(o=-0.081,f=-0.087) USER MOD Single : A 230 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 245 LYS NZ :NH3+ 139:sc= -0.578 (180deg=-2.55!) USER MOD Single : A 249 ASN : amide:sc= -2.83! X(o=-2.8!,f=-2.4) USER MOD Single : A 251 GLN : amide:sc= -0.201 K(o=-0.2,f=-1.2) USER MOD Single : A 254 GLN : amide:sc= -0.934! K(o=-0.93!,f=0) USER MOD Single : A 255 MET CE :methyl -170:sc= -2.59! (180deg=-2.78!) USER MOD Single : A 256 SER OG : rot 13:sc= 0.354 USER MOD Single : A 258 SER OG : rot 180:sc= 0.241 USER MOD Single : A 259 LYS NZ :NH3+ 163:sc= -0.731! (180deg=-1.84!) USER MOD Single : A 260 TYR OH : rot 180:sc= 0 USER MOD Single : A 264 SER OG : rot 180:sc= -0.0538 USER MOD Single : A 268 LYS NZ :NH3+ -105:sc= 1.17 (180deg=-0.844) USER MOD Single : A 272 THR OG1 : rot 180:sc= 0 USER MOD Single : A 274 SER OG : rot 105:sc= 0.635 USER MOD Single : A 275 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 276 CYS SG : rot -111:sc= -3.69! USER MOD Single : A 277 SER OG : rot 180:sc= 0.0523 USER MOD Single : A 285 GLN : amide:sc= -16.7! C(o=-17!,f=-12!) USER MOD Single : A 286 CYS SG : rot 116:sc= -3.99! USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 293 CYS SG : rot 177:sc= -1.85! USER MOD Single : A 294 SER OG : rot 180:sc= 0.0241 USER MOD Single : A 300 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0959) USER MOD ----------------------------------------------------------------- ATOM 97 N ALA A 214 11.834 -2.845 -0.156 1.00 0.50 N ATOM 98 CA ALA A 214 12.653 -1.839 0.480 1.00 0.39 C ATOM 99 C ALA A 214 11.834 -1.118 1.520 1.00 0.25 C ATOM 100 O ALA A 214 12.143 0.000 1.921 1.00 0.27 O ATOM 101 CB ALA A 214 13.197 -0.859 -0.524 1.00 0.48 C ATOM 0 HA ALA A 214 13.503 -2.331 0.954 1.00 0.39 H new ATOM 0 HB1 ALA A 214 13.809 -0.116 -0.012 1.00 0.48 H new ATOM 0 HB2 ALA A 214 13.806 -1.389 -1.256 1.00 0.48 H new ATOM 0 HB3 ALA A 214 12.371 -0.362 -1.032 1.00 0.48 H new ATOM 107 N PHE A 215 10.827 -1.803 2.008 1.00 0.25 N ATOM 108 CA PHE A 215 10.030 -1.300 3.092 1.00 0.18 C ATOM 109 C PHE A 215 10.533 -1.946 4.358 1.00 0.21 C ATOM 110 O PHE A 215 10.356 -3.147 4.560 1.00 0.28 O ATOM 111 CB PHE A 215 8.536 -1.616 2.884 1.00 0.20 C ATOM 112 CG PHE A 215 7.975 -1.188 1.544 1.00 0.23 C ATOM 113 CD1 PHE A 215 8.482 -1.699 0.359 1.00 0.41 C ATOM 114 CD2 PHE A 215 6.933 -0.279 1.472 1.00 0.26 C ATOM 115 CE1 PHE A 215 7.968 -1.310 -0.860 1.00 0.46 C ATOM 116 CE2 PHE A 215 6.415 0.114 0.254 1.00 0.31 C ATOM 117 CZ PHE A 215 6.936 -0.400 -0.913 1.00 0.35 C ATOM 0 H PHE A 215 10.541 -2.720 1.664 1.00 0.25 H new ATOM 0 HA PHE A 215 10.119 -0.215 3.147 1.00 0.18 H new ATOM 0 HB2 PHE A 215 8.387 -2.690 2.998 1.00 0.20 H new ATOM 0 HB3 PHE A 215 7.963 -1.130 3.674 1.00 0.20 H new ATOM 0 HD1 PHE A 215 9.292 -2.413 0.391 1.00 0.41 H new ATOM 0 HD2 PHE A 215 6.519 0.129 2.382 1.00 0.26 H new ATOM 0 HE1 PHE A 215 8.375 -1.719 -1.773 1.00 0.46 H new ATOM 0 HE2 PHE A 215 5.602 0.824 0.216 1.00 0.31 H new ATOM 0 HZ PHE A 215 6.536 -0.090 -1.867 1.00 0.35 H new ATOM 127 N GLN A 216 11.217 -1.143 5.157 1.00 0.18 N ATOM 128 CA GLN A 216 11.783 -1.570 6.425 1.00 0.21 C ATOM 129 C GLN A 216 10.767 -2.398 7.176 1.00 0.24 C ATOM 130 O GLN A 216 10.968 -3.583 7.438 1.00 0.31 O ATOM 131 CB GLN A 216 12.119 -0.332 7.239 1.00 0.20 C ATOM 132 CG GLN A 216 13.485 -0.381 7.898 1.00 0.25 C ATOM 133 CD GLN A 216 13.677 0.734 8.904 1.00 0.30 C ATOM 134 OE1 GLN A 216 13.025 0.763 9.944 1.00 0.92 O ATOM 135 NE2 GLN A 216 14.563 1.664 8.596 1.00 0.79 N ATOM 0 H GLN A 216 11.397 -0.163 4.939 1.00 0.18 H new ATOM 0 HA GLN A 216 12.679 -2.167 6.254 1.00 0.21 H new ATOM 0 HB2 GLN A 216 12.071 0.542 6.589 1.00 0.20 H new ATOM 0 HB3 GLN A 216 11.359 -0.199 8.009 1.00 0.20 H new ATOM 0 HG2 GLN A 216 13.612 -1.342 8.396 1.00 0.25 H new ATOM 0 HG3 GLN A 216 14.258 -0.314 7.132 1.00 0.25 H new ATOM 0 HE21 GLN A 216 15.084 1.602 7.721 1.00 0.79 H new ATOM 0 HE22 GLN A 216 14.726 2.444 9.233 1.00 0.79 H new ATOM 144 N LYS A 217 9.602 -1.809 7.323 1.00 0.20 N ATOM 145 CA LYS A 217 8.452 -2.516 7.807 1.00 0.22 C ATOM 146 C LYS A 217 7.244 -2.166 6.949 1.00 0.17 C ATOM 147 O LYS A 217 6.809 -1.018 6.930 1.00 0.17 O ATOM 148 CB LYS A 217 8.201 -2.131 9.263 1.00 0.28 C ATOM 149 CG LYS A 217 6.966 -2.757 9.859 1.00 0.36 C ATOM 150 CD LYS A 217 6.709 -2.223 11.255 1.00 0.59 C ATOM 151 CE LYS A 217 5.412 -2.761 11.831 1.00 1.26 C ATOM 152 NZ LYS A 217 5.148 -2.224 13.191 1.00 1.85 N ATOM 0 H LYS A 217 9.431 -0.826 7.109 1.00 0.20 H new ATOM 0 HA LYS A 217 8.624 -3.591 7.749 1.00 0.22 H new ATOM 0 HB2 LYS A 217 9.066 -2.421 9.859 1.00 0.28 H new ATOM 0 HB3 LYS A 217 8.115 -1.047 9.332 1.00 0.28 H new ATOM 0 HG2 LYS A 217 6.106 -2.551 9.222 1.00 0.36 H new ATOM 0 HG3 LYS A 217 7.084 -3.840 9.895 1.00 0.36 H new ATOM 0 HD2 LYS A 217 7.538 -2.496 11.908 1.00 0.59 H new ATOM 0 HD3 LYS A 217 6.671 -1.134 11.227 1.00 0.59 H new ATOM 0 HE2 LYS A 217 4.585 -2.500 11.170 1.00 1.26 H new ATOM 0 HE3 LYS A 217 5.456 -3.849 11.872 1.00 1.26 H new ATOM 0 HZ1 LYS A 217 4.254 -2.614 13.551 1.00 1.85 H new ATOM 0 HZ2 LYS A 217 5.925 -2.494 13.828 1.00 1.85 H new ATOM 0 HZ3 LYS A 217 5.081 -1.187 13.148 1.00 1.85 H new ATOM 166 N LYS A 218 6.605 -3.173 6.391 1.00 0.19 N ATOM 167 CA LYS A 218 5.328 -2.979 5.727 1.00 0.20 C ATOM 168 C LYS A 218 4.223 -3.469 6.663 1.00 0.18 C ATOM 169 O LYS A 218 4.430 -4.429 7.408 1.00 0.20 O ATOM 170 CB LYS A 218 5.309 -3.674 4.342 1.00 0.31 C ATOM 171 CG LYS A 218 4.005 -4.378 3.985 1.00 0.39 C ATOM 172 CD LYS A 218 4.039 -5.813 4.476 1.00 0.96 C ATOM 173 CE LYS A 218 2.849 -6.605 3.996 1.00 1.56 C ATOM 174 NZ LYS A 218 2.746 -7.909 4.696 1.00 2.42 N ATOM 0 H LYS A 218 6.946 -4.134 6.383 1.00 0.19 H new ATOM 0 HA LYS A 218 5.159 -1.922 5.521 1.00 0.20 H new ATOM 0 HB2 LYS A 218 5.521 -2.928 3.576 1.00 0.31 H new ATOM 0 HB3 LYS A 218 6.118 -4.404 4.309 1.00 0.31 H new ATOM 0 HG2 LYS A 218 3.163 -3.851 4.434 1.00 0.39 H new ATOM 0 HG3 LYS A 218 3.855 -4.358 2.906 1.00 0.39 H new ATOM 0 HD2 LYS A 218 4.956 -6.292 4.132 1.00 0.96 H new ATOM 0 HD3 LYS A 218 4.065 -5.822 5.566 1.00 0.96 H new ATOM 0 HE2 LYS A 218 1.938 -6.030 4.160 1.00 1.56 H new ATOM 0 HE3 LYS A 218 2.931 -6.773 2.922 1.00 1.56 H new ATOM 0 HZ1 LYS A 218 2.366 -8.624 4.044 1.00 2.42 H new ATOM 0 HZ2 LYS A 218 3.689 -8.204 5.021 1.00 2.42 H new ATOM 0 HZ3 LYS A 218 2.111 -7.815 5.514 1.00 2.42 H new ATOM 188 N LEU A 219 3.144 -2.699 6.765 1.00 0.16 N ATOM 189 CA LEU A 219 2.105 -2.964 7.758 1.00 0.16 C ATOM 190 C LEU A 219 1.511 -4.371 7.632 1.00 0.16 C ATOM 191 O LEU A 219 1.761 -5.083 6.656 1.00 0.17 O ATOM 192 CB LEU A 219 0.996 -1.915 7.692 1.00 0.20 C ATOM 193 CG LEU A 219 1.239 -0.652 8.519 1.00 0.66 C ATOM 194 CD1 LEU A 219 0.024 0.259 8.463 1.00 1.20 C ATOM 195 CD2 LEU A 219 1.573 -1.010 9.960 1.00 1.62 C ATOM 0 H LEU A 219 2.965 -1.887 6.174 1.00 0.16 H new ATOM 0 HA LEU A 219 2.592 -2.903 8.731 1.00 0.16 H new ATOM 0 HB2 LEU A 219 0.854 -1.626 6.651 1.00 0.20 H new ATOM 0 HB3 LEU A 219 0.065 -2.374 8.025 1.00 0.20 H new ATOM 0 HG LEU A 219 2.090 -0.120 8.094 1.00 0.66 H new ATOM 0 HD11 LEU A 219 0.212 1.154 9.056 1.00 1.20 H new ATOM 0 HD12 LEU A 219 -0.170 0.544 7.429 1.00 1.20 H new ATOM 0 HD13 LEU A 219 -0.843 -0.266 8.863 1.00 1.20 H new ATOM 0 HD21 LEU A 219 1.742 -0.098 10.532 1.00 1.62 H new ATOM 0 HD22 LEU A 219 0.743 -1.564 10.399 1.00 1.62 H new ATOM 0 HD23 LEU A 219 2.473 -1.625 9.983 1.00 1.62 H new ATOM 207 N GLU A 220 0.798 -4.782 8.682 1.00 0.17 N ATOM 208 CA GLU A 220 0.224 -6.127 8.791 1.00 0.20 C ATOM 209 C GLU A 220 -0.502 -6.543 7.509 1.00 0.19 C ATOM 210 O GLU A 220 -1.125 -5.714 6.855 1.00 0.19 O ATOM 211 CB GLU A 220 -0.760 -6.161 9.966 1.00 0.23 C ATOM 212 CG GLU A 220 -1.896 -5.148 9.842 1.00 0.24 C ATOM 213 CD GLU A 220 -2.824 -5.149 11.039 1.00 0.75 C ATOM 214 OE1 GLU A 220 -2.572 -5.911 11.998 1.00 1.43 O ATOM 215 OE2 GLU A 220 -3.812 -4.383 11.032 1.00 1.12 O ATOM 0 H GLU A 220 0.600 -4.188 9.487 1.00 0.17 H new ATOM 0 HA GLU A 220 1.041 -6.830 8.955 1.00 0.20 H new ATOM 0 HB2 GLU A 220 -1.184 -7.162 10.045 1.00 0.23 H new ATOM 0 HB3 GLU A 220 -0.215 -5.972 10.891 1.00 0.23 H new ATOM 0 HG2 GLU A 220 -1.474 -4.151 9.717 1.00 0.24 H new ATOM 0 HG3 GLU A 220 -2.472 -5.365 8.943 1.00 0.24 H new ATOM 222 N PRO A 221 -0.391 -7.831 7.111 1.00 0.22 N ATOM 223 CA PRO A 221 -1.005 -8.358 5.876 1.00 0.23 C ATOM 224 C PRO A 221 -2.527 -8.363 5.902 1.00 0.20 C ATOM 225 O PRO A 221 -3.144 -9.229 5.303 1.00 0.19 O ATOM 226 CB PRO A 221 -0.479 -9.794 5.778 1.00 0.29 C ATOM 227 CG PRO A 221 0.681 -9.853 6.713 1.00 0.57 C ATOM 228 CD PRO A 221 0.379 -8.869 7.809 1.00 0.26 C ATOM 0 HA PRO A 221 -0.745 -7.729 5.025 1.00 0.23 H new ATOM 0 HB2 PRO A 221 -1.247 -10.514 6.059 1.00 0.29 H new ATOM 0 HB3 PRO A 221 -0.175 -10.033 4.759 1.00 0.29 H new ATOM 0 HG2 PRO A 221 0.808 -10.858 7.115 1.00 0.57 H new ATOM 0 HG3 PRO A 221 1.608 -9.595 6.201 1.00 0.57 H new ATOM 0 HD2 PRO A 221 -0.195 -9.325 8.615 1.00 0.26 H new ATOM 0 HD3 PRO A 221 1.289 -8.467 8.254 1.00 0.26 H new ATOM 236 N ALA A 222 -3.109 -7.307 6.434 1.00 0.20 N ATOM 237 CA ALA A 222 -4.544 -7.115 6.410 1.00 0.19 C ATOM 238 C ALA A 222 -4.877 -5.662 6.710 1.00 0.15 C ATOM 239 O ALA A 222 -5.217 -5.304 7.840 1.00 0.17 O ATOM 240 CB ALA A 222 -5.238 -8.036 7.398 1.00 0.24 C ATOM 0 H ALA A 222 -2.598 -6.556 6.897 1.00 0.20 H new ATOM 0 HA ALA A 222 -4.907 -7.365 5.413 1.00 0.19 H new ATOM 0 HB1 ALA A 222 -6.314 -7.869 7.357 1.00 0.24 H new ATOM 0 HB2 ALA A 222 -5.022 -9.073 7.142 1.00 0.24 H new ATOM 0 HB3 ALA A 222 -4.877 -7.828 8.405 1.00 0.24 H new ATOM 246 N TYR A 223 -4.778 -4.824 5.691 1.00 0.12 N ATOM 247 CA TYR A 223 -5.100 -3.415 5.836 1.00 0.11 C ATOM 248 C TYR A 223 -6.614 -3.252 5.827 1.00 0.13 C ATOM 249 O TYR A 223 -7.305 -3.878 5.018 1.00 0.17 O ATOM 250 CB TYR A 223 -4.483 -2.579 4.701 1.00 0.12 C ATOM 251 CG TYR A 223 -2.966 -2.448 4.712 1.00 0.12 C ATOM 252 CD1 TYR A 223 -2.178 -3.418 5.324 1.00 0.16 C ATOM 253 CD2 TYR A 223 -2.322 -1.355 4.154 1.00 0.18 C ATOM 254 CE1 TYR A 223 -0.797 -3.296 5.376 1.00 0.18 C ATOM 255 CE2 TYR A 223 -0.945 -1.229 4.211 1.00 0.20 C ATOM 256 CZ TYR A 223 -0.189 -2.211 4.642 1.00 0.16 C ATOM 257 OH TYR A 223 1.177 -2.077 4.888 1.00 0.21 O ATOM 0 H TYR A 223 -4.477 -5.095 4.755 1.00 0.12 H new ATOM 0 HA TYR A 223 -4.685 -3.058 6.778 1.00 0.11 H new ATOM 0 HB2 TYR A 223 -4.782 -3.019 3.750 1.00 0.12 H new ATOM 0 HB3 TYR A 223 -4.914 -1.578 4.739 1.00 0.12 H new ATOM 0 HD1 TYR A 223 -2.650 -4.282 5.767 1.00 0.16 H new ATOM 0 HD2 TYR A 223 -2.905 -0.588 3.666 1.00 0.18 H new ATOM 0 HE1 TYR A 223 -0.197 -3.989 5.946 1.00 0.18 H new ATOM 0 HE2 TYR A 223 -0.484 -0.305 3.895 1.00 0.20 H new ATOM 0 HH TYR A 223 1.426 -1.130 4.842 1.00 0.21 H new ATOM 267 N GLN A 224 -7.128 -2.489 6.781 1.00 0.15 N ATOM 268 CA GLN A 224 -8.567 -2.303 6.920 1.00 0.18 C ATOM 269 C GLN A 224 -8.992 -0.927 6.423 1.00 0.17 C ATOM 270 O GLN A 224 -8.777 0.077 7.105 1.00 0.22 O ATOM 271 CB GLN A 224 -8.980 -2.468 8.384 1.00 0.26 C ATOM 272 CG GLN A 224 -8.784 -3.874 8.926 1.00 0.34 C ATOM 273 CD GLN A 224 -10.000 -4.759 8.729 1.00 0.61 C ATOM 274 OE1 GLN A 224 -10.500 -4.921 7.616 1.00 1.42 O ATOM 275 NE2 GLN A 224 -10.473 -5.356 9.811 1.00 0.99 N ATOM 0 H GLN A 224 -6.570 -1.988 7.472 1.00 0.15 H new ATOM 0 HA GLN A 224 -9.064 -3.060 6.313 1.00 0.18 H new ATOM 0 HB2 GLN A 224 -8.405 -1.771 8.994 1.00 0.26 H new ATOM 0 HB3 GLN A 224 -10.029 -2.192 8.488 1.00 0.26 H new ATOM 0 HG2 GLN A 224 -7.925 -4.331 8.434 1.00 0.34 H new ATOM 0 HG3 GLN A 224 -8.550 -3.818 9.989 1.00 0.34 H new ATOM 0 HE21 GLN A 224 -10.031 -5.196 10.716 1.00 0.99 H new ATOM 0 HE22 GLN A 224 -11.280 -5.976 9.740 1.00 0.99 H new ATOM 284 N VAL A 225 -9.603 -0.883 5.241 1.00 0.16 N ATOM 285 CA VAL A 225 -10.114 0.364 4.698 1.00 0.18 C ATOM 286 C VAL A 225 -11.190 0.910 5.600 1.00 0.24 C ATOM 287 O VAL A 225 -12.198 0.259 5.794 1.00 0.30 O ATOM 288 CB VAL A 225 -10.766 0.196 3.308 1.00 0.28 C ATOM 289 CG1 VAL A 225 -11.105 1.553 2.709 1.00 0.77 C ATOM 290 CG2 VAL A 225 -9.899 -0.604 2.363 1.00 0.77 C ATOM 0 H VAL A 225 -9.754 -1.697 4.645 1.00 0.16 H new ATOM 0 HA VAL A 225 -9.253 1.028 4.618 1.00 0.18 H new ATOM 0 HB VAL A 225 -11.689 -0.367 3.450 1.00 0.28 H new ATOM 0 HG11 VAL A 225 -11.563 1.414 1.730 1.00 0.77 H new ATOM 0 HG12 VAL A 225 -11.801 2.077 3.365 1.00 0.77 H new ATOM 0 HG13 VAL A 225 -10.194 2.142 2.603 1.00 0.77 H new ATOM 0 HG21 VAL A 225 -10.400 -0.695 1.399 1.00 0.77 H new ATOM 0 HG22 VAL A 225 -8.943 -0.097 2.229 1.00 0.77 H new ATOM 0 HG23 VAL A 225 -9.728 -1.597 2.778 1.00 0.77 H new ATOM 300 N SER A 226 -11.142 2.182 5.875 1.00 0.26 N ATOM 301 CA SER A 226 -12.322 2.811 6.408 1.00 0.33 C ATOM 302 C SER A 226 -13.147 3.278 5.216 1.00 0.32 C ATOM 303 O SER A 226 -12.661 4.087 4.432 1.00 0.32 O ATOM 304 CB SER A 226 -11.938 3.970 7.319 1.00 0.42 C ATOM 305 OG SER A 226 -11.009 3.545 8.307 1.00 1.20 O ATOM 0 H SER A 226 -10.332 2.788 5.746 1.00 0.26 H new ATOM 0 HA SER A 226 -12.904 2.119 7.017 1.00 0.33 H new ATOM 0 HB2 SER A 226 -11.504 4.776 6.727 1.00 0.42 H new ATOM 0 HB3 SER A 226 -12.830 4.372 7.800 1.00 0.42 H new ATOM 0 HG SER A 226 -10.773 4.303 8.882 1.00 1.20 H new ATOM 311 N LYS A 227 -14.193 2.520 4.890 1.00 0.34 N ATOM 312 CA LYS A 227 -14.880 2.694 3.609 1.00 0.37 C ATOM 313 C LYS A 227 -15.153 4.155 3.292 1.00 0.42 C ATOM 314 O LYS A 227 -15.798 4.871 4.060 1.00 0.48 O ATOM 315 CB LYS A 227 -16.186 1.884 3.544 1.00 0.44 C ATOM 316 CG LYS A 227 -17.342 2.602 2.839 1.00 0.95 C ATOM 317 CD LYS A 227 -18.556 1.702 2.644 1.00 0.93 C ATOM 318 CE LYS A 227 -19.426 1.620 3.889 1.00 0.96 C ATOM 319 NZ LYS A 227 -20.188 2.877 4.131 1.00 1.54 N ATOM 0 H LYS A 227 -14.580 1.788 5.486 1.00 0.34 H new ATOM 0 HA LYS A 227 -14.199 2.310 2.849 1.00 0.37 H new ATOM 0 HB2 LYS A 227 -15.991 0.943 3.029 1.00 0.44 H new ATOM 0 HB3 LYS A 227 -16.495 1.634 4.559 1.00 0.44 H new ATOM 0 HG2 LYS A 227 -17.632 3.476 3.422 1.00 0.95 H new ATOM 0 HG3 LYS A 227 -17.003 2.964 1.869 1.00 0.95 H new ATOM 0 HD2 LYS A 227 -19.152 2.077 1.812 1.00 0.93 H new ATOM 0 HD3 LYS A 227 -18.222 0.701 2.371 1.00 0.93 H new ATOM 0 HE2 LYS A 227 -20.124 0.789 3.788 1.00 0.96 H new ATOM 0 HE3 LYS A 227 -18.799 1.406 4.754 1.00 0.96 H new ATOM 0 HZ1 LYS A 227 -20.900 2.714 4.872 1.00 1.54 H new ATOM 0 HZ2 LYS A 227 -19.534 3.626 4.437 1.00 1.54 H new ATOM 0 HZ3 LYS A 227 -20.663 3.170 3.253 1.00 1.54 H new ATOM 333 N GLY A 228 -14.641 4.578 2.148 1.00 0.46 N ATOM 334 CA GLY A 228 -14.856 5.940 1.690 1.00 0.57 C ATOM 335 C GLY A 228 -13.912 6.934 2.330 1.00 0.57 C ATOM 336 O GLY A 228 -13.836 8.090 1.912 1.00 0.70 O ATOM 0 H GLY A 228 -14.077 4.002 1.523 1.00 0.46 H new ATOM 0 HA2 GLY A 228 -14.735 5.977 0.607 1.00 0.57 H new ATOM 0 HA3 GLY A 228 -15.884 6.232 1.906 1.00 0.57 H new ATOM 340 N HIS A 229 -13.136 6.470 3.291 1.00 0.47 N ATOM 341 CA HIS A 229 -12.156 7.318 3.950 1.00 0.53 C ATOM 342 C HIS A 229 -10.863 7.313 3.156 1.00 0.54 C ATOM 343 O HIS A 229 -9.938 8.065 3.461 1.00 1.02 O ATOM 344 CB HIS A 229 -11.908 6.823 5.377 1.00 0.55 C ATOM 345 CG HIS A 229 -11.015 7.704 6.197 1.00 1.32 C ATOM 346 ND1 HIS A 229 -11.284 9.030 6.442 1.00 1.94 N ATOM 347 CD2 HIS A 229 -9.863 7.431 6.854 1.00 2.31 C ATOM 348 CE1 HIS A 229 -10.343 9.533 7.213 1.00 2.66 C ATOM 349 NE2 HIS A 229 -9.466 8.583 7.481 1.00 2.89 N ATOM 0 H HIS A 229 -13.164 5.510 3.634 1.00 0.47 H new ATOM 0 HA HIS A 229 -12.537 8.338 4.000 1.00 0.53 H new ATOM 0 HB2 HIS A 229 -12.867 6.726 5.886 1.00 0.55 H new ATOM 0 HB3 HIS A 229 -11.470 5.826 5.331 1.00 0.55 H new ATOM 0 HD2 HIS A 229 -9.351 6.480 6.879 1.00 2.31 H new ATOM 0 HE1 HIS A 229 -10.296 10.552 7.567 1.00 2.66 H new ATOM 0 HE2 HIS A 229 -8.632 8.689 8.059 1.00 2.89 H new ATOM 358 N LYS A 230 -10.799 6.401 2.184 1.00 0.30 N ATOM 359 CA LYS A 230 -9.600 6.171 1.381 1.00 0.28 C ATOM 360 C LYS A 230 -8.526 5.533 2.249 1.00 0.24 C ATOM 361 O LYS A 230 -8.065 6.140 3.218 1.00 0.28 O ATOM 362 CB LYS A 230 -9.071 7.481 0.775 1.00 0.36 C ATOM 363 CG LYS A 230 -10.107 8.259 -0.024 1.00 1.00 C ATOM 364 CD LYS A 230 -9.583 9.633 -0.413 1.00 1.23 C ATOM 365 CE LYS A 230 -10.607 10.421 -1.214 1.00 1.65 C ATOM 366 NZ LYS A 230 -10.098 11.767 -1.586 1.00 2.24 N ATOM 0 H LYS A 230 -11.583 5.799 1.932 1.00 0.30 H new ATOM 0 HA LYS A 230 -9.860 5.503 0.560 1.00 0.28 H new ATOM 0 HB2 LYS A 230 -8.696 8.115 1.578 1.00 0.36 H new ATOM 0 HB3 LYS A 230 -8.224 7.253 0.127 1.00 0.36 H new ATOM 0 HG2 LYS A 230 -10.372 7.701 -0.922 1.00 1.00 H new ATOM 0 HG3 LYS A 230 -11.018 8.368 0.565 1.00 1.00 H new ATOM 0 HD2 LYS A 230 -9.319 10.189 0.486 1.00 1.23 H new ATOM 0 HD3 LYS A 230 -8.671 9.522 -0.999 1.00 1.23 H new ATOM 0 HE2 LYS A 230 -10.866 9.868 -2.117 1.00 1.65 H new ATOM 0 HE3 LYS A 230 -11.522 10.526 -0.631 1.00 1.65 H new ATOM 0 HZ1 LYS A 230 -10.824 12.274 -2.131 1.00 2.24 H new ATOM 0 HZ2 LYS A 230 -9.874 12.304 -0.724 1.00 2.24 H new ATOM 0 HZ3 LYS A 230 -9.239 11.666 -2.164 1.00 2.24 H new ATOM 380 N ILE A 231 -8.233 4.262 2.027 1.00 0.20 N ATOM 381 CA ILE A 231 -7.333 3.584 2.951 1.00 0.17 C ATOM 382 C ILE A 231 -5.875 3.826 2.583 1.00 0.16 C ATOM 383 O ILE A 231 -5.500 3.867 1.411 1.00 0.17 O ATOM 384 CB ILE A 231 -7.590 2.065 3.055 1.00 0.16 C ATOM 385 CG1 ILE A 231 -6.651 1.466 4.112 1.00 0.17 C ATOM 386 CG2 ILE A 231 -7.365 1.389 1.714 1.00 0.18 C ATOM 387 CD1 ILE A 231 -6.708 -0.037 4.230 1.00 0.19 C ATOM 0 H ILE A 231 -8.585 3.698 1.253 1.00 0.20 H new ATOM 0 HA ILE A 231 -7.542 4.019 3.928 1.00 0.17 H new ATOM 0 HB ILE A 231 -8.627 1.899 3.348 1.00 0.16 H new ATOM 0 HG12 ILE A 231 -5.628 1.759 3.877 1.00 0.17 H new ATOM 0 HG13 ILE A 231 -6.893 1.902 5.081 1.00 0.17 H new ATOM 0 HG21 ILE A 231 -7.551 0.319 1.810 1.00 0.18 H new ATOM 0 HG22 ILE A 231 -8.046 1.811 0.975 1.00 0.18 H new ATOM 0 HG23 ILE A 231 -6.336 1.551 1.393 1.00 0.18 H new ATOM 0 HD11 ILE A 231 -6.012 -0.368 5.000 1.00 0.19 H new ATOM 0 HD12 ILE A 231 -7.719 -0.343 4.499 1.00 0.19 H new ATOM 0 HD13 ILE A 231 -6.434 -0.488 3.276 1.00 0.19 H new ATOM 399 N ARG A 232 -5.083 4.081 3.608 1.00 0.17 N ATOM 400 CA ARG A 232 -3.679 4.394 3.450 1.00 0.17 C ATOM 401 C ARG A 232 -2.816 3.167 3.712 1.00 0.15 C ATOM 402 O ARG A 232 -3.010 2.477 4.714 1.00 0.19 O ATOM 403 CB ARG A 232 -3.312 5.509 4.422 1.00 0.22 C ATOM 404 CG ARG A 232 -3.852 6.864 4.015 1.00 0.34 C ATOM 405 CD ARG A 232 -3.436 7.943 4.997 1.00 0.77 C ATOM 406 NE ARG A 232 -3.485 9.272 4.394 1.00 1.44 N ATOM 407 CZ ARG A 232 -4.605 9.895 4.036 1.00 2.13 C ATOM 408 NH1 ARG A 232 -5.790 9.411 4.392 1.00 2.48 N ATOM 409 NH2 ARG A 232 -4.537 11.042 3.377 1.00 3.14 N ATOM 0 H ARG A 232 -5.399 4.076 4.578 1.00 0.17 H new ATOM 0 HA ARG A 232 -3.498 4.718 2.425 1.00 0.17 H new ATOM 0 HB2 ARG A 232 -3.692 5.257 5.412 1.00 0.22 H new ATOM 0 HB3 ARG A 232 -2.227 5.568 4.503 1.00 0.22 H new ATOM 0 HG2 ARG A 232 -3.490 7.117 3.019 1.00 0.34 H new ATOM 0 HG3 ARG A 232 -4.940 6.822 3.958 1.00 0.34 H new ATOM 0 HD2 ARG A 232 -4.091 7.914 5.868 1.00 0.77 H new ATOM 0 HD3 ARG A 232 -2.425 7.742 5.352 1.00 0.77 H new ATOM 0 HE ARG A 232 -2.601 9.756 4.237 1.00 1.44 H new ATOM 0 HH11 ARG A 232 -5.846 8.555 4.944 1.00 2.48 H new ATOM 0 HH12 ARG A 232 -6.643 9.895 4.113 1.00 2.48 H new ATOM 0 HH21 ARG A 232 -3.629 11.444 3.146 1.00 3.14 H new ATOM 0 HH22 ARG A 232 -5.393 11.523 3.101 1.00 3.14 H new ATOM 423 N LEU A 233 -1.835 2.912 2.849 1.00 0.13 N ATOM 424 CA LEU A 233 -0.943 1.801 3.059 1.00 0.14 C ATOM 425 C LEU A 233 0.344 2.322 3.654 1.00 0.13 C ATOM 426 O LEU A 233 1.197 2.844 2.940 1.00 0.13 O ATOM 427 CB LEU A 233 -0.680 1.063 1.741 1.00 0.15 C ATOM 428 CG LEU A 233 -1.778 0.085 1.291 1.00 0.17 C ATOM 429 CD1 LEU A 233 -3.093 0.802 1.024 1.00 0.18 C ATOM 430 CD2 LEU A 233 -1.338 -0.677 0.053 1.00 0.23 C ATOM 0 H LEU A 233 -1.648 3.460 2.009 1.00 0.13 H new ATOM 0 HA LEU A 233 -1.397 1.087 3.746 1.00 0.14 H new ATOM 0 HB2 LEU A 233 -0.535 1.804 0.955 1.00 0.15 H new ATOM 0 HB3 LEU A 233 0.255 0.511 1.836 1.00 0.15 H new ATOM 0 HG LEU A 233 -1.941 -0.621 2.105 1.00 0.17 H new ATOM 0 HD11 LEU A 233 -3.844 0.078 0.708 1.00 0.18 H new ATOM 0 HD12 LEU A 233 -3.428 1.299 1.935 1.00 0.18 H new ATOM 0 HD13 LEU A 233 -2.950 1.543 0.238 1.00 0.18 H new ATOM 0 HD21 LEU A 233 -2.128 -1.364 -0.251 1.00 0.23 H new ATOM 0 HD22 LEU A 233 -1.138 0.026 -0.755 1.00 0.23 H new ATOM 0 HD23 LEU A 233 -0.432 -1.241 0.276 1.00 0.23 H new ATOM 442 N THR A 234 0.403 2.318 4.972 1.00 0.14 N ATOM 443 CA THR A 234 1.519 2.903 5.687 1.00 0.16 C ATOM 444 C THR A 234 2.622 1.883 5.903 1.00 0.16 C ATOM 445 O THR A 234 2.361 0.708 6.153 1.00 0.22 O ATOM 446 CB THR A 234 1.065 3.489 7.037 1.00 0.22 C ATOM 447 OG1 THR A 234 0.088 4.511 6.802 1.00 0.33 O ATOM 448 CG2 THR A 234 2.240 4.074 7.808 1.00 0.24 C ATOM 0 H THR A 234 -0.315 1.913 5.572 1.00 0.14 H new ATOM 0 HA THR A 234 1.914 3.714 5.074 1.00 0.16 H new ATOM 0 HB THR A 234 0.634 2.686 7.635 1.00 0.22 H new ATOM 0 HG1 THR A 234 0.459 5.184 6.194 1.00 0.33 H new ATOM 0 HG21 THR A 234 1.887 4.480 8.756 1.00 0.24 H new ATOM 0 HG22 THR A 234 2.975 3.292 7.999 1.00 0.24 H new ATOM 0 HG23 THR A 234 2.700 4.869 7.222 1.00 0.24 H new ATOM 456 N VAL A 235 3.850 2.324 5.701 1.00 0.14 N ATOM 457 CA VAL A 235 5.012 1.465 5.811 1.00 0.14 C ATOM 458 C VAL A 235 6.191 2.259 6.345 1.00 0.14 C ATOM 459 O VAL A 235 6.378 3.417 5.970 1.00 0.16 O ATOM 460 CB VAL A 235 5.408 0.862 4.447 1.00 0.14 C ATOM 461 CG1 VAL A 235 4.320 -0.038 3.909 1.00 0.15 C ATOM 462 CG2 VAL A 235 5.690 1.964 3.452 1.00 0.14 C ATOM 0 H VAL A 235 4.069 3.290 5.456 1.00 0.14 H new ATOM 0 HA VAL A 235 4.753 0.654 6.492 1.00 0.14 H new ATOM 0 HB VAL A 235 6.308 0.265 4.596 1.00 0.14 H new ATOM 0 HG11 VAL A 235 4.629 -0.447 2.947 1.00 0.15 H new ATOM 0 HG12 VAL A 235 4.142 -0.853 4.610 1.00 0.15 H new ATOM 0 HG13 VAL A 235 3.403 0.537 3.781 1.00 0.15 H new ATOM 0 HG21 VAL A 235 5.968 1.526 2.493 1.00 0.14 H new ATOM 0 HG22 VAL A 235 4.798 2.577 3.325 1.00 0.14 H new ATOM 0 HG23 VAL A 235 6.508 2.585 3.819 1.00 0.14 H new ATOM 472 N GLU A 236 7.067 1.598 7.074 1.00 0.13 N ATOM 473 CA GLU A 236 8.317 2.206 7.446 1.00 0.13 C ATOM 474 C GLU A 236 9.318 1.813 6.391 1.00 0.13 C ATOM 475 O GLU A 236 9.469 0.635 6.102 1.00 0.17 O ATOM 476 CB GLU A 236 8.764 1.727 8.827 1.00 0.18 C ATOM 477 CG GLU A 236 9.829 2.608 9.457 1.00 0.29 C ATOM 478 CD GLU A 236 9.900 2.442 10.959 1.00 0.54 C ATOM 479 OE1 GLU A 236 8.897 2.705 11.645 1.00 1.05 O ATOM 480 OE2 GLU A 236 10.968 2.038 11.464 1.00 1.18 O ATOM 0 H GLU A 236 6.933 0.646 7.416 1.00 0.13 H new ATOM 0 HA GLU A 236 8.221 3.290 7.506 1.00 0.13 H new ATOM 0 HB2 GLU A 236 7.898 1.688 9.488 1.00 0.18 H new ATOM 0 HB3 GLU A 236 9.147 0.710 8.744 1.00 0.18 H new ATOM 0 HG2 GLU A 236 10.799 2.369 9.021 1.00 0.29 H new ATOM 0 HG3 GLU A 236 9.621 3.651 9.219 1.00 0.29 H new ATOM 487 N LEU A 237 9.784 2.782 5.637 1.00 0.13 N ATOM 488 CA LEU A 237 10.589 2.487 4.472 1.00 0.15 C ATOM 489 C LEU A 237 12.039 2.269 4.835 1.00 0.17 C ATOM 490 O LEU A 237 12.611 3.047 5.585 1.00 0.19 O ATOM 491 CB LEU A 237 10.501 3.616 3.454 1.00 0.17 C ATOM 492 CG LEU A 237 9.532 3.394 2.303 1.00 0.23 C ATOM 493 CD1 LEU A 237 9.563 4.585 1.366 1.00 0.44 C ATOM 494 CD2 LEU A 237 9.893 2.129 1.552 1.00 0.55 C ATOM 0 H LEU A 237 9.622 3.775 5.807 1.00 0.13 H new ATOM 0 HA LEU A 237 10.193 1.568 4.039 1.00 0.15 H new ATOM 0 HB2 LEU A 237 10.213 4.529 3.976 1.00 0.17 H new ATOM 0 HB3 LEU A 237 11.495 3.785 3.040 1.00 0.17 H new ATOM 0 HG LEU A 237 8.525 3.285 2.705 1.00 0.23 H new ATOM 0 HD11 LEU A 237 8.867 4.419 0.544 1.00 0.44 H new ATOM 0 HD12 LEU A 237 9.274 5.484 1.911 1.00 0.44 H new ATOM 0 HD13 LEU A 237 10.570 4.709 0.969 1.00 0.44 H new ATOM 0 HD21 LEU A 237 9.192 1.981 0.730 1.00 0.55 H new ATOM 0 HD22 LEU A 237 10.904 2.218 1.155 1.00 0.55 H new ATOM 0 HD23 LEU A 237 9.843 1.277 2.230 1.00 0.55 H new ATOM 506 N ALA A 238 12.672 1.369 4.100 1.00 0.19 N ATOM 507 CA ALA A 238 14.119 1.265 4.100 1.00 0.21 C ATOM 508 C ALA A 238 14.654 2.301 3.129 1.00 0.23 C ATOM 509 O ALA A 238 15.785 2.773 3.239 1.00 0.28 O ATOM 510 CB ALA A 238 14.562 -0.121 3.677 1.00 0.25 C ATOM 0 H ALA A 238 12.202 0.697 3.493 1.00 0.19 H new ATOM 0 HA ALA A 238 14.504 1.440 5.105 1.00 0.21 H new ATOM 0 HB1 ALA A 238 15.651 -0.173 3.685 1.00 0.25 H new ATOM 0 HB2 ALA A 238 14.158 -0.859 4.370 1.00 0.25 H new ATOM 0 HB3 ALA A 238 14.196 -0.329 2.671 1.00 0.25 H new ATOM 516 N ASP A 239 13.791 2.653 2.184 1.00 0.22 N ATOM 517 CA ASP A 239 14.085 3.660 1.178 1.00 0.25 C ATOM 518 C ASP A 239 14.305 5.021 1.817 1.00 0.25 C ATOM 519 O ASP A 239 15.251 5.724 1.474 1.00 0.34 O ATOM 520 CB ASP A 239 12.940 3.750 0.172 1.00 0.31 C ATOM 521 CG ASP A 239 12.935 2.593 -0.800 1.00 0.63 C ATOM 522 OD1 ASP A 239 13.954 2.398 -1.503 1.00 1.28 O ATOM 523 OD2 ASP A 239 11.923 1.882 -0.864 1.00 1.19 O ATOM 0 H ASP A 239 12.861 2.243 2.096 1.00 0.22 H new ATOM 0 HA ASP A 239 14.999 3.364 0.664 1.00 0.25 H new ATOM 0 HB2 ASP A 239 11.991 3.775 0.707 1.00 0.31 H new ATOM 0 HB3 ASP A 239 13.019 4.686 -0.382 1.00 0.31 H new ATOM 528 N HIS A 240 13.400 5.387 2.731 1.00 0.27 N ATOM 529 CA HIS A 240 13.446 6.670 3.455 1.00 0.39 C ATOM 530 C HIS A 240 13.020 7.837 2.567 1.00 0.47 C ATOM 531 O HIS A 240 12.406 8.788 3.042 1.00 0.70 O ATOM 532 CB HIS A 240 14.833 6.955 4.048 1.00 0.46 C ATOM 533 CG HIS A 240 15.318 5.920 5.019 1.00 0.46 C ATOM 534 ND1 HIS A 240 16.454 6.087 5.777 1.00 0.56 N ATOM 535 CD2 HIS A 240 14.843 4.686 5.324 1.00 0.40 C ATOM 536 CE1 HIS A 240 16.663 5.005 6.499 1.00 0.57 C ATOM 537 NE2 HIS A 240 15.702 4.135 6.246 1.00 0.48 N ATOM 0 H HIS A 240 12.608 4.800 2.994 1.00 0.27 H new ATOM 0 HA HIS A 240 12.736 6.575 4.277 1.00 0.39 H new ATOM 0 HB2 HIS A 240 15.553 7.037 3.234 1.00 0.46 H new ATOM 0 HB3 HIS A 240 14.808 7.922 4.550 1.00 0.46 H new ATOM 0 HD2 HIS A 240 13.956 4.223 4.918 1.00 0.40 H new ATOM 0 HE1 HIS A 240 17.484 4.854 7.184 1.00 0.57 H new ATOM 0 HE2 HIS A 240 15.612 3.209 6.664 1.00 0.48 H new ATOM 546 N ASP A 241 13.347 7.764 1.287 1.00 0.41 N ATOM 547 CA ASP A 241 12.977 8.805 0.336 1.00 0.51 C ATOM 548 C ASP A 241 12.986 8.232 -1.074 1.00 0.44 C ATOM 549 O ASP A 241 13.862 8.541 -1.883 1.00 0.78 O ATOM 550 CB ASP A 241 13.932 10.002 0.420 1.00 0.80 C ATOM 551 CG ASP A 241 13.350 11.267 -0.196 1.00 1.53 C ATOM 552 OD1 ASP A 241 12.869 11.200 -1.349 1.00 2.22 O ATOM 553 OD2 ASP A 241 13.344 12.327 0.469 1.00 2.08 O ATOM 0 H ASP A 241 13.871 6.990 0.879 1.00 0.41 H new ATOM 0 HA ASP A 241 11.976 9.157 0.585 1.00 0.51 H new ATOM 0 HB2 ASP A 241 14.178 10.192 1.465 1.00 0.80 H new ATOM 0 HB3 ASP A 241 14.865 9.753 -0.086 1.00 0.80 H new ATOM 558 N ALA A 242 12.031 7.360 -1.342 1.00 0.33 N ATOM 559 CA ALA A 242 11.908 6.729 -2.643 1.00 0.30 C ATOM 560 C ALA A 242 10.448 6.507 -2.967 1.00 0.24 C ATOM 561 O ALA A 242 9.638 6.267 -2.066 1.00 0.28 O ATOM 562 CB ALA A 242 12.656 5.409 -2.680 1.00 0.38 C ATOM 0 H ALA A 242 11.322 7.071 -0.668 1.00 0.33 H new ATOM 0 HA ALA A 242 12.349 7.389 -3.390 1.00 0.30 H new ATOM 0 HB1 ALA A 242 12.548 4.957 -3.666 1.00 0.38 H new ATOM 0 HB2 ALA A 242 13.712 5.583 -2.475 1.00 0.38 H new ATOM 0 HB3 ALA A 242 12.246 4.737 -1.926 1.00 0.38 H new ATOM 568 N GLU A 243 10.111 6.611 -4.240 1.00 0.26 N ATOM 569 CA GLU A 243 8.744 6.421 -4.673 1.00 0.30 C ATOM 570 C GLU A 243 8.358 4.961 -4.525 1.00 0.25 C ATOM 571 O GLU A 243 8.950 4.086 -5.157 1.00 0.25 O ATOM 572 CB GLU A 243 8.579 6.846 -6.133 1.00 0.39 C ATOM 573 CG GLU A 243 9.048 8.261 -6.420 1.00 0.67 C ATOM 574 CD GLU A 243 8.844 8.653 -7.867 1.00 1.10 C ATOM 575 OE1 GLU A 243 7.685 8.663 -8.330 1.00 1.56 O ATOM 576 OE2 GLU A 243 9.843 8.951 -8.555 1.00 1.64 O ATOM 0 H GLU A 243 10.768 6.826 -4.990 1.00 0.26 H new ATOM 0 HA GLU A 243 8.094 7.037 -4.051 1.00 0.30 H new ATOM 0 HB2 GLU A 243 9.134 6.154 -6.767 1.00 0.39 H new ATOM 0 HB3 GLU A 243 7.528 6.759 -6.410 1.00 0.39 H new ATOM 0 HG2 GLU A 243 8.508 8.957 -5.778 1.00 0.67 H new ATOM 0 HG3 GLU A 243 10.105 8.349 -6.168 1.00 0.67 H new ATOM 583 N VAL A 244 7.352 4.704 -3.713 1.00 0.24 N ATOM 584 CA VAL A 244 6.886 3.351 -3.511 1.00 0.21 C ATOM 585 C VAL A 244 5.743 3.041 -4.462 1.00 0.20 C ATOM 586 O VAL A 244 4.698 3.692 -4.433 1.00 0.23 O ATOM 587 CB VAL A 244 6.442 3.097 -2.043 1.00 0.22 C ATOM 588 CG1 VAL A 244 7.639 3.186 -1.113 1.00 0.24 C ATOM 589 CG2 VAL A 244 5.350 4.073 -1.589 1.00 0.27 C ATOM 0 H VAL A 244 6.844 5.414 -3.185 1.00 0.24 H new ATOM 0 HA VAL A 244 7.724 2.685 -3.720 1.00 0.21 H new ATOM 0 HB VAL A 244 6.019 2.093 -2.001 1.00 0.22 H new ATOM 0 HG11 VAL A 244 7.317 3.007 -0.087 1.00 0.24 H new ATOM 0 HG12 VAL A 244 8.378 2.437 -1.398 1.00 0.24 H new ATOM 0 HG13 VAL A 244 8.083 4.179 -1.185 1.00 0.24 H new ATOM 0 HG21 VAL A 244 5.073 3.855 -0.557 1.00 0.27 H new ATOM 0 HG22 VAL A 244 5.724 5.095 -1.657 1.00 0.27 H new ATOM 0 HG23 VAL A 244 4.475 3.964 -2.230 1.00 0.27 H new ATOM 599 N LYS A 245 5.912 1.994 -5.243 1.00 0.18 N ATOM 600 CA LYS A 245 4.826 1.505 -6.062 1.00 0.19 C ATOM 601 C LYS A 245 4.190 0.347 -5.335 1.00 0.15 C ATOM 602 O LYS A 245 4.771 -0.191 -4.396 1.00 0.16 O ATOM 603 CB LYS A 245 5.299 1.098 -7.459 1.00 0.30 C ATOM 604 CG LYS A 245 5.542 2.286 -8.378 1.00 0.89 C ATOM 605 CD LYS A 245 5.786 1.859 -9.823 1.00 1.51 C ATOM 606 CE LYS A 245 7.199 1.333 -10.043 1.00 2.00 C ATOM 607 NZ LYS A 245 7.399 -0.033 -9.489 1.00 2.79 N ATOM 0 H LYS A 245 6.783 1.470 -5.327 1.00 0.18 H new ATOM 0 HA LYS A 245 4.096 2.300 -6.217 1.00 0.19 H new ATOM 0 HB2 LYS A 245 6.219 0.521 -7.370 1.00 0.30 H new ATOM 0 HB3 LYS A 245 4.554 0.443 -7.911 1.00 0.30 H new ATOM 0 HG2 LYS A 245 4.682 2.955 -8.339 1.00 0.89 H new ATOM 0 HG3 LYS A 245 6.402 2.851 -8.018 1.00 0.89 H new ATOM 0 HD2 LYS A 245 5.067 1.087 -10.097 1.00 1.51 H new ATOM 0 HD3 LYS A 245 5.610 2.707 -10.484 1.00 1.51 H new ATOM 0 HE2 LYS A 245 7.415 1.322 -11.111 1.00 2.00 H new ATOM 0 HE3 LYS A 245 7.912 2.016 -9.580 1.00 2.00 H new ATOM 0 HZ1 LYS A 245 7.966 -0.597 -10.153 1.00 2.79 H new ATOM 0 HZ2 LYS A 245 7.896 0.031 -8.578 1.00 2.79 H new ATOM 0 HZ3 LYS A 245 6.475 -0.489 -9.348 1.00 2.79 H new ATOM 621 N TRP A 246 2.942 0.088 -5.599 1.00 0.14 N ATOM 622 CA TRP A 246 2.250 -0.909 -4.824 1.00 0.13 C ATOM 623 C TRP A 246 1.592 -1.891 -5.756 1.00 0.14 C ATOM 624 O TRP A 246 1.744 -1.795 -6.967 1.00 0.14 O ATOM 625 CB TRP A 246 1.262 -0.275 -3.826 1.00 0.14 C ATOM 626 CG TRP A 246 1.927 0.708 -2.893 1.00 0.12 C ATOM 627 CD1 TRP A 246 2.439 1.923 -3.235 1.00 0.14 C ATOM 628 CD2 TRP A 246 2.180 0.561 -1.480 1.00 0.11 C ATOM 629 NE1 TRP A 246 2.988 2.535 -2.145 1.00 0.15 N ATOM 630 CE2 TRP A 246 2.848 1.730 -1.058 1.00 0.12 C ATOM 631 CE3 TRP A 246 1.916 -0.427 -0.526 1.00 0.13 C ATOM 632 CZ2 TRP A 246 3.248 1.935 0.258 1.00 0.14 C ATOM 633 CZ3 TRP A 246 2.320 -0.209 0.785 1.00 0.15 C ATOM 634 CH2 TRP A 246 2.978 0.961 1.156 1.00 0.15 C ATOM 0 H TRP A 246 2.390 0.540 -6.328 1.00 0.14 H new ATOM 0 HA TRP A 246 2.969 -1.452 -4.211 1.00 0.13 H new ATOM 0 HB2 TRP A 246 0.470 0.232 -4.377 1.00 0.14 H new ATOM 0 HB3 TRP A 246 0.788 -1.063 -3.240 1.00 0.14 H new ATOM 0 HD1 TRP A 246 2.414 2.344 -4.229 1.00 0.14 H new ATOM 0 HE1 TRP A 246 3.434 3.453 -2.146 1.00 0.15 H new ATOM 0 HE3 TRP A 246 1.409 -1.340 -0.803 1.00 0.13 H new ATOM 0 HZ2 TRP A 246 3.757 2.841 0.553 1.00 0.14 H new ATOM 0 HZ3 TRP A 246 2.120 -0.963 1.532 1.00 0.15 H new ATOM 0 HH2 TRP A 246 3.280 1.093 2.185 1.00 0.15 H new ATOM 645 N LEU A 247 1.143 -2.975 -5.219 1.00 0.15 N ATOM 646 CA LEU A 247 0.658 -4.054 -6.034 1.00 0.14 C ATOM 647 C LEU A 247 -0.738 -4.429 -5.565 1.00 0.15 C ATOM 648 O LEU A 247 -0.952 -4.622 -4.394 1.00 0.16 O ATOM 649 CB LEU A 247 1.618 -5.243 -5.886 1.00 0.15 C ATOM 650 CG LEU A 247 2.476 -5.644 -7.094 1.00 0.16 C ATOM 651 CD1 LEU A 247 1.812 -6.769 -7.870 1.00 0.21 C ATOM 652 CD2 LEU A 247 2.762 -4.458 -7.999 1.00 0.17 C ATOM 0 H LEU A 247 1.099 -3.144 -4.214 1.00 0.15 H new ATOM 0 HA LEU A 247 0.610 -3.763 -7.083 1.00 0.14 H new ATOM 0 HB2 LEU A 247 2.292 -5.024 -5.058 1.00 0.15 H new ATOM 0 HB3 LEU A 247 1.028 -6.112 -5.595 1.00 0.15 H new ATOM 0 HG LEU A 247 3.433 -6.002 -6.715 1.00 0.16 H new ATOM 0 HD11 LEU A 247 2.435 -7.040 -8.723 1.00 0.21 H new ATOM 0 HD12 LEU A 247 1.689 -7.636 -7.221 1.00 0.21 H new ATOM 0 HD13 LEU A 247 0.835 -6.440 -8.224 1.00 0.21 H new ATOM 0 HD21 LEU A 247 3.372 -4.782 -8.842 1.00 0.17 H new ATOM 0 HD22 LEU A 247 1.822 -4.047 -8.368 1.00 0.17 H new ATOM 0 HD23 LEU A 247 3.298 -3.693 -7.437 1.00 0.17 H new ATOM 664 N LYS A 248 -1.639 -4.670 -6.474 1.00 0.19 N ATOM 665 CA LYS A 248 -2.897 -5.286 -6.105 1.00 0.25 C ATOM 666 C LYS A 248 -2.678 -6.772 -6.287 1.00 0.25 C ATOM 667 O LYS A 248 -1.775 -7.133 -7.037 1.00 0.21 O ATOM 668 CB LYS A 248 -4.033 -4.813 -7.014 1.00 0.34 C ATOM 669 CG LYS A 248 -5.419 -5.096 -6.466 1.00 0.77 C ATOM 670 CD LYS A 248 -6.489 -4.859 -7.516 1.00 0.95 C ATOM 671 CE LYS A 248 -7.853 -4.629 -6.888 1.00 1.57 C ATOM 672 NZ LYS A 248 -8.009 -3.234 -6.392 1.00 2.06 N ATOM 0 H LYS A 248 -1.536 -4.455 -7.466 1.00 0.19 H new ATOM 0 HA LYS A 248 -3.182 -5.025 -5.086 1.00 0.25 H new ATOM 0 HB2 LYS A 248 -3.930 -3.740 -7.179 1.00 0.34 H new ATOM 0 HB3 LYS A 248 -3.932 -5.296 -7.986 1.00 0.34 H new ATOM 0 HG2 LYS A 248 -5.471 -6.128 -6.118 1.00 0.77 H new ATOM 0 HG3 LYS A 248 -5.607 -4.459 -5.602 1.00 0.77 H new ATOM 0 HD2 LYS A 248 -6.218 -3.995 -8.123 1.00 0.95 H new ATOM 0 HD3 LYS A 248 -6.537 -5.717 -8.186 1.00 0.95 H new ATOM 0 HE2 LYS A 248 -8.631 -4.842 -7.621 1.00 1.57 H new ATOM 0 HE3 LYS A 248 -7.994 -5.326 -6.062 1.00 1.57 H new ATOM 0 HZ1 LYS A 248 -8.140 -3.245 -5.360 1.00 2.06 H new ATOM 0 HZ2 LYS A 248 -7.158 -2.685 -6.627 1.00 2.06 H new ATOM 0 HZ3 LYS A 248 -8.838 -2.796 -6.842 1.00 2.06 H new ATOM 686 N ASN A 249 -3.308 -7.624 -5.486 1.00 0.34 N ATOM 687 CA ASN A 249 -2.978 -9.046 -5.551 1.00 0.40 C ATOM 688 C ASN A 249 -2.985 -9.506 -7.010 1.00 0.35 C ATOM 689 O ASN A 249 -3.982 -9.339 -7.721 1.00 0.35 O ATOM 690 CB ASN A 249 -3.904 -9.908 -4.666 1.00 0.61 C ATOM 691 CG ASN A 249 -5.262 -10.224 -5.270 1.00 0.75 C ATOM 692 OD1 ASN A 249 -5.383 -11.036 -6.190 1.00 1.38 O ATOM 693 ND2 ASN A 249 -6.299 -9.608 -4.736 1.00 1.19 N ATOM 0 H ASN A 249 -4.025 -7.370 -4.806 1.00 0.34 H new ATOM 0 HA ASN A 249 -1.976 -9.184 -5.145 1.00 0.40 H new ATOM 0 HB2 ASN A 249 -3.396 -10.846 -4.442 1.00 0.61 H new ATOM 0 HB3 ASN A 249 -4.056 -9.393 -3.717 1.00 0.61 H new ATOM 0 HD21 ASN A 249 -7.239 -9.798 -5.083 1.00 1.19 H new ATOM 0 HD22 ASN A 249 -6.161 -8.942 -3.976 1.00 1.19 H new ATOM 700 N GLY A 250 -1.785 -9.805 -7.501 1.00 0.35 N ATOM 701 CA GLY A 250 -1.579 -10.085 -8.910 1.00 0.35 C ATOM 702 C GLY A 250 -1.375 -8.846 -9.781 1.00 0.33 C ATOM 703 O GLY A 250 -0.511 -8.850 -10.661 1.00 0.39 O ATOM 0 H GLY A 250 -0.938 -9.859 -6.935 1.00 0.35 H new ATOM 0 HA2 GLY A 250 -0.710 -10.734 -9.015 1.00 0.35 H new ATOM 0 HA3 GLY A 250 -2.438 -10.640 -9.286 1.00 0.35 H new ATOM 707 N GLN A 251 -2.229 -7.840 -9.625 1.00 0.30 N ATOM 708 CA GLN A 251 -2.200 -6.661 -10.501 1.00 0.36 C ATOM 709 C GLN A 251 -1.192 -5.622 -10.015 1.00 0.25 C ATOM 710 O GLN A 251 -1.096 -5.354 -8.833 1.00 0.28 O ATOM 711 CB GLN A 251 -3.592 -6.023 -10.593 1.00 0.52 C ATOM 712 CG GLN A 251 -4.531 -6.672 -11.606 1.00 1.28 C ATOM 713 CD GLN A 251 -4.986 -8.067 -11.216 1.00 2.00 C ATOM 714 OE1 GLN A 251 -4.212 -9.022 -11.245 1.00 2.77 O ATOM 715 NE2 GLN A 251 -6.253 -8.196 -10.856 1.00 2.59 N ATOM 0 H GLN A 251 -2.950 -7.812 -8.904 1.00 0.30 H new ATOM 0 HA GLN A 251 -1.891 -7.001 -11.490 1.00 0.36 H new ATOM 0 HB2 GLN A 251 -4.059 -6.062 -9.609 1.00 0.52 H new ATOM 0 HB3 GLN A 251 -3.477 -4.970 -10.849 1.00 0.52 H new ATOM 0 HG2 GLN A 251 -5.408 -6.037 -11.733 1.00 1.28 H new ATOM 0 HG3 GLN A 251 -4.029 -6.721 -12.573 1.00 1.28 H new ATOM 0 HE21 GLN A 251 -6.865 -7.380 -10.844 1.00 2.59 H new ATOM 0 HE22 GLN A 251 -6.617 -9.111 -10.590 1.00 2.59 H new ATOM 724 N GLU A 252 -0.426 -5.036 -10.915 1.00 0.26 N ATOM 725 CA GLU A 252 0.562 -4.046 -10.510 1.00 0.25 C ATOM 726 C GLU A 252 -0.060 -2.668 -10.311 1.00 0.27 C ATOM 727 O GLU A 252 -0.935 -2.253 -11.069 1.00 0.32 O ATOM 728 CB GLU A 252 1.717 -4.002 -11.496 1.00 0.32 C ATOM 729 CG GLU A 252 2.527 -5.285 -11.473 1.00 0.60 C ATOM 730 CD GLU A 252 3.886 -5.134 -12.114 1.00 1.05 C ATOM 731 OE1 GLU A 252 4.134 -4.083 -12.735 1.00 1.49 O ATOM 732 OE2 GLU A 252 4.713 -6.062 -12.009 1.00 1.60 O ATOM 0 H GLU A 252 -0.464 -5.222 -11.917 1.00 0.26 H new ATOM 0 HA GLU A 252 0.958 -4.353 -9.542 1.00 0.25 H new ATOM 0 HB2 GLU A 252 1.330 -3.834 -12.501 1.00 0.32 H new ATOM 0 HB3 GLU A 252 2.365 -3.159 -11.259 1.00 0.32 H new ATOM 0 HG2 GLU A 252 2.652 -5.611 -10.440 1.00 0.60 H new ATOM 0 HG3 GLU A 252 1.972 -6.068 -11.990 1.00 0.60 H new ATOM 739 N ILE A 253 0.297 -2.038 -9.197 1.00 0.23 N ATOM 740 CA ILE A 253 -0.313 -0.786 -8.783 1.00 0.27 C ATOM 741 C ILE A 253 0.685 0.383 -8.834 1.00 0.28 C ATOM 742 O ILE A 253 1.596 0.521 -7.996 1.00 0.28 O ATOM 743 CB ILE A 253 -0.938 -0.966 -7.377 1.00 0.26 C ATOM 744 CG1 ILE A 253 -2.363 -1.488 -7.498 1.00 0.31 C ATOM 745 CG2 ILE A 253 -0.897 0.294 -6.536 1.00 0.28 C ATOM 746 CD1 ILE A 253 -3.000 -1.778 -6.160 1.00 0.33 C ATOM 0 H ILE A 253 1.015 -2.382 -8.560 1.00 0.23 H new ATOM 0 HA ILE A 253 -1.105 -0.527 -9.485 1.00 0.27 H new ATOM 0 HB ILE A 253 -0.325 -1.699 -6.853 1.00 0.26 H new ATOM 0 HG12 ILE A 253 -2.969 -0.755 -8.031 1.00 0.31 H new ATOM 0 HG13 ILE A 253 -2.361 -2.398 -8.098 1.00 0.31 H new ATOM 0 HG21 ILE A 253 -1.351 0.098 -5.564 1.00 0.28 H new ATOM 0 HG22 ILE A 253 0.138 0.605 -6.397 1.00 0.28 H new ATOM 0 HG23 ILE A 253 -1.449 1.087 -7.041 1.00 0.28 H new ATOM 0 HD11 ILE A 253 -4.014 -2.147 -6.312 1.00 0.33 H new ATOM 0 HD12 ILE A 253 -2.415 -2.532 -5.634 1.00 0.33 H new ATOM 0 HD13 ILE A 253 -3.031 -0.864 -5.566 1.00 0.33 H new ATOM 758 N GLN A 254 0.523 1.210 -9.851 1.00 0.36 N ATOM 759 CA GLN A 254 1.385 2.358 -10.057 1.00 0.43 C ATOM 760 C GLN A 254 0.697 3.617 -9.539 1.00 0.61 C ATOM 761 O GLN A 254 -0.510 3.784 -9.715 1.00 1.42 O ATOM 762 CB GLN A 254 1.727 2.473 -11.543 1.00 0.70 C ATOM 763 CG GLN A 254 2.312 1.183 -12.109 1.00 1.00 C ATOM 764 CD GLN A 254 2.353 1.144 -13.625 1.00 1.75 C ATOM 765 OE1 GLN A 254 2.596 0.094 -14.223 1.00 2.63 O ATOM 766 NE2 GLN A 254 2.146 2.281 -14.261 1.00 2.21 N ATOM 0 H GLN A 254 -0.208 1.105 -10.555 1.00 0.36 H new ATOM 0 HA GLN A 254 2.315 2.235 -9.502 1.00 0.43 H new ATOM 0 HB2 GLN A 254 0.828 2.736 -12.100 1.00 0.70 H new ATOM 0 HB3 GLN A 254 2.440 3.285 -11.687 1.00 0.70 H new ATOM 0 HG2 GLN A 254 3.323 1.054 -11.724 1.00 1.00 H new ATOM 0 HG3 GLN A 254 1.724 0.339 -11.749 1.00 1.00 H new ATOM 0 HE21 GLN A 254 1.947 3.131 -13.734 1.00 2.21 H new ATOM 0 HE22 GLN A 254 2.185 2.310 -15.280 1.00 2.21 H new ATOM 775 N MET A 255 1.439 4.412 -8.777 1.00 0.59 N ATOM 776 CA MET A 255 0.888 5.575 -8.079 1.00 0.61 C ATOM 777 C MET A 255 0.224 6.568 -9.033 1.00 0.65 C ATOM 778 O MET A 255 0.598 6.673 -10.204 1.00 0.95 O ATOM 779 CB MET A 255 1.987 6.281 -7.282 1.00 0.95 C ATOM 780 CG MET A 255 3.080 6.882 -8.148 1.00 1.58 C ATOM 781 SD MET A 255 4.409 7.621 -7.178 1.00 2.30 S ATOM 782 CE MET A 255 5.017 6.192 -6.289 1.00 2.61 C ATOM 0 H MET A 255 2.438 4.272 -8.624 1.00 0.59 H new ATOM 0 HA MET A 255 0.118 5.206 -7.402 1.00 0.61 H new ATOM 0 HB2 MET A 255 1.537 7.071 -6.681 1.00 0.95 H new ATOM 0 HB3 MET A 255 2.435 5.569 -6.589 1.00 0.95 H new ATOM 0 HG2 MET A 255 3.494 6.107 -8.793 1.00 1.58 H new ATOM 0 HG3 MET A 255 2.646 7.641 -8.799 1.00 1.58 H new ATOM 0 HE1 MET A 255 5.718 6.514 -5.519 1.00 2.61 H new ATOM 0 HE2 MET A 255 4.181 5.670 -5.823 1.00 2.61 H new ATOM 0 HE3 MET A 255 5.523 5.520 -6.982 1.00 2.61 H new ATOM 792 N SER A 256 -0.766 7.287 -8.521 1.00 0.57 N ATOM 793 CA SER A 256 -1.500 8.262 -9.312 1.00 0.69 C ATOM 794 C SER A 256 -2.019 9.392 -8.410 1.00 1.00 C ATOM 795 O SER A 256 -1.416 9.695 -7.376 1.00 1.47 O ATOM 796 CB SER A 256 -2.660 7.566 -10.041 1.00 0.76 C ATOM 797 OG SER A 256 -3.232 8.399 -11.038 1.00 1.64 O ATOM 0 H SER A 256 -1.080 7.211 -7.554 1.00 0.57 H new ATOM 0 HA SER A 256 -0.834 8.701 -10.055 1.00 0.69 H new ATOM 0 HB2 SER A 256 -2.301 6.645 -10.500 1.00 0.76 H new ATOM 0 HB3 SER A 256 -3.426 7.285 -9.319 1.00 0.76 H new ATOM 0 HG SER A 256 -2.644 9.166 -11.200 1.00 1.64 H new ATOM 803 N GLY A 257 -3.128 10.013 -8.801 1.00 1.01 N ATOM 804 CA GLY A 257 -3.689 11.101 -8.024 1.00 1.41 C ATOM 805 C GLY A 257 -5.159 10.889 -7.737 1.00 1.28 C ATOM 806 O GLY A 257 -5.937 11.841 -7.660 1.00 1.69 O ATOM 0 H GLY A 257 -3.649 9.780 -9.646 1.00 1.01 H new ATOM 0 HA2 GLY A 257 -3.145 11.194 -7.084 1.00 1.41 H new ATOM 0 HA3 GLY A 257 -3.556 12.039 -8.563 1.00 1.41 H new ATOM 810 N SER A 258 -5.521 9.638 -7.535 1.00 1.07 N ATOM 811 CA SER A 258 -6.885 9.263 -7.205 1.00 0.96 C ATOM 812 C SER A 258 -6.872 7.882 -6.567 1.00 0.74 C ATOM 813 O SER A 258 -6.939 7.750 -5.345 1.00 1.14 O ATOM 814 CB SER A 258 -7.754 9.276 -8.468 1.00 1.08 C ATOM 815 OG SER A 258 -7.117 8.582 -9.532 1.00 1.77 O ATOM 0 H SER A 258 -4.877 8.849 -7.595 1.00 1.07 H new ATOM 0 HA SER A 258 -7.310 9.978 -6.500 1.00 0.96 H new ATOM 0 HB2 SER A 258 -8.719 8.815 -8.255 1.00 1.08 H new ATOM 0 HB3 SER A 258 -7.951 10.305 -8.767 1.00 1.08 H new ATOM 0 HG SER A 258 -7.691 8.602 -10.326 1.00 1.77 H new ATOM 821 N LYS A 259 -6.488 6.905 -7.360 1.00 0.51 N ATOM 822 CA LYS A 259 -6.139 5.604 -6.837 1.00 0.37 C ATOM 823 C LYS A 259 -4.639 5.554 -6.628 1.00 0.33 C ATOM 824 O LYS A 259 -3.894 6.155 -7.405 1.00 0.45 O ATOM 825 CB LYS A 259 -6.561 4.486 -7.803 1.00 0.48 C ATOM 826 CG LYS A 259 -7.982 3.970 -7.618 1.00 1.11 C ATOM 827 CD LYS A 259 -9.030 5.039 -7.875 1.00 1.59 C ATOM 828 CE LYS A 259 -10.415 4.430 -8.040 1.00 2.02 C ATOM 829 NZ LYS A 259 -10.795 3.565 -6.888 1.00 2.41 N ATOM 0 H LYS A 259 -6.410 6.989 -8.374 1.00 0.51 H new ATOM 0 HA LYS A 259 -6.663 5.449 -5.894 1.00 0.37 H new ATOM 0 HB2 LYS A 259 -6.454 4.851 -8.824 1.00 0.48 H new ATOM 0 HB3 LYS A 259 -5.871 3.650 -7.690 1.00 0.48 H new ATOM 0 HG2 LYS A 259 -8.151 3.131 -8.293 1.00 1.11 H new ATOM 0 HG3 LYS A 259 -8.097 3.590 -6.603 1.00 1.11 H new ATOM 0 HD2 LYS A 259 -9.039 5.748 -7.047 1.00 1.59 H new ATOM 0 HD3 LYS A 259 -8.768 5.599 -8.772 1.00 1.59 H new ATOM 0 HE2 LYS A 259 -11.149 5.228 -8.150 1.00 2.02 H new ATOM 0 HE3 LYS A 259 -10.444 3.842 -8.957 1.00 2.02 H new ATOM 0 HZ1 LYS A 259 -11.823 3.408 -6.896 1.00 2.41 H new ATOM 0 HZ2 LYS A 259 -10.305 2.651 -6.964 1.00 2.41 H new ATOM 0 HZ3 LYS A 259 -10.522 4.031 -5.999 1.00 2.41 H new ATOM 843 N TYR A 260 -4.197 4.806 -5.618 1.00 0.24 N ATOM 844 CA TYR A 260 -2.770 4.615 -5.371 1.00 0.27 C ATOM 845 C TYR A 260 -2.063 5.961 -5.218 1.00 0.27 C ATOM 846 O TYR A 260 -1.117 6.271 -5.940 1.00 0.29 O ATOM 847 CB TYR A 260 -2.127 3.801 -6.504 1.00 0.33 C ATOM 848 CG TYR A 260 -3.076 2.835 -7.186 1.00 0.43 C ATOM 849 CD1 TYR A 260 -3.868 1.957 -6.454 1.00 0.29 C ATOM 850 CD2 TYR A 260 -3.189 2.818 -8.569 1.00 0.84 C ATOM 851 CE1 TYR A 260 -4.742 1.093 -7.084 1.00 0.52 C ATOM 852 CE2 TYR A 260 -4.062 1.959 -9.203 1.00 1.11 C ATOM 853 CZ TYR A 260 -4.835 1.100 -8.457 1.00 0.95 C ATOM 854 OH TYR A 260 -5.710 0.248 -9.089 1.00 1.24 O ATOM 0 H TYR A 260 -4.807 4.323 -4.958 1.00 0.24 H new ATOM 0 HA TYR A 260 -2.660 4.059 -4.440 1.00 0.27 H new ATOM 0 HB2 TYR A 260 -1.727 4.488 -7.249 1.00 0.33 H new ATOM 0 HB3 TYR A 260 -1.283 3.241 -6.101 1.00 0.33 H new ATOM 0 HD1 TYR A 260 -3.799 1.951 -5.376 1.00 0.29 H new ATOM 0 HD2 TYR A 260 -2.583 3.489 -9.159 1.00 0.84 H new ATOM 0 HE1 TYR A 260 -5.349 0.415 -6.502 1.00 0.52 H new ATOM 0 HE2 TYR A 260 -4.138 1.961 -10.280 1.00 1.11 H new ATOM 0 HH TYR A 260 -5.653 0.381 -10.058 1.00 1.24 H new ATOM 864 N ILE A 261 -2.547 6.761 -4.289 1.00 0.26 N ATOM 865 CA ILE A 261 -1.991 8.078 -4.033 1.00 0.27 C ATOM 866 C ILE A 261 -0.774 7.968 -3.120 1.00 0.28 C ATOM 867 O ILE A 261 -0.850 7.378 -2.049 1.00 0.35 O ATOM 868 CB ILE A 261 -3.048 8.982 -3.367 1.00 0.29 C ATOM 869 CG1 ILE A 261 -4.242 9.192 -4.304 1.00 0.32 C ATOM 870 CG2 ILE A 261 -2.442 10.312 -2.944 1.00 0.33 C ATOM 871 CD1 ILE A 261 -5.339 10.047 -3.702 1.00 0.39 C ATOM 0 H ILE A 261 -3.336 6.518 -3.690 1.00 0.26 H new ATOM 0 HA ILE A 261 -1.690 8.516 -4.985 1.00 0.27 H new ATOM 0 HB ILE A 261 -3.406 8.482 -2.467 1.00 0.29 H new ATOM 0 HG12 ILE A 261 -3.893 9.658 -5.225 1.00 0.32 H new ATOM 0 HG13 ILE A 261 -4.656 8.221 -4.575 1.00 0.32 H new ATOM 0 HG21 ILE A 261 -3.209 10.930 -2.477 1.00 0.33 H new ATOM 0 HG22 ILE A 261 -1.636 10.135 -2.232 1.00 0.33 H new ATOM 0 HG23 ILE A 261 -2.045 10.826 -3.820 1.00 0.33 H new ATOM 0 HD11 ILE A 261 -6.152 10.154 -4.420 1.00 0.39 H new ATOM 0 HD12 ILE A 261 -5.715 9.572 -2.796 1.00 0.39 H new ATOM 0 HD13 ILE A 261 -4.940 11.031 -3.457 1.00 0.39 H new ATOM 883 N PHE A 262 0.352 8.502 -3.552 1.00 0.30 N ATOM 884 CA PHE A 262 1.569 8.423 -2.759 1.00 0.32 C ATOM 885 C PHE A 262 1.554 9.436 -1.615 1.00 0.30 C ATOM 886 O PHE A 262 1.141 10.584 -1.792 1.00 0.37 O ATOM 887 CB PHE A 262 2.808 8.609 -3.649 1.00 0.46 C ATOM 888 CG PHE A 262 2.815 9.875 -4.462 1.00 0.63 C ATOM 889 CD1 PHE A 262 3.255 11.069 -3.914 1.00 0.87 C ATOM 890 CD2 PHE A 262 2.387 9.868 -5.779 1.00 0.84 C ATOM 891 CE1 PHE A 262 3.266 12.228 -4.661 1.00 1.13 C ATOM 892 CE2 PHE A 262 2.396 11.024 -6.532 1.00 1.09 C ATOM 893 CZ PHE A 262 2.835 12.205 -5.973 1.00 1.18 C ATOM 0 H PHE A 262 0.452 8.992 -4.441 1.00 0.30 H new ATOM 0 HA PHE A 262 1.617 7.429 -2.314 1.00 0.32 H new ATOM 0 HB2 PHE A 262 3.697 8.594 -3.018 1.00 0.46 H new ATOM 0 HB3 PHE A 262 2.883 7.758 -4.326 1.00 0.46 H new ATOM 0 HD1 PHE A 262 3.594 11.092 -2.889 1.00 0.87 H new ATOM 0 HD2 PHE A 262 2.042 8.946 -6.222 1.00 0.84 H new ATOM 0 HE1 PHE A 262 3.611 13.152 -4.221 1.00 1.13 H new ATOM 0 HE2 PHE A 262 2.060 11.004 -7.558 1.00 1.09 H new ATOM 0 HZ PHE A 262 2.842 13.111 -6.560 1.00 1.18 H new ATOM 903 N GLU A 263 1.979 8.994 -0.438 1.00 0.26 N ATOM 904 CA GLU A 263 2.031 9.853 0.735 1.00 0.30 C ATOM 905 C GLU A 263 3.269 9.501 1.558 1.00 0.28 C ATOM 906 O GLU A 263 3.681 8.338 1.599 1.00 0.33 O ATOM 907 CB GLU A 263 0.759 9.694 1.575 1.00 0.37 C ATOM 908 CG GLU A 263 0.551 10.815 2.578 1.00 0.56 C ATOM 909 CD GLU A 263 -0.690 10.623 3.426 1.00 1.07 C ATOM 910 OE1 GLU A 263 -0.687 9.732 4.303 1.00 1.79 O ATOM 911 OE2 GLU A 263 -1.673 11.362 3.228 1.00 1.73 O ATOM 0 H GLU A 263 2.294 8.038 -0.272 1.00 0.26 H new ATOM 0 HA GLU A 263 2.093 10.894 0.419 1.00 0.30 H new ATOM 0 HB2 GLU A 263 -0.103 9.648 0.909 1.00 0.37 H new ATOM 0 HB3 GLU A 263 0.801 8.744 2.108 1.00 0.37 H new ATOM 0 HG2 GLU A 263 1.423 10.880 3.229 1.00 0.56 H new ATOM 0 HG3 GLU A 263 0.478 11.763 2.046 1.00 0.56 H new ATOM 918 N SER A 264 3.945 10.514 2.072 1.00 0.34 N ATOM 919 CA SER A 264 5.229 10.316 2.725 1.00 0.36 C ATOM 920 C SER A 264 5.225 10.856 4.153 1.00 0.34 C ATOM 921 O SER A 264 4.772 11.974 4.401 1.00 0.39 O ATOM 922 CB SER A 264 6.320 11.010 1.907 1.00 0.46 C ATOM 923 OG SER A 264 6.300 10.566 0.556 1.00 1.41 O ATOM 0 H SER A 264 3.627 11.483 2.050 1.00 0.34 H new ATOM 0 HA SER A 264 5.425 9.245 2.780 1.00 0.36 H new ATOM 0 HB2 SER A 264 6.175 12.090 1.942 1.00 0.46 H new ATOM 0 HB3 SER A 264 7.296 10.805 2.347 1.00 0.46 H new ATOM 0 HG SER A 264 7.004 11.024 0.051 1.00 1.41 H new ATOM 929 N ILE A 265 5.778 10.078 5.081 1.00 0.31 N ATOM 930 CA ILE A 265 5.926 10.517 6.464 1.00 0.34 C ATOM 931 C ILE A 265 7.347 10.234 6.943 1.00 0.38 C ATOM 932 O ILE A 265 7.650 9.123 7.392 1.00 0.42 O ATOM 933 CB ILE A 265 4.928 9.796 7.406 1.00 0.42 C ATOM 934 CG1 ILE A 265 3.494 9.931 6.888 1.00 0.82 C ATOM 935 CG2 ILE A 265 5.033 10.352 8.823 1.00 0.73 C ATOM 936 CD1 ILE A 265 2.480 9.153 7.700 1.00 1.31 C ATOM 0 H ILE A 265 6.131 9.139 4.898 1.00 0.31 H new ATOM 0 HA ILE A 265 5.717 11.586 6.494 1.00 0.34 H new ATOM 0 HB ILE A 265 5.187 8.737 7.426 1.00 0.42 H new ATOM 0 HG12 ILE A 265 3.215 10.985 6.887 1.00 0.82 H new ATOM 0 HG13 ILE A 265 3.457 9.590 5.853 1.00 0.82 H new ATOM 0 HG21 ILE A 265 4.325 9.834 9.470 1.00 0.73 H new ATOM 0 HG22 ILE A 265 6.045 10.202 9.199 1.00 0.73 H new ATOM 0 HG23 ILE A 265 4.804 11.418 8.814 1.00 0.73 H new ATOM 0 HD11 ILE A 265 1.487 9.296 7.275 1.00 1.31 H new ATOM 0 HD12 ILE A 265 2.734 8.093 7.681 1.00 1.31 H new ATOM 0 HD13 ILE A 265 2.488 9.509 8.730 1.00 1.31 H new ATOM 948 N GLY A 266 8.230 11.215 6.792 1.00 0.48 N ATOM 949 CA GLY A 266 9.626 11.011 7.143 1.00 0.65 C ATOM 950 C GLY A 266 10.235 9.877 6.345 1.00 0.86 C ATOM 951 O GLY A 266 10.250 9.915 5.114 1.00 1.93 O ATOM 0 H GLY A 266 8.007 12.144 6.435 1.00 0.48 H new ATOM 0 HA2 GLY A 266 10.186 11.928 6.961 1.00 0.65 H new ATOM 0 HA3 GLY A 266 9.707 10.793 8.208 1.00 0.65 H new ATOM 955 N ALA A 267 10.623 8.817 7.040 1.00 0.48 N ATOM 956 CA ALA A 267 11.078 7.599 6.391 1.00 0.39 C ATOM 957 C ALA A 267 9.885 6.785 5.906 1.00 0.30 C ATOM 958 O ALA A 267 9.946 6.137 4.862 1.00 0.32 O ATOM 959 CB ALA A 267 11.922 6.768 7.343 1.00 0.44 C ATOM 0 H ALA A 267 10.631 8.778 8.059 1.00 0.48 H new ATOM 0 HA ALA A 267 11.692 7.875 5.534 1.00 0.39 H new ATOM 0 HB1 ALA A 267 12.253 5.860 6.838 1.00 0.44 H new ATOM 0 HB2 ALA A 267 12.791 7.346 7.658 1.00 0.44 H new ATOM 0 HB3 ALA A 267 11.328 6.501 8.217 1.00 0.44 H new ATOM 965 N LYS A 268 8.809 6.818 6.682 1.00 0.26 N ATOM 966 CA LYS A 268 7.606 6.047 6.387 1.00 0.25 C ATOM 967 C LYS A 268 6.939 6.489 5.088 1.00 0.29 C ATOM 968 O LYS A 268 6.875 7.678 4.772 1.00 0.47 O ATOM 969 CB LYS A 268 6.610 6.158 7.542 1.00 0.28 C ATOM 970 CG LYS A 268 7.032 5.398 8.785 1.00 0.30 C ATOM 971 CD LYS A 268 6.045 5.614 9.920 1.00 0.41 C ATOM 972 CE LYS A 268 6.394 4.777 11.140 1.00 1.20 C ATOM 973 NZ LYS A 268 7.738 5.106 11.682 1.00 2.00 N ATOM 0 H LYS A 268 8.745 7.378 7.532 1.00 0.26 H new ATOM 0 HA LYS A 268 7.914 5.009 6.263 1.00 0.25 H new ATOM 0 HB2 LYS A 268 6.478 7.210 7.797 1.00 0.28 H new ATOM 0 HB3 LYS A 268 5.640 5.786 7.211 1.00 0.28 H new ATOM 0 HG2 LYS A 268 7.103 4.334 8.558 1.00 0.30 H new ATOM 0 HG3 LYS A 268 8.025 5.724 9.095 1.00 0.30 H new ATOM 0 HD2 LYS A 268 6.032 6.669 10.195 1.00 0.41 H new ATOM 0 HD3 LYS A 268 5.040 5.361 9.581 1.00 0.41 H new ATOM 0 HE2 LYS A 268 5.643 4.936 11.914 1.00 1.20 H new ATOM 0 HE3 LYS A 268 6.360 3.720 10.875 1.00 1.20 H new ATOM 0 HZ1 LYS A 268 8.408 4.352 11.429 1.00 2.00 H new ATOM 0 HZ2 LYS A 268 8.063 6.008 11.279 1.00 2.00 H new ATOM 0 HZ3 LYS A 268 7.684 5.189 12.717 1.00 2.00 H new ATOM 987 N ARG A 269 6.382 5.522 4.374 1.00 0.16 N ATOM 988 CA ARG A 269 5.651 5.806 3.151 1.00 0.16 C ATOM 989 C ARG A 269 4.242 5.263 3.242 1.00 0.18 C ATOM 990 O ARG A 269 3.962 4.366 4.036 1.00 0.17 O ATOM 991 CB ARG A 269 6.367 5.234 1.924 1.00 0.20 C ATOM 992 CG ARG A 269 6.224 6.095 0.681 1.00 0.53 C ATOM 993 CD ARG A 269 6.896 7.447 0.849 1.00 0.79 C ATOM 994 NE ARG A 269 8.010 7.384 1.790 1.00 0.69 N ATOM 995 CZ ARG A 269 8.885 8.362 1.980 1.00 0.97 C ATOM 996 NH1 ARG A 269 8.949 9.390 1.147 1.00 1.85 N ATOM 997 NH2 ARG A 269 9.742 8.279 2.980 1.00 1.17 N ATOM 0 H ARG A 269 6.423 4.533 4.622 1.00 0.16 H new ATOM 0 HA ARG A 269 5.605 6.889 3.033 1.00 0.16 H new ATOM 0 HB2 ARG A 269 7.426 5.115 2.154 1.00 0.20 H new ATOM 0 HB3 ARG A 269 5.973 4.240 1.714 1.00 0.20 H new ATOM 0 HG2 ARG A 269 6.660 5.576 -0.172 1.00 0.53 H new ATOM 0 HG3 ARG A 269 5.167 6.240 0.459 1.00 0.53 H new ATOM 0 HD2 ARG A 269 7.256 7.797 -0.118 1.00 0.79 H new ATOM 0 HD3 ARG A 269 6.165 8.176 1.199 1.00 0.79 H new ATOM 0 HE ARG A 269 8.123 6.531 2.338 1.00 0.69 H new ATOM 0 HH11 ARG A 269 8.320 9.437 0.346 1.00 1.85 H new ATOM 0 HH12 ARG A 269 9.628 10.134 1.307 1.00 1.85 H new ATOM 0 HH21 ARG A 269 9.727 7.468 3.598 1.00 1.17 H new ATOM 0 HH22 ARG A 269 10.419 9.026 3.135 1.00 1.17 H new ATOM 1011 N THR A 270 3.331 5.927 2.568 1.00 0.18 N ATOM 1012 CA THR A 270 1.936 5.568 2.635 1.00 0.18 C ATOM 1013 C THR A 270 1.288 5.580 1.256 1.00 0.19 C ATOM 1014 O THR A 270 1.373 6.571 0.525 1.00 0.22 O ATOM 1015 CB THR A 270 1.173 6.524 3.573 1.00 0.20 C ATOM 1016 OG1 THR A 270 1.593 6.324 4.932 1.00 0.25 O ATOM 1017 CG2 THR A 270 -0.325 6.318 3.460 1.00 0.24 C ATOM 0 H THR A 270 3.535 6.723 1.964 1.00 0.18 H new ATOM 0 HA THR A 270 1.882 4.554 3.031 1.00 0.18 H new ATOM 0 HB THR A 270 1.402 7.546 3.273 1.00 0.20 H new ATOM 0 HG1 THR A 270 1.103 6.937 5.519 1.00 0.25 H new ATOM 0 HG21 THR A 270 -0.839 7.005 4.132 1.00 0.24 H new ATOM 0 HG22 THR A 270 -0.642 6.509 2.435 1.00 0.24 H new ATOM 0 HG23 THR A 270 -0.573 5.292 3.732 1.00 0.24 H new ATOM 1025 N LEU A 271 0.569 4.510 0.948 1.00 0.17 N ATOM 1026 CA LEU A 271 -0.212 4.452 -0.272 1.00 0.17 C ATOM 1027 C LEU A 271 -1.663 4.796 0.042 1.00 0.16 C ATOM 1028 O LEU A 271 -2.392 3.977 0.584 1.00 0.17 O ATOM 1029 CB LEU A 271 -0.121 3.056 -0.898 1.00 0.20 C ATOM 1030 CG LEU A 271 -0.614 2.918 -2.345 1.00 0.26 C ATOM 1031 CD1 LEU A 271 -2.126 2.774 -2.405 1.00 0.56 C ATOM 1032 CD2 LEU A 271 -0.148 4.101 -3.178 1.00 0.49 C ATOM 0 H LEU A 271 0.512 3.673 1.528 1.00 0.17 H new ATOM 0 HA LEU A 271 0.184 5.173 -0.987 1.00 0.17 H new ATOM 0 HB2 LEU A 271 0.919 2.733 -0.860 1.00 0.20 H new ATOM 0 HB3 LEU A 271 -0.692 2.366 -0.276 1.00 0.20 H new ATOM 0 HG LEU A 271 -0.182 2.008 -2.763 1.00 0.26 H new ATOM 0 HD11 LEU A 271 -2.441 2.679 -3.444 1.00 0.56 H new ATOM 0 HD12 LEU A 271 -2.429 1.886 -1.851 1.00 0.56 H new ATOM 0 HD13 LEU A 271 -2.593 3.654 -1.963 1.00 0.56 H new ATOM 0 HD21 LEU A 271 -0.505 3.989 -4.202 1.00 0.49 H new ATOM 0 HD22 LEU A 271 -0.545 5.023 -2.754 1.00 0.49 H new ATOM 0 HD23 LEU A 271 0.941 4.141 -3.176 1.00 0.49 H new ATOM 1044 N THR A 272 -2.087 5.988 -0.314 1.00 0.18 N ATOM 1045 CA THR A 272 -3.461 6.394 -0.096 1.00 0.21 C ATOM 1046 C THR A 272 -4.339 5.893 -1.238 1.00 0.22 C ATOM 1047 O THR A 272 -4.227 6.353 -2.369 1.00 0.29 O ATOM 1048 CB THR A 272 -3.564 7.925 0.012 1.00 0.27 C ATOM 1049 OG1 THR A 272 -2.518 8.419 0.862 1.00 0.33 O ATOM 1050 CG2 THR A 272 -4.913 8.339 0.574 1.00 0.30 C ATOM 0 H THR A 272 -1.501 6.696 -0.757 1.00 0.18 H new ATOM 0 HA THR A 272 -3.806 5.957 0.841 1.00 0.21 H new ATOM 0 HB THR A 272 -3.460 8.349 -0.987 1.00 0.27 H new ATOM 0 HG1 THR A 272 -2.584 9.395 0.928 1.00 0.33 H new ATOM 0 HG21 THR A 272 -4.961 9.426 0.641 1.00 0.30 H new ATOM 0 HG22 THR A 272 -5.706 7.980 -0.082 1.00 0.30 H new ATOM 0 HG23 THR A 272 -5.041 7.909 1.567 1.00 0.30 H new ATOM 1058 N ILE A 273 -5.164 4.905 -0.963 1.00 0.23 N ATOM 1059 CA ILE A 273 -6.002 4.333 -1.996 1.00 0.26 C ATOM 1060 C ILE A 273 -7.454 4.782 -1.809 1.00 0.28 C ATOM 1061 O ILE A 273 -8.018 4.690 -0.709 1.00 0.27 O ATOM 1062 CB ILE A 273 -5.851 2.781 -2.040 1.00 0.31 C ATOM 1063 CG1 ILE A 273 -5.757 2.295 -3.490 1.00 0.41 C ATOM 1064 CG2 ILE A 273 -6.974 2.060 -1.317 1.00 0.32 C ATOM 1065 CD1 ILE A 273 -6.991 2.573 -4.321 1.00 0.86 C ATOM 0 H ILE A 273 -5.272 4.484 -0.040 1.00 0.23 H new ATOM 0 HA ILE A 273 -5.674 4.702 -2.968 1.00 0.26 H new ATOM 0 HB ILE A 273 -4.927 2.540 -1.514 1.00 0.31 H new ATOM 0 HG12 ILE A 273 -4.899 2.770 -3.965 1.00 0.41 H new ATOM 0 HG13 ILE A 273 -5.568 1.222 -3.490 1.00 0.41 H new ATOM 0 HG21 ILE A 273 -6.816 0.983 -1.381 1.00 0.32 H new ATOM 0 HG22 ILE A 273 -6.987 2.363 -0.270 1.00 0.32 H new ATOM 0 HG23 ILE A 273 -7.927 2.315 -1.780 1.00 0.32 H new ATOM 0 HD11 ILE A 273 -6.840 2.197 -5.333 1.00 0.86 H new ATOM 0 HD12 ILE A 273 -7.851 2.075 -3.873 1.00 0.86 H new ATOM 0 HD13 ILE A 273 -7.172 3.647 -4.356 1.00 0.86 H new ATOM 1077 N SER A 274 -7.973 5.450 -2.835 1.00 0.33 N ATOM 1078 CA SER A 274 -9.284 6.080 -2.764 1.00 0.39 C ATOM 1079 C SER A 274 -10.337 5.241 -3.475 1.00 0.45 C ATOM 1080 O SER A 274 -10.039 4.585 -4.476 1.00 0.50 O ATOM 1081 CB SER A 274 -9.229 7.474 -3.384 1.00 0.52 C ATOM 1082 OG SER A 274 -8.108 8.197 -2.907 1.00 1.13 O ATOM 0 H SER A 274 -7.500 5.568 -3.731 1.00 0.33 H new ATOM 0 HA SER A 274 -9.563 6.160 -1.713 1.00 0.39 H new ATOM 0 HB2 SER A 274 -9.178 7.391 -4.470 1.00 0.52 H new ATOM 0 HB3 SER A 274 -10.144 8.017 -3.148 1.00 0.52 H new ATOM 0 HG SER A 274 -7.421 8.233 -3.605 1.00 1.13 H new ATOM 1088 N GLN A 275 -11.563 5.263 -2.944 1.00 0.51 N ATOM 1089 CA GLN A 275 -12.673 4.484 -3.492 1.00 0.62 C ATOM 1090 C GLN A 275 -12.317 3.010 -3.477 1.00 0.62 C ATOM 1091 O GLN A 275 -12.077 2.395 -4.518 1.00 0.74 O ATOM 1092 CB GLN A 275 -13.039 4.940 -4.905 1.00 0.75 C ATOM 1093 CG GLN A 275 -13.407 6.411 -4.989 1.00 0.90 C ATOM 1094 CD GLN A 275 -13.961 6.792 -6.346 1.00 1.53 C ATOM 1095 OE1 GLN A 275 -13.348 6.528 -7.380 1.00 2.14 O ATOM 1096 NE2 GLN A 275 -15.120 7.426 -6.348 1.00 2.27 N ATOM 0 H GLN A 275 -11.812 5.819 -2.126 1.00 0.51 H new ATOM 0 HA GLN A 275 -13.550 4.648 -2.865 1.00 0.62 H new ATOM 0 HB2 GLN A 275 -12.198 4.745 -5.571 1.00 0.75 H new ATOM 0 HB3 GLN A 275 -13.876 4.343 -5.266 1.00 0.75 H new ATOM 0 HG2 GLN A 275 -14.145 6.642 -4.221 1.00 0.90 H new ATOM 0 HG3 GLN A 275 -12.525 7.016 -4.777 1.00 0.90 H new ATOM 0 HE21 GLN A 275 -15.594 7.625 -5.467 1.00 2.27 H new ATOM 0 HE22 GLN A 275 -15.541 7.717 -7.231 1.00 2.27 H new ATOM 1105 N CYS A 276 -12.157 2.493 -2.275 1.00 0.60 N ATOM 1106 CA CYS A 276 -11.659 1.152 -2.070 1.00 0.69 C ATOM 1107 C CYS A 276 -12.482 0.492 -1.001 1.00 0.75 C ATOM 1108 O CYS A 276 -11.966 -0.207 -0.133 1.00 1.27 O ATOM 1109 CB CYS A 276 -10.212 1.245 -1.621 1.00 0.80 C ATOM 1110 SG CYS A 276 -9.972 2.502 -0.339 1.00 2.00 S ATOM 0 H CYS A 276 -12.370 2.994 -1.412 1.00 0.60 H new ATOM 0 HA CYS A 276 -11.723 0.569 -2.989 1.00 0.69 H new ATOM 0 HB2 CYS A 276 -9.888 0.276 -1.242 1.00 0.80 H new ATOM 0 HB3 CYS A 276 -9.582 1.479 -2.479 1.00 0.80 H new ATOM 0 HG CYS A 276 -9.285 3.492 -0.826 1.00 2.00 H new ATOM 1116 N SER A 277 -13.731 0.881 -0.967 1.00 0.54 N ATOM 1117 CA SER A 277 -14.596 0.492 0.102 1.00 0.52 C ATOM 1118 C SER A 277 -15.092 -0.952 -0.075 1.00 0.48 C ATOM 1119 O SER A 277 -14.300 -1.854 -0.369 1.00 0.47 O ATOM 1120 CB SER A 277 -15.740 1.489 0.182 1.00 0.56 C ATOM 1121 OG SER A 277 -16.268 1.767 -1.105 1.00 0.63 O ATOM 0 H SER A 277 -14.168 1.471 -1.675 1.00 0.54 H new ATOM 0 HA SER A 277 -14.049 0.505 1.045 1.00 0.52 H new ATOM 0 HB2 SER A 277 -16.527 1.093 0.823 1.00 0.56 H new ATOM 0 HB3 SER A 277 -15.389 2.413 0.642 1.00 0.56 H new ATOM 0 HG SER A 277 -17.004 2.410 -1.025 1.00 0.63 H new ATOM 1127 N LEU A 278 -16.390 -1.173 0.112 1.00 0.51 N ATOM 1128 CA LEU A 278 -16.978 -2.510 0.027 1.00 0.54 C ATOM 1129 C LEU A 278 -17.062 -3.001 -1.421 1.00 0.58 C ATOM 1130 O LEU A 278 -18.152 -3.267 -1.932 1.00 0.71 O ATOM 1131 CB LEU A 278 -18.383 -2.524 0.651 1.00 0.63 C ATOM 1132 CG LEU A 278 -18.453 -2.745 2.166 1.00 0.78 C ATOM 1133 CD1 LEU A 278 -17.936 -4.125 2.532 1.00 1.22 C ATOM 1134 CD2 LEU A 278 -17.678 -1.672 2.910 1.00 0.79 C ATOM 0 H LEU A 278 -17.062 -0.436 0.326 1.00 0.51 H new ATOM 0 HA LEU A 278 -16.325 -3.183 0.582 1.00 0.54 H new ATOM 0 HB2 LEU A 278 -18.868 -1.576 0.421 1.00 0.63 H new ATOM 0 HB3 LEU A 278 -18.965 -3.306 0.164 1.00 0.63 H new ATOM 0 HG LEU A 278 -19.499 -2.677 2.466 1.00 0.78 H new ATOM 0 HD11 LEU A 278 -17.995 -4.261 3.612 1.00 1.22 H new ATOM 0 HD12 LEU A 278 -18.542 -4.884 2.037 1.00 1.22 H new ATOM 0 HD13 LEU A 278 -16.899 -4.222 2.210 1.00 1.22 H new ATOM 0 HD21 LEU A 278 -17.744 -1.853 3.983 1.00 0.79 H new ATOM 0 HD22 LEU A 278 -16.633 -1.698 2.602 1.00 0.79 H new ATOM 0 HD23 LEU A 278 -18.100 -0.693 2.680 1.00 0.79 H new ATOM 1146 N ALA A 279 -15.916 -3.086 -2.082 1.00 0.53 N ATOM 1147 CA ALA A 279 -15.855 -3.520 -3.471 1.00 0.61 C ATOM 1148 C ALA A 279 -14.425 -3.856 -3.864 1.00 0.58 C ATOM 1149 O ALA A 279 -14.175 -4.847 -4.553 1.00 0.62 O ATOM 1150 CB ALA A 279 -16.406 -2.442 -4.394 1.00 0.71 C ATOM 0 H ALA A 279 -15.009 -2.858 -1.675 1.00 0.53 H new ATOM 0 HA ALA A 279 -16.467 -4.416 -3.572 1.00 0.61 H new ATOM 0 HB1 ALA A 279 -16.352 -2.785 -5.427 1.00 0.71 H new ATOM 0 HB2 ALA A 279 -17.444 -2.236 -4.134 1.00 0.71 H new ATOM 0 HB3 ALA A 279 -15.817 -1.532 -4.283 1.00 0.71 H new ATOM 1156 N ASP A 280 -13.495 -2.994 -3.473 1.00 0.56 N ATOM 1157 CA ASP A 280 -12.090 -3.171 -3.827 1.00 0.59 C ATOM 1158 C ASP A 280 -11.483 -4.339 -3.051 1.00 0.50 C ATOM 1159 O ASP A 280 -10.680 -5.089 -3.601 1.00 0.70 O ATOM 1160 CB ASP A 280 -11.306 -1.886 -3.559 1.00 0.70 C ATOM 1161 CG ASP A 280 -9.990 -1.833 -4.313 1.00 1.21 C ATOM 1162 OD1 ASP A 280 -9.080 -2.631 -4.007 1.00 1.77 O ATOM 1163 OD2 ASP A 280 -9.863 -1.000 -5.234 1.00 1.84 O ATOM 0 H ASP A 280 -13.687 -2.165 -2.911 1.00 0.56 H new ATOM 0 HA ASP A 280 -12.030 -3.398 -4.891 1.00 0.59 H new ATOM 0 HB2 ASP A 280 -11.916 -1.028 -3.841 1.00 0.70 H new ATOM 0 HB3 ASP A 280 -11.111 -1.801 -2.490 1.00 0.70 H new ATOM 1168 N ASP A 281 -11.941 -4.492 -1.796 1.00 0.37 N ATOM 1169 CA ASP A 281 -11.543 -5.577 -0.864 1.00 0.33 C ATOM 1170 C ASP A 281 -10.833 -6.756 -1.545 1.00 0.34 C ATOM 1171 O ASP A 281 -11.427 -7.458 -2.370 1.00 0.43 O ATOM 1172 CB ASP A 281 -12.803 -6.076 -0.143 1.00 0.40 C ATOM 1173 CG ASP A 281 -12.602 -7.386 0.593 1.00 0.52 C ATOM 1174 OD1 ASP A 281 -11.829 -7.420 1.570 1.00 1.12 O ATOM 1175 OD2 ASP A 281 -13.234 -8.390 0.203 1.00 0.81 O ATOM 0 H ASP A 281 -12.618 -3.849 -1.385 1.00 0.37 H new ATOM 0 HA ASP A 281 -10.817 -5.158 -0.167 1.00 0.33 H new ATOM 0 HB2 ASP A 281 -13.130 -5.316 0.567 1.00 0.40 H new ATOM 0 HB3 ASP A 281 -13.604 -6.197 -0.872 1.00 0.40 H new ATOM 1180 N ALA A 282 -9.569 -6.973 -1.167 1.00 0.31 N ATOM 1181 CA ALA A 282 -8.750 -8.056 -1.723 1.00 0.37 C ATOM 1182 C ALA A 282 -7.376 -8.092 -1.043 1.00 0.35 C ATOM 1183 O ALA A 282 -7.289 -8.379 0.148 1.00 0.58 O ATOM 1184 CB ALA A 282 -8.601 -7.917 -3.236 1.00 0.48 C ATOM 0 H ALA A 282 -9.086 -6.406 -0.470 1.00 0.31 H new ATOM 0 HA ALA A 282 -9.260 -8.999 -1.526 1.00 0.37 H new ATOM 0 HB1 ALA A 282 -7.989 -8.734 -3.618 1.00 0.48 H new ATOM 0 HB2 ALA A 282 -9.585 -7.952 -3.703 1.00 0.48 H new ATOM 0 HB3 ALA A 282 -8.122 -6.966 -3.469 1.00 0.48 H new ATOM 1190 N ALA A 283 -6.313 -7.766 -1.786 1.00 0.22 N ATOM 1191 CA ALA A 283 -4.966 -7.678 -1.210 1.00 0.17 C ATOM 1192 C ALA A 283 -4.111 -6.673 -1.978 1.00 0.15 C ATOM 1193 O ALA A 283 -4.132 -6.667 -3.210 1.00 0.19 O ATOM 1194 CB ALA A 283 -4.282 -9.041 -1.187 1.00 0.22 C ATOM 0 H ALA A 283 -6.358 -7.559 -2.784 1.00 0.22 H new ATOM 0 HA ALA A 283 -5.072 -7.333 -0.181 1.00 0.17 H new ATOM 0 HB1 ALA A 283 -3.286 -8.941 -0.755 1.00 0.22 H new ATOM 0 HB2 ALA A 283 -4.871 -9.734 -0.586 1.00 0.22 H new ATOM 0 HB3 ALA A 283 -4.199 -9.424 -2.204 1.00 0.22 H new ATOM 1200 N TYR A 284 -3.283 -5.912 -1.265 1.00 0.12 N ATOM 1201 CA TYR A 284 -2.319 -5.016 -1.904 1.00 0.13 C ATOM 1202 C TYR A 284 -0.896 -5.323 -1.417 1.00 0.14 C ATOM 1203 O TYR A 284 -0.568 -5.116 -0.256 1.00 0.16 O ATOM 1204 CB TYR A 284 -2.626 -3.527 -1.633 1.00 0.15 C ATOM 1205 CG TYR A 284 -3.758 -2.920 -2.451 1.00 0.19 C ATOM 1206 CD1 TYR A 284 -4.752 -3.730 -3.010 1.00 0.22 C ATOM 1207 CD2 TYR A 284 -3.854 -1.553 -2.653 1.00 0.26 C ATOM 1208 CE1 TYR A 284 -5.788 -3.186 -3.740 1.00 0.29 C ATOM 1209 CE2 TYR A 284 -4.892 -1.008 -3.377 1.00 0.32 C ATOM 1210 CZ TYR A 284 -5.800 -1.795 -3.970 1.00 0.35 C ATOM 1211 OH TYR A 284 -6.894 -1.277 -4.629 1.00 0.41 O ATOM 0 H TYR A 284 -3.260 -5.897 -0.245 1.00 0.12 H new ATOM 0 HA TYR A 284 -2.399 -5.191 -2.977 1.00 0.13 H new ATOM 0 HB2 TYR A 284 -2.866 -3.412 -0.576 1.00 0.15 H new ATOM 0 HB3 TYR A 284 -1.720 -2.950 -1.819 1.00 0.15 H new ATOM 0 HD1 TYR A 284 -4.707 -4.800 -2.868 1.00 0.22 H new ATOM 0 HD2 TYR A 284 -3.101 -0.902 -2.235 1.00 0.26 H new ATOM 0 HE1 TYR A 284 -6.576 -3.814 -4.128 1.00 0.29 H new ATOM 0 HE2 TYR A 284 -4.975 0.065 -3.467 1.00 0.32 H new ATOM 0 HH TYR A 284 -7.715 -1.632 -4.229 1.00 0.41 H new ATOM 1221 N GLN A 285 -0.023 -5.669 -2.349 1.00 0.13 N ATOM 1222 CA GLN A 285 1.392 -5.814 -2.074 1.00 0.13 C ATOM 1223 C GLN A 285 2.079 -4.454 -2.151 1.00 0.12 C ATOM 1224 O GLN A 285 1.518 -3.499 -2.685 1.00 0.13 O ATOM 1225 CB GLN A 285 2.058 -6.774 -3.069 1.00 0.12 C ATOM 1226 CG GLN A 285 1.479 -8.176 -3.081 1.00 0.15 C ATOM 1227 CD GLN A 285 0.226 -8.310 -3.921 1.00 0.21 C ATOM 1228 OE1 GLN A 285 -0.515 -9.279 -3.787 1.00 0.29 O ATOM 1229 NE2 GLN A 285 -0.006 -7.361 -4.812 1.00 0.18 N ATOM 0 H GLN A 285 -0.279 -5.857 -3.318 1.00 0.13 H new ATOM 0 HA GLN A 285 1.496 -6.227 -1.071 1.00 0.13 H new ATOM 0 HB2 GLN A 285 1.975 -6.353 -4.071 1.00 0.12 H new ATOM 0 HB3 GLN A 285 3.121 -6.837 -2.837 1.00 0.12 H new ATOM 0 HG2 GLN A 285 2.233 -8.868 -3.456 1.00 0.15 H new ATOM 0 HG3 GLN A 285 1.253 -8.475 -2.057 1.00 0.15 H new ATOM 0 HE21 GLN A 285 0.634 -6.571 -4.893 1.00 0.18 H new ATOM 0 HE22 GLN A 285 -0.825 -7.419 -5.418 1.00 0.18 H new ATOM 1238 N CYS A 286 3.312 -4.387 -1.674 1.00 0.14 N ATOM 1239 CA CYS A 286 4.085 -3.147 -1.728 1.00 0.19 C ATOM 1240 C CYS A 286 5.366 -3.347 -2.479 1.00 0.19 C ATOM 1241 O CYS A 286 5.897 -4.448 -2.482 1.00 0.20 O ATOM 1242 CB CYS A 286 4.399 -2.666 -0.348 1.00 0.28 C ATOM 1243 SG CYS A 286 5.429 -3.781 0.631 1.00 1.00 S ATOM 0 H CYS A 286 3.802 -5.172 -1.245 1.00 0.14 H new ATOM 0 HA CYS A 286 3.480 -2.403 -2.246 1.00 0.19 H new ATOM 0 HB2 CYS A 286 4.901 -1.701 -0.421 1.00 0.28 H new ATOM 0 HB3 CYS A 286 3.463 -2.499 0.184 1.00 0.28 H new ATOM 0 HG CYS A 286 6.562 -3.203 0.898 1.00 1.00 H new ATOM 1249 N VAL A 287 5.732 -2.376 -3.307 1.00 0.20 N ATOM 1250 CA VAL A 287 6.768 -2.636 -4.279 1.00 0.21 C ATOM 1251 C VAL A 287 7.708 -1.442 -4.517 1.00 0.22 C ATOM 1252 O VAL A 287 7.299 -0.302 -4.783 1.00 0.24 O ATOM 1253 CB VAL A 287 6.128 -3.155 -5.600 1.00 0.21 C ATOM 1254 CG1 VAL A 287 4.648 -3.449 -5.370 1.00 0.18 C ATOM 1255 CG2 VAL A 287 6.311 -2.196 -6.770 1.00 0.27 C ATOM 0 H VAL A 287 5.339 -1.435 -3.322 1.00 0.20 H new ATOM 0 HA VAL A 287 7.413 -3.412 -3.867 1.00 0.21 H new ATOM 0 HB VAL A 287 6.650 -4.071 -5.875 1.00 0.21 H new ATOM 0 HG11 VAL A 287 4.201 -3.812 -6.295 1.00 0.18 H new ATOM 0 HG12 VAL A 287 4.544 -4.208 -4.595 1.00 0.18 H new ATOM 0 HG13 VAL A 287 4.140 -2.537 -5.056 1.00 0.18 H new ATOM 0 HG21 VAL A 287 5.843 -2.615 -7.661 1.00 0.27 H new ATOM 0 HG22 VAL A 287 5.846 -1.239 -6.532 1.00 0.27 H new ATOM 0 HG23 VAL A 287 7.375 -2.047 -6.955 1.00 0.27 H new ATOM 1265 N VAL A 288 8.990 -1.753 -4.464 1.00 0.24 N ATOM 1266 CA VAL A 288 10.045 -0.802 -4.759 1.00 0.26 C ATOM 1267 C VAL A 288 11.171 -1.552 -5.455 1.00 0.33 C ATOM 1268 O VAL A 288 11.718 -2.508 -4.896 1.00 0.37 O ATOM 1269 CB VAL A 288 10.602 -0.122 -3.487 1.00 0.27 C ATOM 1270 CG1 VAL A 288 11.907 0.594 -3.785 1.00 0.31 C ATOM 1271 CG2 VAL A 288 9.602 0.863 -2.912 1.00 0.36 C ATOM 0 H VAL A 288 9.331 -2.681 -4.213 1.00 0.24 H new ATOM 0 HA VAL A 288 9.631 -0.016 -5.390 1.00 0.26 H new ATOM 0 HB VAL A 288 10.786 -0.905 -2.751 1.00 0.27 H new ATOM 0 HG11 VAL A 288 12.280 1.065 -2.875 1.00 0.31 H new ATOM 0 HG12 VAL A 288 12.641 -0.125 -4.149 1.00 0.31 H new ATOM 0 HG13 VAL A 288 11.738 1.357 -4.545 1.00 0.31 H new ATOM 0 HG21 VAL A 288 10.020 1.326 -2.018 1.00 0.36 H new ATOM 0 HG22 VAL A 288 9.384 1.633 -3.652 1.00 0.36 H new ATOM 0 HG23 VAL A 288 8.683 0.338 -2.652 1.00 0.36 H new ATOM 1281 N GLY A 289 11.437 -1.199 -6.702 1.00 0.43 N ATOM 1282 CA GLY A 289 12.441 -1.911 -7.470 1.00 0.57 C ATOM 1283 C GLY A 289 12.064 -3.364 -7.714 1.00 0.73 C ATOM 1284 O GLY A 289 12.862 -4.268 -7.469 1.00 1.51 O ATOM 0 H GLY A 289 10.978 -0.434 -7.197 1.00 0.43 H new ATOM 0 HA2 GLY A 289 12.584 -1.410 -8.428 1.00 0.57 H new ATOM 0 HA3 GLY A 289 13.394 -1.870 -6.943 1.00 0.57 H new ATOM 1288 N GLY A 290 10.841 -3.585 -8.188 1.00 0.41 N ATOM 1289 CA GLY A 290 10.387 -4.932 -8.505 1.00 0.41 C ATOM 1290 C GLY A 290 9.881 -5.712 -7.298 1.00 0.37 C ATOM 1291 O GLY A 290 8.940 -6.497 -7.417 1.00 0.64 O ATOM 0 H GLY A 290 10.152 -2.853 -8.360 1.00 0.41 H new ATOM 0 HA2 GLY A 290 9.590 -4.871 -9.246 1.00 0.41 H new ATOM 0 HA3 GLY A 290 11.208 -5.483 -8.964 1.00 0.41 H new ATOM 1295 N GLU A 291 10.541 -5.546 -6.158 1.00 0.27 N ATOM 1296 CA GLU A 291 10.190 -6.286 -4.946 1.00 0.22 C ATOM 1297 C GLU A 291 8.781 -5.948 -4.465 1.00 0.16 C ATOM 1298 O GLU A 291 8.506 -4.796 -4.149 1.00 0.19 O ATOM 1299 CB GLU A 291 11.194 -5.968 -3.831 1.00 0.26 C ATOM 1300 CG GLU A 291 12.491 -6.746 -3.939 1.00 0.53 C ATOM 1301 CD GLU A 291 13.349 -6.610 -2.701 1.00 1.48 C ATOM 1302 OE1 GLU A 291 13.875 -5.507 -2.457 1.00 2.11 O ATOM 1303 OE2 GLU A 291 13.479 -7.601 -1.947 1.00 2.19 O ATOM 0 H GLU A 291 11.325 -4.904 -6.045 1.00 0.27 H new ATOM 0 HA GLU A 291 10.222 -7.348 -5.189 1.00 0.22 H new ATOM 0 HB2 GLU A 291 11.418 -4.901 -3.849 1.00 0.26 H new ATOM 0 HB3 GLU A 291 10.732 -6.181 -2.867 1.00 0.26 H new ATOM 0 HG2 GLU A 291 12.267 -7.799 -4.109 1.00 0.53 H new ATOM 0 HG3 GLU A 291 13.051 -6.396 -4.806 1.00 0.53 H new ATOM 1310 N LYS A 292 7.934 -6.973 -4.304 1.00 0.18 N ATOM 1311 CA LYS A 292 6.587 -6.789 -3.764 1.00 0.16 C ATOM 1312 C LYS A 292 6.362 -7.633 -2.504 1.00 0.17 C ATOM 1313 O LYS A 292 6.696 -8.819 -2.463 1.00 0.29 O ATOM 1314 CB LYS A 292 5.519 -7.091 -4.819 1.00 0.18 C ATOM 1315 CG LYS A 292 5.741 -8.373 -5.599 1.00 0.23 C ATOM 1316 CD LYS A 292 4.648 -8.566 -6.636 1.00 0.29 C ATOM 1317 CE LYS A 292 4.993 -9.679 -7.612 1.00 0.49 C ATOM 1318 NZ LYS A 292 3.917 -9.904 -8.614 1.00 1.33 N ATOM 0 H LYS A 292 8.161 -7.939 -4.541 1.00 0.18 H new ATOM 0 HA LYS A 292 6.495 -5.741 -3.480 1.00 0.16 H new ATOM 0 HB2 LYS A 292 4.548 -7.145 -4.327 1.00 0.18 H new ATOM 0 HB3 LYS A 292 5.476 -6.258 -5.521 1.00 0.18 H new ATOM 0 HG2 LYS A 292 6.714 -8.342 -6.090 1.00 0.23 H new ATOM 0 HG3 LYS A 292 5.755 -9.222 -4.916 1.00 0.23 H new ATOM 0 HD2 LYS A 292 3.708 -8.798 -6.136 1.00 0.29 H new ATOM 0 HD3 LYS A 292 4.496 -7.636 -7.183 1.00 0.29 H new ATOM 0 HE2 LYS A 292 5.921 -9.432 -8.128 1.00 0.49 H new ATOM 0 HE3 LYS A 292 5.171 -10.602 -7.060 1.00 0.49 H new ATOM 0 HZ1 LYS A 292 4.197 -10.672 -9.258 1.00 1.33 H new ATOM 0 HZ2 LYS A 292 3.037 -10.165 -8.125 1.00 1.33 H new ATOM 0 HZ3 LYS A 292 3.764 -9.033 -9.161 1.00 1.33 H new ATOM 1332 N CYS A 293 5.770 -7.006 -1.491 1.00 0.16 N ATOM 1333 CA CYS A 293 5.445 -7.669 -0.229 1.00 0.18 C ATOM 1334 C CYS A 293 3.937 -7.694 -0.090 1.00 0.15 C ATOM 1335 O CYS A 293 3.300 -6.653 -0.223 1.00 0.14 O ATOM 1336 CB CYS A 293 6.050 -6.910 0.964 1.00 0.28 C ATOM 1337 SG CYS A 293 6.107 -7.847 2.508 1.00 1.55 S ATOM 0 H CYS A 293 5.501 -6.022 -1.521 1.00 0.16 H new ATOM 0 HA CYS A 293 5.857 -8.678 -0.234 1.00 0.18 H new ATOM 0 HB2 CYS A 293 7.063 -6.602 0.705 1.00 0.28 H new ATOM 0 HB3 CYS A 293 5.472 -6.000 1.129 1.00 0.28 H new ATOM 0 HG CYS A 293 6.693 -7.137 3.425 1.00 1.55 H new ATOM 1343 N SER A 294 3.358 -8.879 0.020 1.00 0.17 N ATOM 1344 CA SER A 294 1.913 -9.008 -0.040 1.00 0.18 C ATOM 1345 C SER A 294 1.233 -8.691 1.282 1.00 0.17 C ATOM 1346 O SER A 294 1.673 -9.112 2.353 1.00 0.20 O ATOM 1347 CB SER A 294 1.529 -10.408 -0.518 1.00 0.27 C ATOM 1348 OG SER A 294 2.277 -11.405 0.157 1.00 0.61 O ATOM 0 H SER A 294 3.861 -9.757 0.150 1.00 0.17 H new ATOM 0 HA SER A 294 1.558 -8.267 -0.756 1.00 0.18 H new ATOM 0 HB2 SER A 294 0.465 -10.573 -0.350 1.00 0.27 H new ATOM 0 HB3 SER A 294 1.699 -10.487 -1.592 1.00 0.27 H new ATOM 0 HG SER A 294 2.010 -12.290 -0.167 1.00 0.61 H new ATOM 1354 N THR A 295 0.130 -7.970 1.176 1.00 0.17 N ATOM 1355 CA THR A 295 -0.678 -7.613 2.318 1.00 0.15 C ATOM 1356 C THR A 295 -2.146 -7.664 1.916 1.00 0.15 C ATOM 1357 O THR A 295 -2.506 -7.239 0.820 1.00 0.15 O ATOM 1358 CB THR A 295 -0.293 -6.203 2.844 1.00 0.18 C ATOM 1359 OG1 THR A 295 -0.064 -6.259 4.251 1.00 0.29 O ATOM 1360 CG2 THR A 295 -1.358 -5.152 2.554 1.00 0.20 C ATOM 0 H THR A 295 -0.228 -7.616 0.289 1.00 0.17 H new ATOM 0 HA THR A 295 -0.501 -8.321 3.127 1.00 0.15 H new ATOM 0 HB THR A 295 0.614 -5.906 2.317 1.00 0.18 H new ATOM 0 HG1 THR A 295 -0.268 -5.388 4.651 1.00 0.29 H new ATOM 0 HG21 THR A 295 -1.033 -4.188 2.945 1.00 0.20 H new ATOM 0 HG22 THR A 295 -1.509 -5.075 1.477 1.00 0.20 H new ATOM 0 HG23 THR A 295 -2.294 -5.441 3.032 1.00 0.20 H new ATOM 1368 N GLU A 296 -2.970 -8.299 2.730 1.00 0.15 N ATOM 1369 CA GLU A 296 -4.376 -8.441 2.399 1.00 0.15 C ATOM 1370 C GLU A 296 -5.111 -7.146 2.717 1.00 0.14 C ATOM 1371 O GLU A 296 -4.672 -6.361 3.560 1.00 0.19 O ATOM 1372 CB GLU A 296 -4.978 -9.631 3.138 1.00 0.18 C ATOM 1373 CG GLU A 296 -4.165 -10.902 2.951 1.00 0.22 C ATOM 1374 CD GLU A 296 -4.727 -12.090 3.702 1.00 0.34 C ATOM 1375 OE1 GLU A 296 -5.953 -12.317 3.626 1.00 0.96 O ATOM 1376 OE2 GLU A 296 -3.955 -12.776 4.406 1.00 0.76 O ATOM 0 H GLU A 296 -2.694 -8.721 3.617 1.00 0.15 H new ATOM 0 HA GLU A 296 -4.482 -8.635 1.332 1.00 0.15 H new ATOM 0 HB2 GLU A 296 -5.045 -9.399 4.201 1.00 0.18 H new ATOM 0 HB3 GLU A 296 -5.995 -9.798 2.784 1.00 0.18 H new ATOM 0 HG2 GLU A 296 -4.118 -11.142 1.889 1.00 0.22 H new ATOM 0 HG3 GLU A 296 -3.142 -10.723 3.282 1.00 0.22 H new ATOM 1383 N LEU A 297 -6.129 -6.855 1.936 1.00 0.15 N ATOM 1384 CA LEU A 297 -6.841 -5.599 2.051 1.00 0.15 C ATOM 1385 C LEU A 297 -8.324 -5.849 2.279 1.00 0.15 C ATOM 1386 O LEU A 297 -9.018 -6.369 1.399 1.00 0.23 O ATOM 1387 CB LEU A 297 -6.633 -4.772 0.780 1.00 0.22 C ATOM 1388 CG LEU A 297 -7.212 -3.362 0.830 1.00 0.21 C ATOM 1389 CD1 LEU A 297 -6.625 -2.607 2.006 1.00 0.26 C ATOM 1390 CD2 LEU A 297 -6.935 -2.627 -0.471 1.00 0.29 C ATOM 0 H LEU A 297 -6.485 -7.476 1.209 1.00 0.15 H new ATOM 0 HA LEU A 297 -6.450 -5.047 2.906 1.00 0.15 H new ATOM 0 HB2 LEU A 297 -5.564 -4.703 0.580 1.00 0.22 H new ATOM 0 HB3 LEU A 297 -7.081 -5.304 -0.059 1.00 0.22 H new ATOM 0 HG LEU A 297 -8.292 -3.427 0.959 1.00 0.21 H new ATOM 0 HD11 LEU A 297 -7.042 -1.600 2.037 1.00 0.26 H new ATOM 0 HD12 LEU A 297 -6.868 -3.129 2.931 1.00 0.26 H new ATOM 0 HD13 LEU A 297 -5.542 -2.548 1.896 1.00 0.26 H new ATOM 0 HD21 LEU A 297 -7.355 -1.623 -0.418 1.00 0.29 H new ATOM 0 HD22 LEU A 297 -5.859 -2.562 -0.630 1.00 0.29 H new ATOM 0 HD23 LEU A 297 -7.392 -3.168 -1.299 1.00 0.29 H new ATOM 1402 N PHE A 298 -8.802 -5.450 3.448 1.00 0.14 N ATOM 1403 CA PHE A 298 -10.203 -5.615 3.806 1.00 0.19 C ATOM 1404 C PHE A 298 -10.794 -4.266 4.176 1.00 0.19 C ATOM 1405 O PHE A 298 -10.075 -3.373 4.611 1.00 0.24 O ATOM 1406 CB PHE A 298 -10.364 -6.593 4.974 1.00 0.26 C ATOM 1407 CG PHE A 298 -9.862 -7.981 4.694 1.00 0.28 C ATOM 1408 CD1 PHE A 298 -8.508 -8.267 4.760 1.00 0.25 C ATOM 1409 CD2 PHE A 298 -10.739 -8.993 4.343 1.00 0.50 C ATOM 1410 CE1 PHE A 298 -8.039 -9.536 4.485 1.00 0.32 C ATOM 1411 CE2 PHE A 298 -10.277 -10.264 4.071 1.00 0.58 C ATOM 1412 CZ PHE A 298 -8.946 -10.558 4.209 1.00 0.45 C ATOM 0 H PHE A 298 -8.235 -5.006 4.170 1.00 0.14 H new ATOM 0 HA PHE A 298 -10.733 -6.026 2.946 1.00 0.19 H new ATOM 0 HB2 PHE A 298 -9.835 -6.196 5.840 1.00 0.26 H new ATOM 0 HB3 PHE A 298 -11.419 -6.648 5.243 1.00 0.26 H new ATOM 0 HD1 PHE A 298 -7.811 -7.488 5.030 1.00 0.25 H new ATOM 0 HD2 PHE A 298 -11.797 -8.785 4.281 1.00 0.50 H new ATOM 0 HE1 PHE A 298 -6.978 -9.735 4.484 1.00 0.32 H new ATOM 0 HE2 PHE A 298 -10.967 -11.030 3.748 1.00 0.58 H new ATOM 0 HZ PHE A 298 -8.601 -11.576 4.105 1.00 0.45 H new ATOM 1422 N VAL A 299 -12.071 -4.073 3.906 1.00 0.28 N ATOM 1423 CA VAL A 299 -12.691 -2.783 4.159 1.00 0.28 C ATOM 1424 C VAL A 299 -13.651 -2.834 5.350 1.00 0.32 C ATOM 1425 O VAL A 299 -14.504 -3.719 5.449 1.00 0.40 O ATOM 1426 CB VAL A 299 -13.434 -2.250 2.908 1.00 0.33 C ATOM 1427 CG1 VAL A 299 -14.523 -3.199 2.462 1.00 0.44 C ATOM 1428 CG2 VAL A 299 -14.008 -0.869 3.174 1.00 0.35 C ATOM 0 H VAL A 299 -12.694 -4.781 3.517 1.00 0.28 H new ATOM 0 HA VAL A 299 -11.881 -2.096 4.401 1.00 0.28 H new ATOM 0 HB VAL A 299 -12.706 -2.176 2.100 1.00 0.33 H new ATOM 0 HG11 VAL A 299 -15.022 -2.792 1.583 1.00 0.44 H new ATOM 0 HG12 VAL A 299 -14.085 -4.166 2.216 1.00 0.44 H new ATOM 0 HG13 VAL A 299 -15.249 -3.324 3.266 1.00 0.44 H new ATOM 0 HG21 VAL A 299 -14.526 -0.512 2.284 1.00 0.35 H new ATOM 0 HG22 VAL A 299 -14.711 -0.921 4.006 1.00 0.35 H new ATOM 0 HG23 VAL A 299 -13.200 -0.181 3.424 1.00 0.35 H new ATOM 1438 N LYS A 300 -13.574 -1.813 6.186 1.00 0.33 N ATOM 1439 CA LYS A 300 -14.536 -1.606 7.249 1.00 0.41 C ATOM 1440 C LYS A 300 -15.569 -0.603 6.763 1.00 0.40 C ATOM 1441 O LYS A 300 -15.208 0.415 6.161 1.00 0.37 O ATOM 1442 CB LYS A 300 -13.847 -1.073 8.509 1.00 0.48 C ATOM 1443 CG LYS A 300 -14.793 -0.882 9.685 1.00 1.17 C ATOM 1444 CD LYS A 300 -14.073 -0.310 10.895 1.00 1.72 C ATOM 1445 CE LYS A 300 -15.031 -0.049 12.046 1.00 2.32 C ATOM 1446 NZ LYS A 300 -15.684 -1.294 12.530 1.00 3.03 N ATOM 0 H LYS A 300 -12.841 -1.105 6.145 1.00 0.33 H new ATOM 0 HA LYS A 300 -15.012 -2.554 7.502 1.00 0.41 H new ATOM 0 HB2 LYS A 300 -13.054 -1.763 8.799 1.00 0.48 H new ATOM 0 HB3 LYS A 300 -13.371 -0.120 8.277 1.00 0.48 H new ATOM 0 HG2 LYS A 300 -15.605 -0.215 9.395 1.00 1.17 H new ATOM 0 HG3 LYS A 300 -15.245 -1.838 9.948 1.00 1.17 H new ATOM 0 HD2 LYS A 300 -13.296 -1.003 11.218 1.00 1.72 H new ATOM 0 HD3 LYS A 300 -13.576 0.619 10.617 1.00 1.72 H new ATOM 0 HE2 LYS A 300 -14.489 0.418 12.868 1.00 2.32 H new ATOM 0 HE3 LYS A 300 -15.796 0.659 11.726 1.00 2.32 H new ATOM 0 HZ1 LYS A 300 -16.207 -1.094 13.406 1.00 3.03 H new ATOM 0 HZ2 LYS A 300 -16.343 -1.645 11.806 1.00 3.03 H new ATOM 0 HZ3 LYS A 300 -14.959 -2.016 12.717 1.00 3.03 H new ATOM 1460 N GLU A 301 -16.838 -0.912 6.962 1.00 0.50 N ATOM 1461 CA GLU A 301 -17.906 -0.041 6.507 1.00 0.57 C ATOM 1462 C GLU A 301 -17.853 1.297 7.234 1.00 0.65 C ATOM 1463 O GLU A 301 -17.398 1.326 8.396 1.00 1.41 O ATOM 1464 CB GLU A 301 -19.269 -0.698 6.717 1.00 0.83 C ATOM 1465 CG GLU A 301 -19.500 -1.904 5.826 1.00 0.66 C ATOM 1466 CD GLU A 301 -20.839 -2.557 6.072 1.00 0.90 C ATOM 1467 OE1 GLU A 301 -21.065 -3.055 7.193 1.00 1.21 O ATOM 1468 OE2 GLU A 301 -21.669 -2.588 5.137 1.00 1.44 O ATOM 1469 OXT GLU A 301 -18.259 2.314 6.640 1.00 1.20 O ATOM 0 H GLU A 301 -17.154 -1.759 7.435 1.00 0.50 H new ATOM 0 HA GLU A 301 -17.766 0.134 5.440 1.00 0.57 H new ATOM 0 HB2 GLU A 301 -19.360 -1.003 7.759 1.00 0.83 H new ATOM 0 HB3 GLU A 301 -20.051 0.038 6.530 1.00 0.83 H new ATOM 0 HG2 GLU A 301 -19.435 -1.598 4.782 1.00 0.66 H new ATOM 0 HG3 GLU A 301 -18.707 -2.633 5.994 1.00 0.66 H new