USER MOD reduce.3.24.130724 H: found=0, std=0, add=557, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 556 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 262 LYS NZ :NH3+ -120:sc= -3.26! (180deg=-4.11!) USER MOD Set 1.2: A 315 CYS SG : rot 70:sc= -4.95! USER MOD Set 2.1: A 271 GLN :FLIP amide:sc= 0.449 F(o=-4.8,f=-2.6) USER MOD Set 2.2: A 289 CYS SG : rot 170:sc= -3! USER MOD Set 3.1: A 288 THR OG1 : rot 34:sc= 0.224 USER MOD Set 3.2: A 293 GLN : amide:sc= -0.993 K(o=-0.77,f=-1.5) USER MOD Single : A 254 CYS SG : rot 180:sc= -0.565 USER MOD Single : A 257 SER OG : rot 98:sc= 0.239 USER MOD Single : A 261 MET CE :methyl -111:sc= -2.33 (180deg=-3.04!) USER MOD Single : A 268 SER OG : rot -168:sc= 0.555 USER MOD Single : A 269 THR OG1 : rot -130:sc= -2.46! USER MOD Single : A 272 THR OG1 : rot 180:sc= -0.033 USER MOD Single : A 273 TYR OH : rot 30:sc= -1.5! USER MOD Single : A 276 SER OG : rot -70:sc= 0.563 USER MOD Single : A 277 SER OG : rot -145:sc= 1.23 USER MOD Single : A 279 GLN : amide:sc= -2.62! C(o=-2.6!,f=-5.5!) USER MOD Single : A 280 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 286 HIS : no HD1:sc= -0.156 X(o=-0.16,f=0.013) USER MOD Single : A 287 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 291 LYS NZ :NH3+ -178:sc= 0.173 (180deg=0.171) USER MOD Single : A 292 SER OG : rot 180:sc= 0 USER MOD Single : A 295 THR OG1 : rot 180:sc= 0 USER MOD Single : A 298 HIS :FLIP no HD1:sc= -0.709 F(o=-1.9!,f=-0.71) USER MOD Single : A 302 THR OG1 : rot 180:sc= 0 USER MOD Single : A 304 ASN :FLIP amide:sc= -2.92 F(o=-5.1,f=-2.9) USER MOD Single : A 305 TYR OH : rot 180:sc= 0 USER MOD Single : A 308 LYS NZ :NH3+ -166:sc= 1.23 (180deg=1.07) USER MOD Single : A 309 SER OG : rot 180:sc= 0 USER MOD Single : A 317 SER OG : rot 180:sc= 0 USER MOD Single : A 318 ASN : amide:sc= -0.0171 X(o=-0.017,f=0) USER MOD ----------------------------------------------------------------- ATOM 120 N PHE A 252 2.485 -6.447 0.996 1.00 0.00 N ATOM 121 CA PHE A 252 1.207 -6.942 1.496 1.00 0.00 C ATOM 122 C PHE A 252 0.741 -6.117 2.690 1.00 0.00 C ATOM 123 O PHE A 252 -0.251 -6.452 3.332 1.00 0.00 O ATOM 124 CB PHE A 252 1.302 -8.400 1.954 1.00 0.00 C ATOM 125 CG PHE A 252 1.475 -9.412 0.860 1.00 0.00 C ATOM 126 CD1 PHE A 252 0.752 -9.321 -0.319 1.00 0.00 C ATOM 127 CD2 PHE A 252 2.345 -10.478 1.028 1.00 0.00 C ATOM 128 CE1 PHE A 252 0.899 -10.273 -1.308 1.00 0.00 C ATOM 129 CE2 PHE A 252 2.496 -11.430 0.039 1.00 0.00 C ATOM 130 CZ PHE A 252 1.771 -11.327 -1.131 1.00 0.00 C ATOM 0 HA PHE A 252 0.501 -6.862 0.670 1.00 0.00 H new ATOM 0 HB2 PHE A 252 2.140 -8.491 2.645 1.00 0.00 H new ATOM 0 HB3 PHE A 252 0.399 -8.646 2.513 1.00 0.00 H new ATOM 0 HD1 PHE A 252 0.068 -8.498 -0.465 1.00 0.00 H new ATOM 0 HD2 PHE A 252 2.912 -10.565 1.943 1.00 0.00 H new ATOM 0 HE1 PHE A 252 0.330 -10.192 -2.222 1.00 0.00 H new ATOM 0 HE2 PHE A 252 3.180 -12.254 0.181 1.00 0.00 H new ATOM 0 HZ PHE A 252 1.886 -12.070 -1.906 1.00 0.00 H new ATOM 140 N ARG A 253 1.465 -5.064 3.027 1.00 0.00 N ATOM 141 CA ARG A 253 1.135 -4.321 4.233 1.00 0.00 C ATOM 142 C ARG A 253 0.917 -2.840 3.968 1.00 0.00 C ATOM 143 O ARG A 253 1.756 -2.168 3.374 1.00 0.00 O ATOM 144 CB ARG A 253 2.222 -4.541 5.301 1.00 0.00 C ATOM 145 CG ARG A 253 1.905 -3.951 6.674 1.00 0.00 C ATOM 146 CD ARG A 253 2.211 -2.461 6.751 1.00 0.00 C ATOM 147 NE ARG A 253 3.644 -2.179 6.889 1.00 0.00 N ATOM 148 CZ ARG A 253 4.375 -1.482 6.011 1.00 0.00 C ATOM 149 NH1 ARG A 253 3.858 -1.081 4.857 1.00 0.00 N ATOM 150 NH2 ARG A 253 5.641 -1.202 6.284 1.00 0.00 N ATOM 0 H ARG A 253 2.264 -4.710 2.500 1.00 0.00 H new ATOM 0 HA ARG A 253 0.186 -4.706 4.606 1.00 0.00 H new ATOM 0 HB2 ARG A 253 2.390 -5.612 5.412 1.00 0.00 H new ATOM 0 HB3 ARG A 253 3.156 -4.108 4.943 1.00 0.00 H new ATOM 0 HG2 ARG A 253 0.852 -4.115 6.902 1.00 0.00 H new ATOM 0 HG3 ARG A 253 2.482 -4.477 7.434 1.00 0.00 H new ATOM 0 HD2 ARG A 253 1.834 -1.971 5.853 1.00 0.00 H new ATOM 0 HD3 ARG A 253 1.678 -2.029 7.598 1.00 0.00 H new ATOM 0 HE ARG A 253 4.119 -2.541 7.716 1.00 0.00 H new ATOM 0 HH11 ARG A 253 2.889 -1.303 4.628 1.00 0.00 H new ATOM 0 HH12 ARG A 253 4.429 -0.551 4.199 1.00 0.00 H new ATOM 0 HH21 ARG A 253 6.055 -1.517 7.161 1.00 0.00 H new ATOM 0 HH22 ARG A 253 6.201 -0.671 5.617 1.00 0.00 H new ATOM 164 N CYS A 254 -0.215 -2.341 4.439 1.00 0.00 N ATOM 165 CA CYS A 254 -0.463 -0.911 4.484 1.00 0.00 C ATOM 166 C CYS A 254 -0.290 -0.441 5.925 1.00 0.00 C ATOM 167 O CYS A 254 -0.979 -0.915 6.819 1.00 0.00 O ATOM 168 CB CYS A 254 -1.866 -0.591 3.972 1.00 0.00 C ATOM 169 SG CYS A 254 -2.245 1.174 3.883 1.00 0.00 S ATOM 0 H CYS A 254 -0.981 -2.911 4.798 1.00 0.00 H new ATOM 0 HA CYS A 254 0.244 -0.390 3.839 1.00 0.00 H new ATOM 0 HB2 CYS A 254 -1.985 -1.026 2.980 1.00 0.00 H new ATOM 0 HB3 CYS A 254 -2.596 -1.074 4.622 1.00 0.00 H new ATOM 0 HG CYS A 254 -3.455 1.336 3.436 1.00 0.00 H new ATOM 175 N PRO A 255 0.653 0.475 6.177 1.00 0.00 N ATOM 176 CA PRO A 255 1.020 0.882 7.538 1.00 0.00 C ATOM 177 C PRO A 255 0.014 1.848 8.150 1.00 0.00 C ATOM 178 O PRO A 255 0.197 2.332 9.269 1.00 0.00 O ATOM 179 CB PRO A 255 2.368 1.569 7.335 1.00 0.00 C ATOM 180 CG PRO A 255 2.287 2.145 5.965 1.00 0.00 C ATOM 181 CD PRO A 255 1.429 1.201 5.161 1.00 0.00 C ATOM 0 HA PRO A 255 1.049 0.038 8.227 1.00 0.00 H new ATOM 0 HB2 PRO A 255 2.536 2.344 8.083 1.00 0.00 H new ATOM 0 HB3 PRO A 255 3.192 0.861 7.420 1.00 0.00 H new ATOM 0 HG2 PRO A 255 1.851 3.144 5.988 1.00 0.00 H new ATOM 0 HG3 PRO A 255 3.279 2.241 5.524 1.00 0.00 H new ATOM 0 HD2 PRO A 255 0.779 1.741 4.472 1.00 0.00 H new ATOM 0 HD3 PRO A 255 2.036 0.522 4.561 1.00 0.00 H new ATOM 189 N ILE A 256 -1.054 2.113 7.412 1.00 0.00 N ATOM 190 CA ILE A 256 -2.057 3.069 7.837 1.00 0.00 C ATOM 191 C ILE A 256 -3.076 2.408 8.766 1.00 0.00 C ATOM 192 O ILE A 256 -3.352 2.925 9.851 1.00 0.00 O ATOM 193 CB ILE A 256 -2.749 3.717 6.614 1.00 0.00 C ATOM 194 CG1 ILE A 256 -1.670 4.302 5.691 1.00 0.00 C ATOM 195 CG2 ILE A 256 -3.721 4.802 7.061 1.00 0.00 C ATOM 196 CD1 ILE A 256 -2.179 4.769 4.346 1.00 0.00 C ATOM 0 H ILE A 256 -1.246 1.675 6.511 1.00 0.00 H new ATOM 0 HA ILE A 256 -1.561 3.861 8.397 1.00 0.00 H new ATOM 0 HB ILE A 256 -3.322 2.963 6.074 1.00 0.00 H new ATOM 0 HG12 ILE A 256 -1.194 5.142 6.197 1.00 0.00 H new ATOM 0 HG13 ILE A 256 -0.899 3.548 5.531 1.00 0.00 H new ATOM 0 HG21 ILE A 256 -4.198 5.246 6.187 1.00 0.00 H new ATOM 0 HG22 ILE A 256 -4.482 4.365 7.707 1.00 0.00 H new ATOM 0 HG23 ILE A 256 -3.179 5.573 7.609 1.00 0.00 H new ATOM 0 HD11 ILE A 256 -1.350 5.167 3.761 1.00 0.00 H new ATOM 0 HD12 ILE A 256 -2.628 3.929 3.815 1.00 0.00 H new ATOM 0 HD13 ILE A 256 -2.927 5.548 4.491 1.00 0.00 H new ATOM 208 N SER A 257 -3.608 1.258 8.370 1.00 0.00 N ATOM 209 CA SER A 257 -4.532 0.528 9.233 1.00 0.00 C ATOM 210 C SER A 257 -4.197 -0.967 9.263 1.00 0.00 C ATOM 211 O SER A 257 -4.877 -1.747 9.932 1.00 0.00 O ATOM 212 CB SER A 257 -5.970 0.713 8.735 1.00 0.00 C ATOM 213 OG SER A 257 -6.209 2.052 8.334 1.00 0.00 O ATOM 0 H SER A 257 -3.420 0.815 7.471 1.00 0.00 H new ATOM 0 HA SER A 257 -4.435 0.928 10.242 1.00 0.00 H new ATOM 0 HB2 SER A 257 -6.156 0.042 7.897 1.00 0.00 H new ATOM 0 HB3 SER A 257 -6.669 0.438 9.525 1.00 0.00 H new ATOM 0 HG SER A 257 -6.116 2.124 7.361 1.00 0.00 H new ATOM 219 N LEU A 258 -3.137 -1.349 8.548 1.00 0.00 N ATOM 220 CA LEU A 258 -2.844 -2.757 8.264 1.00 0.00 C ATOM 221 C LEU A 258 -4.077 -3.387 7.639 1.00 0.00 C ATOM 222 O LEU A 258 -4.451 -4.518 7.941 1.00 0.00 O ATOM 223 CB LEU A 258 -2.426 -3.538 9.516 1.00 0.00 C ATOM 224 CG LEU A 258 -1.338 -4.606 9.289 1.00 0.00 C ATOM 225 CD1 LEU A 258 -1.042 -5.343 10.582 1.00 0.00 C ATOM 226 CD2 LEU A 258 -1.730 -5.602 8.193 1.00 0.00 C ATOM 0 H LEU A 258 -2.461 -0.696 8.151 1.00 0.00 H new ATOM 0 HA LEU A 258 -1.998 -2.799 7.578 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -2.068 -2.830 10.264 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -3.308 -4.024 9.933 1.00 0.00 H new ATOM 0 HG LEU A 258 -0.439 -4.087 8.956 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -0.272 -6.094 10.405 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -0.692 -4.634 11.333 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -1.949 -5.831 10.938 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -0.934 -6.336 8.067 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -2.651 -6.111 8.476 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -1.884 -5.069 7.255 1.00 0.00 H new ATOM 238 N GLU A 259 -4.714 -2.630 6.773 1.00 0.00 N ATOM 239 CA GLU A 259 -5.877 -3.112 6.073 1.00 0.00 C ATOM 240 C GLU A 259 -5.428 -3.961 4.905 1.00 0.00 C ATOM 241 O GLU A 259 -6.065 -4.948 4.561 1.00 0.00 O ATOM 242 CB GLU A 259 -6.756 -1.950 5.582 1.00 0.00 C ATOM 243 CG GLU A 259 -6.048 -0.957 4.650 1.00 0.00 C ATOM 244 CD GLU A 259 -5.231 0.096 5.390 1.00 0.00 C ATOM 245 OE1 GLU A 259 -4.137 -0.235 5.899 1.00 0.00 O ATOM 246 OE2 GLU A 259 -5.673 1.260 5.463 1.00 0.00 O ATOM 0 H GLU A 259 -4.442 -1.675 6.538 1.00 0.00 H new ATOM 0 HA GLU A 259 -6.479 -3.710 6.758 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -7.621 -2.362 5.062 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -7.134 -1.407 6.449 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -5.391 -1.508 3.977 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -6.793 -0.458 4.031 1.00 0.00 H new ATOM 253 N LEU A 260 -4.286 -3.586 4.344 1.00 0.00 N ATOM 254 CA LEU A 260 -3.788 -4.189 3.124 1.00 0.00 C ATOM 255 C LEU A 260 -4.714 -3.838 1.963 1.00 0.00 C ATOM 256 O LEU A 260 -5.808 -4.382 1.808 1.00 0.00 O ATOM 257 CB LEU A 260 -3.593 -5.702 3.283 1.00 0.00 C ATOM 258 CG LEU A 260 -3.310 -6.474 1.994 1.00 0.00 C ATOM 259 CD1 LEU A 260 -2.231 -5.790 1.175 1.00 0.00 C ATOM 260 CD2 LEU A 260 -2.898 -7.903 2.311 1.00 0.00 C ATOM 0 H LEU A 260 -3.683 -2.856 4.724 1.00 0.00 H new ATOM 0 HA LEU A 260 -2.802 -3.781 2.903 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -2.768 -5.873 3.975 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -4.488 -6.118 3.745 1.00 0.00 H new ATOM 0 HG LEU A 260 -4.227 -6.492 1.405 1.00 0.00 H new ATOM 0 HD11 LEU A 260 -2.050 -6.360 0.264 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -2.556 -4.783 0.914 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -1.312 -5.735 1.758 1.00 0.00 H new ATOM 0 HD21 LEU A 260 -2.700 -8.439 1.383 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -1.997 -7.894 2.924 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -3.701 -8.401 2.854 1.00 0.00 H new ATOM 272 N MET A 261 -4.241 -2.878 1.189 1.00 0.00 N ATOM 273 CA MET A 261 -4.942 -2.304 0.043 1.00 0.00 C ATOM 274 C MET A 261 -5.596 -3.336 -0.876 1.00 0.00 C ATOM 275 O MET A 261 -5.199 -4.500 -0.920 1.00 0.00 O ATOM 276 CB MET A 261 -3.930 -1.499 -0.766 1.00 0.00 C ATOM 277 CG MET A 261 -2.504 -2.021 -0.621 1.00 0.00 C ATOM 278 SD MET A 261 -1.611 -1.253 0.742 1.00 0.00 S ATOM 279 CE MET A 261 -0.042 -2.105 0.628 1.00 0.00 C ATOM 0 H MET A 261 -3.324 -2.458 1.343 1.00 0.00 H new ATOM 0 HA MET A 261 -5.753 -1.692 0.436 1.00 0.00 H new ATOM 0 HB2 MET A 261 -4.214 -1.520 -1.818 1.00 0.00 H new ATOM 0 HB3 MET A 261 -3.964 -0.457 -0.448 1.00 0.00 H new ATOM 0 HG2 MET A 261 -2.531 -3.100 -0.469 1.00 0.00 H new ATOM 0 HG3 MET A 261 -1.962 -1.844 -1.550 1.00 0.00 H new ATOM 0 HE1 MET A 261 0.077 -2.764 1.488 1.00 0.00 H new ATOM 0 HE2 MET A 261 -0.014 -2.695 -0.288 1.00 0.00 H new ATOM 0 HE3 MET A 261 0.768 -1.376 0.615 1.00 0.00 H new ATOM 289 N LYS A 262 -6.609 -2.884 -1.611 1.00 0.00 N ATOM 290 CA LYS A 262 -7.213 -3.682 -2.680 1.00 0.00 C ATOM 291 C LYS A 262 -6.688 -3.200 -4.020 1.00 0.00 C ATOM 292 O LYS A 262 -6.309 -3.983 -4.892 1.00 0.00 O ATOM 293 CB LYS A 262 -8.742 -3.535 -2.694 1.00 0.00 C ATOM 294 CG LYS A 262 -9.460 -3.983 -1.432 1.00 0.00 C ATOM 295 CD LYS A 262 -9.363 -5.482 -1.216 1.00 0.00 C ATOM 296 CE LYS A 262 -8.151 -5.837 -0.387 1.00 0.00 C ATOM 297 NZ LYS A 262 -8.233 -5.242 0.970 1.00 0.00 N ATOM 0 H LYS A 262 -7.032 -1.964 -1.486 1.00 0.00 H new ATOM 0 HA LYS A 262 -6.955 -4.726 -2.503 1.00 0.00 H new ATOM 0 HB2 LYS A 262 -8.986 -2.488 -2.876 1.00 0.00 H new ATOM 0 HB3 LYS A 262 -9.135 -4.105 -3.535 1.00 0.00 H new ATOM 0 HG2 LYS A 262 -9.035 -3.466 -0.572 1.00 0.00 H new ATOM 0 HG3 LYS A 262 -10.509 -3.694 -1.491 1.00 0.00 H new ATOM 0 HD2 LYS A 262 -10.265 -5.840 -0.719 1.00 0.00 H new ATOM 0 HD3 LYS A 262 -9.309 -5.988 -2.180 1.00 0.00 H new ATOM 0 HE2 LYS A 262 -8.067 -6.921 -0.307 1.00 0.00 H new ATOM 0 HE3 LYS A 262 -7.249 -5.484 -0.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 262 -7.423 -4.607 1.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 262 -9.118 -4.702 1.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 262 -8.216 -5.999 1.683 1.00 0.00 H new ATOM 311 N ASP A 263 -6.667 -1.891 -4.154 1.00 0.00 N ATOM 312 CA ASP A 263 -6.234 -1.225 -5.365 1.00 0.00 C ATOM 313 C ASP A 263 -5.275 -0.119 -4.953 1.00 0.00 C ATOM 314 O ASP A 263 -5.698 0.916 -4.435 1.00 0.00 O ATOM 315 CB ASP A 263 -7.445 -0.636 -6.100 1.00 0.00 C ATOM 316 CG ASP A 263 -7.183 -0.358 -7.569 1.00 0.00 C ATOM 317 OD1 ASP A 263 -6.445 0.595 -7.886 1.00 0.00 O ATOM 318 OD2 ASP A 263 -7.735 -1.095 -8.421 1.00 0.00 O ATOM 0 H ASP A 263 -6.954 -1.250 -3.414 1.00 0.00 H new ATOM 0 HA ASP A 263 -5.742 -1.925 -6.040 1.00 0.00 H new ATOM 0 HB2 ASP A 263 -8.284 -1.326 -6.013 1.00 0.00 H new ATOM 0 HB3 ASP A 263 -7.742 0.291 -5.610 1.00 0.00 H new ATOM 323 N PRO A 264 -3.969 -0.342 -5.124 1.00 0.00 N ATOM 324 CA PRO A 264 -2.956 0.550 -4.608 1.00 0.00 C ATOM 325 C PRO A 264 -2.519 1.594 -5.612 1.00 0.00 C ATOM 326 O PRO A 264 -2.572 1.380 -6.827 1.00 0.00 O ATOM 327 CB PRO A 264 -1.811 -0.405 -4.300 1.00 0.00 C ATOM 328 CG PRO A 264 -1.952 -1.519 -5.293 1.00 0.00 C ATOM 329 CD PRO A 264 -3.367 -1.472 -5.835 1.00 0.00 C ATOM 0 HA PRO A 264 -3.310 1.128 -3.755 1.00 0.00 H new ATOM 0 HB2 PRO A 264 -0.846 0.092 -4.400 1.00 0.00 H new ATOM 0 HB3 PRO A 264 -1.873 -0.778 -3.278 1.00 0.00 H new ATOM 0 HG2 PRO A 264 -1.229 -1.406 -6.100 1.00 0.00 H new ATOM 0 HG3 PRO A 264 -1.755 -2.481 -4.820 1.00 0.00 H new ATOM 0 HD2 PRO A 264 -3.378 -1.319 -6.914 1.00 0.00 H new ATOM 0 HD3 PRO A 264 -3.903 -2.401 -5.639 1.00 0.00 H new ATOM 337 N VAL A 265 -2.088 2.722 -5.094 1.00 0.00 N ATOM 338 CA VAL A 265 -1.538 3.770 -5.916 1.00 0.00 C ATOM 339 C VAL A 265 -0.133 4.099 -5.453 1.00 0.00 C ATOM 340 O VAL A 265 0.120 4.286 -4.257 1.00 0.00 O ATOM 341 CB VAL A 265 -2.416 5.038 -5.898 1.00 0.00 C ATOM 342 CG1 VAL A 265 -3.694 4.811 -6.691 1.00 0.00 C ATOM 343 CG2 VAL A 265 -2.744 5.448 -4.467 1.00 0.00 C ATOM 0 H VAL A 265 -2.109 2.936 -4.097 1.00 0.00 H new ATOM 0 HA VAL A 265 -1.510 3.409 -6.944 1.00 0.00 H new ATOM 0 HB VAL A 265 -1.856 5.848 -6.366 1.00 0.00 H new ATOM 0 HG11 VAL A 265 -4.302 5.715 -6.668 1.00 0.00 H new ATOM 0 HG12 VAL A 265 -3.443 4.568 -7.724 1.00 0.00 H new ATOM 0 HG13 VAL A 265 -4.254 3.986 -6.250 1.00 0.00 H new ATOM 0 HG21 VAL A 265 -3.364 6.344 -4.478 1.00 0.00 H new ATOM 0 HG22 VAL A 265 -3.283 4.640 -3.972 1.00 0.00 H new ATOM 0 HG23 VAL A 265 -1.820 5.653 -3.926 1.00 0.00 H new ATOM 353 N ILE A 266 0.779 4.131 -6.398 1.00 0.00 N ATOM 354 CA ILE A 266 2.159 4.432 -6.117 1.00 0.00 C ATOM 355 C ILE A 266 2.395 5.933 -6.158 1.00 0.00 C ATOM 356 O ILE A 266 1.818 6.645 -6.976 1.00 0.00 O ATOM 357 CB ILE A 266 3.094 3.705 -7.116 1.00 0.00 C ATOM 358 CG1 ILE A 266 3.714 2.474 -6.462 1.00 0.00 C ATOM 359 CG2 ILE A 266 4.180 4.618 -7.653 1.00 0.00 C ATOM 360 CD1 ILE A 266 4.766 1.805 -7.313 1.00 0.00 C ATOM 0 H ILE A 266 0.582 3.949 -7.382 1.00 0.00 H new ATOM 0 HA ILE A 266 2.390 4.074 -5.114 1.00 0.00 H new ATOM 0 HB ILE A 266 2.483 3.394 -7.963 1.00 0.00 H new ATOM 0 HG12 ILE A 266 4.158 2.763 -5.510 1.00 0.00 H new ATOM 0 HG13 ILE A 266 2.926 1.754 -6.240 1.00 0.00 H new ATOM 0 HG21 ILE A 266 4.810 4.064 -8.349 1.00 0.00 H new ATOM 0 HG22 ILE A 266 3.723 5.462 -8.170 1.00 0.00 H new ATOM 0 HG23 ILE A 266 4.788 4.985 -6.826 1.00 0.00 H new ATOM 0 HD11 ILE A 266 5.163 0.938 -6.786 1.00 0.00 H new ATOM 0 HD12 ILE A 266 4.322 1.484 -8.255 1.00 0.00 H new ATOM 0 HD13 ILE A 266 5.574 2.509 -7.513 1.00 0.00 H new ATOM 372 N VAL A 267 3.216 6.410 -5.252 1.00 0.00 N ATOM 373 CA VAL A 267 3.625 7.797 -5.254 1.00 0.00 C ATOM 374 C VAL A 267 5.141 7.835 -5.209 1.00 0.00 C ATOM 375 O VAL A 267 5.774 6.800 -4.973 1.00 0.00 O ATOM 376 CB VAL A 267 3.021 8.572 -4.052 1.00 0.00 C ATOM 377 CG1 VAL A 267 3.282 10.071 -4.150 1.00 0.00 C ATOM 378 CG2 VAL A 267 1.530 8.312 -3.954 1.00 0.00 C ATOM 0 H VAL A 267 3.617 5.853 -4.497 1.00 0.00 H new ATOM 0 HA VAL A 267 3.258 8.285 -6.157 1.00 0.00 H new ATOM 0 HB VAL A 267 3.514 8.208 -3.150 1.00 0.00 H new ATOM 0 HG11 VAL A 267 2.842 10.574 -3.289 1.00 0.00 H new ATOM 0 HG12 VAL A 267 4.357 10.253 -4.167 1.00 0.00 H new ATOM 0 HG13 VAL A 267 2.834 10.459 -5.065 1.00 0.00 H new ATOM 0 HG21 VAL A 267 1.120 8.862 -3.107 1.00 0.00 H new ATOM 0 HG22 VAL A 267 1.042 8.642 -4.871 1.00 0.00 H new ATOM 0 HG23 VAL A 267 1.355 7.245 -3.813 1.00 0.00 H new ATOM 388 N SER A 268 5.723 9.001 -5.427 1.00 0.00 N ATOM 389 CA SER A 268 7.168 9.139 -5.389 1.00 0.00 C ATOM 390 C SER A 268 7.696 8.747 -4.008 1.00 0.00 C ATOM 391 O SER A 268 6.914 8.563 -3.069 1.00 0.00 O ATOM 392 CB SER A 268 7.578 10.569 -5.732 1.00 0.00 C ATOM 393 OG SER A 268 8.983 10.671 -5.898 1.00 0.00 O ATOM 0 H SER A 268 5.219 9.864 -5.632 1.00 0.00 H new ATOM 0 HA SER A 268 7.603 8.471 -6.133 1.00 0.00 H new ATOM 0 HB2 SER A 268 7.077 10.885 -6.647 1.00 0.00 H new ATOM 0 HB3 SER A 268 7.252 11.244 -4.941 1.00 0.00 H new ATOM 0 HG SER A 268 9.241 11.616 -5.927 1.00 0.00 H new ATOM 399 N THR A 269 9.020 8.621 -3.903 1.00 0.00 N ATOM 400 CA THR A 269 9.685 8.015 -2.745 1.00 0.00 C ATOM 401 C THR A 269 9.654 6.494 -2.876 1.00 0.00 C ATOM 402 O THR A 269 10.578 5.798 -2.450 1.00 0.00 O ATOM 403 CB THR A 269 9.045 8.423 -1.396 1.00 0.00 C ATOM 404 OG1 THR A 269 8.781 9.828 -1.377 1.00 0.00 O ATOM 405 CG2 THR A 269 9.950 8.065 -0.228 1.00 0.00 C ATOM 0 H THR A 269 9.667 8.939 -4.624 1.00 0.00 H new ATOM 0 HA THR A 269 10.711 8.384 -2.740 1.00 0.00 H new ATOM 0 HB THR A 269 8.109 7.874 -1.294 1.00 0.00 H new ATOM 0 HG1 THR A 269 9.141 10.217 -0.553 1.00 0.00 H new ATOM 0 HG21 THR A 269 9.474 8.364 0.706 1.00 0.00 H new ATOM 0 HG22 THR A 269 10.124 6.989 -0.219 1.00 0.00 H new ATOM 0 HG23 THR A 269 10.902 8.585 -0.333 1.00 0.00 H new ATOM 413 N GLY A 270 8.595 5.986 -3.496 1.00 0.00 N ATOM 414 CA GLY A 270 8.446 4.560 -3.662 1.00 0.00 C ATOM 415 C GLY A 270 7.465 3.984 -2.668 1.00 0.00 C ATOM 416 O GLY A 270 7.762 3.004 -1.988 1.00 0.00 O ATOM 0 H GLY A 270 7.835 6.543 -3.887 1.00 0.00 H new ATOM 0 HA2 GLY A 270 8.107 4.345 -4.675 1.00 0.00 H new ATOM 0 HA3 GLY A 270 9.415 4.076 -3.540 1.00 0.00 H new ATOM 420 N GLN A 271 6.306 4.612 -2.548 1.00 0.00 N ATOM 421 CA GLN A 271 5.271 4.104 -1.663 1.00 0.00 C ATOM 422 C GLN A 271 4.132 3.488 -2.457 1.00 0.00 C ATOM 423 O GLN A 271 3.837 3.915 -3.571 1.00 0.00 O ATOM 424 CB GLN A 271 4.737 5.213 -0.757 1.00 0.00 C ATOM 425 CG GLN A 271 3.891 6.251 -1.473 1.00 0.00 C ATOM 426 CD GLN A 271 3.223 7.212 -0.512 1.00 0.00 C ATOM 427 OE1 GLN A 271 2.041 7.688 -0.876 1.00 0.00 O flip ATOM 428 NE2 GLN A 271 3.755 7.510 0.555 1.00 0.00 N flip ATOM 0 H GLN A 271 6.060 5.467 -3.047 1.00 0.00 H new ATOM 0 HA GLN A 271 5.719 3.330 -1.040 1.00 0.00 H new ATOM 0 HB2 GLN A 271 4.143 4.762 0.038 1.00 0.00 H new ATOM 0 HB3 GLN A 271 5.579 5.714 -0.280 1.00 0.00 H new ATOM 0 HG2 GLN A 271 4.518 6.812 -2.166 1.00 0.00 H new ATOM 0 HG3 GLN A 271 3.129 5.748 -2.068 1.00 0.00 H new ATOM 0 HE21 GLN A 271 4.666 7.121 0.797 1.00 0.00 H new ATOM 0 HE22 GLN A 271 3.285 8.146 1.199 1.00 0.00 H new ATOM 437 N THR A 272 3.503 2.477 -1.882 1.00 0.00 N ATOM 438 CA THR A 272 2.384 1.809 -2.519 1.00 0.00 C ATOM 439 C THR A 272 1.362 1.384 -1.471 1.00 0.00 C ATOM 440 O THR A 272 1.556 0.381 -0.787 1.00 0.00 O ATOM 441 CB THR A 272 2.859 0.564 -3.290 1.00 0.00 C ATOM 442 OG1 THR A 272 4.191 0.763 -3.784 1.00 0.00 O ATOM 443 CG2 THR A 272 1.937 0.291 -4.452 1.00 0.00 C ATOM 0 H THR A 272 3.752 2.099 -0.968 1.00 0.00 H new ATOM 0 HA THR A 272 1.927 2.509 -3.218 1.00 0.00 H new ATOM 0 HB THR A 272 2.849 -0.287 -2.609 1.00 0.00 H new ATOM 0 HG1 THR A 272 4.482 -0.036 -4.271 1.00 0.00 H new ATOM 0 HG21 THR A 272 2.282 -0.592 -4.991 1.00 0.00 H new ATOM 0 HG22 THR A 272 0.926 0.118 -4.082 1.00 0.00 H new ATOM 0 HG23 THR A 272 1.935 1.149 -5.124 1.00 0.00 H new ATOM 451 N TYR A 273 0.285 2.150 -1.331 1.00 0.00 N ATOM 452 CA TYR A 273 -0.676 1.909 -0.264 1.00 0.00 C ATOM 453 C TYR A 273 -2.109 2.028 -0.767 1.00 0.00 C ATOM 454 O TYR A 273 -2.344 2.387 -1.923 1.00 0.00 O ATOM 455 CB TYR A 273 -0.440 2.893 0.879 1.00 0.00 C ATOM 456 CG TYR A 273 0.976 2.857 1.400 1.00 0.00 C ATOM 457 CD1 TYR A 273 1.511 1.688 1.919 1.00 0.00 C ATOM 458 CD2 TYR A 273 1.782 3.985 1.352 1.00 0.00 C ATOM 459 CE1 TYR A 273 2.811 1.645 2.383 1.00 0.00 C ATOM 460 CE2 TYR A 273 3.082 3.947 1.814 1.00 0.00 C ATOM 461 CZ TYR A 273 3.591 2.775 2.328 1.00 0.00 C ATOM 462 OH TYR A 273 4.877 2.743 2.805 1.00 0.00 O ATOM 0 H TYR A 273 0.058 2.937 -1.939 1.00 0.00 H new ATOM 0 HA TYR A 273 -0.531 0.890 0.096 1.00 0.00 H new ATOM 0 HB2 TYR A 273 -0.671 3.902 0.537 1.00 0.00 H new ATOM 0 HB3 TYR A 273 -1.128 2.668 1.694 1.00 0.00 H new ATOM 0 HD1 TYR A 273 0.902 0.797 1.961 1.00 0.00 H new ATOM 0 HD2 TYR A 273 1.387 4.905 0.948 1.00 0.00 H new ATOM 0 HE1 TYR A 273 3.213 0.728 2.787 1.00 0.00 H new ATOM 0 HE2 TYR A 273 3.698 4.833 1.773 1.00 0.00 H new ATOM 0 HH TYR A 273 5.243 1.840 2.699 1.00 0.00 H new ATOM 472 N GLU A 274 -3.059 1.720 0.113 1.00 0.00 N ATOM 473 CA GLU A 274 -4.478 1.803 -0.208 1.00 0.00 C ATOM 474 C GLU A 274 -4.870 3.243 -0.512 1.00 0.00 C ATOM 475 O GLU A 274 -4.671 4.136 0.311 1.00 0.00 O ATOM 476 CB GLU A 274 -5.303 1.235 0.956 1.00 0.00 C ATOM 477 CG GLU A 274 -6.810 1.394 0.814 1.00 0.00 C ATOM 478 CD GLU A 274 -7.332 1.001 -0.553 1.00 0.00 C ATOM 479 OE1 GLU A 274 -7.200 -0.183 -0.942 1.00 0.00 O ATOM 480 OE2 GLU A 274 -7.898 1.885 -1.239 1.00 0.00 O ATOM 0 H GLU A 274 -2.866 1.407 1.064 1.00 0.00 H new ATOM 0 HA GLU A 274 -4.683 1.210 -1.099 1.00 0.00 H new ATOM 0 HB2 GLU A 274 -5.073 0.175 1.061 1.00 0.00 H new ATOM 0 HB3 GLU A 274 -4.987 1.723 1.878 1.00 0.00 H new ATOM 0 HG2 GLU A 274 -7.305 0.786 1.572 1.00 0.00 H new ATOM 0 HG3 GLU A 274 -7.078 2.432 1.012 1.00 0.00 H new ATOM 487 N ARG A 275 -5.431 3.451 -1.697 1.00 0.00 N ATOM 488 CA ARG A 275 -5.742 4.785 -2.202 1.00 0.00 C ATOM 489 C ARG A 275 -6.665 5.546 -1.256 1.00 0.00 C ATOM 490 O ARG A 275 -6.467 6.735 -1.014 1.00 0.00 O ATOM 491 CB ARG A 275 -6.390 4.666 -3.587 1.00 0.00 C ATOM 492 CG ARG A 275 -6.552 5.987 -4.322 1.00 0.00 C ATOM 493 CD ARG A 275 -7.279 5.791 -5.645 1.00 0.00 C ATOM 494 NE ARG A 275 -7.298 7.010 -6.455 1.00 0.00 N ATOM 495 CZ ARG A 275 -8.407 7.668 -6.793 1.00 0.00 C ATOM 496 NH1 ARG A 275 -9.589 7.259 -6.348 1.00 0.00 N ATOM 497 NH2 ARG A 275 -8.334 8.732 -7.580 1.00 0.00 N ATOM 0 H ARG A 275 -5.684 2.698 -2.337 1.00 0.00 H new ATOM 0 HA ARG A 275 -4.811 5.348 -2.274 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -5.788 3.995 -4.200 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -7.371 4.203 -3.477 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -7.107 6.688 -3.699 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -5.572 6.429 -4.504 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -6.796 4.992 -6.207 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -8.303 5.471 -5.450 1.00 0.00 H new ATOM 0 HE ARG A 275 -6.405 7.380 -6.782 1.00 0.00 H new ATOM 0 HH11 ARG A 275 -9.651 6.439 -5.745 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -10.435 7.765 -6.609 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -7.429 9.048 -7.928 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -9.183 9.235 -7.838 1.00 0.00 H new ATOM 511 N SER A 276 -7.650 4.854 -0.701 1.00 0.00 N ATOM 512 CA SER A 276 -8.622 5.486 0.178 1.00 0.00 C ATOM 513 C SER A 276 -8.000 5.810 1.539 1.00 0.00 C ATOM 514 O SER A 276 -8.562 6.565 2.332 1.00 0.00 O ATOM 515 CB SER A 276 -9.851 4.584 0.338 1.00 0.00 C ATOM 516 OG SER A 276 -9.478 3.249 0.640 1.00 0.00 O ATOM 0 H SER A 276 -7.797 3.855 -0.844 1.00 0.00 H new ATOM 0 HA SER A 276 -8.938 6.427 -0.273 1.00 0.00 H new ATOM 0 HB2 SER A 276 -10.489 4.973 1.131 1.00 0.00 H new ATOM 0 HB3 SER A 276 -10.438 4.600 -0.580 1.00 0.00 H new ATOM 0 HG SER A 276 -9.059 2.841 -0.146 1.00 0.00 H new ATOM 522 N SER A 277 -6.834 5.236 1.793 1.00 0.00 N ATOM 523 CA SER A 277 -6.101 5.492 3.020 1.00 0.00 C ATOM 524 C SER A 277 -5.046 6.578 2.797 1.00 0.00 C ATOM 525 O SER A 277 -4.887 7.479 3.617 1.00 0.00 O ATOM 526 CB SER A 277 -5.456 4.197 3.524 1.00 0.00 C ATOM 527 OG SER A 277 -6.439 3.200 3.750 1.00 0.00 O ATOM 0 H SER A 277 -6.373 4.584 1.158 1.00 0.00 H new ATOM 0 HA SER A 277 -6.796 5.850 3.780 1.00 0.00 H new ATOM 0 HB2 SER A 277 -4.730 3.839 2.794 1.00 0.00 H new ATOM 0 HB3 SER A 277 -4.911 4.392 4.447 1.00 0.00 H new ATOM 0 HG SER A 277 -6.180 2.655 4.522 1.00 0.00 H new ATOM 533 N ILE A 278 -4.347 6.506 1.668 1.00 0.00 N ATOM 534 CA ILE A 278 -3.242 7.420 1.390 1.00 0.00 C ATOM 535 C ILE A 278 -3.717 8.757 0.826 1.00 0.00 C ATOM 536 O ILE A 278 -3.361 9.817 1.347 1.00 0.00 O ATOM 537 CB ILE A 278 -2.202 6.783 0.421 1.00 0.00 C ATOM 538 CG1 ILE A 278 -1.112 7.784 0.064 1.00 0.00 C ATOM 539 CG2 ILE A 278 -2.852 6.264 -0.856 1.00 0.00 C ATOM 540 CD1 ILE A 278 -0.382 8.322 1.261 1.00 0.00 C ATOM 0 H ILE A 278 -4.526 5.824 0.930 1.00 0.00 H new ATOM 0 HA ILE A 278 -2.763 7.611 2.350 1.00 0.00 H new ATOM 0 HB ILE A 278 -1.761 5.936 0.946 1.00 0.00 H new ATOM 0 HG12 ILE A 278 -0.396 7.307 -0.605 1.00 0.00 H new ATOM 0 HG13 ILE A 278 -1.557 8.614 -0.485 1.00 0.00 H new ATOM 0 HG21 ILE A 278 -2.089 5.829 -1.502 1.00 0.00 H new ATOM 0 HG22 ILE A 278 -3.592 5.504 -0.605 1.00 0.00 H new ATOM 0 HG23 ILE A 278 -3.341 7.088 -1.376 1.00 0.00 H new ATOM 0 HD11 ILE A 278 0.380 9.029 0.935 1.00 0.00 H new ATOM 0 HD12 ILE A 278 -1.087 8.828 1.920 1.00 0.00 H new ATOM 0 HD13 ILE A 278 0.092 7.500 1.798 1.00 0.00 H new ATOM 552 N GLN A 279 -4.543 8.711 -0.205 1.00 0.00 N ATOM 553 CA GLN A 279 -4.934 9.920 -0.910 1.00 0.00 C ATOM 554 C GLN A 279 -5.859 10.741 -0.051 1.00 0.00 C ATOM 555 O GLN A 279 -5.958 11.954 -0.201 1.00 0.00 O ATOM 556 CB GLN A 279 -5.598 9.580 -2.232 1.00 0.00 C ATOM 557 CG GLN A 279 -4.611 9.419 -3.366 1.00 0.00 C ATOM 558 CD GLN A 279 -3.892 10.715 -3.669 1.00 0.00 C ATOM 559 OE1 GLN A 279 -2.812 10.975 -3.147 1.00 0.00 O ATOM 560 NE2 GLN A 279 -4.500 11.546 -4.497 1.00 0.00 N ATOM 0 H GLN A 279 -4.955 7.853 -0.572 1.00 0.00 H new ATOM 0 HA GLN A 279 -4.039 10.504 -1.121 1.00 0.00 H new ATOM 0 HB2 GLN A 279 -6.167 8.657 -2.119 1.00 0.00 H new ATOM 0 HB3 GLN A 279 -6.310 10.365 -2.487 1.00 0.00 H new ATOM 0 HG2 GLN A 279 -3.883 8.650 -3.108 1.00 0.00 H new ATOM 0 HG3 GLN A 279 -5.134 9.076 -4.258 1.00 0.00 H new ATOM 0 HE21 GLN A 279 -5.397 11.290 -4.909 1.00 0.00 H new ATOM 0 HE22 GLN A 279 -4.072 12.444 -4.724 1.00 0.00 H new ATOM 569 N LYS A 280 -6.504 10.057 0.869 1.00 0.00 N ATOM 570 CA LYS A 280 -7.340 10.691 1.855 1.00 0.00 C ATOM 571 C LYS A 280 -6.580 11.823 2.547 1.00 0.00 C ATOM 572 O LYS A 280 -7.128 12.904 2.768 1.00 0.00 O ATOM 573 CB LYS A 280 -7.786 9.624 2.852 1.00 0.00 C ATOM 574 CG LYS A 280 -8.048 10.138 4.251 1.00 0.00 C ATOM 575 CD LYS A 280 -7.730 9.061 5.264 1.00 0.00 C ATOM 576 CE LYS A 280 -8.770 7.951 5.253 1.00 0.00 C ATOM 577 NZ LYS A 280 -8.490 6.917 6.284 1.00 0.00 N ATOM 0 H LYS A 280 -6.461 9.041 0.951 1.00 0.00 H new ATOM 0 HA LYS A 280 -8.217 11.136 1.385 1.00 0.00 H new ATOM 0 HB2 LYS A 280 -8.694 9.152 2.477 1.00 0.00 H new ATOM 0 HB3 LYS A 280 -7.021 8.849 2.901 1.00 0.00 H new ATOM 0 HG2 LYS A 280 -7.439 11.021 4.443 1.00 0.00 H new ATOM 0 HG3 LYS A 280 -9.090 10.443 4.346 1.00 0.00 H new ATOM 0 HD2 LYS A 280 -6.747 8.640 5.051 1.00 0.00 H new ATOM 0 HD3 LYS A 280 -7.679 9.502 6.260 1.00 0.00 H new ATOM 0 HE2 LYS A 280 -9.758 8.378 5.426 1.00 0.00 H new ATOM 0 HE3 LYS A 280 -8.792 7.485 4.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 -9.222 6.179 6.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 -7.558 6.491 6.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 -8.494 7.357 7.227 1.00 0.00 H new ATOM 591 N TRP A 281 -5.312 11.584 2.868 1.00 0.00 N ATOM 592 CA TRP A 281 -4.518 12.600 3.530 1.00 0.00 C ATOM 593 C TRP A 281 -3.608 13.347 2.542 1.00 0.00 C ATOM 594 O TRP A 281 -3.306 14.524 2.748 1.00 0.00 O ATOM 595 CB TRP A 281 -3.745 11.994 4.722 1.00 0.00 C ATOM 596 CG TRP A 281 -2.313 11.620 4.475 1.00 0.00 C ATOM 597 CD1 TRP A 281 -1.278 12.452 4.168 1.00 0.00 C ATOM 598 CD2 TRP A 281 -1.754 10.313 4.586 1.00 0.00 C ATOM 599 NE1 TRP A 281 -0.116 11.736 4.041 1.00 0.00 N ATOM 600 CE2 TRP A 281 -0.380 10.422 4.302 1.00 0.00 C ATOM 601 CE3 TRP A 281 -2.284 9.060 4.886 1.00 0.00 C ATOM 602 CZ2 TRP A 281 0.468 9.324 4.313 1.00 0.00 C ATOM 603 CZ3 TRP A 281 -1.441 7.972 4.899 1.00 0.00 C ATOM 604 CH2 TRP A 281 -0.079 8.110 4.615 1.00 0.00 C ATOM 0 H TRP A 281 -4.823 10.708 2.682 1.00 0.00 H new ATOM 0 HA TRP A 281 -5.193 13.353 3.936 1.00 0.00 H new ATOM 0 HB2 TRP A 281 -3.773 12.708 5.545 1.00 0.00 H new ATOM 0 HB3 TRP A 281 -4.277 11.103 5.055 1.00 0.00 H new ATOM 0 HD1 TRP A 281 -1.361 13.521 4.043 1.00 0.00 H new ATOM 0 HE1 TRP A 281 0.795 12.121 3.793 1.00 0.00 H new ATOM 0 HE3 TRP A 281 -3.335 8.945 5.104 1.00 0.00 H new ATOM 0 HZ2 TRP A 281 1.520 9.426 4.091 1.00 0.00 H new ATOM 0 HZ3 TRP A 281 -1.838 6.995 5.133 1.00 0.00 H new ATOM 0 HH2 TRP A 281 0.555 7.236 4.635 1.00 0.00 H new ATOM 615 N LEU A 282 -3.160 12.680 1.470 1.00 0.00 N ATOM 616 CA LEU A 282 -2.345 13.349 0.458 1.00 0.00 C ATOM 617 C LEU A 282 -3.124 14.456 -0.241 1.00 0.00 C ATOM 618 O LEU A 282 -2.569 15.518 -0.531 1.00 0.00 O ATOM 619 CB LEU A 282 -1.807 12.364 -0.576 1.00 0.00 C ATOM 620 CG LEU A 282 -0.629 11.508 -0.110 1.00 0.00 C ATOM 621 CD1 LEU A 282 -0.017 10.768 -1.290 1.00 0.00 C ATOM 622 CD2 LEU A 282 0.419 12.365 0.580 1.00 0.00 C ATOM 0 H LEU A 282 -3.346 11.694 1.286 1.00 0.00 H new ATOM 0 HA LEU A 282 -1.499 13.794 0.982 1.00 0.00 H new ATOM 0 HB2 LEU A 282 -2.618 11.702 -0.880 1.00 0.00 H new ATOM 0 HB3 LEU A 282 -1.502 12.922 -1.461 1.00 0.00 H new ATOM 0 HG LEU A 282 -0.998 10.776 0.609 1.00 0.00 H new ATOM 0 HD11 LEU A 282 0.821 10.162 -0.945 1.00 0.00 H new ATOM 0 HD12 LEU A 282 -0.769 10.122 -1.744 1.00 0.00 H new ATOM 0 HD13 LEU A 282 0.336 11.488 -2.028 1.00 0.00 H new ATOM 0 HD21 LEU A 282 1.248 11.736 0.903 1.00 0.00 H new ATOM 0 HD22 LEU A 282 0.786 13.120 -0.115 1.00 0.00 H new ATOM 0 HD23 LEU A 282 -0.025 12.855 1.447 1.00 0.00 H new ATOM 634 N ASP A 283 -4.407 14.210 -0.501 1.00 0.00 N ATOM 635 CA ASP A 283 -5.262 15.227 -1.116 1.00 0.00 C ATOM 636 C ASP A 283 -5.455 16.402 -0.165 1.00 0.00 C ATOM 637 O ASP A 283 -5.630 17.544 -0.599 1.00 0.00 O ATOM 638 CB ASP A 283 -6.637 14.671 -1.508 1.00 0.00 C ATOM 639 CG ASP A 283 -6.615 13.798 -2.752 1.00 0.00 C ATOM 640 OD1 ASP A 283 -5.986 14.194 -3.753 1.00 0.00 O ATOM 641 OD2 ASP A 283 -7.267 12.728 -2.743 1.00 0.00 O ATOM 0 H ASP A 283 -4.874 13.326 -0.299 1.00 0.00 H new ATOM 0 HA ASP A 283 -4.757 15.556 -2.024 1.00 0.00 H new ATOM 0 HB2 ASP A 283 -7.034 14.091 -0.675 1.00 0.00 H new ATOM 0 HB3 ASP A 283 -7.322 15.503 -1.672 1.00 0.00 H new ATOM 646 N ALA A 284 -5.424 16.112 1.135 1.00 0.00 N ATOM 647 CA ALA A 284 -5.560 17.141 2.160 1.00 0.00 C ATOM 648 C ALA A 284 -4.424 18.153 2.063 1.00 0.00 C ATOM 649 O ALA A 284 -4.651 19.361 2.096 1.00 0.00 O ATOM 650 CB ALA A 284 -5.598 16.511 3.544 1.00 0.00 C ATOM 0 H ALA A 284 -5.305 15.168 1.503 1.00 0.00 H new ATOM 0 HA ALA A 284 -6.500 17.668 1.994 1.00 0.00 H new ATOM 0 HB1 ALA A 284 -5.700 17.293 4.297 1.00 0.00 H new ATOM 0 HB2 ALA A 284 -6.447 15.830 3.611 1.00 0.00 H new ATOM 0 HB3 ALA A 284 -4.675 15.958 3.718 1.00 0.00 H new ATOM 656 N GLY A 285 -3.199 17.658 1.934 1.00 0.00 N ATOM 657 CA GLY A 285 -2.072 18.550 1.741 1.00 0.00 C ATOM 658 C GLY A 285 -0.837 18.156 2.530 1.00 0.00 C ATOM 659 O GLY A 285 -0.182 19.011 3.126 1.00 0.00 O ATOM 0 H GLY A 285 -2.967 16.665 1.959 1.00 0.00 H new ATOM 0 HA2 GLY A 285 -1.821 18.579 0.681 1.00 0.00 H new ATOM 0 HA3 GLY A 285 -2.367 19.560 2.026 1.00 0.00 H new ATOM 663 N HIS A 286 -0.508 16.873 2.531 1.00 0.00 N ATOM 664 CA HIS A 286 0.723 16.414 3.171 1.00 0.00 C ATOM 665 C HIS A 286 1.665 15.852 2.124 1.00 0.00 C ATOM 666 O HIS A 286 1.281 15.693 0.965 1.00 0.00 O ATOM 667 CB HIS A 286 0.447 15.368 4.252 1.00 0.00 C ATOM 668 CG HIS A 286 -0.478 15.838 5.337 1.00 0.00 C ATOM 669 ND1 HIS A 286 -0.064 16.528 6.455 1.00 0.00 N ATOM 670 CD2 HIS A 286 -1.822 15.694 5.464 1.00 0.00 C ATOM 671 CE1 HIS A 286 -1.141 16.773 7.211 1.00 0.00 C ATOM 672 NE2 HIS A 286 -2.234 16.287 6.653 1.00 0.00 N ATOM 0 H HIS A 286 -1.067 16.136 2.102 1.00 0.00 H new ATOM 0 HA HIS A 286 1.188 17.271 3.659 1.00 0.00 H new ATOM 0 HB2 HIS A 286 0.020 14.481 3.784 1.00 0.00 H new ATOM 0 HB3 HIS A 286 1.393 15.067 4.701 1.00 0.00 H new ATOM 0 HD2 HIS A 286 -2.468 15.198 4.755 1.00 0.00 H new ATOM 0 HE1 HIS A 286 -1.119 17.299 8.154 1.00 0.00 H new ATOM 0 HE2 HIS A 286 -3.185 16.336 7.018 1.00 0.00 H new ATOM 680 N LYS A 287 2.888 15.537 2.521 1.00 0.00 N ATOM 681 CA LYS A 287 3.913 15.183 1.553 1.00 0.00 C ATOM 682 C LYS A 287 4.939 14.222 2.147 1.00 0.00 C ATOM 683 O LYS A 287 6.135 14.446 2.012 1.00 0.00 O ATOM 684 CB LYS A 287 4.624 16.464 1.098 1.00 0.00 C ATOM 685 CG LYS A 287 5.050 16.447 -0.358 1.00 0.00 C ATOM 686 CD LYS A 287 3.853 16.616 -1.275 1.00 0.00 C ATOM 687 CE LYS A 287 3.287 18.026 -1.211 1.00 0.00 C ATOM 688 NZ LYS A 287 2.174 18.226 -2.177 1.00 0.00 N ATOM 0 H LYS A 287 3.192 15.519 3.494 1.00 0.00 H new ATOM 0 HA LYS A 287 3.435 14.684 0.710 1.00 0.00 H new ATOM 0 HB2 LYS A 287 3.961 17.314 1.263 1.00 0.00 H new ATOM 0 HB3 LYS A 287 5.504 16.621 1.722 1.00 0.00 H new ATOM 0 HG2 LYS A 287 5.768 17.246 -0.540 1.00 0.00 H new ATOM 0 HG3 LYS A 287 5.555 15.507 -0.582 1.00 0.00 H new ATOM 0 HD2 LYS A 287 4.145 16.388 -2.300 1.00 0.00 H new ATOM 0 HD3 LYS A 287 3.079 15.901 -0.998 1.00 0.00 H new ATOM 0 HE2 LYS A 287 2.930 18.228 -0.201 1.00 0.00 H new ATOM 0 HE3 LYS A 287 4.080 18.744 -1.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 287 1.818 19.200 -2.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 287 2.519 18.059 -3.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 287 1.405 17.559 -1.964 1.00 0.00 H new ATOM 702 N THR A 288 4.489 13.150 2.786 1.00 0.00 N ATOM 703 CA THR A 288 5.410 12.218 3.435 1.00 0.00 C ATOM 704 C THR A 288 4.901 10.767 3.373 1.00 0.00 C ATOM 705 O THR A 288 3.694 10.532 3.272 1.00 0.00 O ATOM 706 CB THR A 288 5.620 12.613 4.907 1.00 0.00 C ATOM 707 OG1 THR A 288 4.359 12.956 5.500 1.00 0.00 O ATOM 708 CG2 THR A 288 6.587 13.783 5.044 1.00 0.00 C ATOM 0 H THR A 288 3.503 12.903 2.870 1.00 0.00 H new ATOM 0 HA THR A 288 6.354 12.274 2.893 1.00 0.00 H new ATOM 0 HB THR A 288 6.054 11.758 5.424 1.00 0.00 H new ATOM 0 HG1 THR A 288 3.651 12.405 5.105 1.00 0.00 H new ATOM 0 HG21 THR A 288 6.709 14.032 6.098 1.00 0.00 H new ATOM 0 HG22 THR A 288 7.553 13.508 4.622 1.00 0.00 H new ATOM 0 HG23 THR A 288 6.191 14.647 4.510 1.00 0.00 H new ATOM 716 N CYS A 289 5.829 9.807 3.426 1.00 0.00 N ATOM 717 CA CYS A 289 5.490 8.387 3.457 1.00 0.00 C ATOM 718 C CYS A 289 5.103 7.954 4.866 1.00 0.00 C ATOM 719 O CYS A 289 5.822 8.236 5.817 1.00 0.00 O ATOM 720 CB CYS A 289 6.683 7.554 2.979 1.00 0.00 C ATOM 721 SG CYS A 289 6.707 7.230 1.203 1.00 0.00 S ATOM 0 H CYS A 289 6.831 9.994 3.448 1.00 0.00 H new ATOM 0 HA CYS A 289 4.640 8.225 2.794 1.00 0.00 H new ATOM 0 HB2 CYS A 289 7.603 8.070 3.254 1.00 0.00 H new ATOM 0 HB3 CYS A 289 6.681 6.602 3.509 1.00 0.00 H new ATOM 0 HG CYS A 289 7.851 6.710 0.872 1.00 0.00 H new ATOM 727 N PRO A 290 3.982 7.232 5.011 1.00 0.00 N ATOM 728 CA PRO A 290 3.479 6.792 6.322 1.00 0.00 C ATOM 729 C PRO A 290 4.446 5.861 7.053 1.00 0.00 C ATOM 730 O PRO A 290 4.448 5.802 8.281 1.00 0.00 O ATOM 731 CB PRO A 290 2.188 6.039 5.985 1.00 0.00 C ATOM 732 CG PRO A 290 2.308 5.687 4.544 1.00 0.00 C ATOM 733 CD PRO A 290 3.108 6.791 3.914 1.00 0.00 C ATOM 0 HA PRO A 290 3.339 7.641 6.992 1.00 0.00 H new ATOM 0 HB2 PRO A 290 2.080 5.146 6.601 1.00 0.00 H new ATOM 0 HB3 PRO A 290 1.311 6.660 6.167 1.00 0.00 H new ATOM 0 HG2 PRO A 290 2.804 4.725 4.417 1.00 0.00 H new ATOM 0 HG3 PRO A 290 1.325 5.603 4.080 1.00 0.00 H new ATOM 0 HD2 PRO A 290 3.682 6.436 3.058 1.00 0.00 H new ATOM 0 HD3 PRO A 290 2.470 7.599 3.557 1.00 0.00 H new ATOM 741 N LYS A 291 5.266 5.141 6.290 1.00 0.00 N ATOM 742 CA LYS A 291 6.169 4.150 6.861 1.00 0.00 C ATOM 743 C LYS A 291 7.194 4.780 7.804 1.00 0.00 C ATOM 744 O LYS A 291 7.155 4.550 9.012 1.00 0.00 O ATOM 745 CB LYS A 291 6.868 3.351 5.759 1.00 0.00 C ATOM 746 CG LYS A 291 7.430 4.196 4.637 1.00 0.00 C ATOM 747 CD LYS A 291 8.001 3.319 3.547 1.00 0.00 C ATOM 748 CE LYS A 291 7.598 3.827 2.180 1.00 0.00 C ATOM 749 NZ LYS A 291 8.008 2.880 1.101 1.00 0.00 N ATOM 0 H LYS A 291 5.322 5.227 5.275 1.00 0.00 H new ATOM 0 HA LYS A 291 5.561 3.467 7.454 1.00 0.00 H new ATOM 0 HB2 LYS A 291 7.678 2.773 6.204 1.00 0.00 H new ATOM 0 HB3 LYS A 291 6.160 2.636 5.340 1.00 0.00 H new ATOM 0 HG2 LYS A 291 6.646 4.833 4.226 1.00 0.00 H new ATOM 0 HG3 LYS A 291 8.206 4.856 5.025 1.00 0.00 H new ATOM 0 HD2 LYS A 291 9.088 3.296 3.625 1.00 0.00 H new ATOM 0 HD3 LYS A 291 7.650 2.295 3.677 1.00 0.00 H new ATOM 0 HE2 LYS A 291 6.518 3.971 2.148 1.00 0.00 H new ATOM 0 HE3 LYS A 291 8.055 4.801 2.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 291 7.747 3.275 0.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 291 9.037 2.736 1.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 291 7.526 1.969 1.237 1.00 0.00 H new ATOM 763 N SER A 292 8.092 5.587 7.259 1.00 0.00 N ATOM 764 CA SER A 292 9.165 6.169 8.049 1.00 0.00 C ATOM 765 C SER A 292 9.174 7.691 7.939 1.00 0.00 C ATOM 766 O SER A 292 10.067 8.346 8.474 1.00 0.00 O ATOM 767 CB SER A 292 10.508 5.600 7.592 1.00 0.00 C ATOM 768 OG SER A 292 10.529 4.185 7.709 1.00 0.00 O ATOM 0 H SER A 292 8.099 5.853 6.274 1.00 0.00 H new ATOM 0 HA SER A 292 8.997 5.912 9.095 1.00 0.00 H new ATOM 0 HB2 SER A 292 10.694 5.885 6.557 1.00 0.00 H new ATOM 0 HB3 SER A 292 11.311 6.030 8.190 1.00 0.00 H new ATOM 0 HG SER A 292 11.398 3.845 7.409 1.00 0.00 H new ATOM 774 N GLN A 293 8.176 8.240 7.249 1.00 0.00 N ATOM 775 CA GLN A 293 8.055 9.679 7.058 1.00 0.00 C ATOM 776 C GLN A 293 9.176 10.223 6.205 1.00 0.00 C ATOM 777 O GLN A 293 10.188 10.724 6.690 1.00 0.00 O ATOM 778 CB GLN A 293 7.952 10.422 8.383 1.00 0.00 C ATOM 779 CG GLN A 293 6.535 10.457 8.911 1.00 0.00 C ATOM 780 CD GLN A 293 5.606 11.219 7.996 1.00 0.00 C ATOM 781 OE1 GLN A 293 4.940 10.640 7.140 1.00 0.00 O ATOM 782 NE2 GLN A 293 5.587 12.529 8.140 1.00 0.00 N ATOM 0 H GLN A 293 7.432 7.699 6.809 1.00 0.00 H new ATOM 0 HA GLN A 293 7.122 9.851 6.521 1.00 0.00 H new ATOM 0 HB2 GLN A 293 8.600 9.943 9.117 1.00 0.00 H new ATOM 0 HB3 GLN A 293 8.315 11.442 8.255 1.00 0.00 H new ATOM 0 HG2 GLN A 293 6.168 9.438 9.032 1.00 0.00 H new ATOM 0 HG3 GLN A 293 6.528 10.917 9.899 1.00 0.00 H new ATOM 0 HE21 GLN A 293 6.155 12.971 8.863 1.00 0.00 H new ATOM 0 HE22 GLN A 293 5.005 13.101 7.528 1.00 0.00 H new ATOM 791 N GLU A 294 8.963 10.101 4.918 1.00 0.00 N ATOM 792 CA GLU A 294 9.885 10.590 3.917 1.00 0.00 C ATOM 793 C GLU A 294 9.130 11.512 2.985 1.00 0.00 C ATOM 794 O GLU A 294 8.120 11.110 2.410 1.00 0.00 O ATOM 795 CB GLU A 294 10.498 9.425 3.134 1.00 0.00 C ATOM 796 CG GLU A 294 11.468 8.577 3.942 1.00 0.00 C ATOM 797 CD GLU A 294 12.723 9.338 4.319 1.00 0.00 C ATOM 798 OE1 GLU A 294 13.560 9.583 3.428 1.00 0.00 O ATOM 799 OE2 GLU A 294 12.879 9.694 5.505 1.00 0.00 O ATOM 0 H GLU A 294 8.133 9.653 4.529 1.00 0.00 H new ATOM 0 HA GLU A 294 10.700 11.131 4.398 1.00 0.00 H new ATOM 0 HB2 GLU A 294 9.695 8.787 2.764 1.00 0.00 H new ATOM 0 HB3 GLU A 294 11.018 9.821 2.262 1.00 0.00 H new ATOM 0 HG2 GLU A 294 10.973 8.226 4.848 1.00 0.00 H new ATOM 0 HG3 GLU A 294 11.741 7.693 3.366 1.00 0.00 H new ATOM 806 N THR A 295 9.582 12.750 2.883 1.00 0.00 N ATOM 807 CA THR A 295 8.922 13.735 2.044 1.00 0.00 C ATOM 808 C THR A 295 8.805 13.242 0.604 1.00 0.00 C ATOM 809 O THR A 295 9.810 13.029 -0.076 1.00 0.00 O ATOM 810 CB THR A 295 9.668 15.076 2.074 1.00 0.00 C ATOM 811 OG1 THR A 295 9.791 15.532 3.431 1.00 0.00 O ATOM 812 CG2 THR A 295 8.943 16.127 1.244 1.00 0.00 C ATOM 0 H THR A 295 10.406 13.098 3.373 1.00 0.00 H new ATOM 0 HA THR A 295 7.920 13.883 2.446 1.00 0.00 H new ATOM 0 HB THR A 295 10.658 14.925 1.645 1.00 0.00 H new ATOM 0 HG1 THR A 295 10.269 16.387 3.447 1.00 0.00 H new ATOM 0 HG21 THR A 295 9.495 17.066 1.284 1.00 0.00 H new ATOM 0 HG22 THR A 295 8.875 15.790 0.210 1.00 0.00 H new ATOM 0 HG23 THR A 295 7.940 16.278 1.644 1.00 0.00 H new ATOM 820 N LEU A 296 7.567 13.043 0.163 1.00 0.00 N ATOM 821 CA LEU A 296 7.295 12.550 -1.173 1.00 0.00 C ATOM 822 C LEU A 296 7.718 13.593 -2.206 1.00 0.00 C ATOM 823 O LEU A 296 7.001 14.567 -2.435 1.00 0.00 O ATOM 824 CB LEU A 296 5.802 12.233 -1.336 1.00 0.00 C ATOM 825 CG LEU A 296 5.158 11.486 -0.164 1.00 0.00 C ATOM 826 CD1 LEU A 296 3.670 11.279 -0.409 1.00 0.00 C ATOM 827 CD2 LEU A 296 5.848 10.153 0.069 1.00 0.00 C ATOM 0 H LEU A 296 6.732 13.219 0.722 1.00 0.00 H new ATOM 0 HA LEU A 296 7.865 11.634 -1.329 1.00 0.00 H new ATOM 0 HB2 LEU A 296 5.264 13.168 -1.489 1.00 0.00 H new ATOM 0 HB3 LEU A 296 5.671 11.639 -2.240 1.00 0.00 H new ATOM 0 HG LEU A 296 5.277 12.096 0.732 1.00 0.00 H new ATOM 0 HD11 LEU A 296 3.233 10.747 0.436 1.00 0.00 H new ATOM 0 HD12 LEU A 296 3.181 12.247 -0.520 1.00 0.00 H new ATOM 0 HD13 LEU A 296 3.529 10.695 -1.318 1.00 0.00 H new ATOM 0 HD21 LEU A 296 5.374 9.640 0.906 1.00 0.00 H new ATOM 0 HD22 LEU A 296 5.765 9.539 -0.828 1.00 0.00 H new ATOM 0 HD23 LEU A 296 6.900 10.323 0.296 1.00 0.00 H new ATOM 839 N LEU A 297 8.895 13.403 -2.796 1.00 0.00 N ATOM 840 CA LEU A 297 9.430 14.347 -3.773 1.00 0.00 C ATOM 841 C LEU A 297 8.527 14.390 -5.005 1.00 0.00 C ATOM 842 O LEU A 297 8.570 13.489 -5.841 1.00 0.00 O ATOM 843 CB LEU A 297 10.865 13.945 -4.149 1.00 0.00 C ATOM 844 CG LEU A 297 11.771 15.061 -4.686 1.00 0.00 C ATOM 845 CD1 LEU A 297 11.427 15.405 -6.125 1.00 0.00 C ATOM 846 CD2 LEU A 297 11.674 16.298 -3.804 1.00 0.00 C ATOM 0 H LEU A 297 9.498 12.601 -2.614 1.00 0.00 H new ATOM 0 HA LEU A 297 9.457 15.347 -3.339 1.00 0.00 H new ATOM 0 HB2 LEU A 297 11.340 13.514 -3.268 1.00 0.00 H new ATOM 0 HB3 LEU A 297 10.813 13.157 -4.900 1.00 0.00 H new ATOM 0 HG LEU A 297 12.798 14.697 -4.665 1.00 0.00 H new ATOM 0 HD11 LEU A 297 12.086 16.199 -6.477 1.00 0.00 H new ATOM 0 HD12 LEU A 297 11.556 14.522 -6.751 1.00 0.00 H new ATOM 0 HD13 LEU A 297 10.392 15.741 -6.181 1.00 0.00 H new ATOM 0 HD21 LEU A 297 12.323 17.079 -4.200 1.00 0.00 H new ATOM 0 HD22 LEU A 297 10.644 16.655 -3.790 1.00 0.00 H new ATOM 0 HD23 LEU A 297 11.985 16.047 -2.790 1.00 0.00 H new ATOM 858 N HIS A 298 7.719 15.450 -5.097 1.00 0.00 N ATOM 859 CA HIS A 298 6.677 15.574 -6.123 1.00 0.00 C ATOM 860 C HIS A 298 5.544 14.593 -5.843 1.00 0.00 C ATOM 861 O HIS A 298 5.637 13.410 -6.175 1.00 0.00 O ATOM 862 CB HIS A 298 7.222 15.345 -7.546 1.00 0.00 C ATOM 863 CG HIS A 298 8.043 16.474 -8.094 1.00 0.00 C ATOM 864 ND1 HIS A 298 8.990 17.246 -7.502 1.00 0.00 N flip ATOM 865 CD2 HIS A 298 7.966 16.909 -9.399 1.00 0.00 C flip ATOM 866 CE1 HIS A 298 9.494 18.148 -8.436 1.00 0.00 C flip ATOM 867 NE2 HIS A 298 8.845 17.904 -9.557 1.00 0.00 N flip ATOM 0 H HIS A 298 7.768 16.247 -4.463 1.00 0.00 H new ATOM 0 HA HIS A 298 6.303 16.597 -6.075 1.00 0.00 H new ATOM 0 HB2 HIS A 298 7.829 14.440 -7.546 1.00 0.00 H new ATOM 0 HB3 HIS A 298 6.382 15.166 -8.217 1.00 0.00 H new ATOM 0 HD2 HIS A 298 7.310 16.515 -10.161 1.00 0.00 H new ATOM 0 HE1 HIS A 298 10.259 18.893 -8.275 1.00 0.00 H new ATOM 0 HE2 HIS A 298 8.994 18.408 -10.431 1.00 0.00 H new ATOM 875 N ALA A 299 4.476 15.075 -5.216 1.00 0.00 N ATOM 876 CA ALA A 299 3.336 14.219 -4.922 1.00 0.00 C ATOM 877 C ALA A 299 2.483 14.031 -6.167 1.00 0.00 C ATOM 878 O ALA A 299 1.618 14.850 -6.478 1.00 0.00 O ATOM 879 CB ALA A 299 2.497 14.780 -3.779 1.00 0.00 C ATOM 0 H ALA A 299 4.377 16.042 -4.906 1.00 0.00 H new ATOM 0 HA ALA A 299 3.718 13.248 -4.606 1.00 0.00 H new ATOM 0 HB1 ALA A 299 1.654 14.116 -3.586 1.00 0.00 H new ATOM 0 HB2 ALA A 299 3.111 14.858 -2.881 1.00 0.00 H new ATOM 0 HB3 ALA A 299 2.125 15.768 -4.051 1.00 0.00 H new ATOM 885 N GLY A 300 2.771 12.968 -6.895 1.00 0.00 N ATOM 886 CA GLY A 300 1.979 12.609 -8.047 1.00 0.00 C ATOM 887 C GLY A 300 1.535 11.171 -7.951 1.00 0.00 C ATOM 888 O GLY A 300 2.353 10.282 -7.710 1.00 0.00 O ATOM 0 H GLY A 300 3.551 12.339 -6.705 1.00 0.00 H new ATOM 0 HA2 GLY A 300 1.109 13.261 -8.116 1.00 0.00 H new ATOM 0 HA3 GLY A 300 2.561 12.757 -8.957 1.00 0.00 H new ATOM 892 N LEU A 301 0.248 10.933 -8.117 1.00 0.00 N ATOM 893 CA LEU A 301 -0.289 9.597 -7.936 1.00 0.00 C ATOM 894 C LEU A 301 -0.087 8.775 -9.206 1.00 0.00 C ATOM 895 O LEU A 301 -0.575 9.130 -10.281 1.00 0.00 O ATOM 896 CB LEU A 301 -1.775 9.667 -7.573 1.00 0.00 C ATOM 897 CG LEU A 301 -2.287 8.549 -6.659 1.00 0.00 C ATOM 898 CD1 LEU A 301 -1.719 8.709 -5.261 1.00 0.00 C ATOM 899 CD2 LEU A 301 -3.805 8.551 -6.617 1.00 0.00 C ATOM 0 H LEU A 301 -0.440 11.640 -8.375 1.00 0.00 H new ATOM 0 HA LEU A 301 0.243 9.111 -7.118 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -1.968 10.624 -7.089 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -2.357 9.653 -8.495 1.00 0.00 H new ATOM 0 HG LEU A 301 -1.954 7.593 -7.062 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -2.092 7.908 -4.623 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -0.631 8.663 -5.303 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -2.026 9.671 -4.851 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -4.152 7.751 -5.963 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -4.157 9.509 -6.236 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -4.197 8.394 -7.622 1.00 0.00 H new ATOM 911 N THR A 302 0.653 7.693 -9.073 1.00 0.00 N ATOM 912 CA THR A 302 0.965 6.816 -10.184 1.00 0.00 C ATOM 913 C THR A 302 0.368 5.430 -9.946 1.00 0.00 C ATOM 914 O THR A 302 0.788 4.719 -9.038 1.00 0.00 O ATOM 915 CB THR A 302 2.492 6.705 -10.350 1.00 0.00 C ATOM 916 OG1 THR A 302 3.046 8.001 -10.623 1.00 0.00 O ATOM 917 CG2 THR A 302 2.872 5.734 -11.458 1.00 0.00 C ATOM 0 H THR A 302 1.058 7.395 -8.185 1.00 0.00 H new ATOM 0 HA THR A 302 0.534 7.234 -11.094 1.00 0.00 H new ATOM 0 HB THR A 302 2.902 6.318 -9.417 1.00 0.00 H new ATOM 0 HG1 THR A 302 4.018 7.926 -10.726 1.00 0.00 H new ATOM 0 HG21 THR A 302 3.958 5.685 -11.542 1.00 0.00 H new ATOM 0 HG22 THR A 302 2.481 4.744 -11.224 1.00 0.00 H new ATOM 0 HG23 THR A 302 2.450 6.077 -12.403 1.00 0.00 H new ATOM 925 N PRO A 303 -0.639 5.040 -10.734 1.00 0.00 N ATOM 926 CA PRO A 303 -1.275 3.731 -10.592 1.00 0.00 C ATOM 927 C PRO A 303 -0.307 2.590 -10.891 1.00 0.00 C ATOM 928 O PRO A 303 0.238 2.493 -11.990 1.00 0.00 O ATOM 929 CB PRO A 303 -2.419 3.757 -11.617 1.00 0.00 C ATOM 930 CG PRO A 303 -2.595 5.195 -11.976 1.00 0.00 C ATOM 931 CD PRO A 303 -1.245 5.834 -11.810 1.00 0.00 C ATOM 0 HA PRO A 303 -1.620 3.557 -9.573 1.00 0.00 H new ATOM 0 HB2 PRO A 303 -2.174 3.160 -12.495 1.00 0.00 H new ATOM 0 HB3 PRO A 303 -3.334 3.342 -11.195 1.00 0.00 H new ATOM 0 HG2 PRO A 303 -2.953 5.300 -13.000 1.00 0.00 H new ATOM 0 HG3 PRO A 303 -3.333 5.670 -11.330 1.00 0.00 H new ATOM 0 HD2 PRO A 303 -0.659 5.785 -12.728 1.00 0.00 H new ATOM 0 HD3 PRO A 303 -1.326 6.887 -11.539 1.00 0.00 H new ATOM 939 N ASN A 304 -0.096 1.736 -9.902 1.00 0.00 N ATOM 940 CA ASN A 304 0.864 0.650 -10.020 1.00 0.00 C ATOM 941 C ASN A 304 0.143 -0.689 -10.156 1.00 0.00 C ATOM 942 O ASN A 304 -0.847 -0.950 -9.470 1.00 0.00 O ATOM 943 CB ASN A 304 1.778 0.627 -8.802 1.00 0.00 C ATOM 944 CG ASN A 304 1.049 0.194 -7.554 1.00 0.00 C ATOM 945 OD1 ASN A 304 1.206 -1.067 -7.189 1.00 0.00 O flip ATOM 946 ND2 ASN A 304 0.372 0.989 -6.909 1.00 0.00 N flip ATOM 0 H ASN A 304 -0.579 1.775 -9.005 1.00 0.00 H new ATOM 0 HA ASN A 304 1.465 0.814 -10.914 1.00 0.00 H new ATOM 0 HB2 ASN A 304 2.612 -0.050 -8.988 1.00 0.00 H new ATOM 0 HB3 ASN A 304 2.201 1.620 -8.648 1.00 0.00 H new ATOM 0 HD21 ASN A 304 0.277 1.954 -7.227 1.00 0.00 H new ATOM 0 HD22 ASN A 304 -0.096 0.685 -6.055 1.00 0.00 H new ATOM 953 N TYR A 305 0.623 -1.532 -11.051 1.00 0.00 N ATOM 954 CA TYR A 305 0.017 -2.839 -11.262 1.00 0.00 C ATOM 955 C TYR A 305 0.652 -3.905 -10.373 1.00 0.00 C ATOM 956 O TYR A 305 0.007 -4.894 -10.023 1.00 0.00 O ATOM 957 CB TYR A 305 0.109 -3.239 -12.734 1.00 0.00 C ATOM 958 CG TYR A 305 -0.797 -2.419 -13.628 1.00 0.00 C ATOM 959 CD1 TYR A 305 -0.405 -1.171 -14.095 1.00 0.00 C ATOM 960 CD2 TYR A 305 -2.049 -2.894 -13.996 1.00 0.00 C ATOM 961 CE1 TYR A 305 -1.237 -0.416 -14.901 1.00 0.00 C ATOM 962 CE2 TYR A 305 -2.885 -2.147 -14.803 1.00 0.00 C ATOM 963 CZ TYR A 305 -2.477 -0.911 -15.251 1.00 0.00 C ATOM 964 OH TYR A 305 -3.313 -0.163 -16.052 1.00 0.00 O ATOM 0 H TYR A 305 1.430 -1.338 -11.644 1.00 0.00 H new ATOM 0 HA TYR A 305 -1.034 -2.765 -10.984 1.00 0.00 H new ATOM 0 HB2 TYR A 305 1.140 -3.128 -13.071 1.00 0.00 H new ATOM 0 HB3 TYR A 305 -0.148 -4.293 -12.835 1.00 0.00 H new ATOM 0 HD1 TYR A 305 0.566 -0.784 -13.824 1.00 0.00 H new ATOM 0 HD2 TYR A 305 -2.374 -3.863 -13.646 1.00 0.00 H new ATOM 0 HE1 TYR A 305 -0.919 0.554 -15.254 1.00 0.00 H new ATOM 0 HE2 TYR A 305 -3.855 -2.531 -15.081 1.00 0.00 H new ATOM 0 HH TYR A 305 -4.146 -0.655 -16.205 1.00 0.00 H new ATOM 974 N VAL A 306 1.914 -3.681 -9.999 1.00 0.00 N ATOM 975 CA VAL A 306 2.694 -4.662 -9.238 1.00 0.00 C ATOM 976 C VAL A 306 1.957 -5.179 -7.999 1.00 0.00 C ATOM 977 O VAL A 306 1.893 -6.384 -7.767 1.00 0.00 O ATOM 978 CB VAL A 306 4.077 -4.093 -8.805 1.00 0.00 C ATOM 979 CG1 VAL A 306 3.932 -2.806 -8.000 1.00 0.00 C ATOM 980 CG2 VAL A 306 4.858 -5.126 -8.001 1.00 0.00 C ATOM 0 H VAL A 306 2.421 -2.822 -10.213 1.00 0.00 H new ATOM 0 HA VAL A 306 2.844 -5.499 -9.920 1.00 0.00 H new ATOM 0 HB VAL A 306 4.629 -3.860 -9.716 1.00 0.00 H new ATOM 0 HG11 VAL A 306 4.919 -2.441 -7.717 1.00 0.00 H new ATOM 0 HG12 VAL A 306 3.427 -2.053 -8.605 1.00 0.00 H new ATOM 0 HG13 VAL A 306 3.346 -3.003 -7.102 1.00 0.00 H new ATOM 0 HG21 VAL A 306 5.821 -4.707 -7.709 1.00 0.00 H new ATOM 0 HG22 VAL A 306 4.293 -5.395 -7.108 1.00 0.00 H new ATOM 0 HG23 VAL A 306 5.019 -6.015 -8.610 1.00 0.00 H new ATOM 990 N LEU A 307 1.372 -4.277 -7.231 1.00 0.00 N ATOM 991 CA LEU A 307 0.885 -4.631 -5.912 1.00 0.00 C ATOM 992 C LEU A 307 -0.538 -5.173 -5.956 1.00 0.00 C ATOM 993 O LEU A 307 -0.891 -6.016 -5.146 1.00 0.00 O ATOM 994 CB LEU A 307 0.954 -3.427 -4.978 1.00 0.00 C ATOM 995 CG LEU A 307 1.392 -3.754 -3.557 1.00 0.00 C ATOM 996 CD1 LEU A 307 2.863 -4.124 -3.539 1.00 0.00 C ATOM 997 CD2 LEU A 307 1.121 -2.586 -2.630 1.00 0.00 C ATOM 0 H LEU A 307 1.224 -3.303 -7.495 1.00 0.00 H new ATOM 0 HA LEU A 307 1.531 -5.422 -5.531 1.00 0.00 H new ATOM 0 HB2 LEU A 307 1.645 -2.696 -5.398 1.00 0.00 H new ATOM 0 HB3 LEU A 307 -0.027 -2.954 -4.942 1.00 0.00 H new ATOM 0 HG LEU A 307 0.814 -4.606 -3.201 1.00 0.00 H new ATOM 0 HD11 LEU A 307 3.167 -4.356 -2.518 1.00 0.00 H new ATOM 0 HD12 LEU A 307 3.027 -4.995 -4.174 1.00 0.00 H new ATOM 0 HD13 LEU A 307 3.453 -3.287 -3.912 1.00 0.00 H new ATOM 0 HD21 LEU A 307 1.441 -2.841 -1.620 1.00 0.00 H new ATOM 0 HD22 LEU A 307 1.672 -1.712 -2.976 1.00 0.00 H new ATOM 0 HD23 LEU A 307 0.054 -2.364 -2.627 1.00 0.00 H new ATOM 1009 N LYS A 308 -1.338 -4.708 -6.912 1.00 0.00 N ATOM 1010 CA LYS A 308 -2.745 -5.090 -6.996 1.00 0.00 C ATOM 1011 C LYS A 308 -2.877 -6.602 -7.102 1.00 0.00 C ATOM 1012 O LYS A 308 -3.638 -7.213 -6.367 1.00 0.00 O ATOM 1013 CB LYS A 308 -3.399 -4.426 -8.210 1.00 0.00 C ATOM 1014 CG LYS A 308 -4.912 -4.562 -8.232 1.00 0.00 C ATOM 1015 CD LYS A 308 -5.524 -3.862 -9.436 1.00 0.00 C ATOM 1016 CE LYS A 308 -5.065 -2.413 -9.541 1.00 0.00 C ATOM 1017 NZ LYS A 308 -6.007 -1.581 -10.335 1.00 0.00 N ATOM 0 H LYS A 308 -1.034 -4.064 -7.642 1.00 0.00 H new ATOM 0 HA LYS A 308 -3.250 -4.754 -6.090 1.00 0.00 H new ATOM 0 HB2 LYS A 308 -3.137 -3.368 -8.221 1.00 0.00 H new ATOM 0 HB3 LYS A 308 -2.989 -4.865 -9.119 1.00 0.00 H new ATOM 0 HG2 LYS A 308 -5.182 -5.618 -8.249 1.00 0.00 H new ATOM 0 HG3 LYS A 308 -5.328 -4.142 -7.317 1.00 0.00 H new ATOM 0 HD2 LYS A 308 -5.250 -4.397 -10.345 1.00 0.00 H new ATOM 0 HD3 LYS A 308 -6.611 -3.895 -9.362 1.00 0.00 H new ATOM 0 HE2 LYS A 308 -4.966 -1.992 -8.541 1.00 0.00 H new ATOM 0 HE3 LYS A 308 -4.077 -2.379 -10.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 308 -5.551 -0.679 -10.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 308 -6.267 -2.087 -11.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 308 -6.863 -1.394 -9.774 1.00 0.00 H new ATOM 1031 N SER A 309 -2.103 -7.195 -8.000 1.00 0.00 N ATOM 1032 CA SER A 309 -2.132 -8.637 -8.209 1.00 0.00 C ATOM 1033 C SER A 309 -1.703 -9.391 -6.946 1.00 0.00 C ATOM 1034 O SER A 309 -2.177 -10.494 -6.676 1.00 0.00 O ATOM 1035 CB SER A 309 -1.215 -9.003 -9.375 1.00 0.00 C ATOM 1036 OG SER A 309 -1.510 -8.214 -10.518 1.00 0.00 O ATOM 0 H SER A 309 -1.444 -6.697 -8.599 1.00 0.00 H new ATOM 0 HA SER A 309 -3.156 -8.930 -8.442 1.00 0.00 H new ATOM 0 HB2 SER A 309 -0.175 -8.856 -9.085 1.00 0.00 H new ATOM 0 HB3 SER A 309 -1.332 -10.059 -9.617 1.00 0.00 H new ATOM 0 HG SER A 309 -0.910 -8.464 -11.252 1.00 0.00 H new ATOM 1042 N LEU A 310 -0.817 -8.780 -6.169 1.00 0.00 N ATOM 1043 CA LEU A 310 -0.279 -9.414 -4.970 1.00 0.00 C ATOM 1044 C LEU A 310 -1.226 -9.236 -3.787 1.00 0.00 C ATOM 1045 O LEU A 310 -1.593 -10.203 -3.121 1.00 0.00 O ATOM 1046 CB LEU A 310 1.097 -8.828 -4.639 1.00 0.00 C ATOM 1047 CG LEU A 310 2.151 -8.979 -5.738 1.00 0.00 C ATOM 1048 CD1 LEU A 310 3.445 -8.290 -5.334 1.00 0.00 C ATOM 1049 CD2 LEU A 310 2.400 -10.448 -6.036 1.00 0.00 C ATOM 0 H LEU A 310 -0.455 -7.844 -6.348 1.00 0.00 H new ATOM 0 HA LEU A 310 -0.175 -10.482 -5.164 1.00 0.00 H new ATOM 0 HB2 LEU A 310 0.978 -7.768 -4.415 1.00 0.00 H new ATOM 0 HB3 LEU A 310 1.469 -9.306 -3.733 1.00 0.00 H new ATOM 0 HG LEU A 310 1.776 -8.502 -6.644 1.00 0.00 H new ATOM 0 HD11 LEU A 310 4.183 -8.408 -6.127 1.00 0.00 H new ATOM 0 HD12 LEU A 310 3.256 -7.229 -5.169 1.00 0.00 H new ATOM 0 HD13 LEU A 310 3.825 -8.738 -4.416 1.00 0.00 H new ATOM 0 HD21 LEU A 310 3.152 -10.538 -6.820 1.00 0.00 H new ATOM 0 HD22 LEU A 310 2.754 -10.947 -5.134 1.00 0.00 H new ATOM 0 HD23 LEU A 310 1.472 -10.914 -6.368 1.00 0.00 H new ATOM 1061 N ILE A 311 -1.631 -7.999 -3.537 1.00 0.00 N ATOM 1062 CA ILE A 311 -2.510 -7.688 -2.415 1.00 0.00 C ATOM 1063 C ILE A 311 -3.863 -8.365 -2.585 1.00 0.00 C ATOM 1064 O ILE A 311 -4.467 -8.822 -1.614 1.00 0.00 O ATOM 1065 CB ILE A 311 -2.713 -6.167 -2.257 1.00 0.00 C ATOM 1066 CG1 ILE A 311 -3.401 -5.579 -3.487 1.00 0.00 C ATOM 1067 CG2 ILE A 311 -1.383 -5.475 -2.019 1.00 0.00 C ATOM 1068 CD1 ILE A 311 -3.425 -4.070 -3.496 1.00 0.00 C ATOM 0 H ILE A 311 -1.364 -7.190 -4.098 1.00 0.00 H new ATOM 0 HA ILE A 311 -2.027 -8.068 -1.515 1.00 0.00 H new ATOM 0 HB ILE A 311 -3.355 -6.000 -1.392 1.00 0.00 H new ATOM 0 HG12 ILE A 311 -2.891 -5.932 -4.383 1.00 0.00 H new ATOM 0 HG13 ILE A 311 -4.424 -5.952 -3.535 1.00 0.00 H new ATOM 0 HG21 ILE A 311 -1.545 -4.403 -1.910 1.00 0.00 H new ATOM 0 HG22 ILE A 311 -0.926 -5.867 -1.110 1.00 0.00 H new ATOM 0 HG23 ILE A 311 -0.721 -5.658 -2.866 1.00 0.00 H new ATOM 0 HD11 ILE A 311 -3.928 -3.719 -4.397 1.00 0.00 H new ATOM 0 HD12 ILE A 311 -3.961 -3.709 -2.618 1.00 0.00 H new ATOM 0 HD13 ILE A 311 -2.404 -3.690 -3.479 1.00 0.00 H new ATOM 1080 N ALA A 312 -4.313 -8.458 -3.832 1.00 0.00 N ATOM 1081 CA ALA A 312 -5.577 -9.097 -4.154 1.00 0.00 C ATOM 1082 C ALA A 312 -5.514 -10.593 -3.849 1.00 0.00 C ATOM 1083 O ALA A 312 -6.536 -11.268 -3.729 1.00 0.00 O ATOM 1084 CB ALA A 312 -5.921 -8.856 -5.617 1.00 0.00 C ATOM 0 H ALA A 312 -3.812 -8.093 -4.642 1.00 0.00 H new ATOM 0 HA ALA A 312 -6.362 -8.661 -3.536 1.00 0.00 H new ATOM 0 HB1 ALA A 312 -6.870 -9.338 -5.852 1.00 0.00 H new ATOM 0 HB2 ALA A 312 -6.003 -7.785 -5.800 1.00 0.00 H new ATOM 0 HB3 ALA A 312 -5.136 -9.273 -6.249 1.00 0.00 H new ATOM 1090 N LEU A 313 -4.294 -11.092 -3.712 1.00 0.00 N ATOM 1091 CA LEU A 313 -4.048 -12.496 -3.432 1.00 0.00 C ATOM 1092 C LEU A 313 -4.065 -12.775 -1.926 1.00 0.00 C ATOM 1093 O LEU A 313 -4.561 -13.813 -1.483 1.00 0.00 O ATOM 1094 CB LEU A 313 -2.704 -12.902 -4.074 1.00 0.00 C ATOM 1095 CG LEU A 313 -1.937 -14.058 -3.417 1.00 0.00 C ATOM 1096 CD1 LEU A 313 -1.131 -14.810 -4.463 1.00 0.00 C ATOM 1097 CD2 LEU A 313 -1.002 -13.537 -2.327 1.00 0.00 C ATOM 0 H LEU A 313 -3.446 -10.532 -3.792 1.00 0.00 H new ATOM 0 HA LEU A 313 -4.846 -13.099 -3.865 1.00 0.00 H new ATOM 0 HB2 LEU A 313 -2.893 -13.169 -5.114 1.00 0.00 H new ATOM 0 HB3 LEU A 313 -2.055 -12.027 -4.082 1.00 0.00 H new ATOM 0 HG LEU A 313 -2.662 -14.734 -2.963 1.00 0.00 H new ATOM 0 HD11 LEU A 313 -0.590 -15.628 -3.987 1.00 0.00 H new ATOM 0 HD12 LEU A 313 -1.803 -15.212 -5.221 1.00 0.00 H new ATOM 0 HD13 LEU A 313 -0.420 -14.130 -4.933 1.00 0.00 H new ATOM 0 HD21 LEU A 313 -0.469 -14.373 -1.875 1.00 0.00 H new ATOM 0 HD22 LEU A 313 -0.284 -12.843 -2.764 1.00 0.00 H new ATOM 0 HD23 LEU A 313 -1.585 -13.023 -1.563 1.00 0.00 H new ATOM 1109 N TRP A 314 -3.552 -11.833 -1.141 1.00 0.00 N ATOM 1110 CA TRP A 314 -3.363 -12.064 0.288 1.00 0.00 C ATOM 1111 C TRP A 314 -4.661 -11.849 1.065 1.00 0.00 C ATOM 1112 O TRP A 314 -5.012 -12.663 1.918 1.00 0.00 O ATOM 1113 CB TRP A 314 -2.256 -11.165 0.846 1.00 0.00 C ATOM 1114 CG TRP A 314 -1.608 -11.727 2.082 1.00 0.00 C ATOM 1115 CD1 TRP A 314 -0.444 -12.437 2.141 1.00 0.00 C ATOM 1116 CD2 TRP A 314 -2.089 -11.638 3.430 1.00 0.00 C ATOM 1117 NE1 TRP A 314 -0.170 -12.795 3.439 1.00 0.00 N ATOM 1118 CE2 TRP A 314 -1.165 -12.316 4.249 1.00 0.00 C ATOM 1119 CE3 TRP A 314 -3.208 -11.052 4.022 1.00 0.00 C ATOM 1120 CZ2 TRP A 314 -1.331 -12.422 5.629 1.00 0.00 C ATOM 1121 CZ3 TRP A 314 -3.373 -11.159 5.388 1.00 0.00 C ATOM 1122 CH2 TRP A 314 -2.439 -11.838 6.179 1.00 0.00 C ATOM 0 H TRP A 314 -3.262 -10.911 -1.466 1.00 0.00 H new ATOM 0 HA TRP A 314 -3.062 -13.104 0.412 1.00 0.00 H new ATOM 0 HB2 TRP A 314 -1.495 -11.017 0.079 1.00 0.00 H new ATOM 0 HB3 TRP A 314 -2.673 -10.184 1.075 1.00 0.00 H new ATOM 0 HD1 TRP A 314 0.173 -12.682 1.289 1.00 0.00 H new ATOM 0 HE1 TRP A 314 0.641 -13.330 3.749 1.00 0.00 H new ATOM 0 HE3 TRP A 314 -3.933 -10.523 3.421 1.00 0.00 H new ATOM 0 HZ2 TRP A 314 -0.612 -12.946 6.241 1.00 0.00 H new ATOM 0 HZ3 TRP A 314 -4.238 -10.711 5.855 1.00 0.00 H new ATOM 0 HH2 TRP A 314 -2.596 -11.902 7.246 1.00 0.00 H new ATOM 1133 N CYS A 315 -5.375 -10.766 0.766 1.00 0.00 N ATOM 1134 CA CYS A 315 -6.628 -10.462 1.461 1.00 0.00 C ATOM 1135 C CYS A 315 -7.668 -11.548 1.181 1.00 0.00 C ATOM 1136 O CYS A 315 -8.576 -11.782 1.978 1.00 0.00 O ATOM 1137 CB CYS A 315 -7.176 -9.116 1.003 1.00 0.00 C ATOM 1138 SG CYS A 315 -5.912 -7.856 0.753 1.00 0.00 S ATOM 0 H CYS A 315 -5.111 -10.087 0.052 1.00 0.00 H new ATOM 0 HA CYS A 315 -6.422 -10.424 2.531 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -7.724 -9.256 0.071 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -7.892 -8.756 1.742 1.00 0.00 H new ATOM 0 HG CYS A 315 -5.201 -8.156 -0.293 1.00 0.00 H new ATOM 1144 N GLU A 316 -7.520 -12.202 0.032 1.00 0.00 N ATOM 1145 CA GLU A 316 -8.392 -13.305 -0.354 1.00 0.00 C ATOM 1146 C GLU A 316 -8.102 -14.525 0.518 1.00 0.00 C ATOM 1147 O GLU A 316 -8.988 -15.325 0.808 1.00 0.00 O ATOM 1148 CB GLU A 316 -8.170 -13.646 -1.836 1.00 0.00 C ATOM 1149 CG GLU A 316 -9.102 -14.718 -2.388 1.00 0.00 C ATOM 1150 CD GLU A 316 -10.542 -14.256 -2.504 1.00 0.00 C ATOM 1151 OE1 GLU A 316 -11.308 -14.426 -1.532 1.00 0.00 O ATOM 1152 OE2 GLU A 316 -10.920 -13.732 -3.576 1.00 0.00 O ATOM 0 H GLU A 316 -6.797 -11.983 -0.653 1.00 0.00 H new ATOM 0 HA GLU A 316 -9.432 -13.010 -0.211 1.00 0.00 H new ATOM 0 HB2 GLU A 316 -8.293 -12.738 -2.426 1.00 0.00 H new ATOM 0 HB3 GLU A 316 -7.140 -13.976 -1.969 1.00 0.00 H new ATOM 0 HG2 GLU A 316 -8.747 -15.028 -3.371 1.00 0.00 H new ATOM 0 HG3 GLU A 316 -9.059 -15.595 -1.742 1.00 0.00 H new ATOM 1159 N SER A 317 -6.854 -14.651 0.944 1.00 0.00 N ATOM 1160 CA SER A 317 -6.436 -15.774 1.767 1.00 0.00 C ATOM 1161 C SER A 317 -6.858 -15.561 3.218 1.00 0.00 C ATOM 1162 O SER A 317 -7.346 -16.481 3.874 1.00 0.00 O ATOM 1163 CB SER A 317 -4.917 -15.950 1.690 1.00 0.00 C ATOM 1164 OG SER A 317 -4.494 -17.108 2.392 1.00 0.00 O ATOM 0 H SER A 317 -6.111 -13.986 0.732 1.00 0.00 H new ATOM 0 HA SER A 317 -6.920 -16.675 1.389 1.00 0.00 H new ATOM 0 HB2 SER A 317 -4.610 -16.023 0.647 1.00 0.00 H new ATOM 0 HB3 SER A 317 -4.426 -15.071 2.106 1.00 0.00 H new ATOM 0 HG SER A 317 -3.520 -17.195 2.324 1.00 0.00 H new ATOM 1170 N ASN A 318 -6.655 -14.347 3.710 1.00 0.00 N ATOM 1171 CA ASN A 318 -7.000 -14.008 5.084 1.00 0.00 C ATOM 1172 C ASN A 318 -7.731 -12.677 5.124 1.00 0.00 C ATOM 1173 O ASN A 318 -7.239 -11.682 4.591 1.00 0.00 O ATOM 1174 CB ASN A 318 -5.736 -13.946 5.951 1.00 0.00 C ATOM 1175 CG ASN A 318 -6.017 -13.551 7.391 1.00 0.00 C ATOM 1176 OD1 ASN A 318 -6.343 -14.392 8.226 1.00 0.00 O ATOM 1177 ND2 ASN A 318 -5.871 -12.270 7.694 1.00 0.00 N ATOM 0 H ASN A 318 -6.251 -13.577 3.176 1.00 0.00 H new ATOM 0 HA ASN A 318 -7.656 -14.782 5.482 1.00 0.00 H new ATOM 0 HB2 ASN A 318 -5.246 -14.919 5.937 1.00 0.00 H new ATOM 0 HB3 ASN A 318 -5.038 -13.231 5.514 1.00 0.00 H new ATOM 0 HD21 ASN A 318 -6.030 -11.951 8.649 1.00 0.00 H new ATOM 0 HD22 ASN A 318 -5.599 -11.603 6.972 1.00 0.00 H new ATOM 1184 N GLY A 319 -8.904 -12.671 5.751 1.00 0.00 N ATOM 1185 CA GLY A 319 -9.707 -11.464 5.841 1.00 0.00 C ATOM 1186 C GLY A 319 -8.972 -10.337 6.533 1.00 0.00 C ATOM 1187 O GLY A 319 -8.894 -10.295 7.761 1.00 0.00 O ATOM 0 H GLY A 319 -9.315 -13.488 6.202 1.00 0.00 H new ATOM 0 HA2 GLY A 319 -9.995 -11.146 4.839 1.00 0.00 H new ATOM 0 HA3 GLY A 319 -10.627 -11.682 6.383 1.00 0.00 H new ATOM 1191 N ILE A 320 -8.433 -9.423 5.747 1.00 0.00 N ATOM 1192 CA ILE A 320 -7.622 -8.347 6.283 1.00 0.00 C ATOM 1193 C ILE A 320 -8.278 -6.988 6.010 1.00 0.00 C ATOM 1194 O ILE A 320 -8.225 -6.083 6.844 1.00 0.00 O ATOM 1195 CB ILE A 320 -6.179 -8.415 5.712 1.00 0.00 C ATOM 1196 CG1 ILE A 320 -5.246 -7.497 6.488 1.00 0.00 C ATOM 1197 CG2 ILE A 320 -6.143 -8.058 4.240 1.00 0.00 C ATOM 1198 CD1 ILE A 320 -3.782 -7.744 6.214 1.00 0.00 C ATOM 0 H ILE A 320 -8.543 -9.405 4.733 1.00 0.00 H new ATOM 0 HA ILE A 320 -7.553 -8.466 7.364 1.00 0.00 H new ATOM 0 HB ILE A 320 -5.838 -9.445 5.822 1.00 0.00 H new ATOM 0 HG12 ILE A 320 -5.483 -6.462 6.242 1.00 0.00 H new ATOM 0 HG13 ILE A 320 -5.433 -7.622 7.555 1.00 0.00 H new ATOM 0 HG21 ILE A 320 -5.117 -8.117 3.876 1.00 0.00 H new ATOM 0 HG22 ILE A 320 -6.767 -8.756 3.681 1.00 0.00 H new ATOM 0 HG23 ILE A 320 -6.519 -7.044 4.102 1.00 0.00 H new ATOM 0 HD11 ILE A 320 -3.180 -7.052 6.803 1.00 0.00 H new ATOM 0 HD12 ILE A 320 -3.529 -8.768 6.487 1.00 0.00 H new ATOM 0 HD13 ILE A 320 -3.579 -7.590 5.154 1.00 0.00 H new ATOM 1210 N GLU A 321 -8.929 -6.882 4.858 1.00 0.00 N ATOM 1211 CA GLU A 321 -9.702 -5.706 4.486 1.00 0.00 C ATOM 1212 C GLU A 321 -10.754 -6.154 3.486 1.00 0.00 C ATOM 1213 O GLU A 321 -11.876 -6.483 3.910 1.00 0.00 O ATOM 1214 CB GLU A 321 -8.802 -4.628 3.872 1.00 0.00 C ATOM 1215 CG GLU A 321 -9.435 -3.243 3.755 1.00 0.00 C ATOM 1216 CD GLU A 321 -10.517 -3.147 2.701 1.00 0.00 C ATOM 1217 OE1 GLU A 321 -10.186 -3.216 1.497 1.00 0.00 O ATOM 1218 OE2 GLU A 321 -11.701 -2.999 3.069 1.00 0.00 O ATOM 1219 OXT GLU A 321 -10.429 -6.240 2.281 1.00 0.00 O ATOM 0 H GLU A 321 -8.935 -7.617 4.151 1.00 0.00 H new ATOM 0 HA GLU A 321 -10.169 -5.268 5.368 1.00 0.00 H new ATOM 0 HB2 GLU A 321 -7.897 -4.547 4.474 1.00 0.00 H new ATOM 0 HB3 GLU A 321 -8.496 -4.955 2.878 1.00 0.00 H new ATOM 0 HG2 GLU A 321 -9.857 -2.965 4.721 1.00 0.00 H new ATOM 0 HG3 GLU A 321 -8.655 -2.516 3.527 1.00 0.00 H new