USER MOD reduce.3.24.130724 H: found=0, std=0, add=535, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 535 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 215 GLN : amide:sc= 0 K(o=-0.00082,f=-1.3) USER MOD Set 1.2: A 217 MET CE :methyl -162:sc=-0.000822 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ -125:sc= 0 (180deg=-0.108) USER MOD Single : A 157 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 159 ASN : amide:sc= -1.31 K(o=-1.3,f=-4!) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc=-0.00383 K(o=-0.0038,f=-0.91) USER MOD Single : A 162 GLN : amide:sc= -0.0128 K(o=-0.013,f=-0.78) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 176 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 180 CYS SG : rot 180:sc= -0.0938 USER MOD Single : A 181 THR OG1 : rot 180:sc= -0.0296 USER MOD Single : A 190 SER OG : rot 120:sc= -0.718 USER MOD Single : A 191 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 193 CYS SG : rot 64:sc= 0.434 USER MOD Single : A 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 198 TYR OH : rot -130:sc= -2.34! USER MOD Single : A 199 SER OG : rot 180:sc= 0 USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 HIS : no HD1:sc= -0.0732 X(o=-0.073,f=0.0051) USER MOD Single : A 205 GLN : amide:sc= -0.0511 X(o=-0.051,f=-0.32) USER MOD Single : A 209 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 212 HIS : no HD1:sc= -2.38! C(o=-2.4!,f=-8.1!) USER MOD Single : A 214 SER OG : rot 173:sc= 0.331 USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 221 SER OG : rot 180:sc= 0 USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD Single : A 223 SER OG : rot -91:sc= 0.0303 USER MOD Single : A 227 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 217 N LYS A 152 5.698 2.154 3.738 1.00 0.00 N ATOM 218 CA LYS A 152 4.396 2.652 3.309 1.00 0.00 C ATOM 219 C LYS A 152 3.980 2.018 1.986 1.00 0.00 C ATOM 220 O LYS A 152 4.824 1.691 1.150 1.00 0.00 O ATOM 221 CB LYS A 152 4.431 4.175 3.169 1.00 0.00 C ATOM 222 CG LYS A 152 3.053 4.814 3.133 1.00 0.00 C ATOM 223 CD LYS A 152 3.098 6.264 3.587 1.00 0.00 C ATOM 224 CE LYS A 152 3.401 7.201 2.428 1.00 0.00 C ATOM 225 NZ LYS A 152 4.866 7.370 2.220 1.00 0.00 N ATOM 0 HA LYS A 152 3.662 2.380 4.068 1.00 0.00 H new ATOM 0 HB2 LYS A 152 4.996 4.595 4.001 1.00 0.00 H new ATOM 0 HB3 LYS A 152 4.967 4.435 2.256 1.00 0.00 H new ATOM 0 HG2 LYS A 152 2.653 4.761 2.120 1.00 0.00 H new ATOM 0 HG3 LYS A 152 2.374 4.252 3.774 1.00 0.00 H new ATOM 0 HD2 LYS A 152 2.143 6.536 4.036 1.00 0.00 H new ATOM 0 HD3 LYS A 152 3.858 6.381 4.359 1.00 0.00 H new ATOM 0 HE2 LYS A 152 2.948 6.810 1.517 1.00 0.00 H new ATOM 0 HE3 LYS A 152 2.947 8.173 2.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 5.106 8.382 2.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 5.383 6.872 2.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 5.133 6.975 1.296 1.00 0.00 H new ATOM 239 N LEU A 153 2.675 1.850 1.800 1.00 0.00 N ATOM 240 CA LEU A 153 2.147 1.257 0.576 1.00 0.00 C ATOM 241 C LEU A 153 1.059 2.137 -0.030 1.00 0.00 C ATOM 242 O LEU A 153 0.189 2.644 0.680 1.00 0.00 O ATOM 243 CB LEU A 153 1.590 -0.139 0.862 1.00 0.00 C ATOM 244 CG LEU A 153 2.618 -1.209 1.230 1.00 0.00 C ATOM 245 CD1 LEU A 153 1.938 -2.394 1.898 1.00 0.00 C ATOM 246 CD2 LEU A 153 3.386 -1.658 -0.004 1.00 0.00 C ATOM 0 H LEU A 153 1.964 2.116 2.481 1.00 0.00 H new ATOM 0 HA LEU A 153 2.964 1.176 -0.141 1.00 0.00 H new ATOM 0 HB2 LEU A 153 0.869 -0.061 1.676 1.00 0.00 H new ATOM 0 HB3 LEU A 153 1.042 -0.477 -0.018 1.00 0.00 H new ATOM 0 HG LEU A 153 3.327 -0.777 1.937 1.00 0.00 H new ATOM 0 HD11 LEU A 153 2.685 -3.146 2.153 1.00 0.00 H new ATOM 0 HD12 LEU A 153 1.434 -2.060 2.805 1.00 0.00 H new ATOM 0 HD13 LEU A 153 1.207 -2.826 1.215 1.00 0.00 H new ATOM 0 HD21 LEU A 153 4.113 -2.420 0.277 1.00 0.00 H new ATOM 0 HD22 LEU A 153 2.691 -2.072 -0.734 1.00 0.00 H new ATOM 0 HD23 LEU A 153 3.905 -0.804 -0.440 1.00 0.00 H new ATOM 258 N PHE A 154 1.112 2.314 -1.345 1.00 0.00 N ATOM 259 CA PHE A 154 0.130 3.132 -2.047 1.00 0.00 C ATOM 260 C PHE A 154 -1.005 2.271 -2.593 1.00 0.00 C ATOM 261 O PHE A 154 -0.770 1.243 -3.228 1.00 0.00 O ATOM 262 CB PHE A 154 0.798 3.899 -3.191 1.00 0.00 C ATOM 263 CG PHE A 154 -0.169 4.682 -4.033 1.00 0.00 C ATOM 264 CD1 PHE A 154 -0.819 5.791 -3.515 1.00 0.00 C ATOM 265 CD2 PHE A 154 -0.428 4.308 -5.342 1.00 0.00 C ATOM 266 CE1 PHE A 154 -1.709 6.512 -4.288 1.00 0.00 C ATOM 267 CE2 PHE A 154 -1.318 5.026 -6.119 1.00 0.00 C ATOM 268 CZ PHE A 154 -1.958 6.130 -5.592 1.00 0.00 C ATOM 0 H PHE A 154 1.825 1.902 -1.947 1.00 0.00 H new ATOM 0 HA PHE A 154 -0.287 3.844 -1.335 1.00 0.00 H new ATOM 0 HB2 PHE A 154 1.541 4.581 -2.776 1.00 0.00 H new ATOM 0 HB3 PHE A 154 1.333 3.194 -3.827 1.00 0.00 H new ATOM 0 HD1 PHE A 154 -0.628 6.095 -2.496 1.00 0.00 H new ATOM 0 HD2 PHE A 154 0.071 3.446 -5.760 1.00 0.00 H new ATOM 0 HE1 PHE A 154 -2.210 7.374 -3.873 1.00 0.00 H new ATOM 0 HE2 PHE A 154 -1.512 4.724 -7.137 1.00 0.00 H new ATOM 0 HZ PHE A 154 -2.652 6.694 -6.198 1.00 0.00 H new ATOM 278 N VAL A 155 -2.238 2.698 -2.339 1.00 0.00 N ATOM 279 CA VAL A 155 -3.411 1.968 -2.804 1.00 0.00 C ATOM 280 C VAL A 155 -4.313 2.858 -3.652 1.00 0.00 C ATOM 281 O VAL A 155 -4.666 3.965 -3.249 1.00 0.00 O ATOM 282 CB VAL A 155 -4.227 1.405 -1.624 1.00 0.00 C ATOM 283 CG1 VAL A 155 -5.470 0.689 -2.128 1.00 0.00 C ATOM 284 CG2 VAL A 155 -3.370 0.474 -0.781 1.00 0.00 C ATOM 0 H VAL A 155 -2.450 3.546 -1.814 1.00 0.00 H new ATOM 0 HA VAL A 155 -3.047 1.140 -3.412 1.00 0.00 H new ATOM 0 HB VAL A 155 -4.546 2.236 -0.996 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -6.033 0.298 -1.281 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -6.092 1.389 -2.686 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -5.177 -0.134 -2.779 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -3.962 0.085 0.048 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -3.019 -0.355 -1.396 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -2.514 1.023 -0.389 1.00 0.00 H new ATOM 294 N GLY A 156 -4.682 2.365 -4.831 1.00 0.00 N ATOM 295 CA GLY A 156 -5.539 3.129 -5.718 1.00 0.00 C ATOM 296 C GLY A 156 -6.775 2.357 -6.137 1.00 0.00 C ATOM 297 O GLY A 156 -7.172 1.401 -5.472 1.00 0.00 O ATOM 0 H GLY A 156 -4.403 1.451 -5.187 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.841 4.051 -5.221 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.975 3.415 -6.606 1.00 0.00 H new ATOM 301 N MET A 157 -7.385 2.773 -7.242 1.00 0.00 N ATOM 302 CA MET A 157 -8.583 2.114 -7.747 1.00 0.00 C ATOM 303 C MET A 157 -9.561 1.819 -6.614 1.00 0.00 C ATOM 304 O MET A 157 -10.316 0.847 -6.669 1.00 0.00 O ATOM 305 CB MET A 157 -8.211 0.816 -8.467 1.00 0.00 C ATOM 306 CG MET A 157 -7.943 0.999 -9.952 1.00 0.00 C ATOM 307 SD MET A 157 -6.390 1.855 -10.276 1.00 0.00 S ATOM 308 CE MET A 157 -6.217 1.586 -12.038 1.00 0.00 C ATOM 0 H MET A 157 -7.069 3.563 -7.804 1.00 0.00 H new ATOM 0 HA MET A 157 -9.067 2.788 -8.454 1.00 0.00 H new ATOM 0 HB2 MET A 157 -7.325 0.390 -7.996 1.00 0.00 H new ATOM 0 HB3 MET A 157 -9.018 0.095 -8.338 1.00 0.00 H new ATOM 0 HG2 MET A 157 -7.924 0.023 -10.437 1.00 0.00 H new ATOM 0 HG3 MET A 157 -8.763 1.561 -10.399 1.00 0.00 H new ATOM 0 HE1 MET A 157 -5.300 2.058 -12.390 1.00 0.00 H new ATOM 0 HE2 MET A 157 -6.175 0.516 -12.240 1.00 0.00 H new ATOM 0 HE3 MET A 157 -7.071 2.020 -12.558 1.00 0.00 H new ATOM 318 N LEU A 158 -9.542 2.663 -5.588 1.00 0.00 N ATOM 319 CA LEU A 158 -10.427 2.492 -4.441 1.00 0.00 C ATOM 320 C LEU A 158 -11.756 3.205 -4.668 1.00 0.00 C ATOM 321 O LEU A 158 -11.843 4.137 -5.467 1.00 0.00 O ATOM 322 CB LEU A 158 -9.759 3.026 -3.173 1.00 0.00 C ATOM 323 CG LEU A 158 -8.620 2.177 -2.606 1.00 0.00 C ATOM 324 CD1 LEU A 158 -7.889 2.931 -1.506 1.00 0.00 C ATOM 325 CD2 LEU A 158 -9.152 0.851 -2.084 1.00 0.00 C ATOM 0 H LEU A 158 -8.924 3.472 -5.527 1.00 0.00 H new ATOM 0 HA LEU A 158 -10.623 1.427 -4.320 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -9.372 4.023 -3.382 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -10.522 3.135 -2.403 1.00 0.00 H new ATOM 0 HG LEU A 158 -7.912 1.970 -3.409 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -7.082 2.311 -1.115 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -7.474 3.854 -1.911 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -8.586 3.169 -0.703 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -8.328 0.260 -1.684 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -9.881 1.037 -1.295 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -9.629 0.305 -2.898 1.00 0.00 H new ATOM 337 N ASN A 159 -12.789 2.762 -3.959 1.00 0.00 N ATOM 338 CA ASN A 159 -14.114 3.359 -4.082 1.00 0.00 C ATOM 339 C ASN A 159 -14.391 4.310 -2.921 1.00 0.00 C ATOM 340 O ASN A 159 -13.746 4.236 -1.875 1.00 0.00 O ATOM 341 CB ASN A 159 -15.185 2.268 -4.129 1.00 0.00 C ATOM 342 CG ASN A 159 -16.553 2.816 -4.488 1.00 0.00 C ATOM 343 OD1 ASN A 159 -17.244 3.390 -3.647 1.00 0.00 O ATOM 344 ND2 ASN A 159 -16.950 2.641 -5.743 1.00 0.00 N ATOM 0 H ASN A 159 -12.734 1.991 -3.293 1.00 0.00 H new ATOM 0 HA ASN A 159 -14.145 3.929 -5.011 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -14.897 1.511 -4.858 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -15.238 1.773 -3.160 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -17.861 2.989 -6.043 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -16.344 2.159 -6.407 1.00 0.00 H new ATOM 351 N LYS A 160 -15.357 5.202 -3.113 1.00 0.00 N ATOM 352 CA LYS A 160 -15.723 6.167 -2.083 1.00 0.00 C ATOM 353 C LYS A 160 -16.703 5.555 -1.088 1.00 0.00 C ATOM 354 O LYS A 160 -17.619 6.226 -0.613 1.00 0.00 O ATOM 355 CB LYS A 160 -16.340 7.415 -2.720 1.00 0.00 C ATOM 356 CG LYS A 160 -15.423 8.107 -3.713 1.00 0.00 C ATOM 357 CD LYS A 160 -16.187 9.084 -4.591 1.00 0.00 C ATOM 358 CE LYS A 160 -15.465 9.335 -5.906 1.00 0.00 C ATOM 359 NZ LYS A 160 -15.963 10.561 -6.588 1.00 0.00 N ATOM 0 H LYS A 160 -15.901 5.277 -3.973 1.00 0.00 H new ATOM 0 HA LYS A 160 -14.817 6.450 -1.547 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -17.264 7.136 -3.225 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -16.608 8.120 -1.933 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -14.637 8.638 -3.175 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -14.933 7.361 -4.338 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -17.184 8.692 -4.791 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -16.316 10.027 -4.060 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -14.395 9.432 -5.720 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -15.597 8.475 -6.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -15.446 10.697 -7.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -16.978 10.458 -6.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -15.813 11.386 -5.972 1.00 0.00 H new ATOM 373 N GLN A 161 -16.502 4.279 -0.775 1.00 0.00 N ATOM 374 CA GLN A 161 -17.368 3.577 0.165 1.00 0.00 C ATOM 375 C GLN A 161 -16.560 2.997 1.321 1.00 0.00 C ATOM 376 O GLN A 161 -16.935 3.138 2.485 1.00 0.00 O ATOM 377 CB GLN A 161 -18.133 2.462 -0.548 1.00 0.00 C ATOM 378 CG GLN A 161 -19.155 1.764 0.335 1.00 0.00 C ATOM 379 CD GLN A 161 -20.380 2.617 0.595 1.00 0.00 C ATOM 380 OE1 GLN A 161 -20.809 3.387 -0.264 1.00 0.00 O ATOM 381 NE2 GLN A 161 -20.952 2.485 1.787 1.00 0.00 N ATOM 0 H GLN A 161 -15.747 3.710 -1.159 1.00 0.00 H new ATOM 0 HA GLN A 161 -18.081 4.296 0.569 1.00 0.00 H new ATOM 0 HB2 GLN A 161 -18.641 2.880 -1.417 1.00 0.00 H new ATOM 0 HB3 GLN A 161 -17.421 1.724 -0.919 1.00 0.00 H new ATOM 0 HG2 GLN A 161 -19.461 0.830 -0.137 1.00 0.00 H new ATOM 0 HG3 GLN A 161 -18.690 1.503 1.286 1.00 0.00 H new ATOM 0 HE21 GLN A 161 -20.563 1.835 2.470 1.00 0.00 H new ATOM 0 HE22 GLN A 161 -21.780 3.034 2.019 1.00 0.00 H new ATOM 390 N GLN A 162 -15.450 2.345 0.992 1.00 0.00 N ATOM 391 CA GLN A 162 -14.589 1.743 2.004 1.00 0.00 C ATOM 392 C GLN A 162 -14.152 2.779 3.033 1.00 0.00 C ATOM 393 O GLN A 162 -14.044 3.966 2.726 1.00 0.00 O ATOM 394 CB GLN A 162 -13.362 1.108 1.348 1.00 0.00 C ATOM 395 CG GLN A 162 -13.632 -0.264 0.752 1.00 0.00 C ATOM 396 CD GLN A 162 -12.358 -1.012 0.408 1.00 0.00 C ATOM 397 OE1 GLN A 162 -11.301 -0.408 0.225 1.00 0.00 O ATOM 398 NE2 GLN A 162 -12.453 -2.333 0.320 1.00 0.00 N ATOM 0 H GLN A 162 -15.125 2.220 0.033 1.00 0.00 H new ATOM 0 HA GLN A 162 -15.160 0.968 2.516 1.00 0.00 H new ATOM 0 HB2 GLN A 162 -12.996 1.770 0.563 1.00 0.00 H new ATOM 0 HB3 GLN A 162 -12.567 1.023 2.089 1.00 0.00 H new ATOM 0 HG2 GLN A 162 -14.216 -0.854 1.458 1.00 0.00 H new ATOM 0 HG3 GLN A 162 -14.238 -0.152 -0.147 1.00 0.00 H new ATOM 0 HE21 GLN A 162 -13.350 -2.792 0.480 1.00 0.00 H new ATOM 0 HE22 GLN A 162 -11.629 -2.890 0.093 1.00 0.00 H new ATOM 407 N SER A 163 -13.901 2.323 4.256 1.00 0.00 N ATOM 408 CA SER A 163 -13.479 3.211 5.333 1.00 0.00 C ATOM 409 C SER A 163 -12.190 2.711 5.976 1.00 0.00 C ATOM 410 O SER A 163 -11.777 1.572 5.759 1.00 0.00 O ATOM 411 CB SER A 163 -14.580 3.324 6.390 1.00 0.00 C ATOM 412 OG SER A 163 -14.435 4.511 7.151 1.00 0.00 O ATOM 0 H SER A 163 -13.983 1.343 4.526 1.00 0.00 H new ATOM 0 HA SER A 163 -13.292 4.196 4.906 1.00 0.00 H new ATOM 0 HB2 SER A 163 -15.556 3.316 5.905 1.00 0.00 H new ATOM 0 HB3 SER A 163 -14.545 2.458 7.051 1.00 0.00 H new ATOM 0 HG SER A 163 -15.151 4.561 7.818 1.00 0.00 H new ATOM 418 N GLU A 164 -11.558 3.572 6.768 1.00 0.00 N ATOM 419 CA GLU A 164 -10.315 3.218 7.442 1.00 0.00 C ATOM 420 C GLU A 164 -10.405 1.822 8.052 1.00 0.00 C ATOM 421 O GLU A 164 -9.504 1.000 7.883 1.00 0.00 O ATOM 422 CB GLU A 164 -9.990 4.242 8.532 1.00 0.00 C ATOM 423 CG GLU A 164 -9.267 5.474 8.013 1.00 0.00 C ATOM 424 CD GLU A 164 -9.164 6.571 9.055 1.00 0.00 C ATOM 425 OE1 GLU A 164 -10.172 6.835 9.742 1.00 0.00 O ATOM 426 OE2 GLU A 164 -8.073 7.165 9.183 1.00 0.00 O ATOM 0 H GLU A 164 -11.886 4.519 6.958 1.00 0.00 H new ATOM 0 HA GLU A 164 -9.516 3.221 6.700 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -10.916 4.552 9.016 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -9.375 3.765 9.295 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -8.266 5.193 7.687 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -9.792 5.857 7.138 1.00 0.00 H new ATOM 433 N ASP A 165 -11.498 1.562 8.761 1.00 0.00 N ATOM 434 CA ASP A 165 -11.707 0.266 9.396 1.00 0.00 C ATOM 435 C ASP A 165 -11.672 -0.857 8.364 1.00 0.00 C ATOM 436 O ASP A 165 -10.876 -1.790 8.473 1.00 0.00 O ATOM 437 CB ASP A 165 -13.043 0.248 10.141 1.00 0.00 C ATOM 438 CG ASP A 165 -13.249 1.489 10.987 1.00 0.00 C ATOM 439 OD1 ASP A 165 -12.609 1.593 12.055 1.00 0.00 O ATOM 440 OD2 ASP A 165 -14.050 2.357 10.582 1.00 0.00 O ATOM 0 H ASP A 165 -12.253 2.231 8.910 1.00 0.00 H new ATOM 0 HA ASP A 165 -10.899 0.105 10.110 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -13.857 0.163 9.421 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -13.089 -0.635 10.779 1.00 0.00 H new ATOM 445 N ASP A 166 -12.540 -0.761 7.363 1.00 0.00 N ATOM 446 CA ASP A 166 -12.608 -1.768 6.310 1.00 0.00 C ATOM 447 C ASP A 166 -11.210 -2.169 5.850 1.00 0.00 C ATOM 448 O ASP A 166 -10.844 -3.344 5.893 1.00 0.00 O ATOM 449 CB ASP A 166 -13.418 -1.243 5.124 1.00 0.00 C ATOM 450 CG ASP A 166 -14.891 -1.089 5.451 1.00 0.00 C ATOM 451 OD1 ASP A 166 -15.555 -2.118 5.691 1.00 0.00 O ATOM 452 OD2 ASP A 166 -15.379 0.061 5.466 1.00 0.00 O ATOM 0 H ASP A 166 -13.207 0.004 7.258 1.00 0.00 H new ATOM 0 HA ASP A 166 -13.104 -2.650 6.716 1.00 0.00 H new ATOM 0 HB2 ASP A 166 -13.016 -0.279 4.811 1.00 0.00 H new ATOM 0 HB3 ASP A 166 -13.305 -1.924 4.281 1.00 0.00 H new ATOM 457 N VAL A 167 -10.433 -1.185 5.409 1.00 0.00 N ATOM 458 CA VAL A 167 -9.075 -1.435 4.940 1.00 0.00 C ATOM 459 C VAL A 167 -8.206 -2.008 6.054 1.00 0.00 C ATOM 460 O VAL A 167 -7.511 -3.005 5.862 1.00 0.00 O ATOM 461 CB VAL A 167 -8.421 -0.148 4.404 1.00 0.00 C ATOM 462 CG1 VAL A 167 -7.019 -0.436 3.888 1.00 0.00 C ATOM 463 CG2 VAL A 167 -9.282 0.473 3.314 1.00 0.00 C ATOM 0 H VAL A 167 -10.721 -0.207 5.367 1.00 0.00 H new ATOM 0 HA VAL A 167 -9.148 -2.161 4.130 1.00 0.00 H new ATOM 0 HB VAL A 167 -8.341 0.566 5.223 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -6.573 0.485 3.513 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -6.407 -0.832 4.699 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -7.071 -1.168 3.082 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -8.805 1.382 2.947 1.00 0.00 H new ATOM 0 HG22 VAL A 167 -9.396 -0.235 2.493 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -10.263 0.718 3.721 1.00 0.00 H new ATOM 473 N ARG A 168 -8.252 -1.371 7.220 1.00 0.00 N ATOM 474 CA ARG A 168 -7.468 -1.816 8.365 1.00 0.00 C ATOM 475 C ARG A 168 -7.489 -3.338 8.480 1.00 0.00 C ATOM 476 O ARG A 168 -6.472 -4.000 8.271 1.00 0.00 O ATOM 477 CB ARG A 168 -8.005 -1.190 9.653 1.00 0.00 C ATOM 478 CG ARG A 168 -7.377 0.153 9.986 1.00 0.00 C ATOM 479 CD ARG A 168 -7.885 0.693 11.313 1.00 0.00 C ATOM 480 NE ARG A 168 -7.634 2.125 11.455 1.00 0.00 N ATOM 481 CZ ARG A 168 -8.175 2.875 12.408 1.00 0.00 C ATOM 482 NH1 ARG A 168 -8.993 2.332 13.299 1.00 0.00 N ATOM 483 NH2 ARG A 168 -7.898 4.171 12.471 1.00 0.00 N ATOM 0 H ARG A 168 -8.824 -0.545 7.396 1.00 0.00 H new ATOM 0 HA ARG A 168 -6.438 -1.494 8.215 1.00 0.00 H new ATOM 0 HB2 ARG A 168 -9.084 -1.065 9.563 1.00 0.00 H new ATOM 0 HB3 ARG A 168 -7.832 -1.878 10.481 1.00 0.00 H new ATOM 0 HG2 ARG A 168 -6.293 0.049 10.026 1.00 0.00 H new ATOM 0 HG3 ARG A 168 -7.600 0.866 9.193 1.00 0.00 H new ATOM 0 HD2 ARG A 168 -8.955 0.503 11.396 1.00 0.00 H new ATOM 0 HD3 ARG A 168 -7.402 0.158 12.131 1.00 0.00 H new ATOM 0 HE ARG A 168 -7.009 2.573 10.785 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -9.208 1.336 13.253 1.00 0.00 H new ATOM 0 HH12 ARG A 168 -9.407 2.910 14.030 1.00 0.00 H new ATOM 0 HH21 ARG A 168 -7.269 4.592 11.787 1.00 0.00 H new ATOM 0 HH22 ARG A 168 -8.314 4.746 13.203 1.00 0.00 H new ATOM 497 N ARG A 169 -8.653 -3.885 8.812 1.00 0.00 N ATOM 498 CA ARG A 169 -8.806 -5.328 8.956 1.00 0.00 C ATOM 499 C ARG A 169 -8.436 -6.045 7.661 1.00 0.00 C ATOM 500 O ARG A 169 -7.604 -6.954 7.659 1.00 0.00 O ATOM 501 CB ARG A 169 -10.244 -5.673 9.350 1.00 0.00 C ATOM 502 CG ARG A 169 -10.591 -5.297 10.781 1.00 0.00 C ATOM 503 CD ARG A 169 -11.940 -5.863 11.195 1.00 0.00 C ATOM 504 NE ARG A 169 -12.406 -5.298 12.458 1.00 0.00 N ATOM 505 CZ ARG A 169 -11.931 -5.660 13.645 1.00 0.00 C ATOM 506 NH1 ARG A 169 -10.980 -6.581 13.729 1.00 0.00 N ATOM 507 NH2 ARG A 169 -12.406 -5.101 14.750 1.00 0.00 N ATOM 0 H ARG A 169 -9.504 -3.351 8.986 1.00 0.00 H new ATOM 0 HA ARG A 169 -8.131 -5.664 9.743 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -10.929 -5.163 8.673 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -10.401 -6.743 9.216 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -9.818 -5.668 11.453 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -10.605 -4.212 10.880 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -12.673 -5.660 10.415 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -11.865 -6.946 11.288 1.00 0.00 H new ATOM 0 HE ARG A 169 -13.136 -4.586 12.428 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -10.612 -7.013 12.881 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -10.617 -6.857 14.641 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -13.137 -4.392 14.689 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -12.040 -5.380 15.660 1.00 0.00 H new ATOM 521 N LEU A 170 -9.059 -5.633 6.563 1.00 0.00 N ATOM 522 CA LEU A 170 -8.796 -6.236 5.261 1.00 0.00 C ATOM 523 C LEU A 170 -7.305 -6.502 5.076 1.00 0.00 C ATOM 524 O LEU A 170 -6.873 -7.653 5.008 1.00 0.00 O ATOM 525 CB LEU A 170 -9.306 -5.326 4.143 1.00 0.00 C ATOM 526 CG LEU A 170 -9.531 -5.993 2.785 1.00 0.00 C ATOM 527 CD1 LEU A 170 -10.760 -6.887 2.827 1.00 0.00 C ATOM 528 CD2 LEU A 170 -9.669 -4.943 1.692 1.00 0.00 C ATOM 0 H LEU A 170 -9.750 -4.883 6.548 1.00 0.00 H new ATOM 0 HA LEU A 170 -9.325 -7.188 5.215 1.00 0.00 H new ATOM 0 HB2 LEU A 170 -10.246 -4.879 4.466 1.00 0.00 H new ATOM 0 HB3 LEU A 170 -8.594 -4.511 4.012 1.00 0.00 H new ATOM 0 HG LEU A 170 -8.664 -6.613 2.558 1.00 0.00 H new ATOM 0 HD11 LEU A 170 -10.904 -7.353 1.852 1.00 0.00 H new ATOM 0 HD12 LEU A 170 -10.622 -7.661 3.582 1.00 0.00 H new ATOM 0 HD13 LEU A 170 -11.637 -6.289 3.077 1.00 0.00 H new ATOM 0 HD21 LEU A 170 -9.828 -5.435 0.733 1.00 0.00 H new ATOM 0 HD22 LEU A 170 -10.518 -4.296 1.914 1.00 0.00 H new ATOM 0 HD23 LEU A 170 -8.759 -4.344 1.646 1.00 0.00 H new ATOM 540 N PHE A 171 -6.524 -5.431 4.997 1.00 0.00 N ATOM 541 CA PHE A 171 -5.081 -5.548 4.821 1.00 0.00 C ATOM 542 C PHE A 171 -4.466 -6.403 5.926 1.00 0.00 C ATOM 543 O PHE A 171 -4.072 -7.545 5.693 1.00 0.00 O ATOM 544 CB PHE A 171 -4.432 -4.162 4.812 1.00 0.00 C ATOM 545 CG PHE A 171 -4.563 -3.448 3.497 1.00 0.00 C ATOM 546 CD1 PHE A 171 -5.813 -3.152 2.976 1.00 0.00 C ATOM 547 CD2 PHE A 171 -3.437 -3.072 2.783 1.00 0.00 C ATOM 548 CE1 PHE A 171 -5.936 -2.495 1.766 1.00 0.00 C ATOM 549 CE2 PHE A 171 -3.554 -2.414 1.573 1.00 0.00 C ATOM 550 CZ PHE A 171 -4.805 -2.125 1.064 1.00 0.00 C ATOM 0 H PHE A 171 -6.866 -4.471 5.052 1.00 0.00 H new ATOM 0 HA PHE A 171 -4.895 -6.034 3.863 1.00 0.00 H new ATOM 0 HB2 PHE A 171 -4.885 -3.552 5.594 1.00 0.00 H new ATOM 0 HB3 PHE A 171 -3.375 -4.263 5.058 1.00 0.00 H new ATOM 0 HD1 PHE A 171 -6.700 -3.438 3.521 1.00 0.00 H new ATOM 0 HD2 PHE A 171 -2.456 -3.296 3.176 1.00 0.00 H new ATOM 0 HE1 PHE A 171 -6.915 -2.271 1.370 1.00 0.00 H new ATOM 0 HE2 PHE A 171 -2.668 -2.126 1.026 1.00 0.00 H new ATOM 0 HZ PHE A 171 -4.899 -1.611 0.119 1.00 0.00 H new ATOM 560 N GLU A 172 -4.387 -5.839 7.127 1.00 0.00 N ATOM 561 CA GLU A 172 -3.819 -6.549 8.267 1.00 0.00 C ATOM 562 C GLU A 172 -4.235 -8.017 8.257 1.00 0.00 C ATOM 563 O GLU A 172 -3.522 -8.879 8.770 1.00 0.00 O ATOM 564 CB GLU A 172 -4.260 -5.892 9.577 1.00 0.00 C ATOM 565 CG GLU A 172 -5.549 -6.465 10.142 1.00 0.00 C ATOM 566 CD GLU A 172 -5.321 -7.734 10.941 1.00 0.00 C ATOM 567 OE1 GLU A 172 -4.232 -7.874 11.535 1.00 0.00 O ATOM 568 OE2 GLU A 172 -6.233 -8.587 10.971 1.00 0.00 O ATOM 0 H GLU A 172 -4.709 -4.894 7.336 1.00 0.00 H new ATOM 0 HA GLU A 172 -2.733 -6.497 8.190 1.00 0.00 H new ATOM 0 HB2 GLU A 172 -3.467 -6.006 10.316 1.00 0.00 H new ATOM 0 HB3 GLU A 172 -4.390 -4.822 9.412 1.00 0.00 H new ATOM 0 HG2 GLU A 172 -6.025 -5.720 10.779 1.00 0.00 H new ATOM 0 HG3 GLU A 172 -6.239 -6.674 9.324 1.00 0.00 H new ATOM 575 N ALA A 173 -5.395 -8.293 7.669 1.00 0.00 N ATOM 576 CA ALA A 173 -5.906 -9.656 7.590 1.00 0.00 C ATOM 577 C ALA A 173 -4.788 -10.644 7.276 1.00 0.00 C ATOM 578 O ALA A 173 -4.880 -11.826 7.606 1.00 0.00 O ATOM 579 CB ALA A 173 -7.004 -9.747 6.541 1.00 0.00 C ATOM 0 H ALA A 173 -5.998 -7.591 7.241 1.00 0.00 H new ATOM 0 HA ALA A 173 -6.324 -9.918 8.562 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -7.377 -10.770 6.492 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -7.820 -9.076 6.809 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -6.603 -9.460 5.569 1.00 0.00 H new ATOM 585 N PHE A 174 -3.733 -10.152 6.636 1.00 0.00 N ATOM 586 CA PHE A 174 -2.597 -10.993 6.276 1.00 0.00 C ATOM 587 C PHE A 174 -1.396 -10.696 7.169 1.00 0.00 C ATOM 588 O PHE A 174 -1.021 -11.508 8.013 1.00 0.00 O ATOM 589 CB PHE A 174 -2.221 -10.778 4.808 1.00 0.00 C ATOM 590 CG PHE A 174 -3.294 -11.202 3.846 1.00 0.00 C ATOM 591 CD1 PHE A 174 -3.463 -12.538 3.521 1.00 0.00 C ATOM 592 CD2 PHE A 174 -4.135 -10.264 3.268 1.00 0.00 C ATOM 593 CE1 PHE A 174 -4.449 -12.930 2.635 1.00 0.00 C ATOM 594 CE2 PHE A 174 -5.123 -10.650 2.383 1.00 0.00 C ATOM 595 CZ PHE A 174 -5.281 -11.985 2.067 1.00 0.00 C ATOM 0 H PHE A 174 -3.641 -9.176 6.356 1.00 0.00 H new ATOM 0 HA PHE A 174 -2.887 -12.034 6.421 1.00 0.00 H new ATOM 0 HB2 PHE A 174 -1.998 -9.723 4.649 1.00 0.00 H new ATOM 0 HB3 PHE A 174 -1.309 -11.333 4.590 1.00 0.00 H new ATOM 0 HD1 PHE A 174 -2.817 -13.281 3.965 1.00 0.00 H new ATOM 0 HD2 PHE A 174 -4.016 -9.219 3.512 1.00 0.00 H new ATOM 0 HE1 PHE A 174 -4.569 -13.974 2.387 1.00 0.00 H new ATOM 0 HE2 PHE A 174 -5.771 -9.909 1.939 1.00 0.00 H new ATOM 0 HZ PHE A 174 -6.054 -12.290 1.377 1.00 0.00 H new ATOM 605 N GLY A 175 -0.796 -9.526 6.974 1.00 0.00 N ATOM 606 CA GLY A 175 0.357 -9.142 7.768 1.00 0.00 C ATOM 607 C GLY A 175 0.005 -8.155 8.862 1.00 0.00 C ATOM 608 O GLY A 175 -1.165 -7.993 9.208 1.00 0.00 O ATOM 0 H GLY A 175 -1.087 -8.837 6.281 1.00 0.00 H new ATOM 0 HA2 GLY A 175 0.799 -10.032 8.215 1.00 0.00 H new ATOM 0 HA3 GLY A 175 1.113 -8.703 7.117 1.00 0.00 H new ATOM 612 N ASN A 176 1.019 -7.494 9.411 1.00 0.00 N ATOM 613 CA ASN A 176 0.811 -6.519 10.475 1.00 0.00 C ATOM 614 C ASN A 176 0.758 -5.102 9.911 1.00 0.00 C ATOM 615 O ASN A 176 1.218 -4.849 8.797 1.00 0.00 O ATOM 616 CB ASN A 176 1.926 -6.624 11.517 1.00 0.00 C ATOM 617 CG ASN A 176 1.929 -7.964 12.227 1.00 0.00 C ATOM 618 OD1 ASN A 176 2.890 -8.728 12.131 1.00 0.00 O ATOM 619 ND2 ASN A 176 0.850 -8.255 12.945 1.00 0.00 N ATOM 0 H ASN A 176 1.994 -7.616 9.136 1.00 0.00 H new ATOM 0 HA ASN A 176 -0.144 -6.737 10.952 1.00 0.00 H new ATOM 0 HB2 ASN A 176 2.890 -6.471 11.031 1.00 0.00 H new ATOM 0 HB3 ASN A 176 1.810 -5.827 12.251 1.00 0.00 H new ATOM 0 HD21 ASN A 176 0.794 -9.142 13.445 1.00 0.00 H new ATOM 0 HD22 ASN A 176 0.077 -7.591 12.996 1.00 0.00 H new ATOM 626 N ILE A 177 0.195 -4.183 10.688 1.00 0.00 N ATOM 627 CA ILE A 177 0.084 -2.792 10.267 1.00 0.00 C ATOM 628 C ILE A 177 0.635 -1.850 11.332 1.00 0.00 C ATOM 629 O ILE A 177 0.607 -2.159 12.523 1.00 0.00 O ATOM 630 CB ILE A 177 -1.377 -2.409 9.967 1.00 0.00 C ATOM 631 CG1 ILE A 177 -1.825 -3.023 8.639 1.00 0.00 C ATOM 632 CG2 ILE A 177 -1.533 -0.896 9.936 1.00 0.00 C ATOM 633 CD1 ILE A 177 -3.190 -2.555 8.186 1.00 0.00 C ATOM 0 H ILE A 177 -0.191 -4.376 11.612 1.00 0.00 H new ATOM 0 HA ILE A 177 0.672 -2.691 9.355 1.00 0.00 H new ATOM 0 HB ILE A 177 -2.011 -2.804 10.761 1.00 0.00 H new ATOM 0 HG12 ILE A 177 -1.092 -2.779 7.870 1.00 0.00 H new ATOM 0 HG13 ILE A 177 -1.836 -4.109 8.735 1.00 0.00 H new ATOM 0 HG21 ILE A 177 -2.571 -0.642 9.723 1.00 0.00 H new ATOM 0 HG22 ILE A 177 -1.249 -0.481 10.903 1.00 0.00 H new ATOM 0 HG23 ILE A 177 -0.891 -0.480 9.160 1.00 0.00 H new ATOM 0 HD11 ILE A 177 -3.442 -3.031 7.238 1.00 0.00 H new ATOM 0 HD12 ILE A 177 -3.934 -2.823 8.936 1.00 0.00 H new ATOM 0 HD13 ILE A 177 -3.179 -1.473 8.057 1.00 0.00 H new ATOM 645 N GLU A 178 1.135 -0.698 10.895 1.00 0.00 N ATOM 646 CA GLU A 178 1.692 0.290 11.811 1.00 0.00 C ATOM 647 C GLU A 178 0.868 1.574 11.794 1.00 0.00 C ATOM 648 O GLU A 178 0.597 2.163 12.839 1.00 0.00 O ATOM 649 CB GLU A 178 3.145 0.598 11.443 1.00 0.00 C ATOM 650 CG GLU A 178 4.138 -0.418 11.982 1.00 0.00 C ATOM 651 CD GLU A 178 4.082 -0.543 13.493 1.00 0.00 C ATOM 652 OE1 GLU A 178 3.808 0.475 14.162 1.00 0.00 O ATOM 653 OE2 GLU A 178 4.311 -1.659 14.004 1.00 0.00 O ATOM 0 H GLU A 178 1.166 -0.426 9.912 1.00 0.00 H new ATOM 0 HA GLU A 178 1.661 -0.128 12.817 1.00 0.00 H new ATOM 0 HB2 GLU A 178 3.235 0.641 10.358 1.00 0.00 H new ATOM 0 HB3 GLU A 178 3.406 1.586 11.824 1.00 0.00 H new ATOM 0 HG2 GLU A 178 3.937 -1.391 11.533 1.00 0.00 H new ATOM 0 HG3 GLU A 178 5.146 -0.130 11.682 1.00 0.00 H new ATOM 660 N GLU A 179 0.474 2.001 10.598 1.00 0.00 N ATOM 661 CA GLU A 179 -0.318 3.216 10.444 1.00 0.00 C ATOM 662 C GLU A 179 -1.134 3.174 9.156 1.00 0.00 C ATOM 663 O GLU A 179 -0.724 2.563 8.168 1.00 0.00 O ATOM 664 CB GLU A 179 0.591 4.447 10.446 1.00 0.00 C ATOM 665 CG GLU A 179 0.837 5.020 11.831 1.00 0.00 C ATOM 666 CD GLU A 179 2.016 4.372 12.530 1.00 0.00 C ATOM 667 OE1 GLU A 179 2.943 3.915 11.830 1.00 0.00 O ATOM 668 OE2 GLU A 179 2.011 4.323 13.778 1.00 0.00 O ATOM 0 H GLU A 179 0.690 1.524 9.723 1.00 0.00 H new ATOM 0 HA GLU A 179 -1.006 3.280 11.287 1.00 0.00 H new ATOM 0 HB2 GLU A 179 1.548 4.182 9.996 1.00 0.00 H new ATOM 0 HB3 GLU A 179 0.146 5.218 9.817 1.00 0.00 H new ATOM 0 HG2 GLU A 179 1.012 6.093 11.750 1.00 0.00 H new ATOM 0 HG3 GLU A 179 -0.058 4.888 12.439 1.00 0.00 H new ATOM 675 N CYS A 180 -2.291 3.826 9.174 1.00 0.00 N ATOM 676 CA CYS A 180 -3.166 3.863 8.007 1.00 0.00 C ATOM 677 C CYS A 180 -3.744 5.260 7.805 1.00 0.00 C ATOM 678 O CYS A 180 -4.043 5.966 8.769 1.00 0.00 O ATOM 679 CB CYS A 180 -4.298 2.847 8.162 1.00 0.00 C ATOM 680 SG CYS A 180 -5.518 2.893 6.828 1.00 0.00 S ATOM 0 H CYS A 180 -2.645 4.336 9.983 1.00 0.00 H new ATOM 0 HA CYS A 180 -2.573 3.605 7.130 1.00 0.00 H new ATOM 0 HB2 CYS A 180 -3.869 1.846 8.214 1.00 0.00 H new ATOM 0 HB3 CYS A 180 -4.805 3.026 9.110 1.00 0.00 H new ATOM 0 HG CYS A 180 -6.434 1.997 7.047 1.00 0.00 H new ATOM 686 N THR A 181 -3.899 5.655 6.545 1.00 0.00 N ATOM 687 CA THR A 181 -4.438 6.968 6.216 1.00 0.00 C ATOM 688 C THR A 181 -5.184 6.939 4.887 1.00 0.00 C ATOM 689 O THR A 181 -4.844 6.166 3.991 1.00 0.00 O ATOM 690 CB THR A 181 -3.325 8.030 6.144 1.00 0.00 C ATOM 691 OG1 THR A 181 -2.589 8.053 7.372 1.00 0.00 O ATOM 692 CG2 THR A 181 -3.909 9.408 5.871 1.00 0.00 C ATOM 0 H THR A 181 -3.658 5.083 5.735 1.00 0.00 H new ATOM 0 HA THR A 181 -5.132 7.233 7.013 1.00 0.00 H new ATOM 0 HB THR A 181 -2.655 7.768 5.325 1.00 0.00 H new ATOM 0 HG1 THR A 181 -1.882 8.730 7.317 1.00 0.00 H new ATOM 0 HG21 THR A 181 -3.104 10.142 5.824 1.00 0.00 H new ATOM 0 HG22 THR A 181 -4.443 9.395 4.921 1.00 0.00 H new ATOM 0 HG23 THR A 181 -4.598 9.676 6.672 1.00 0.00 H new ATOM 700 N ILE A 182 -6.201 7.785 4.766 1.00 0.00 N ATOM 701 CA ILE A 182 -6.993 7.856 3.545 1.00 0.00 C ATOM 702 C ILE A 182 -6.839 9.214 2.868 1.00 0.00 C ATOM 703 O ILE A 182 -7.052 10.257 3.487 1.00 0.00 O ATOM 704 CB ILE A 182 -8.486 7.603 3.826 1.00 0.00 C ATOM 705 CG1 ILE A 182 -8.653 6.419 4.781 1.00 0.00 C ATOM 706 CG2 ILE A 182 -9.235 7.351 2.526 1.00 0.00 C ATOM 707 CD1 ILE A 182 -8.199 5.101 4.195 1.00 0.00 C ATOM 0 H ILE A 182 -6.496 8.431 5.499 1.00 0.00 H new ATOM 0 HA ILE A 182 -6.619 7.076 2.881 1.00 0.00 H new ATOM 0 HB ILE A 182 -8.907 8.490 4.299 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -8.089 6.616 5.693 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -9.702 6.338 5.067 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -10.289 7.174 2.742 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -9.139 8.221 1.876 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -8.815 6.477 2.028 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -8.347 4.307 4.927 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -8.780 4.881 3.300 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -7.142 5.163 3.935 1.00 0.00 H new ATOM 719 N LEU A 183 -6.469 9.194 1.592 1.00 0.00 N ATOM 720 CA LEU A 183 -6.287 10.424 0.829 1.00 0.00 C ATOM 721 C LEU A 183 -7.631 11.074 0.516 1.00 0.00 C ATOM 722 O LEU A 183 -8.603 10.390 0.195 1.00 0.00 O ATOM 723 CB LEU A 183 -5.533 10.135 -0.470 1.00 0.00 C ATOM 724 CG LEU A 183 -4.055 9.771 -0.322 1.00 0.00 C ATOM 725 CD1 LEU A 183 -3.508 9.218 -1.629 1.00 0.00 C ATOM 726 CD2 LEU A 183 -3.251 10.983 0.125 1.00 0.00 C ATOM 0 H LEU A 183 -6.289 8.340 1.064 1.00 0.00 H new ATOM 0 HA LEU A 183 -5.702 11.115 1.435 1.00 0.00 H new ATOM 0 HB2 LEU A 183 -6.038 9.318 -0.985 1.00 0.00 H new ATOM 0 HB3 LEU A 183 -5.608 11.012 -1.113 1.00 0.00 H new ATOM 0 HG LEU A 183 -3.965 8.998 0.441 1.00 0.00 H new ATOM 0 HD11 LEU A 183 -2.455 8.965 -1.505 1.00 0.00 H new ATOM 0 HD12 LEU A 183 -4.066 8.324 -1.908 1.00 0.00 H new ATOM 0 HD13 LEU A 183 -3.610 9.969 -2.413 1.00 0.00 H new ATOM 0 HD21 LEU A 183 -2.201 10.706 0.225 1.00 0.00 H new ATOM 0 HD22 LEU A 183 -3.348 11.777 -0.615 1.00 0.00 H new ATOM 0 HD23 LEU A 183 -3.627 11.335 1.086 1.00 0.00 H new ATOM 816 N SER A 190 -13.022 11.352 -0.829 1.00 0.00 N ATOM 817 CA SER A 190 -11.946 10.399 -1.073 1.00 0.00 C ATOM 818 C SER A 190 -11.647 10.287 -2.565 1.00 0.00 C ATOM 819 O SER A 190 -12.542 10.039 -3.373 1.00 0.00 O ATOM 820 CB SER A 190 -12.316 9.025 -0.510 1.00 0.00 C ATOM 821 OG SER A 190 -13.280 8.383 -1.326 1.00 0.00 O ATOM 0 HA SER A 190 -11.051 10.762 -0.568 1.00 0.00 H new ATOM 0 HB2 SER A 190 -11.423 8.404 -0.440 1.00 0.00 H new ATOM 0 HB3 SER A 190 -12.707 9.136 0.501 1.00 0.00 H new ATOM 0 HG SER A 190 -12.914 7.538 -1.661 1.00 0.00 H new ATOM 827 N LYS A 191 -10.381 10.470 -2.923 1.00 0.00 N ATOM 828 CA LYS A 191 -9.960 10.389 -4.317 1.00 0.00 C ATOM 829 C LYS A 191 -9.675 8.944 -4.716 1.00 0.00 C ATOM 830 O LYS A 191 -8.881 8.685 -5.619 1.00 0.00 O ATOM 831 CB LYS A 191 -8.715 11.248 -4.547 1.00 0.00 C ATOM 832 CG LYS A 191 -9.019 12.726 -4.722 1.00 0.00 C ATOM 833 CD LYS A 191 -7.836 13.590 -4.321 1.00 0.00 C ATOM 834 CE LYS A 191 -6.888 13.814 -5.489 1.00 0.00 C ATOM 835 NZ LYS A 191 -5.590 14.395 -5.048 1.00 0.00 N ATOM 0 H LYS A 191 -9.628 10.676 -2.267 1.00 0.00 H new ATOM 0 HA LYS A 191 -10.773 10.766 -4.938 1.00 0.00 H new ATOM 0 HB2 LYS A 191 -8.037 11.123 -3.703 1.00 0.00 H new ATOM 0 HB3 LYS A 191 -8.193 10.886 -5.432 1.00 0.00 H new ATOM 0 HG2 LYS A 191 -9.279 12.924 -5.762 1.00 0.00 H new ATOM 0 HG3 LYS A 191 -9.887 12.994 -4.119 1.00 0.00 H new ATOM 0 HD2 LYS A 191 -8.194 14.551 -3.953 1.00 0.00 H new ATOM 0 HD3 LYS A 191 -7.298 13.115 -3.501 1.00 0.00 H new ATOM 0 HE2 LYS A 191 -6.708 12.867 -5.997 1.00 0.00 H new ATOM 0 HE3 LYS A 191 -7.356 14.480 -6.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 191 -4.973 14.532 -5.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 191 -5.759 15.311 -4.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 191 -5.131 13.748 -4.376 1.00 0.00 H new ATOM 849 N GLY A 192 -10.329 8.007 -4.036 1.00 0.00 N ATOM 850 CA GLY A 192 -10.132 6.601 -4.335 1.00 0.00 C ATOM 851 C GLY A 192 -8.697 6.158 -4.126 1.00 0.00 C ATOM 852 O GLY A 192 -8.207 5.270 -4.824 1.00 0.00 O ATOM 0 H GLY A 192 -10.991 8.197 -3.284 1.00 0.00 H new ATOM 0 HA2 GLY A 192 -10.789 6.003 -3.703 1.00 0.00 H new ATOM 0 HA3 GLY A 192 -10.421 6.409 -5.368 1.00 0.00 H new ATOM 856 N CYS A 193 -8.022 6.780 -3.166 1.00 0.00 N ATOM 857 CA CYS A 193 -6.634 6.447 -2.869 1.00 0.00 C ATOM 858 C CYS A 193 -6.361 6.539 -1.371 1.00 0.00 C ATOM 859 O CYS A 193 -6.995 7.319 -0.661 1.00 0.00 O ATOM 860 CB CYS A 193 -5.690 7.380 -3.629 1.00 0.00 C ATOM 861 SG CYS A 193 -5.996 7.448 -5.410 1.00 0.00 S ATOM 0 H CYS A 193 -8.413 7.518 -2.580 1.00 0.00 H new ATOM 0 HA CYS A 193 -6.456 5.421 -3.190 1.00 0.00 H new ATOM 0 HB2 CYS A 193 -5.780 8.385 -3.217 1.00 0.00 H new ATOM 0 HB3 CYS A 193 -4.663 7.057 -3.460 1.00 0.00 H new ATOM 0 HG CYS A 193 -7.176 7.947 -5.629 1.00 0.00 H new ATOM 867 N ALA A 194 -5.414 5.735 -0.897 1.00 0.00 N ATOM 868 CA ALA A 194 -5.058 5.725 0.516 1.00 0.00 C ATOM 869 C ALA A 194 -3.631 5.225 0.719 1.00 0.00 C ATOM 870 O ALA A 194 -2.988 4.757 -0.220 1.00 0.00 O ATOM 871 CB ALA A 194 -6.037 4.867 1.302 1.00 0.00 C ATOM 0 H ALA A 194 -4.880 5.083 -1.471 1.00 0.00 H new ATOM 0 HA ALA A 194 -5.113 6.749 0.886 1.00 0.00 H new ATOM 0 HB1 ALA A 194 -5.758 4.869 2.356 1.00 0.00 H new ATOM 0 HB2 ALA A 194 -7.044 5.270 1.192 1.00 0.00 H new ATOM 0 HB3 ALA A 194 -6.012 3.846 0.922 1.00 0.00 H new ATOM 877 N PHE A 195 -3.143 5.327 1.951 1.00 0.00 N ATOM 878 CA PHE A 195 -1.792 4.886 2.276 1.00 0.00 C ATOM 879 C PHE A 195 -1.801 3.947 3.479 1.00 0.00 C ATOM 880 O PHE A 195 -2.399 4.249 4.512 1.00 0.00 O ATOM 881 CB PHE A 195 -0.894 6.092 2.563 1.00 0.00 C ATOM 882 CG PHE A 195 -0.397 6.778 1.322 1.00 0.00 C ATOM 883 CD1 PHE A 195 0.529 6.161 0.497 1.00 0.00 C ATOM 884 CD2 PHE A 195 -0.857 8.039 0.981 1.00 0.00 C ATOM 885 CE1 PHE A 195 0.988 6.790 -0.644 1.00 0.00 C ATOM 886 CE2 PHE A 195 -0.402 8.674 -0.159 1.00 0.00 C ATOM 887 CZ PHE A 195 0.521 8.047 -0.974 1.00 0.00 C ATOM 0 H PHE A 195 -3.663 5.711 2.740 1.00 0.00 H new ATOM 0 HA PHE A 195 -1.397 4.344 1.417 1.00 0.00 H new ATOM 0 HB2 PHE A 195 -1.446 6.810 3.169 1.00 0.00 H new ATOM 0 HB3 PHE A 195 -0.039 5.766 3.155 1.00 0.00 H new ATOM 0 HD1 PHE A 195 0.896 5.177 0.749 1.00 0.00 H new ATOM 0 HD2 PHE A 195 -1.580 8.532 1.614 1.00 0.00 H new ATOM 0 HE1 PHE A 195 1.712 6.299 -1.278 1.00 0.00 H new ATOM 0 HE2 PHE A 195 -0.767 9.658 -0.412 1.00 0.00 H new ATOM 0 HZ PHE A 195 0.876 8.539 -1.867 1.00 0.00 H new ATOM 897 N VAL A 196 -1.134 2.806 3.336 1.00 0.00 N ATOM 898 CA VAL A 196 -1.064 1.822 4.410 1.00 0.00 C ATOM 899 C VAL A 196 0.380 1.429 4.702 1.00 0.00 C ATOM 900 O VAL A 196 1.155 1.144 3.789 1.00 0.00 O ATOM 901 CB VAL A 196 -1.869 0.556 4.064 1.00 0.00 C ATOM 902 CG1 VAL A 196 -1.838 -0.430 5.222 1.00 0.00 C ATOM 903 CG2 VAL A 196 -3.301 0.919 3.701 1.00 0.00 C ATOM 0 H VAL A 196 -0.635 2.540 2.487 1.00 0.00 H new ATOM 0 HA VAL A 196 -1.497 2.288 5.295 1.00 0.00 H new ATOM 0 HB VAL A 196 -1.408 0.078 3.199 1.00 0.00 H new ATOM 0 HG11 VAL A 196 -2.412 -1.318 4.959 1.00 0.00 H new ATOM 0 HG12 VAL A 196 -0.806 -0.713 5.431 1.00 0.00 H new ATOM 0 HG13 VAL A 196 -2.273 0.034 6.107 1.00 0.00 H new ATOM 0 HG21 VAL A 196 -3.856 0.013 3.459 1.00 0.00 H new ATOM 0 HG22 VAL A 196 -3.775 1.420 4.545 1.00 0.00 H new ATOM 0 HG23 VAL A 196 -3.300 1.585 2.838 1.00 0.00 H new ATOM 913 N LYS A 197 0.736 1.415 5.982 1.00 0.00 N ATOM 914 CA LYS A 197 2.087 1.055 6.397 1.00 0.00 C ATOM 915 C LYS A 197 2.118 -0.352 6.985 1.00 0.00 C ATOM 916 O LYS A 197 1.136 -0.815 7.565 1.00 0.00 O ATOM 917 CB LYS A 197 2.612 2.060 7.425 1.00 0.00 C ATOM 918 CG LYS A 197 3.268 3.280 6.802 1.00 0.00 C ATOM 919 CD LYS A 197 3.656 4.304 7.856 1.00 0.00 C ATOM 920 CE LYS A 197 4.151 5.595 7.223 1.00 0.00 C ATOM 921 NZ LYS A 197 3.036 6.545 6.954 1.00 0.00 N ATOM 0 H LYS A 197 0.107 1.649 6.750 1.00 0.00 H new ATOM 0 HA LYS A 197 2.729 1.077 5.516 1.00 0.00 H new ATOM 0 HB2 LYS A 197 1.786 2.385 8.058 1.00 0.00 H new ATOM 0 HB3 LYS A 197 3.333 1.561 8.073 1.00 0.00 H new ATOM 0 HG2 LYS A 197 4.155 2.974 6.247 1.00 0.00 H new ATOM 0 HG3 LYS A 197 2.585 3.735 6.085 1.00 0.00 H new ATOM 0 HD2 LYS A 197 2.797 4.516 8.493 1.00 0.00 H new ATOM 0 HD3 LYS A 197 4.434 3.890 8.498 1.00 0.00 H new ATOM 0 HE2 LYS A 197 4.879 6.067 7.883 1.00 0.00 H new ATOM 0 HE3 LYS A 197 4.667 5.367 6.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 3.415 7.412 6.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 2.354 6.105 6.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 2.559 6.783 7.847 1.00 0.00 H new ATOM 935 N TYR A 198 3.253 -1.026 6.832 1.00 0.00 N ATOM 936 CA TYR A 198 3.412 -2.381 7.347 1.00 0.00 C ATOM 937 C TYR A 198 4.599 -2.466 8.301 1.00 0.00 C ATOM 938 O TYR A 198 5.333 -1.495 8.483 1.00 0.00 O ATOM 939 CB TYR A 198 3.598 -3.369 6.194 1.00 0.00 C ATOM 940 CG TYR A 198 2.300 -3.945 5.674 1.00 0.00 C ATOM 941 CD1 TYR A 198 1.205 -3.128 5.423 1.00 0.00 C ATOM 942 CD2 TYR A 198 2.170 -5.308 5.434 1.00 0.00 C ATOM 943 CE1 TYR A 198 0.018 -3.651 4.949 1.00 0.00 C ATOM 944 CE2 TYR A 198 0.986 -5.839 4.959 1.00 0.00 C ATOM 945 CZ TYR A 198 -0.087 -5.007 4.718 1.00 0.00 C ATOM 946 OH TYR A 198 -1.268 -5.531 4.245 1.00 0.00 O ATOM 0 H TYR A 198 4.076 -0.656 6.356 1.00 0.00 H new ATOM 0 HA TYR A 198 2.508 -2.641 7.897 1.00 0.00 H new ATOM 0 HB2 TYR A 198 4.116 -2.867 5.377 1.00 0.00 H new ATOM 0 HB3 TYR A 198 4.241 -4.185 6.526 1.00 0.00 H new ATOM 0 HD1 TYR A 198 1.283 -2.066 5.602 1.00 0.00 H new ATOM 0 HD2 TYR A 198 3.008 -5.963 5.622 1.00 0.00 H new ATOM 0 HE1 TYR A 198 -0.824 -3.002 4.760 1.00 0.00 H new ATOM 0 HE2 TYR A 198 0.901 -6.900 4.777 1.00 0.00 H new ATOM 0 HH TYR A 198 -1.532 -6.295 4.799 1.00 0.00 H new ATOM 956 N SER A 199 4.781 -3.635 8.906 1.00 0.00 N ATOM 957 CA SER A 199 5.877 -3.847 9.844 1.00 0.00 C ATOM 958 C SER A 199 7.147 -4.265 9.110 1.00 0.00 C ATOM 959 O SER A 199 8.255 -3.902 9.506 1.00 0.00 O ATOM 960 CB SER A 199 5.496 -4.913 10.874 1.00 0.00 C ATOM 961 OG SER A 199 4.494 -4.435 11.755 1.00 0.00 O ATOM 0 H SER A 199 4.184 -4.450 8.764 1.00 0.00 H new ATOM 0 HA SER A 199 6.069 -2.906 10.359 1.00 0.00 H new ATOM 0 HB2 SER A 199 5.139 -5.807 10.362 1.00 0.00 H new ATOM 0 HB3 SER A 199 6.378 -5.204 11.445 1.00 0.00 H new ATOM 0 HG SER A 199 4.267 -5.135 12.402 1.00 0.00 H new ATOM 967 N SER A 200 6.978 -5.031 8.037 1.00 0.00 N ATOM 968 CA SER A 200 8.110 -5.503 7.248 1.00 0.00 C ATOM 969 C SER A 200 7.735 -5.617 5.774 1.00 0.00 C ATOM 970 O SER A 200 6.604 -5.326 5.385 1.00 0.00 O ATOM 971 CB SER A 200 8.594 -6.857 7.770 1.00 0.00 C ATOM 972 OG SER A 200 9.124 -6.740 9.078 1.00 0.00 O ATOM 0 H SER A 200 6.068 -5.338 7.694 1.00 0.00 H new ATOM 0 HA SER A 200 8.916 -4.776 7.344 1.00 0.00 H new ATOM 0 HB2 SER A 200 7.766 -7.566 7.772 1.00 0.00 H new ATOM 0 HB3 SER A 200 9.355 -7.257 7.100 1.00 0.00 H new ATOM 0 HG SER A 200 9.425 -7.619 9.389 1.00 0.00 H new ATOM 978 N HIS A 201 8.694 -6.043 4.957 1.00 0.00 N ATOM 979 CA HIS A 201 8.465 -6.197 3.525 1.00 0.00 C ATOM 980 C HIS A 201 7.595 -7.419 3.241 1.00 0.00 C ATOM 981 O HIS A 201 6.480 -7.295 2.736 1.00 0.00 O ATOM 982 CB HIS A 201 9.797 -6.323 2.785 1.00 0.00 C ATOM 983 CG HIS A 201 9.647 -6.675 1.337 1.00 0.00 C ATOM 984 ND1 HIS A 201 9.016 -5.857 0.424 1.00 0.00 N ATOM 985 CD2 HIS A 201 10.052 -7.766 0.645 1.00 0.00 C ATOM 986 CE1 HIS A 201 9.038 -6.429 -0.766 1.00 0.00 C ATOM 987 NE2 HIS A 201 9.662 -7.588 -0.660 1.00 0.00 N ATOM 0 H HIS A 201 9.636 -6.287 5.262 1.00 0.00 H new ATOM 0 HA HIS A 201 7.942 -5.310 3.169 1.00 0.00 H new ATOM 0 HB2 HIS A 201 10.339 -5.381 2.867 1.00 0.00 H new ATOM 0 HB3 HIS A 201 10.404 -7.084 3.274 1.00 0.00 H new ATOM 0 HD2 HIS A 201 10.583 -8.617 1.045 1.00 0.00 H new ATOM 0 HE1 HIS A 201 8.617 -6.019 -1.672 1.00 0.00 H new ATOM 0 HE2 HIS A 201 9.827 -8.244 -1.423 1.00 0.00 H new ATOM 995 N ALA A 202 8.114 -8.597 3.570 1.00 0.00 N ATOM 996 CA ALA A 202 7.385 -9.841 3.352 1.00 0.00 C ATOM 997 C ALA A 202 5.887 -9.641 3.556 1.00 0.00 C ATOM 998 O ALA A 202 5.095 -9.835 2.635 1.00 0.00 O ATOM 999 CB ALA A 202 7.906 -10.928 4.280 1.00 0.00 C ATOM 0 H ALA A 202 9.036 -8.716 3.988 1.00 0.00 H new ATOM 0 HA ALA A 202 7.547 -10.153 2.320 1.00 0.00 H new ATOM 0 HB1 ALA A 202 7.353 -11.851 4.106 1.00 0.00 H new ATOM 0 HB2 ALA A 202 8.965 -11.097 4.084 1.00 0.00 H new ATOM 0 HB3 ALA A 202 7.774 -10.616 5.316 1.00 0.00 H new ATOM 1005 N GLU A 203 5.506 -9.254 4.769 1.00 0.00 N ATOM 1006 CA GLU A 203 4.102 -9.030 5.094 1.00 0.00 C ATOM 1007 C GLU A 203 3.432 -8.159 4.035 1.00 0.00 C ATOM 1008 O GLU A 203 2.316 -8.441 3.600 1.00 0.00 O ATOM 1009 CB GLU A 203 3.972 -8.373 6.469 1.00 0.00 C ATOM 1010 CG GLU A 203 4.392 -9.275 7.617 1.00 0.00 C ATOM 1011 CD GLU A 203 3.371 -10.356 7.913 1.00 0.00 C ATOM 1012 OE1 GLU A 203 3.128 -11.202 7.027 1.00 0.00 O ATOM 1013 OE2 GLU A 203 2.815 -10.356 9.031 1.00 0.00 O ATOM 0 H GLU A 203 6.150 -9.089 5.543 1.00 0.00 H new ATOM 0 HA GLU A 203 3.601 -9.998 5.114 1.00 0.00 H new ATOM 0 HB2 GLU A 203 4.579 -7.468 6.489 1.00 0.00 H new ATOM 0 HB3 GLU A 203 2.937 -8.066 6.619 1.00 0.00 H new ATOM 0 HG2 GLU A 203 5.349 -9.740 7.378 1.00 0.00 H new ATOM 0 HG3 GLU A 203 4.546 -8.671 8.511 1.00 0.00 H new ATOM 1020 N ALA A 204 4.121 -7.099 3.627 1.00 0.00 N ATOM 1021 CA ALA A 204 3.594 -6.187 2.619 1.00 0.00 C ATOM 1022 C ALA A 204 3.328 -6.914 1.306 1.00 0.00 C ATOM 1023 O ALA A 204 2.212 -6.890 0.788 1.00 0.00 O ATOM 1024 CB ALA A 204 4.557 -5.030 2.398 1.00 0.00 C ATOM 0 H ALA A 204 5.046 -6.850 3.979 1.00 0.00 H new ATOM 0 HA ALA A 204 2.646 -5.791 2.984 1.00 0.00 H new ATOM 0 HB1 ALA A 204 4.150 -4.357 1.643 1.00 0.00 H new ATOM 0 HB2 ALA A 204 4.693 -4.486 3.333 1.00 0.00 H new ATOM 0 HB3 ALA A 204 5.518 -5.416 2.060 1.00 0.00 H new ATOM 1030 N GLN A 205 4.360 -7.560 0.772 1.00 0.00 N ATOM 1031 CA GLN A 205 4.237 -8.293 -0.482 1.00 0.00 C ATOM 1032 C GLN A 205 3.041 -9.239 -0.444 1.00 0.00 C ATOM 1033 O GLN A 205 2.255 -9.300 -1.389 1.00 0.00 O ATOM 1034 CB GLN A 205 5.517 -9.080 -0.765 1.00 0.00 C ATOM 1035 CG GLN A 205 5.667 -9.495 -2.220 1.00 0.00 C ATOM 1036 CD GLN A 205 6.025 -8.333 -3.125 1.00 0.00 C ATOM 1037 OE1 GLN A 205 7.158 -7.852 -3.118 1.00 0.00 O ATOM 1038 NE2 GLN A 205 5.057 -7.874 -3.910 1.00 0.00 N ATOM 0 H GLN A 205 5.291 -7.590 1.189 1.00 0.00 H new ATOM 0 HA GLN A 205 4.080 -7.570 -1.283 1.00 0.00 H new ATOM 0 HB2 GLN A 205 6.377 -8.475 -0.478 1.00 0.00 H new ATOM 0 HB3 GLN A 205 5.532 -9.972 -0.138 1.00 0.00 H new ATOM 0 HG2 GLN A 205 6.438 -10.262 -2.297 1.00 0.00 H new ATOM 0 HG3 GLN A 205 4.735 -9.944 -2.563 1.00 0.00 H new ATOM 0 HE21 GLN A 205 4.132 -8.303 -3.883 1.00 0.00 H new ATOM 0 HE22 GLN A 205 5.239 -7.092 -4.540 1.00 0.00 H new ATOM 1047 N ALA A 206 2.911 -9.976 0.654 1.00 0.00 N ATOM 1048 CA ALA A 206 1.811 -10.919 0.816 1.00 0.00 C ATOM 1049 C ALA A 206 0.465 -10.229 0.623 1.00 0.00 C ATOM 1050 O ALA A 206 -0.385 -10.706 -0.129 1.00 0.00 O ATOM 1051 CB ALA A 206 1.877 -11.577 2.186 1.00 0.00 C ATOM 0 H ALA A 206 3.554 -9.938 1.445 1.00 0.00 H new ATOM 0 HA ALA A 206 1.909 -11.689 0.051 1.00 0.00 H new ATOM 0 HB1 ALA A 206 1.050 -12.279 2.293 1.00 0.00 H new ATOM 0 HB2 ALA A 206 2.821 -12.112 2.288 1.00 0.00 H new ATOM 0 HB3 ALA A 206 1.807 -10.813 2.960 1.00 0.00 H new ATOM 1057 N ALA A 207 0.277 -9.105 1.306 1.00 0.00 N ATOM 1058 CA ALA A 207 -0.965 -8.349 1.208 1.00 0.00 C ATOM 1059 C ALA A 207 -1.174 -7.817 -0.206 1.00 0.00 C ATOM 1060 O ALA A 207 -2.307 -7.595 -0.634 1.00 0.00 O ATOM 1061 CB ALA A 207 -0.967 -7.205 2.210 1.00 0.00 C ATOM 0 H ALA A 207 0.970 -8.698 1.934 1.00 0.00 H new ATOM 0 HA ALA A 207 -1.790 -9.022 1.440 1.00 0.00 H new ATOM 0 HB1 ALA A 207 -1.901 -6.649 2.126 1.00 0.00 H new ATOM 0 HB2 ALA A 207 -0.873 -7.605 3.219 1.00 0.00 H new ATOM 0 HB3 ALA A 207 -0.129 -6.540 2.004 1.00 0.00 H new ATOM 1067 N ILE A 208 -0.076 -7.615 -0.925 1.00 0.00 N ATOM 1068 CA ILE A 208 -0.140 -7.110 -2.291 1.00 0.00 C ATOM 1069 C ILE A 208 -0.703 -8.161 -3.241 1.00 0.00 C ATOM 1070 O ILE A 208 -1.772 -7.979 -3.821 1.00 0.00 O ATOM 1071 CB ILE A 208 1.247 -6.670 -2.794 1.00 0.00 C ATOM 1072 CG1 ILE A 208 1.662 -5.355 -2.130 1.00 0.00 C ATOM 1073 CG2 ILE A 208 1.240 -6.526 -4.309 1.00 0.00 C ATOM 1074 CD1 ILE A 208 3.127 -5.024 -2.309 1.00 0.00 C ATOM 0 H ILE A 208 0.869 -7.793 -0.585 1.00 0.00 H new ATOM 0 HA ILE A 208 -0.803 -6.245 -2.276 1.00 0.00 H new ATOM 0 HB ILE A 208 1.974 -7.436 -2.525 1.00 0.00 H new ATOM 0 HG12 ILE A 208 1.062 -4.544 -2.542 1.00 0.00 H new ATOM 0 HG13 ILE A 208 1.437 -5.408 -1.065 1.00 0.00 H new ATOM 0 HG21 ILE A 208 2.227 -6.214 -4.649 1.00 0.00 H new ATOM 0 HG22 ILE A 208 0.984 -7.483 -4.764 1.00 0.00 H new ATOM 0 HG23 ILE A 208 0.503 -5.777 -4.600 1.00 0.00 H new ATOM 0 HD11 ILE A 208 3.350 -4.079 -1.813 1.00 0.00 H new ATOM 0 HD12 ILE A 208 3.735 -5.816 -1.872 1.00 0.00 H new ATOM 0 HD13 ILE A 208 3.353 -4.938 -3.372 1.00 0.00 H new ATOM 1086 N ASN A 209 0.024 -9.264 -3.393 1.00 0.00 N ATOM 1087 CA ASN A 209 -0.403 -10.346 -4.271 1.00 0.00 C ATOM 1088 C ASN A 209 -1.768 -10.883 -3.849 1.00 0.00 C ATOM 1089 O ASN A 209 -2.607 -11.203 -4.689 1.00 0.00 O ATOM 1090 CB ASN A 209 0.627 -11.477 -4.260 1.00 0.00 C ATOM 1091 CG ASN A 209 0.197 -12.660 -5.106 1.00 0.00 C ATOM 1092 OD1 ASN A 209 -0.510 -13.550 -4.633 1.00 0.00 O ATOM 1093 ND2 ASN A 209 0.623 -12.675 -6.363 1.00 0.00 N ATOM 0 H ASN A 209 0.912 -9.431 -2.919 1.00 0.00 H new ATOM 0 HA ASN A 209 -0.485 -9.948 -5.282 1.00 0.00 H new ATOM 0 HB2 ASN A 209 1.581 -11.099 -4.627 1.00 0.00 H new ATOM 0 HB3 ASN A 209 0.789 -11.807 -3.234 1.00 0.00 H new ATOM 0 HD21 ASN A 209 0.366 -13.446 -6.979 1.00 0.00 H new ATOM 0 HD22 ASN A 209 1.207 -11.916 -6.712 1.00 0.00 H new ATOM 1100 N ALA A 210 -1.981 -10.978 -2.540 1.00 0.00 N ATOM 1101 CA ALA A 210 -3.244 -11.473 -2.006 1.00 0.00 C ATOM 1102 C ALA A 210 -4.384 -10.508 -2.311 1.00 0.00 C ATOM 1103 O ALA A 210 -5.517 -10.926 -2.553 1.00 0.00 O ATOM 1104 CB ALA A 210 -3.129 -11.701 -0.506 1.00 0.00 C ATOM 0 H ALA A 210 -1.296 -10.719 -1.831 1.00 0.00 H new ATOM 0 HA ALA A 210 -3.468 -12.423 -2.490 1.00 0.00 H new ATOM 0 HB1 ALA A 210 -4.079 -12.071 -0.120 1.00 0.00 H new ATOM 0 HB2 ALA A 210 -2.347 -12.434 -0.308 1.00 0.00 H new ATOM 0 HB3 ALA A 210 -2.878 -10.762 -0.013 1.00 0.00 H new ATOM 1110 N LEU A 211 -4.079 -9.215 -2.297 1.00 0.00 N ATOM 1111 CA LEU A 211 -5.080 -8.190 -2.572 1.00 0.00 C ATOM 1112 C LEU A 211 -4.929 -7.647 -3.989 1.00 0.00 C ATOM 1113 O LEU A 211 -5.722 -7.966 -4.875 1.00 0.00 O ATOM 1114 CB LEU A 211 -4.959 -7.048 -1.561 1.00 0.00 C ATOM 1115 CG LEU A 211 -5.131 -7.432 -0.091 1.00 0.00 C ATOM 1116 CD1 LEU A 211 -4.889 -6.229 0.807 1.00 0.00 C ATOM 1117 CD2 LEU A 211 -6.518 -8.010 0.151 1.00 0.00 C ATOM 0 H LEU A 211 -3.147 -8.852 -2.098 1.00 0.00 H new ATOM 0 HA LEU A 211 -6.066 -8.646 -2.481 1.00 0.00 H new ATOM 0 HB2 LEU A 211 -3.980 -6.584 -1.682 1.00 0.00 H new ATOM 0 HB3 LEU A 211 -5.703 -6.291 -1.807 1.00 0.00 H new ATOM 0 HG LEU A 211 -4.393 -8.196 0.153 1.00 0.00 H new ATOM 0 HD11 LEU A 211 -5.016 -6.522 1.849 1.00 0.00 H new ATOM 0 HD12 LEU A 211 -3.875 -5.859 0.655 1.00 0.00 H new ATOM 0 HD13 LEU A 211 -5.603 -5.442 0.562 1.00 0.00 H new ATOM 0 HD21 LEU A 211 -6.622 -8.278 1.202 1.00 0.00 H new ATOM 0 HD22 LEU A 211 -7.272 -7.268 -0.111 1.00 0.00 H new ATOM 0 HD23 LEU A 211 -6.654 -8.899 -0.465 1.00 0.00 H new ATOM 1129 N HIS A 212 -3.904 -6.826 -4.197 1.00 0.00 N ATOM 1130 CA HIS A 212 -3.647 -6.241 -5.508 1.00 0.00 C ATOM 1131 C HIS A 212 -3.670 -7.312 -6.595 1.00 0.00 C ATOM 1132 O HIS A 212 -3.078 -8.380 -6.441 1.00 0.00 O ATOM 1133 CB HIS A 212 -2.298 -5.521 -5.514 1.00 0.00 C ATOM 1134 CG HIS A 212 -1.771 -5.248 -6.888 1.00 0.00 C ATOM 1135 ND1 HIS A 212 -2.386 -4.388 -7.773 1.00 0.00 N ATOM 1136 CD2 HIS A 212 -0.678 -5.725 -7.528 1.00 0.00 C ATOM 1137 CE1 HIS A 212 -1.695 -4.349 -8.899 1.00 0.00 C ATOM 1138 NE2 HIS A 212 -0.653 -5.152 -8.776 1.00 0.00 N ATOM 0 H HIS A 212 -3.238 -6.551 -3.475 1.00 0.00 H new ATOM 0 HA HIS A 212 -4.436 -5.519 -5.717 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -2.397 -4.577 -4.978 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -1.572 -6.123 -4.968 1.00 0.00 H new ATOM 0 HD2 HIS A 212 0.041 -6.426 -7.131 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -1.940 -3.761 -9.771 1.00 0.00 H new ATOM 0 HE2 HIS A 212 0.055 -5.319 -9.491 1.00 0.00 H new ATOM 1146 N GLY A 213 -4.358 -7.019 -7.694 1.00 0.00 N ATOM 1147 CA GLY A 213 -4.446 -7.967 -8.789 1.00 0.00 C ATOM 1148 C GLY A 213 -5.293 -9.176 -8.444 1.00 0.00 C ATOM 1149 O GLY A 213 -5.476 -10.070 -9.269 1.00 0.00 O ATOM 0 H GLY A 213 -4.856 -6.142 -7.846 1.00 0.00 H new ATOM 0 HA2 GLY A 213 -4.867 -7.470 -9.663 1.00 0.00 H new ATOM 0 HA3 GLY A 213 -3.443 -8.296 -9.062 1.00 0.00 H new ATOM 1153 N SER A 214 -5.810 -9.204 -7.220 1.00 0.00 N ATOM 1154 CA SER A 214 -6.638 -10.315 -6.765 1.00 0.00 C ATOM 1155 C SER A 214 -8.117 -10.021 -6.997 1.00 0.00 C ATOM 1156 O SER A 214 -8.749 -10.621 -7.866 1.00 0.00 O ATOM 1157 CB SER A 214 -6.388 -10.590 -5.280 1.00 0.00 C ATOM 1158 OG SER A 214 -6.583 -11.960 -4.976 1.00 0.00 O ATOM 0 H SER A 214 -5.670 -8.470 -6.525 1.00 0.00 H new ATOM 0 HA SER A 214 -6.366 -11.199 -7.342 1.00 0.00 H new ATOM 0 HB2 SER A 214 -5.371 -10.297 -5.019 1.00 0.00 H new ATOM 0 HB3 SER A 214 -7.060 -9.981 -4.676 1.00 0.00 H new ATOM 0 HG SER A 214 -6.315 -12.131 -4.049 1.00 0.00 H new ATOM 1164 N GLN A 215 -8.660 -9.094 -6.215 1.00 0.00 N ATOM 1165 CA GLN A 215 -10.064 -8.721 -6.335 1.00 0.00 C ATOM 1166 C GLN A 215 -10.218 -7.428 -7.130 1.00 0.00 C ATOM 1167 O GLN A 215 -9.235 -6.856 -7.601 1.00 0.00 O ATOM 1168 CB GLN A 215 -10.691 -8.559 -4.949 1.00 0.00 C ATOM 1169 CG GLN A 215 -9.868 -7.696 -4.006 1.00 0.00 C ATOM 1170 CD GLN A 215 -10.558 -7.461 -2.677 1.00 0.00 C ATOM 1171 OE1 GLN A 215 -10.832 -6.322 -2.300 1.00 0.00 O ATOM 1172 NE2 GLN A 215 -10.844 -8.541 -1.959 1.00 0.00 N ATOM 0 H GLN A 215 -8.149 -8.588 -5.492 1.00 0.00 H new ATOM 0 HA GLN A 215 -10.581 -9.518 -6.869 1.00 0.00 H new ATOM 0 HB2 GLN A 215 -11.683 -8.120 -5.057 1.00 0.00 H new ATOM 0 HB3 GLN A 215 -10.825 -9.544 -4.503 1.00 0.00 H new ATOM 0 HG2 GLN A 215 -8.904 -8.174 -3.831 1.00 0.00 H new ATOM 0 HG3 GLN A 215 -9.667 -6.736 -4.481 1.00 0.00 H new ATOM 0 HE21 GLN A 215 -10.599 -9.467 -2.310 1.00 0.00 H new ATOM 0 HE22 GLN A 215 -11.309 -8.445 -1.056 1.00 0.00 H new ATOM 1181 N THR A 216 -11.458 -6.973 -7.276 1.00 0.00 N ATOM 1182 CA THR A 216 -11.741 -5.749 -8.015 1.00 0.00 C ATOM 1183 C THR A 216 -12.770 -4.892 -7.286 1.00 0.00 C ATOM 1184 O THR A 216 -13.944 -5.251 -7.204 1.00 0.00 O ATOM 1185 CB THR A 216 -12.258 -6.056 -9.433 1.00 0.00 C ATOM 1186 OG1 THR A 216 -11.448 -7.068 -10.041 1.00 0.00 O ATOM 1187 CG2 THR A 216 -12.247 -4.804 -10.296 1.00 0.00 C ATOM 0 H THR A 216 -12.283 -7.434 -6.892 1.00 0.00 H new ATOM 0 HA THR A 216 -10.802 -5.200 -8.089 1.00 0.00 H new ATOM 0 HB THR A 216 -13.285 -6.413 -9.352 1.00 0.00 H new ATOM 0 HG1 THR A 216 -11.784 -7.259 -10.942 1.00 0.00 H new ATOM 0 HG21 THR A 216 -12.616 -5.046 -11.293 1.00 0.00 H new ATOM 0 HG22 THR A 216 -12.888 -4.046 -9.846 1.00 0.00 H new ATOM 0 HG23 THR A 216 -11.229 -4.421 -10.369 1.00 0.00 H new ATOM 1195 N MET A 217 -12.321 -3.758 -6.758 1.00 0.00 N ATOM 1196 CA MET A 217 -13.204 -2.849 -6.038 1.00 0.00 C ATOM 1197 C MET A 217 -14.567 -2.760 -6.719 1.00 0.00 C ATOM 1198 O MET A 217 -14.721 -3.087 -7.895 1.00 0.00 O ATOM 1199 CB MET A 217 -12.575 -1.457 -5.947 1.00 0.00 C ATOM 1200 CG MET A 217 -11.629 -1.294 -4.768 1.00 0.00 C ATOM 1201 SD MET A 217 -10.656 -2.777 -4.447 1.00 0.00 S ATOM 1202 CE MET A 217 -11.116 -3.124 -2.751 1.00 0.00 C ATOM 0 H MET A 217 -11.351 -3.447 -6.815 1.00 0.00 H new ATOM 0 HA MET A 217 -13.346 -3.243 -5.031 1.00 0.00 H new ATOM 0 HB2 MET A 217 -12.032 -1.252 -6.869 1.00 0.00 H new ATOM 0 HB3 MET A 217 -13.368 -0.713 -5.872 1.00 0.00 H new ATOM 0 HG2 MET A 217 -10.957 -0.458 -4.960 1.00 0.00 H new ATOM 0 HG3 MET A 217 -12.205 -1.042 -3.877 1.00 0.00 H new ATOM 0 HE1 MET A 217 -10.383 -3.797 -2.306 1.00 0.00 H new ATOM 0 HE2 MET A 217 -11.146 -2.193 -2.184 1.00 0.00 H new ATOM 0 HE3 MET A 217 -12.099 -3.594 -2.730 1.00 0.00 H new ATOM 1212 N PRO A 218 -15.579 -2.308 -5.963 1.00 0.00 N ATOM 1213 CA PRO A 218 -16.945 -2.166 -6.474 1.00 0.00 C ATOM 1214 C PRO A 218 -17.089 -0.982 -7.424 1.00 0.00 C ATOM 1215 O PRO A 218 -17.153 0.168 -6.993 1.00 0.00 O ATOM 1216 CB PRO A 218 -17.775 -1.940 -5.208 1.00 0.00 C ATOM 1217 CG PRO A 218 -16.828 -1.319 -4.240 1.00 0.00 C ATOM 1218 CD PRO A 218 -15.467 -1.900 -4.553 1.00 0.00 C ATOM 0 HA PRO A 218 -17.255 -3.035 -7.055 1.00 0.00 H new ATOM 0 HB2 PRO A 218 -18.626 -1.287 -5.404 1.00 0.00 H new ATOM 0 HB3 PRO A 218 -18.175 -2.878 -4.824 1.00 0.00 H new ATOM 0 HG2 PRO A 218 -16.821 -0.234 -4.343 1.00 0.00 H new ATOM 0 HG3 PRO A 218 -17.119 -1.540 -3.213 1.00 0.00 H new ATOM 0 HD2 PRO A 218 -14.675 -1.165 -4.410 1.00 0.00 H new ATOM 0 HD3 PRO A 218 -15.235 -2.747 -3.908 1.00 0.00 H new ATOM 1226 N GLY A 219 -17.140 -1.273 -8.721 1.00 0.00 N ATOM 1227 CA GLY A 219 -17.276 -0.221 -9.712 1.00 0.00 C ATOM 1228 C GLY A 219 -16.146 -0.226 -10.722 1.00 0.00 C ATOM 1229 O GLY A 219 -16.383 -0.190 -11.929 1.00 0.00 O ATOM 0 H GLY A 219 -17.090 -2.218 -9.103 1.00 0.00 H new ATOM 0 HA2 GLY A 219 -18.226 -0.338 -10.234 1.00 0.00 H new ATOM 0 HA3 GLY A 219 -17.306 0.746 -9.209 1.00 0.00 H new ATOM 1233 N ALA A 220 -14.913 -0.270 -10.227 1.00 0.00 N ATOM 1234 CA ALA A 220 -13.742 -0.279 -11.095 1.00 0.00 C ATOM 1235 C ALA A 220 -13.689 -1.553 -11.932 1.00 0.00 C ATOM 1236 O ALA A 220 -14.170 -2.605 -11.510 1.00 0.00 O ATOM 1237 CB ALA A 220 -12.472 -0.135 -10.269 1.00 0.00 C ATOM 0 H ALA A 220 -14.700 -0.300 -9.230 1.00 0.00 H new ATOM 0 HA ALA A 220 -13.818 0.569 -11.776 1.00 0.00 H new ATOM 0 HB1 ALA A 220 -11.605 -0.143 -10.930 1.00 0.00 H new ATOM 0 HB2 ALA A 220 -12.500 0.806 -9.719 1.00 0.00 H new ATOM 0 HB3 ALA A 220 -12.400 -0.964 -9.565 1.00 0.00 H new ATOM 1243 N SER A 221 -13.102 -1.451 -13.120 1.00 0.00 N ATOM 1244 CA SER A 221 -12.991 -2.595 -14.018 1.00 0.00 C ATOM 1245 C SER A 221 -11.640 -3.285 -13.854 1.00 0.00 C ATOM 1246 O SER A 221 -11.461 -4.430 -14.269 1.00 0.00 O ATOM 1247 CB SER A 221 -13.175 -2.150 -15.470 1.00 0.00 C ATOM 1248 OG SER A 221 -14.320 -1.326 -15.609 1.00 0.00 O ATOM 0 H SER A 221 -12.696 -0.589 -13.483 1.00 0.00 H new ATOM 0 HA SER A 221 -13.777 -3.305 -13.760 1.00 0.00 H new ATOM 0 HB2 SER A 221 -12.290 -1.608 -15.802 1.00 0.00 H new ATOM 0 HB3 SER A 221 -13.273 -3.025 -16.112 1.00 0.00 H new ATOM 0 HG SER A 221 -14.415 -1.053 -16.545 1.00 0.00 H new ATOM 1254 N SER A 222 -10.692 -2.579 -13.246 1.00 0.00 N ATOM 1255 CA SER A 222 -9.355 -3.121 -13.029 1.00 0.00 C ATOM 1256 C SER A 222 -9.201 -3.632 -11.600 1.00 0.00 C ATOM 1257 O SER A 222 -9.776 -3.075 -10.665 1.00 0.00 O ATOM 1258 CB SER A 222 -8.297 -2.055 -13.319 1.00 0.00 C ATOM 1259 OG SER A 222 -7.093 -2.644 -13.781 1.00 0.00 O ATOM 0 H SER A 222 -10.825 -1.631 -12.895 1.00 0.00 H new ATOM 0 HA SER A 222 -9.214 -3.958 -13.712 1.00 0.00 H new ATOM 0 HB2 SER A 222 -8.674 -1.357 -14.067 1.00 0.00 H new ATOM 0 HB3 SER A 222 -8.100 -1.478 -12.415 1.00 0.00 H new ATOM 0 HG SER A 222 -6.433 -1.942 -13.961 1.00 0.00 H new ATOM 1265 N SER A 223 -8.420 -4.696 -11.440 1.00 0.00 N ATOM 1266 CA SER A 223 -8.192 -5.285 -10.126 1.00 0.00 C ATOM 1267 C SER A 223 -7.518 -4.285 -9.191 1.00 0.00 C ATOM 1268 O SER A 223 -6.807 -3.383 -9.636 1.00 0.00 O ATOM 1269 CB SER A 223 -7.332 -6.544 -10.250 1.00 0.00 C ATOM 1270 OG SER A 223 -6.441 -6.446 -11.348 1.00 0.00 O ATOM 0 H SER A 223 -7.935 -5.167 -12.204 1.00 0.00 H new ATOM 0 HA SER A 223 -9.160 -5.555 -9.704 1.00 0.00 H new ATOM 0 HB2 SER A 223 -6.766 -6.694 -9.331 1.00 0.00 H new ATOM 0 HB3 SER A 223 -7.974 -7.416 -10.375 1.00 0.00 H new ATOM 0 HG SER A 223 -6.865 -6.820 -12.148 1.00 0.00 H new ATOM 1276 N LEU A 224 -7.747 -4.452 -7.893 1.00 0.00 N ATOM 1277 CA LEU A 224 -7.162 -3.564 -6.893 1.00 0.00 C ATOM 1278 C LEU A 224 -5.733 -3.186 -7.270 1.00 0.00 C ATOM 1279 O LEU A 224 -5.043 -3.936 -7.960 1.00 0.00 O ATOM 1280 CB LEU A 224 -7.180 -4.233 -5.517 1.00 0.00 C ATOM 1281 CG LEU A 224 -6.617 -3.404 -4.362 1.00 0.00 C ATOM 1282 CD1 LEU A 224 -7.463 -2.160 -4.136 1.00 0.00 C ATOM 1283 CD2 LEU A 224 -6.544 -4.240 -3.092 1.00 0.00 C ATOM 0 H LEU A 224 -8.333 -5.193 -7.508 1.00 0.00 H new ATOM 0 HA LEU A 224 -7.760 -2.654 -6.855 1.00 0.00 H new ATOM 0 HB2 LEU A 224 -8.209 -4.500 -5.278 1.00 0.00 H new ATOM 0 HB3 LEU A 224 -6.615 -5.163 -5.580 1.00 0.00 H new ATOM 0 HG LEU A 224 -5.607 -3.089 -4.624 1.00 0.00 H new ATOM 0 HD11 LEU A 224 -7.047 -1.582 -3.310 1.00 0.00 H new ATOM 0 HD12 LEU A 224 -7.464 -1.551 -5.040 1.00 0.00 H new ATOM 0 HD13 LEU A 224 -8.485 -2.454 -3.895 1.00 0.00 H new ATOM 0 HD21 LEU A 224 -6.141 -3.634 -2.280 1.00 0.00 H new ATOM 0 HD22 LEU A 224 -7.543 -4.585 -2.826 1.00 0.00 H new ATOM 0 HD23 LEU A 224 -5.896 -5.100 -3.259 1.00 0.00 H new ATOM 1295 N VAL A 225 -5.295 -2.019 -6.809 1.00 0.00 N ATOM 1296 CA VAL A 225 -3.947 -1.542 -7.095 1.00 0.00 C ATOM 1297 C VAL A 225 -3.197 -1.210 -5.809 1.00 0.00 C ATOM 1298 O VAL A 225 -3.447 -0.182 -5.180 1.00 0.00 O ATOM 1299 CB VAL A 225 -3.972 -0.295 -7.998 1.00 0.00 C ATOM 1300 CG1 VAL A 225 -2.561 0.220 -8.237 1.00 0.00 C ATOM 1301 CG2 VAL A 225 -4.665 -0.606 -9.316 1.00 0.00 C ATOM 0 H VAL A 225 -5.854 -1.387 -6.236 1.00 0.00 H new ATOM 0 HA VAL A 225 -3.430 -2.348 -7.616 1.00 0.00 H new ATOM 0 HB VAL A 225 -4.538 0.487 -7.492 1.00 0.00 H new ATOM 0 HG11 VAL A 225 -2.599 1.101 -8.877 1.00 0.00 H new ATOM 0 HG12 VAL A 225 -2.103 0.484 -7.283 1.00 0.00 H new ATOM 0 HG13 VAL A 225 -1.968 -0.555 -8.722 1.00 0.00 H new ATOM 0 HG21 VAL A 225 -4.674 0.286 -9.942 1.00 0.00 H new ATOM 0 HG22 VAL A 225 -4.129 -1.404 -9.829 1.00 0.00 H new ATOM 0 HG23 VAL A 225 -5.690 -0.923 -9.122 1.00 0.00 H new ATOM 1311 N VAL A 226 -2.277 -2.088 -5.424 1.00 0.00 N ATOM 1312 CA VAL A 226 -1.489 -1.888 -4.213 1.00 0.00 C ATOM 1313 C VAL A 226 0.002 -2.025 -4.499 1.00 0.00 C ATOM 1314 O VAL A 226 0.519 -3.133 -4.646 1.00 0.00 O ATOM 1315 CB VAL A 226 -1.884 -2.893 -3.114 1.00 0.00 C ATOM 1316 CG1 VAL A 226 -1.295 -2.477 -1.775 1.00 0.00 C ATOM 1317 CG2 VAL A 226 -3.397 -3.016 -3.025 1.00 0.00 C ATOM 0 H VAL A 226 -2.059 -2.945 -5.933 1.00 0.00 H new ATOM 0 HA VAL A 226 -1.698 -0.877 -3.863 1.00 0.00 H new ATOM 0 HB VAL A 226 -1.478 -3.870 -3.375 1.00 0.00 H new ATOM 0 HG11 VAL A 226 -1.584 -3.198 -1.011 1.00 0.00 H new ATOM 0 HG12 VAL A 226 -0.208 -2.444 -1.850 1.00 0.00 H new ATOM 0 HG13 VAL A 226 -1.670 -1.490 -1.503 1.00 0.00 H new ATOM 0 HG21 VAL A 226 -3.659 -3.730 -2.244 1.00 0.00 H new ATOM 0 HG22 VAL A 226 -3.828 -2.043 -2.787 1.00 0.00 H new ATOM 0 HG23 VAL A 226 -3.791 -3.363 -3.980 1.00 0.00 H new ATOM 1327 N LYS A 227 0.690 -0.891 -4.577 1.00 0.00 N ATOM 1328 CA LYS A 227 2.124 -0.882 -4.844 1.00 0.00 C ATOM 1329 C LYS A 227 2.884 -0.204 -3.709 1.00 0.00 C ATOM 1330 O LYS A 227 2.288 0.450 -2.853 1.00 0.00 O ATOM 1331 CB LYS A 227 2.413 -0.166 -6.165 1.00 0.00 C ATOM 1332 CG LYS A 227 1.823 1.232 -6.242 1.00 0.00 C ATOM 1333 CD LYS A 227 1.514 1.629 -7.675 1.00 0.00 C ATOM 1334 CE LYS A 227 2.712 2.290 -8.341 1.00 0.00 C ATOM 1335 NZ LYS A 227 2.301 3.196 -9.448 1.00 0.00 N ATOM 0 H LYS A 227 0.278 0.034 -4.459 1.00 0.00 H new ATOM 0 HA LYS A 227 2.461 -1.916 -4.917 1.00 0.00 H new ATOM 0 HB2 LYS A 227 3.492 -0.104 -6.306 1.00 0.00 H new ATOM 0 HB3 LYS A 227 2.018 -0.764 -6.986 1.00 0.00 H new ATOM 0 HG2 LYS A 227 0.911 1.276 -5.647 1.00 0.00 H new ATOM 0 HG3 LYS A 227 2.522 1.947 -5.808 1.00 0.00 H new ATOM 0 HD2 LYS A 227 1.222 0.746 -8.243 1.00 0.00 H new ATOM 0 HD3 LYS A 227 0.665 2.313 -7.689 1.00 0.00 H new ATOM 0 HE2 LYS A 227 3.274 2.856 -7.598 1.00 0.00 H new ATOM 0 HE3 LYS A 227 3.381 1.522 -8.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 3.145 3.627 -9.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 1.787 2.651 -10.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 1.683 3.944 -9.073 1.00 0.00 H new ATOM 1349 N PHE A 228 4.204 -0.363 -3.709 1.00 0.00 N ATOM 1350 CA PHE A 228 5.046 0.235 -2.679 1.00 0.00 C ATOM 1351 C PHE A 228 5.133 1.747 -2.858 1.00 0.00 C ATOM 1352 O PHE A 228 5.167 2.249 -3.981 1.00 0.00 O ATOM 1353 CB PHE A 228 6.447 -0.377 -2.718 1.00 0.00 C ATOM 1354 CG PHE A 228 6.451 -1.875 -2.612 1.00 0.00 C ATOM 1355 CD1 PHE A 228 6.361 -2.496 -1.376 1.00 0.00 C ATOM 1356 CD2 PHE A 228 6.545 -2.663 -3.748 1.00 0.00 C ATOM 1357 CE1 PHE A 228 6.363 -3.874 -1.275 1.00 0.00 C ATOM 1358 CE2 PHE A 228 6.548 -4.042 -3.653 1.00 0.00 C ATOM 1359 CZ PHE A 228 6.458 -4.648 -2.415 1.00 0.00 C ATOM 0 H PHE A 228 4.713 -0.901 -4.410 1.00 0.00 H new ATOM 0 HA PHE A 228 4.594 0.028 -1.709 1.00 0.00 H new ATOM 0 HB2 PHE A 228 6.936 -0.085 -3.647 1.00 0.00 H new ATOM 0 HB3 PHE A 228 7.039 0.038 -1.902 1.00 0.00 H new ATOM 0 HD1 PHE A 228 6.288 -1.896 -0.481 1.00 0.00 H new ATOM 0 HD2 PHE A 228 6.617 -2.194 -4.718 1.00 0.00 H new ATOM 0 HE1 PHE A 228 6.290 -4.345 -0.306 1.00 0.00 H new ATOM 0 HE2 PHE A 228 6.621 -4.645 -4.546 1.00 0.00 H new ATOM 0 HZ PHE A 228 6.462 -5.725 -2.339 1.00 0.00 H new