USER MOD reduce.3.24.130724 H: found=0, std=0, add=728, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 730 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: B 368 ASN : amide:sc= 0 X(o=-0.091,f=-0.45) USER MOD Set 1.2: B 369 GLN : amide:sc= -0.0909 K(o=-0.091,f=-0.79) USER MOD Set 2.1: A 221 ASN : amide:sc= 2.77 K(o=4.5,f=-6.1!) USER MOD Set 2.2: B 315 LYS NZ :NH3+ 178:sc= 1.31 (180deg=0) USER MOD Set 2.3: B 325 TYR OH : rot 110:sc= 0.453 USER MOD Single : A 218 MET CE :methyl 134:sc= -0.224 (180deg=-1.11) USER MOD Single : A 223 THR OG1 : rot 101:sc= 1.27 USER MOD Single : B 305 ASN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : B 306 HIS : no HD1:sc= 1.1 K(o=1.1,f=-5.6!) USER MOD Single : B 309 ASN : amide:sc= 0.865 K(o=0.86,f=0) USER MOD Single : B 310 TYR OH : rot 21:sc= -1.17! USER MOD Single : B 312 ASN :FLIP amide:sc= 0 F(o=-0.52,f=0) USER MOD Single : B 313 LYS NZ :NH3+ 140:sc= 1.23 (180deg=1.08) USER MOD Single : B 316 ASN :FLIP amide:sc= -0.0109 F(o=-1.1,f=-0.011) USER MOD Single : B 319 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 321 GLN :FLIP amide:sc= 0 F(o=-0.82,f=0) USER MOD Single : B 326 LYS NZ :NH3+ 180:sc= -0.171 (180deg=-0.171) USER MOD Single : B 333 HIS : no HE2:sc= 1.03 K(o=1,f=-5.2!) USER MOD Single : B 334 THR OG1 : rot 76:sc= 1.22 USER MOD Single : B 335 TYR OH : rot 180:sc= 0 USER MOD Single : B 336 GLN : amide:sc= -0.278 K(o=-0.28,f=-1.3) USER MOD Single : B 337 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 339 GLN : amide:sc= -0.0833 K(o=-0.083,f=-4.1!) USER MOD Single : B 341 ASN :FLIP amide:sc= -0.0185 F(o=-1.1,f=-0.019) USER MOD Single : B 343 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 354 THR OG1 : rot -36:sc= 0.0494 USER MOD Single : B 356 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : B 359 TYR OH : rot 180:sc= 0 USER MOD Single : B 361 GLN : amide:sc= -0.191 X(o=-0.19,f=-0.16) USER MOD Single : B 367 LYS NZ :NH3+ 171:sc=-0.00789 (180deg=-0.153) USER MOD Single : B 374 SER OG : rot 180:sc= 0 USER MOD Single : B 378 GLN : amide:sc= -0.3 K(o=-0.3,f=-2.6!) USER MOD ----------------------------------------------------------------- ATOM 178 N ARG A 208 6.281 9.275 -0.154 1.00 0.00 N ATOM 179 CA ARG A 208 6.736 7.951 0.237 1.00 0.00 C ATOM 180 C ARG A 208 6.376 6.926 -0.829 1.00 0.00 C ATOM 181 O ARG A 208 5.220 6.843 -1.245 1.00 0.00 O ATOM 182 CB ARG A 208 6.101 7.535 1.569 1.00 0.00 C ATOM 183 CG ARG A 208 6.544 8.367 2.756 1.00 0.00 C ATOM 184 CD ARG A 208 5.761 7.992 4.003 1.00 0.00 C ATOM 185 NE ARG A 208 6.283 8.652 5.194 1.00 0.00 N ATOM 186 CZ ARG A 208 5.569 9.466 5.973 1.00 0.00 C ATOM 187 NH1 ARG A 208 4.317 9.783 5.656 1.00 0.00 N ATOM 188 NH2 ARG A 208 6.111 9.980 7.066 1.00 0.00 N ATOM 0 HA ARG A 208 7.819 7.989 0.350 1.00 0.00 H new ATOM 0 HB2 ARG A 208 5.017 7.601 1.478 1.00 0.00 H new ATOM 0 HB3 ARG A 208 6.342 6.490 1.762 1.00 0.00 H new ATOM 0 HG2 ARG A 208 7.609 8.218 2.932 1.00 0.00 H new ATOM 0 HG3 ARG A 208 6.402 9.425 2.537 1.00 0.00 H new ATOM 0 HD2 ARG A 208 4.714 8.262 3.868 1.00 0.00 H new ATOM 0 HD3 ARG A 208 5.796 6.912 4.142 1.00 0.00 H new ATOM 0 HE ARG A 208 7.256 8.480 5.447 1.00 0.00 H new ATOM 0 HH11 ARG A 208 3.893 9.403 4.810 1.00 0.00 H new ATOM 0 HH12 ARG A 208 3.780 10.406 6.259 1.00 0.00 H new ATOM 0 HH21 ARG A 208 7.075 9.754 7.312 1.00 0.00 H new ATOM 0 HH22 ARG A 208 5.565 10.602 7.662 1.00 0.00 H new ATOM 202 N PRO A 209 7.357 6.140 -1.295 1.00 0.00 N ATOM 203 CA PRO A 209 7.101 5.009 -2.193 1.00 0.00 C ATOM 204 C PRO A 209 6.170 3.985 -1.541 1.00 0.00 C ATOM 205 O PRO A 209 5.447 3.257 -2.216 1.00 0.00 O ATOM 206 CB PRO A 209 8.490 4.408 -2.431 1.00 0.00 C ATOM 207 CG PRO A 209 9.446 5.504 -2.101 1.00 0.00 C ATOM 208 CD PRO A 209 8.792 6.303 -1.011 1.00 0.00 C ATOM 0 HA PRO A 209 6.607 5.313 -3.116 1.00 0.00 H new ATOM 0 HB2 PRO A 209 8.656 3.536 -1.799 1.00 0.00 H new ATOM 0 HB3 PRO A 209 8.607 4.080 -3.464 1.00 0.00 H new ATOM 0 HG2 PRO A 209 10.403 5.101 -1.770 1.00 0.00 H new ATOM 0 HG3 PRO A 209 9.646 6.125 -2.974 1.00 0.00 H new ATOM 0 HD2 PRO A 209 9.053 5.926 -0.022 1.00 0.00 H new ATOM 0 HD3 PRO A 209 9.093 7.350 -1.042 1.00 0.00 H new ATOM 216 N PHE A 210 6.186 3.950 -0.214 1.00 0.00 N ATOM 217 CA PHE A 210 5.278 3.101 0.547 1.00 0.00 C ATOM 218 C PHE A 210 3.835 3.570 0.358 1.00 0.00 C ATOM 219 O PHE A 210 2.914 2.763 0.242 1.00 0.00 O ATOM 220 CB PHE A 210 5.666 3.142 2.028 1.00 0.00 C ATOM 221 CG PHE A 210 4.858 2.235 2.912 1.00 0.00 C ATOM 222 CD1 PHE A 210 4.974 0.859 2.808 1.00 0.00 C ATOM 223 CD2 PHE A 210 3.997 2.761 3.860 1.00 0.00 C ATOM 224 CE1 PHE A 210 4.244 0.025 3.632 1.00 0.00 C ATOM 225 CE2 PHE A 210 3.263 1.933 4.685 1.00 0.00 C ATOM 226 CZ PHE A 210 3.387 0.564 4.572 1.00 0.00 C ATOM 0 H PHE A 210 6.822 4.503 0.360 1.00 0.00 H new ATOM 0 HA PHE A 210 5.354 2.075 0.187 1.00 0.00 H new ATOM 0 HB2 PHE A 210 6.719 2.875 2.122 1.00 0.00 H new ATOM 0 HB3 PHE A 210 5.563 4.165 2.389 1.00 0.00 H new ATOM 0 HD1 PHE A 210 5.643 0.433 2.074 1.00 0.00 H new ATOM 0 HD2 PHE A 210 3.898 3.832 3.955 1.00 0.00 H new ATOM 0 HE1 PHE A 210 4.343 -1.047 3.542 1.00 0.00 H new ATOM 0 HE2 PHE A 210 2.592 2.357 5.418 1.00 0.00 H new ATOM 0 HZ PHE A 210 2.815 -0.086 5.218 1.00 0.00 H new ATOM 236 N GLU A 211 3.664 4.886 0.293 1.00 0.00 N ATOM 237 CA GLU A 211 2.348 5.495 0.140 1.00 0.00 C ATOM 238 C GLU A 211 1.729 5.125 -1.203 1.00 0.00 C ATOM 239 O GLU A 211 0.582 4.680 -1.270 1.00 0.00 O ATOM 240 CB GLU A 211 2.464 7.015 0.254 1.00 0.00 C ATOM 241 CG GLU A 211 1.143 7.747 0.094 1.00 0.00 C ATOM 242 CD GLU A 211 1.310 9.250 0.114 1.00 0.00 C ATOM 243 OE1 GLU A 211 1.426 9.818 1.220 1.00 0.00 O ATOM 244 OE2 GLU A 211 1.333 9.867 -0.975 1.00 0.00 O ATOM 0 H GLU A 211 4.430 5.558 0.345 1.00 0.00 H new ATOM 0 HA GLU A 211 1.702 5.118 0.932 1.00 0.00 H new ATOM 0 HB2 GLU A 211 2.891 7.265 1.225 1.00 0.00 H new ATOM 0 HB3 GLU A 211 3.161 7.374 -0.503 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.677 7.449 -0.845 1.00 0.00 H new ATOM 0 HG3 GLU A 211 0.466 7.449 0.895 1.00 0.00 H new ATOM 251 N LEU A 212 2.497 5.305 -2.270 1.00 0.00 N ATOM 252 CA LEU A 212 2.013 5.007 -3.610 1.00 0.00 C ATOM 253 C LEU A 212 1.760 3.511 -3.785 1.00 0.00 C ATOM 254 O LEU A 212 0.948 3.109 -4.616 1.00 0.00 O ATOM 255 CB LEU A 212 2.972 5.557 -4.678 1.00 0.00 C ATOM 256 CG LEU A 212 4.447 5.169 -4.534 1.00 0.00 C ATOM 257 CD1 LEU A 212 4.720 3.804 -5.144 1.00 0.00 C ATOM 258 CD2 LEU A 212 5.336 6.221 -5.170 1.00 0.00 C ATOM 0 H LEU A 212 3.454 5.655 -2.233 1.00 0.00 H new ATOM 0 HA LEU A 212 1.056 5.512 -3.745 1.00 0.00 H new ATOM 0 HB2 LEU A 212 2.624 5.221 -5.655 1.00 0.00 H new ATOM 0 HB3 LEU A 212 2.903 6.645 -4.672 1.00 0.00 H new ATOM 0 HG LEU A 212 4.676 5.112 -3.470 1.00 0.00 H new ATOM 0 HD11 LEU A 212 5.775 3.557 -5.026 1.00 0.00 H new ATOM 0 HD12 LEU A 212 4.113 3.052 -4.640 1.00 0.00 H new ATOM 0 HD13 LEU A 212 4.468 3.822 -6.204 1.00 0.00 H new ATOM 0 HD21 LEU A 212 6.381 5.930 -5.059 1.00 0.00 H new ATOM 0 HD22 LEU A 212 5.095 6.309 -6.229 1.00 0.00 H new ATOM 0 HD23 LEU A 212 5.172 7.181 -4.679 1.00 0.00 H new ATOM 270 N LEU A 213 2.441 2.690 -2.990 1.00 0.00 N ATOM 271 CA LEU A 213 2.194 1.255 -3.002 1.00 0.00 C ATOM 272 C LEU A 213 0.836 0.957 -2.386 1.00 0.00 C ATOM 273 O LEU A 213 0.086 0.123 -2.890 1.00 0.00 O ATOM 274 CB LEU A 213 3.270 0.493 -2.234 1.00 0.00 C ATOM 275 CG LEU A 213 3.194 -1.026 -2.388 1.00 0.00 C ATOM 276 CD1 LEU A 213 3.726 -1.456 -3.742 1.00 0.00 C ATOM 277 CD2 LEU A 213 3.945 -1.723 -1.274 1.00 0.00 C ATOM 0 H LEU A 213 3.162 2.992 -2.335 1.00 0.00 H new ATOM 0 HA LEU A 213 2.215 0.926 -4.041 1.00 0.00 H new ATOM 0 HB2 LEU A 213 4.250 0.832 -2.571 1.00 0.00 H new ATOM 0 HB3 LEU A 213 3.192 0.744 -1.176 1.00 0.00 H new ATOM 0 HG LEU A 213 2.146 -1.318 -2.323 1.00 0.00 H new ATOM 0 HD11 LEU A 213 3.663 -2.541 -3.830 1.00 0.00 H new ATOM 0 HD12 LEU A 213 3.132 -0.993 -4.530 1.00 0.00 H new ATOM 0 HD13 LEU A 213 4.766 -1.144 -3.840 1.00 0.00 H new ATOM 0 HD21 LEU A 213 3.875 -2.802 -1.408 1.00 0.00 H new ATOM 0 HD22 LEU A 213 4.992 -1.422 -1.297 1.00 0.00 H new ATOM 0 HD23 LEU A 213 3.509 -1.447 -0.314 1.00 0.00 H new ATOM 289 N ILE A 214 0.525 1.642 -1.288 1.00 0.00 N ATOM 290 CA ILE A 214 -0.779 1.510 -0.650 1.00 0.00 C ATOM 291 C ILE A 214 -1.882 1.905 -1.628 1.00 0.00 C ATOM 292 O ILE A 214 -2.907 1.229 -1.734 1.00 0.00 O ATOM 293 CB ILE A 214 -0.884 2.383 0.620 1.00 0.00 C ATOM 294 CG1 ILE A 214 0.194 1.988 1.631 1.00 0.00 C ATOM 295 CG2 ILE A 214 -2.265 2.252 1.244 1.00 0.00 C ATOM 296 CD1 ILE A 214 0.222 2.866 2.864 1.00 0.00 C ATOM 0 H ILE A 214 1.158 2.293 -0.823 1.00 0.00 H new ATOM 0 HA ILE A 214 -0.897 0.467 -0.358 1.00 0.00 H new ATOM 0 HB ILE A 214 -0.729 3.424 0.335 1.00 0.00 H new ATOM 0 HG12 ILE A 214 0.033 0.954 1.936 1.00 0.00 H new ATOM 0 HG13 ILE A 214 1.169 2.029 1.144 1.00 0.00 H new ATOM 0 HG21 ILE A 214 -2.321 2.874 2.138 1.00 0.00 H new ATOM 0 HG22 ILE A 214 -3.020 2.577 0.528 1.00 0.00 H new ATOM 0 HG23 ILE A 214 -2.445 1.211 1.514 1.00 0.00 H new ATOM 0 HD11 ILE A 214 1.011 2.526 3.535 1.00 0.00 H new ATOM 0 HD12 ILE A 214 0.414 3.898 2.571 1.00 0.00 H new ATOM 0 HD13 ILE A 214 -0.739 2.807 3.375 1.00 0.00 H new ATOM 308 N ALA A 215 -1.655 2.998 -2.347 1.00 0.00 N ATOM 309 CA ALA A 215 -2.588 3.451 -3.368 1.00 0.00 C ATOM 310 C ALA A 215 -2.718 2.406 -4.471 1.00 0.00 C ATOM 311 O ALA A 215 -3.821 2.106 -4.927 1.00 0.00 O ATOM 312 CB ALA A 215 -2.139 4.785 -3.945 1.00 0.00 C ATOM 0 H ALA A 215 -0.830 3.588 -2.240 1.00 0.00 H new ATOM 0 HA ALA A 215 -3.566 3.588 -2.907 1.00 0.00 H new ATOM 0 HB1 ALA A 215 -2.848 5.109 -4.707 1.00 0.00 H new ATOM 0 HB2 ALA A 215 -2.096 5.529 -3.150 1.00 0.00 H new ATOM 0 HB3 ALA A 215 -1.151 4.674 -4.392 1.00 0.00 H new ATOM 318 N ALA A 216 -1.582 1.846 -4.879 1.00 0.00 N ATOM 319 CA ALA A 216 -1.555 0.791 -5.884 1.00 0.00 C ATOM 320 C ALA A 216 -2.381 -0.410 -5.436 1.00 0.00 C ATOM 321 O ALA A 216 -3.226 -0.910 -6.181 1.00 0.00 O ATOM 322 CB ALA A 216 -0.120 0.366 -6.163 1.00 0.00 C ATOM 0 H ALA A 216 -0.662 2.109 -4.525 1.00 0.00 H new ATOM 0 HA ALA A 216 -1.993 1.184 -6.801 1.00 0.00 H new ATOM 0 HB1 ALA A 216 -0.114 -0.423 -6.915 1.00 0.00 H new ATOM 0 HB2 ALA A 216 0.448 1.221 -6.529 1.00 0.00 H new ATOM 0 HB3 ALA A 216 0.335 -0.005 -5.245 1.00 0.00 H new ATOM 328 N ALA A 217 -2.137 -0.863 -4.211 1.00 0.00 N ATOM 329 CA ALA A 217 -2.870 -1.991 -3.650 1.00 0.00 C ATOM 330 C ALA A 217 -4.362 -1.683 -3.539 1.00 0.00 C ATOM 331 O ALA A 217 -5.200 -2.515 -3.882 1.00 0.00 O ATOM 332 CB ALA A 217 -2.306 -2.365 -2.287 1.00 0.00 C ATOM 0 H ALA A 217 -1.435 -0.465 -3.587 1.00 0.00 H new ATOM 0 HA ALA A 217 -2.750 -2.837 -4.327 1.00 0.00 H new ATOM 0 HB1 ALA A 217 -2.864 -3.209 -1.881 1.00 0.00 H new ATOM 0 HB2 ALA A 217 -1.256 -2.640 -2.391 1.00 0.00 H new ATOM 0 HB3 ALA A 217 -2.393 -1.514 -1.611 1.00 0.00 H new ATOM 338 N MET A 218 -4.681 -0.482 -3.073 1.00 0.00 N ATOM 339 CA MET A 218 -6.067 -0.061 -2.882 1.00 0.00 C ATOM 340 C MET A 218 -6.820 -0.035 -4.209 1.00 0.00 C ATOM 341 O MET A 218 -7.989 -0.411 -4.274 1.00 0.00 O ATOM 342 CB MET A 218 -6.102 1.333 -2.254 1.00 0.00 C ATOM 343 CG MET A 218 -7.439 1.695 -1.630 1.00 0.00 C ATOM 344 SD MET A 218 -7.697 0.883 -0.040 1.00 0.00 S ATOM 345 CE MET A 218 -6.360 1.585 0.927 1.00 0.00 C ATOM 0 H MET A 218 -3.992 0.226 -2.818 1.00 0.00 H new ATOM 0 HA MET A 218 -6.552 -0.779 -2.221 1.00 0.00 H new ATOM 0 HB2 MET A 218 -5.327 1.396 -1.490 1.00 0.00 H new ATOM 0 HB3 MET A 218 -5.857 2.071 -3.018 1.00 0.00 H new ATOM 0 HG2 MET A 218 -7.494 2.775 -1.496 1.00 0.00 H new ATOM 0 HG3 MET A 218 -8.243 1.417 -2.312 1.00 0.00 H new ATOM 0 HE1 MET A 218 -6.740 1.898 1.899 1.00 0.00 H new ATOM 0 HE2 MET A 218 -5.580 0.837 1.066 1.00 0.00 H new ATOM 0 HE3 MET A 218 -5.947 2.447 0.404 1.00 0.00 H new ATOM 355 N GLU A 219 -6.142 0.409 -5.259 1.00 0.00 N ATOM 356 CA GLU A 219 -6.771 0.568 -6.565 1.00 0.00 C ATOM 357 C GLU A 219 -6.859 -0.757 -7.322 1.00 0.00 C ATOM 358 O GLU A 219 -7.869 -1.044 -7.967 1.00 0.00 O ATOM 359 CB GLU A 219 -5.999 1.592 -7.401 1.00 0.00 C ATOM 360 CG GLU A 219 -6.605 1.834 -8.768 1.00 0.00 C ATOM 361 CD GLU A 219 -5.843 2.860 -9.573 1.00 0.00 C ATOM 362 OE1 GLU A 219 -4.904 2.471 -10.296 1.00 0.00 O ATOM 363 OE2 GLU A 219 -6.191 4.058 -9.500 1.00 0.00 O ATOM 0 H GLU A 219 -5.155 0.666 -5.233 1.00 0.00 H new ATOM 0 HA GLU A 219 -7.788 0.923 -6.396 1.00 0.00 H new ATOM 0 HB2 GLU A 219 -5.958 2.536 -6.858 1.00 0.00 H new ATOM 0 HB3 GLU A 219 -4.971 1.249 -7.523 1.00 0.00 H new ATOM 0 HG2 GLU A 219 -6.633 0.894 -9.319 1.00 0.00 H new ATOM 0 HG3 GLU A 219 -7.637 2.165 -8.650 1.00 0.00 H new ATOM 370 N ARG A 220 -5.803 -1.562 -7.249 1.00 0.00 N ATOM 371 CA ARG A 220 -5.746 -2.804 -8.016 1.00 0.00 C ATOM 372 C ARG A 220 -6.553 -3.918 -7.343 1.00 0.00 C ATOM 373 O ARG A 220 -6.749 -4.994 -7.911 1.00 0.00 O ATOM 374 CB ARG A 220 -4.293 -3.236 -8.222 1.00 0.00 C ATOM 375 CG ARG A 220 -4.152 -4.394 -9.191 1.00 0.00 C ATOM 376 CD ARG A 220 -2.716 -4.618 -9.621 1.00 0.00 C ATOM 377 NE ARG A 220 -2.627 -5.684 -10.615 1.00 0.00 N ATOM 378 CZ ARG A 220 -1.711 -5.739 -11.580 1.00 0.00 C ATOM 379 NH1 ARG A 220 -0.718 -4.859 -11.610 1.00 0.00 N ATOM 380 NH2 ARG A 220 -1.774 -6.694 -12.500 1.00 0.00 N ATOM 0 H ARG A 220 -4.982 -1.380 -6.672 1.00 0.00 H new ATOM 0 HA ARG A 220 -6.197 -2.617 -8.991 1.00 0.00 H new ATOM 0 HB2 ARG A 220 -3.716 -2.388 -8.591 1.00 0.00 H new ATOM 0 HB3 ARG A 220 -3.864 -3.519 -7.261 1.00 0.00 H new ATOM 0 HG2 ARG A 220 -4.534 -5.302 -8.725 1.00 0.00 H new ATOM 0 HG3 ARG A 220 -4.766 -4.204 -10.071 1.00 0.00 H new ATOM 0 HD2 ARG A 220 -2.308 -3.696 -10.035 1.00 0.00 H new ATOM 0 HD3 ARG A 220 -2.108 -4.874 -8.753 1.00 0.00 H new ATOM 0 HE ARG A 220 -3.313 -6.437 -10.567 1.00 0.00 H new ATOM 0 HH11 ARG A 220 -0.654 -4.137 -10.892 1.00 0.00 H new ATOM 0 HH12 ARG A 220 -0.018 -4.905 -12.351 1.00 0.00 H new ATOM 0 HH21 ARG A 220 -2.524 -7.385 -12.467 1.00 0.00 H new ATOM 0 HH22 ARG A 220 -1.073 -6.737 -13.239 1.00 0.00 H new ATOM 394 N ASN A 221 -7.026 -3.656 -6.137 1.00 0.00 N ATOM 395 CA ASN A 221 -7.850 -4.618 -5.419 1.00 0.00 C ATOM 396 C ASN A 221 -9.245 -4.046 -5.204 1.00 0.00 C ATOM 397 O ASN A 221 -9.446 -2.838 -5.325 1.00 0.00 O ATOM 398 CB ASN A 221 -7.216 -4.984 -4.071 1.00 0.00 C ATOM 399 CG ASN A 221 -5.963 -5.830 -4.214 1.00 0.00 C ATOM 400 OD1 ASN A 221 -6.024 -7.061 -4.238 1.00 0.00 O ATOM 401 ND2 ASN A 221 -4.820 -5.176 -4.300 1.00 0.00 N ATOM 0 H ASN A 221 -6.855 -2.786 -5.633 1.00 0.00 H new ATOM 0 HA ASN A 221 -7.922 -5.526 -6.018 1.00 0.00 H new ATOM 0 HB2 ASN A 221 -6.970 -4.069 -3.531 1.00 0.00 H new ATOM 0 HB3 ASN A 221 -7.945 -5.524 -3.468 1.00 0.00 H new ATOM 0 HD21 ASN A 221 -3.944 -5.690 -4.390 1.00 0.00 H new ATOM 0 HD22 ASN A 221 -4.813 -4.156 -4.276 1.00 0.00 H new ATOM 408 N PRO A 222 -10.231 -4.902 -4.884 1.00 0.00 N ATOM 409 CA PRO A 222 -11.610 -4.461 -4.614 1.00 0.00 C ATOM 410 C PRO A 222 -11.729 -3.622 -3.341 1.00 0.00 C ATOM 411 O PRO A 222 -12.820 -3.166 -3.005 1.00 0.00 O ATOM 412 CB PRO A 222 -12.383 -5.774 -4.453 1.00 0.00 C ATOM 413 CG PRO A 222 -11.353 -6.782 -4.082 1.00 0.00 C ATOM 414 CD PRO A 222 -10.099 -6.367 -4.794 1.00 0.00 C ATOM 0 HA PRO A 222 -11.984 -3.819 -5.411 1.00 0.00 H new ATOM 0 HB2 PRO A 222 -13.149 -5.690 -3.682 1.00 0.00 H new ATOM 0 HB3 PRO A 222 -12.890 -6.050 -5.377 1.00 0.00 H new ATOM 0 HG2 PRO A 222 -11.200 -6.806 -3.003 1.00 0.00 H new ATOM 0 HG3 PRO A 222 -11.660 -7.784 -4.383 1.00 0.00 H new ATOM 0 HD2 PRO A 222 -9.207 -6.657 -4.240 1.00 0.00 H new ATOM 0 HD3 PRO A 222 -10.025 -6.826 -5.780 1.00 0.00 H new ATOM 422 N THR A 223 -10.591 -3.428 -2.659 1.00 0.00 N ATOM 423 CA THR A 223 -10.498 -2.677 -1.400 1.00 0.00 C ATOM 424 C THR A 223 -11.715 -2.887 -0.488 1.00 0.00 C ATOM 425 O THR A 223 -12.687 -2.127 -0.512 1.00 0.00 O ATOM 426 CB THR A 223 -10.225 -1.161 -1.622 1.00 0.00 C ATOM 427 OG1 THR A 223 -10.259 -0.473 -0.367 1.00 0.00 O ATOM 428 CG2 THR A 223 -11.221 -0.515 -2.581 1.00 0.00 C ATOM 0 H THR A 223 -9.693 -3.796 -2.973 1.00 0.00 H new ATOM 0 HA THR A 223 -9.632 -3.092 -0.884 1.00 0.00 H new ATOM 0 HB THR A 223 -9.237 -1.080 -2.075 1.00 0.00 H new ATOM 0 HG1 THR A 223 -9.343 -0.310 -0.058 1.00 0.00 H new ATOM 0 HG21 THR A 223 -10.981 0.542 -2.697 1.00 0.00 H new ATOM 0 HG22 THR A 223 -11.165 -1.009 -3.551 1.00 0.00 H new ATOM 0 HG23 THR A 223 -12.230 -0.616 -2.181 1.00 0.00 H new ATOM 841 N VAL B 302 6.860 7.180 -12.225 1.00 0.00 N ATOM 842 CA VAL B 302 7.171 5.809 -12.610 1.00 0.00 C ATOM 843 C VAL B 302 7.049 4.851 -11.427 1.00 0.00 C ATOM 844 O VAL B 302 6.797 3.660 -11.610 1.00 0.00 O ATOM 845 CB VAL B 302 8.588 5.698 -13.217 1.00 0.00 C ATOM 846 CG1 VAL B 302 8.688 6.521 -14.493 1.00 0.00 C ATOM 847 CG2 VAL B 302 9.649 6.136 -12.216 1.00 0.00 C ATOM 0 HA VAL B 302 6.440 5.526 -13.367 1.00 0.00 H new ATOM 0 HB VAL B 302 8.768 4.651 -13.463 1.00 0.00 H new ATOM 0 HG11 VAL B 302 9.693 6.431 -14.906 1.00 0.00 H new ATOM 0 HG12 VAL B 302 7.962 6.155 -15.220 1.00 0.00 H new ATOM 0 HG13 VAL B 302 8.481 7.567 -14.268 1.00 0.00 H new ATOM 0 HG21 VAL B 302 10.636 6.048 -12.670 1.00 0.00 H new ATOM 0 HG22 VAL B 302 9.473 7.173 -11.929 1.00 0.00 H new ATOM 0 HG23 VAL B 302 9.598 5.502 -11.331 1.00 0.00 H new ATOM 857 N GLU B 303 7.196 5.374 -10.212 1.00 0.00 N ATOM 858 CA GLU B 303 7.150 4.535 -9.022 1.00 0.00 C ATOM 859 C GLU B 303 5.743 4.023 -8.754 1.00 0.00 C ATOM 860 O GLU B 303 5.572 2.987 -8.118 1.00 0.00 O ATOM 861 CB GLU B 303 7.693 5.270 -7.800 1.00 0.00 C ATOM 862 CG GLU B 303 9.204 5.402 -7.807 1.00 0.00 C ATOM 863 CD GLU B 303 9.745 5.981 -6.522 1.00 0.00 C ATOM 864 OE1 GLU B 303 9.685 7.215 -6.346 1.00 0.00 O ATOM 865 OE2 GLU B 303 10.247 5.196 -5.692 1.00 0.00 O ATOM 0 H GLU B 303 7.347 6.366 -10.028 1.00 0.00 H new ATOM 0 HA GLU B 303 7.791 3.675 -9.213 1.00 0.00 H new ATOM 0 HB2 GLU B 303 7.248 6.264 -7.754 1.00 0.00 H new ATOM 0 HB3 GLU B 303 7.385 4.741 -6.898 1.00 0.00 H new ATOM 0 HG2 GLU B 303 9.649 4.421 -7.974 1.00 0.00 H new ATOM 0 HG3 GLU B 303 9.505 6.036 -8.641 1.00 0.00 H new ATOM 872 N PHE B 304 4.736 4.728 -9.254 1.00 0.00 N ATOM 873 CA PHE B 304 3.366 4.260 -9.116 1.00 0.00 C ATOM 874 C PHE B 304 3.185 2.983 -9.931 1.00 0.00 C ATOM 875 O PHE B 304 2.627 2.002 -9.447 1.00 0.00 O ATOM 876 CB PHE B 304 2.364 5.328 -9.562 1.00 0.00 C ATOM 877 CG PHE B 304 0.934 4.970 -9.255 1.00 0.00 C ATOM 878 CD1 PHE B 304 0.454 5.039 -7.955 1.00 0.00 C ATOM 879 CD2 PHE B 304 0.073 4.558 -10.262 1.00 0.00 C ATOM 880 CE1 PHE B 304 -0.856 4.707 -7.667 1.00 0.00 C ATOM 881 CE2 PHE B 304 -1.237 4.225 -9.978 1.00 0.00 C ATOM 882 CZ PHE B 304 -1.703 4.299 -8.679 1.00 0.00 C ATOM 0 H PHE B 304 4.840 5.612 -9.751 1.00 0.00 H new ATOM 0 HA PHE B 304 3.173 4.051 -8.064 1.00 0.00 H new ATOM 0 HB2 PHE B 304 2.608 6.271 -9.073 1.00 0.00 H new ATOM 0 HB3 PHE B 304 2.469 5.489 -10.635 1.00 0.00 H new ATOM 0 HD1 PHE B 304 1.112 5.356 -7.159 1.00 0.00 H new ATOM 0 HD2 PHE B 304 0.431 4.497 -11.279 1.00 0.00 H new ATOM 0 HE1 PHE B 304 -1.218 4.766 -6.651 1.00 0.00 H new ATOM 0 HE2 PHE B 304 -1.897 3.907 -10.771 1.00 0.00 H new ATOM 0 HZ PHE B 304 -2.727 4.038 -8.456 1.00 0.00 H new ATOM 892 N ASN B 305 3.690 2.996 -11.162 1.00 0.00 N ATOM 893 CA ASN B 305 3.674 1.808 -12.013 1.00 0.00 C ATOM 894 C ASN B 305 4.592 0.736 -11.433 1.00 0.00 C ATOM 895 O ASN B 305 4.297 -0.462 -11.502 1.00 0.00 O ATOM 896 CB ASN B 305 4.097 2.166 -13.443 1.00 0.00 C ATOM 897 CG ASN B 305 4.253 0.944 -14.330 1.00 0.00 C ATOM 898 OD1 ASN B 305 5.347 0.396 -14.466 1.00 0.00 O ATOM 899 ND2 ASN B 305 3.158 0.503 -14.928 1.00 0.00 N ATOM 0 H ASN B 305 4.116 3.816 -11.593 1.00 0.00 H new ATOM 0 HA ASN B 305 2.658 1.415 -12.047 1.00 0.00 H new ATOM 0 HB2 ASN B 305 3.356 2.835 -13.880 1.00 0.00 H new ATOM 0 HB3 ASN B 305 5.040 2.711 -13.413 1.00 0.00 H new ATOM 0 HD21 ASN B 305 3.201 -0.321 -15.528 1.00 0.00 H new ATOM 0 HD22 ASN B 305 2.271 0.987 -14.789 1.00 0.00 H new ATOM 906 N HIS B 306 5.704 1.183 -10.856 1.00 0.00 N ATOM 907 CA HIS B 306 6.621 0.304 -10.138 1.00 0.00 C ATOM 908 C HIS B 306 5.871 -0.425 -9.025 1.00 0.00 C ATOM 909 O HIS B 306 6.057 -1.623 -8.814 1.00 0.00 O ATOM 910 CB HIS B 306 7.783 1.134 -9.565 1.00 0.00 C ATOM 911 CG HIS B 306 8.841 0.350 -8.841 1.00 0.00 C ATOM 912 ND1 HIS B 306 9.463 0.810 -7.695 1.00 0.00 N ATOM 913 CD2 HIS B 306 9.413 -0.846 -9.119 1.00 0.00 C ATOM 914 CE1 HIS B 306 10.373 -0.062 -7.311 1.00 0.00 C ATOM 915 NE2 HIS B 306 10.361 -1.075 -8.152 1.00 0.00 N ATOM 0 H HIS B 306 5.994 2.161 -10.873 1.00 0.00 H new ATOM 0 HA HIS B 306 7.029 -0.441 -10.821 1.00 0.00 H new ATOM 0 HB2 HIS B 306 8.255 1.679 -10.382 1.00 0.00 H new ATOM 0 HB3 HIS B 306 7.373 1.877 -8.881 1.00 0.00 H new ATOM 0 HD2 HIS B 306 9.169 -1.497 -9.946 1.00 0.00 H new ATOM 0 HE1 HIS B 306 11.020 0.037 -6.452 1.00 0.00 H new ATOM 0 HE2 HIS B 306 10.960 -1.898 -8.095 1.00 0.00 H new ATOM 924 N ALA B 307 5.008 0.308 -8.331 1.00 0.00 N ATOM 925 CA ALA B 307 4.174 -0.263 -7.287 1.00 0.00 C ATOM 926 C ALA B 307 3.131 -1.207 -7.869 1.00 0.00 C ATOM 927 O ALA B 307 2.954 -2.318 -7.377 1.00 0.00 O ATOM 928 CB ALA B 307 3.499 0.842 -6.499 1.00 0.00 C ATOM 0 H ALA B 307 4.869 1.308 -8.477 1.00 0.00 H new ATOM 0 HA ALA B 307 4.814 -0.840 -6.619 1.00 0.00 H new ATOM 0 HB1 ALA B 307 2.876 0.404 -5.719 1.00 0.00 H new ATOM 0 HB2 ALA B 307 4.257 1.479 -6.043 1.00 0.00 H new ATOM 0 HB3 ALA B 307 2.878 1.438 -7.167 1.00 0.00 H new ATOM 934 N ILE B 308 2.451 -0.756 -8.920 1.00 0.00 N ATOM 935 CA ILE B 308 1.438 -1.561 -9.601 1.00 0.00 C ATOM 936 C ILE B 308 1.986 -2.947 -9.943 1.00 0.00 C ATOM 937 O ILE B 308 1.361 -3.969 -9.640 1.00 0.00 O ATOM 938 CB ILE B 308 0.946 -0.865 -10.896 1.00 0.00 C ATOM 939 CG1 ILE B 308 0.252 0.464 -10.570 1.00 0.00 C ATOM 940 CG2 ILE B 308 0.009 -1.771 -11.686 1.00 0.00 C ATOM 941 CD1 ILE B 308 -0.983 0.319 -9.704 1.00 0.00 C ATOM 0 H ILE B 308 2.585 0.172 -9.322 1.00 0.00 H new ATOM 0 HA ILE B 308 0.594 -1.668 -8.919 1.00 0.00 H new ATOM 0 HB ILE B 308 1.820 -0.658 -11.513 1.00 0.00 H new ATOM 0 HG12 ILE B 308 0.962 1.119 -10.065 1.00 0.00 H new ATOM 0 HG13 ILE B 308 -0.026 0.955 -11.503 1.00 0.00 H new ATOM 0 HG21 ILE B 308 -0.320 -1.256 -12.589 1.00 0.00 H new ATOM 0 HG22 ILE B 308 0.534 -2.686 -11.961 1.00 0.00 H new ATOM 0 HG23 ILE B 308 -0.858 -2.020 -11.074 1.00 0.00 H new ATOM 0 HD11 ILE B 308 -1.415 1.302 -9.519 1.00 0.00 H new ATOM 0 HD12 ILE B 308 -1.714 -0.308 -10.215 1.00 0.00 H new ATOM 0 HD13 ILE B 308 -0.710 -0.142 -8.755 1.00 0.00 H new ATOM 953 N ASN B 309 3.168 -2.969 -10.546 1.00 0.00 N ATOM 954 CA ASN B 309 3.815 -4.221 -10.918 1.00 0.00 C ATOM 955 C ASN B 309 4.267 -4.999 -9.688 1.00 0.00 C ATOM 956 O ASN B 309 4.199 -6.226 -9.667 1.00 0.00 O ATOM 957 CB ASN B 309 5.009 -3.970 -11.843 1.00 0.00 C ATOM 958 CG ASN B 309 4.593 -3.685 -13.275 1.00 0.00 C ATOM 959 OD1 ASN B 309 4.440 -4.605 -14.081 1.00 0.00 O ATOM 960 ND2 ASN B 309 4.414 -2.416 -13.607 1.00 0.00 N ATOM 0 H ASN B 309 3.699 -2.132 -10.788 1.00 0.00 H new ATOM 0 HA ASN B 309 3.077 -4.819 -11.453 1.00 0.00 H new ATOM 0 HB2 ASN B 309 5.587 -3.128 -11.463 1.00 0.00 H new ATOM 0 HB3 ASN B 309 5.665 -4.840 -11.826 1.00 0.00 H new ATOM 0 HD21 ASN B 309 4.140 -2.172 -14.559 1.00 0.00 H new ATOM 0 HD22 ASN B 309 4.550 -1.683 -12.911 1.00 0.00 H new ATOM 967 N TYR B 310 4.725 -4.290 -8.662 1.00 0.00 N ATOM 968 CA TYR B 310 5.186 -4.944 -7.444 1.00 0.00 C ATOM 969 C TYR B 310 4.029 -5.607 -6.700 1.00 0.00 C ATOM 970 O TYR B 310 4.160 -6.734 -6.226 1.00 0.00 O ATOM 971 CB TYR B 310 5.908 -3.961 -6.523 1.00 0.00 C ATOM 972 CG TYR B 310 6.410 -4.609 -5.254 1.00 0.00 C ATOM 973 CD1 TYR B 310 7.354 -5.627 -5.302 1.00 0.00 C ATOM 974 CD2 TYR B 310 5.931 -4.218 -4.012 1.00 0.00 C ATOM 975 CE1 TYR B 310 7.803 -6.236 -4.149 1.00 0.00 C ATOM 976 CE2 TYR B 310 6.380 -4.819 -2.855 1.00 0.00 C ATOM 977 CZ TYR B 310 7.313 -5.829 -2.929 1.00 0.00 C ATOM 978 OH TYR B 310 7.750 -6.441 -1.777 1.00 0.00 O ATOM 0 H TYR B 310 4.787 -3.272 -8.649 1.00 0.00 H new ATOM 0 HA TYR B 310 5.893 -5.718 -7.743 1.00 0.00 H new ATOM 0 HB2 TYR B 310 6.749 -3.520 -7.058 1.00 0.00 H new ATOM 0 HB3 TYR B 310 5.231 -3.146 -6.266 1.00 0.00 H new ATOM 0 HD1 TYR B 310 7.743 -5.947 -6.258 1.00 0.00 H new ATOM 0 HD2 TYR B 310 5.195 -3.430 -3.950 1.00 0.00 H new ATOM 0 HE1 TYR B 310 8.535 -7.028 -4.203 1.00 0.00 H new ATOM 0 HE2 TYR B 310 6.002 -4.499 -1.895 1.00 0.00 H new ATOM 0 HH TYR B 310 8.610 -6.880 -1.946 1.00 0.00 H new ATOM 988 N VAL B 311 2.900 -4.911 -6.596 1.00 0.00 N ATOM 989 CA VAL B 311 1.713 -5.476 -5.960 1.00 0.00 C ATOM 990 C VAL B 311 1.264 -6.717 -6.721 1.00 0.00 C ATOM 991 O VAL B 311 0.883 -7.728 -6.125 1.00 0.00 O ATOM 992 CB VAL B 311 0.547 -4.464 -5.899 1.00 0.00 C ATOM 993 CG1 VAL B 311 -0.655 -5.068 -5.197 1.00 0.00 C ATOM 994 CG2 VAL B 311 0.971 -3.197 -5.186 1.00 0.00 C ATOM 0 H VAL B 311 2.782 -3.959 -6.942 1.00 0.00 H new ATOM 0 HA VAL B 311 1.983 -5.736 -4.936 1.00 0.00 H new ATOM 0 HB VAL B 311 0.269 -4.216 -6.923 1.00 0.00 H new ATOM 0 HG11 VAL B 311 -1.463 -4.337 -5.166 1.00 0.00 H new ATOM 0 HG12 VAL B 311 -0.987 -5.953 -5.740 1.00 0.00 H new ATOM 0 HG13 VAL B 311 -0.380 -5.348 -4.180 1.00 0.00 H new ATOM 0 HG21 VAL B 311 0.134 -2.499 -5.155 1.00 0.00 H new ATOM 0 HG22 VAL B 311 1.280 -3.438 -4.169 1.00 0.00 H new ATOM 0 HG23 VAL B 311 1.804 -2.740 -5.720 1.00 0.00 H new ATOM 1004 N ASN B 312 1.325 -6.631 -8.046 1.00 0.00 N ATOM 1005 CA ASN B 312 1.037 -7.773 -8.906 1.00 0.00 C ATOM 1006 C ASN B 312 2.007 -8.913 -8.612 1.00 0.00 C ATOM 1007 O ASN B 312 1.609 -10.076 -8.536 1.00 0.00 O ATOM 1008 CB ASN B 312 1.140 -7.367 -10.380 1.00 0.00 C ATOM 1009 CG ASN B 312 0.886 -8.515 -11.345 1.00 0.00 C ATOM 1010 OD1 ASN B 312 0.002 -9.433 -10.980 1.00 0.00 O flip ATOM 1011 ND2 ASN B 312 1.471 -8.565 -12.426 1.00 0.00 N flip ATOM 0 H ASN B 312 1.572 -5.779 -8.549 1.00 0.00 H new ATOM 0 HA ASN B 312 0.021 -8.112 -8.704 1.00 0.00 H new ATOM 0 HB2 ASN B 312 0.424 -6.570 -10.580 1.00 0.00 H new ATOM 0 HB3 ASN B 312 2.133 -6.958 -10.567 1.00 0.00 H new ATOM 0 HD21 ASN B 312 2.145 -7.841 -12.675 1.00 0.00 H new ATOM 0 HD22 ASN B 312 1.282 -9.330 -13.073 1.00 0.00 H new ATOM 1018 N LYS B 313 3.276 -8.564 -8.429 1.00 0.00 N ATOM 1019 CA LYS B 313 4.307 -9.549 -8.147 1.00 0.00 C ATOM 1020 C LYS B 313 4.060 -10.240 -6.808 1.00 0.00 C ATOM 1021 O LYS B 313 4.228 -11.447 -6.702 1.00 0.00 O ATOM 1022 CB LYS B 313 5.701 -8.910 -8.177 1.00 0.00 C ATOM 1023 CG LYS B 313 6.820 -9.897 -7.882 1.00 0.00 C ATOM 1024 CD LYS B 313 8.179 -9.341 -8.271 1.00 0.00 C ATOM 1025 CE LYS B 313 9.296 -10.297 -7.886 1.00 0.00 C ATOM 1026 NZ LYS B 313 10.602 -9.900 -8.470 1.00 0.00 N ATOM 0 H LYS B 313 3.613 -7.602 -8.472 1.00 0.00 H new ATOM 0 HA LYS B 313 4.262 -10.306 -8.930 1.00 0.00 H new ATOM 0 HB2 LYS B 313 5.868 -8.464 -9.157 1.00 0.00 H new ATOM 0 HB3 LYS B 313 5.738 -8.100 -7.448 1.00 0.00 H new ATOM 0 HG2 LYS B 313 6.818 -10.142 -6.820 1.00 0.00 H new ATOM 0 HG3 LYS B 313 6.638 -10.825 -8.424 1.00 0.00 H new ATOM 0 HD2 LYS B 313 8.206 -9.160 -9.345 1.00 0.00 H new ATOM 0 HD3 LYS B 313 8.335 -8.380 -7.781 1.00 0.00 H new ATOM 0 HE2 LYS B 313 9.382 -10.334 -6.800 1.00 0.00 H new ATOM 0 HE3 LYS B 313 9.042 -11.303 -8.220 1.00 0.00 H new ATOM 0 HZ1 LYS B 313 11.356 -10.051 -7.770 1.00 0.00 H new ATOM 0 HZ2 LYS B 313 10.794 -10.475 -9.315 1.00 0.00 H new ATOM 0 HZ3 LYS B 313 10.572 -8.895 -8.735 1.00 0.00 H new ATOM 1040 N ILE B 314 3.652 -9.482 -5.791 1.00 0.00 N ATOM 1041 CA ILE B 314 3.320 -10.075 -4.493 1.00 0.00 C ATOM 1042 C ILE B 314 2.136 -11.028 -4.643 1.00 0.00 C ATOM 1043 O ILE B 314 2.159 -12.159 -4.147 1.00 0.00 O ATOM 1044 CB ILE B 314 2.970 -9.010 -3.426 1.00 0.00 C ATOM 1045 CG1 ILE B 314 4.080 -7.963 -3.307 1.00 0.00 C ATOM 1046 CG2 ILE B 314 2.742 -9.682 -2.079 1.00 0.00 C ATOM 1047 CD1 ILE B 314 3.771 -6.868 -2.305 1.00 0.00 C ATOM 0 H ILE B 314 3.544 -8.469 -5.837 1.00 0.00 H new ATOM 0 HA ILE B 314 4.207 -10.612 -4.156 1.00 0.00 H new ATOM 0 HB ILE B 314 2.057 -8.503 -3.737 1.00 0.00 H new ATOM 0 HG12 ILE B 314 5.007 -8.458 -3.018 1.00 0.00 H new ATOM 0 HG13 ILE B 314 4.251 -7.513 -4.285 1.00 0.00 H new ATOM 0 HG21 ILE B 314 2.496 -8.927 -1.333 1.00 0.00 H new ATOM 0 HG22 ILE B 314 1.919 -10.392 -2.161 1.00 0.00 H new ATOM 0 HG23 ILE B 314 3.647 -10.209 -1.777 1.00 0.00 H new ATOM 0 HD11 ILE B 314 4.600 -6.161 -2.272 1.00 0.00 H new ATOM 0 HD12 ILE B 314 2.861 -6.347 -2.604 1.00 0.00 H new ATOM 0 HD13 ILE B 314 3.629 -7.308 -1.318 1.00 0.00 H new ATOM 1059 N LYS B 315 1.117 -10.558 -5.357 1.00 0.00 N ATOM 1060 CA LYS B 315 -0.089 -11.339 -5.615 1.00 0.00 C ATOM 1061 C LYS B 315 0.253 -12.655 -6.315 1.00 0.00 C ATOM 1062 O LYS B 315 -0.282 -13.709 -5.980 1.00 0.00 O ATOM 1063 CB LYS B 315 -1.056 -10.525 -6.484 1.00 0.00 C ATOM 1064 CG LYS B 315 -2.349 -11.252 -6.836 1.00 0.00 C ATOM 1065 CD LYS B 315 -3.410 -11.114 -5.749 1.00 0.00 C ATOM 1066 CE LYS B 315 -3.911 -9.680 -5.630 1.00 0.00 C ATOM 1067 NZ LYS B 315 -5.161 -9.593 -4.829 1.00 0.00 N ATOM 0 H LYS B 315 1.104 -9.627 -5.772 1.00 0.00 H new ATOM 0 HA LYS B 315 -0.561 -11.570 -4.660 1.00 0.00 H new ATOM 0 HB2 LYS B 315 -1.304 -9.600 -5.963 1.00 0.00 H new ATOM 0 HB3 LYS B 315 -0.548 -10.245 -7.407 1.00 0.00 H new ATOM 0 HG2 LYS B 315 -2.740 -10.857 -7.774 1.00 0.00 H new ATOM 0 HG3 LYS B 315 -2.135 -12.308 -6.999 1.00 0.00 H new ATOM 0 HD2 LYS B 315 -4.248 -11.775 -5.972 1.00 0.00 H new ATOM 0 HD3 LYS B 315 -2.996 -11.435 -4.793 1.00 0.00 H new ATOM 0 HE2 LYS B 315 -3.140 -9.064 -5.168 1.00 0.00 H new ATOM 0 HE3 LYS B 315 -4.089 -9.274 -6.626 1.00 0.00 H new ATOM 0 HZ1 LYS B 315 -5.450 -8.598 -4.744 1.00 0.00 H new ATOM 0 HZ2 LYS B 315 -5.914 -10.133 -5.301 1.00 0.00 H new ATOM 0 HZ3 LYS B 315 -4.994 -9.988 -3.881 1.00 0.00 H new ATOM 1081 N ASN B 316 1.148 -12.578 -7.289 1.00 0.00 N ATOM 1082 CA ASN B 316 1.526 -13.742 -8.081 1.00 0.00 C ATOM 1083 C ASN B 316 2.513 -14.633 -7.329 1.00 0.00 C ATOM 1084 O ASN B 316 2.453 -15.860 -7.429 1.00 0.00 O ATOM 1085 CB ASN B 316 2.127 -13.289 -9.413 1.00 0.00 C ATOM 1086 CG ASN B 316 2.363 -14.433 -10.382 1.00 0.00 C ATOM 1087 OD1 ASN B 316 1.529 -15.461 -10.316 1.00 0.00 O flip ATOM 1088 ND2 ASN B 316 3.282 -14.385 -11.198 1.00 0.00 N flip ATOM 0 H ASN B 316 1.629 -11.718 -7.552 1.00 0.00 H new ATOM 0 HA ASN B 316 0.628 -14.331 -8.271 1.00 0.00 H new ATOM 0 HB2 ASN B 316 1.461 -12.561 -9.876 1.00 0.00 H new ATOM 0 HB3 ASN B 316 3.073 -12.781 -9.224 1.00 0.00 H new ATOM 0 HD21 ASN B 316 3.904 -13.577 -11.219 1.00 0.00 H new ATOM 0 HD22 ASN B 316 3.422 -15.153 -11.854 1.00 0.00 H new ATOM 1095 N ARG B 317 3.413 -14.009 -6.576 1.00 0.00 N ATOM 1096 CA ARG B 317 4.432 -14.723 -5.813 1.00 0.00 C ATOM 1097 C ARG B 317 3.792 -15.701 -4.835 1.00 0.00 C ATOM 1098 O ARG B 317 4.251 -16.832 -4.682 1.00 0.00 O ATOM 1099 CB ARG B 317 5.298 -13.718 -5.048 1.00 0.00 C ATOM 1100 CG ARG B 317 6.469 -14.331 -4.296 1.00 0.00 C ATOM 1101 CD ARG B 317 7.587 -14.763 -5.233 1.00 0.00 C ATOM 1102 NE ARG B 317 7.344 -16.070 -5.840 1.00 0.00 N ATOM 1103 CZ ARG B 317 8.126 -16.604 -6.778 1.00 0.00 C ATOM 1104 NH1 ARG B 317 9.151 -15.912 -7.264 1.00 0.00 N ATOM 1105 NH2 ARG B 317 7.875 -17.826 -7.229 1.00 0.00 N ATOM 0 H ARG B 317 3.457 -12.995 -6.477 1.00 0.00 H new ATOM 0 HA ARG B 317 5.053 -15.289 -6.508 1.00 0.00 H new ATOM 0 HB2 ARG B 317 5.682 -12.980 -5.752 1.00 0.00 H new ATOM 0 HB3 ARG B 317 4.668 -13.183 -4.338 1.00 0.00 H new ATOM 0 HG2 ARG B 317 6.857 -13.608 -3.578 1.00 0.00 H new ATOM 0 HG3 ARG B 317 6.122 -15.192 -3.725 1.00 0.00 H new ATOM 0 HD2 ARG B 317 7.703 -14.018 -6.020 1.00 0.00 H new ATOM 0 HD3 ARG B 317 8.526 -14.793 -4.681 1.00 0.00 H new ATOM 0 HE ARG B 317 6.532 -16.603 -5.529 1.00 0.00 H new ATOM 0 HH11 ARG B 317 9.340 -14.971 -6.919 1.00 0.00 H new ATOM 0 HH12 ARG B 317 9.749 -16.322 -7.982 1.00 0.00 H new ATOM 0 HH21 ARG B 317 7.085 -18.354 -6.858 1.00 0.00 H new ATOM 0 HH22 ARG B 317 8.472 -18.237 -7.947 1.00 0.00 H new ATOM 1119 N PHE B 318 2.728 -15.261 -4.181 1.00 0.00 N ATOM 1120 CA PHE B 318 2.026 -16.095 -3.219 1.00 0.00 C ATOM 1121 C PHE B 318 0.608 -16.363 -3.700 1.00 0.00 C ATOM 1122 O PHE B 318 -0.346 -16.318 -2.928 1.00 0.00 O ATOM 1123 CB PHE B 318 2.013 -15.424 -1.846 1.00 0.00 C ATOM 1124 CG PHE B 318 3.391 -15.158 -1.310 1.00 0.00 C ATOM 1125 CD1 PHE B 318 4.214 -16.209 -0.936 1.00 0.00 C ATOM 1126 CD2 PHE B 318 3.866 -13.863 -1.188 1.00 0.00 C ATOM 1127 CE1 PHE B 318 5.485 -15.973 -0.449 1.00 0.00 C ATOM 1128 CE2 PHE B 318 5.135 -13.622 -0.700 1.00 0.00 C ATOM 1129 CZ PHE B 318 5.947 -14.677 -0.331 1.00 0.00 C ATOM 0 H PHE B 318 2.331 -14.329 -4.300 1.00 0.00 H new ATOM 0 HA PHE B 318 2.548 -17.048 -3.128 1.00 0.00 H new ATOM 0 HB2 PHE B 318 1.467 -14.483 -1.913 1.00 0.00 H new ATOM 0 HB3 PHE B 318 1.472 -16.057 -1.143 1.00 0.00 H new ATOM 0 HD1 PHE B 318 3.857 -17.224 -1.026 1.00 0.00 H new ATOM 0 HD2 PHE B 318 3.238 -13.033 -1.477 1.00 0.00 H new ATOM 0 HE1 PHE B 318 6.116 -16.801 -0.161 1.00 0.00 H new ATOM 0 HE2 PHE B 318 5.493 -12.607 -0.607 1.00 0.00 H new ATOM 0 HZ PHE B 318 6.940 -14.489 0.049 1.00 0.00 H new ATOM 1139 N GLN B 319 0.499 -16.672 -4.987 1.00 0.00 N ATOM 1140 CA GLN B 319 -0.784 -16.921 -5.637 1.00 0.00 C ATOM 1141 C GLN B 319 -1.562 -18.048 -4.954 1.00 0.00 C ATOM 1142 O GLN B 319 -2.794 -18.042 -4.932 1.00 0.00 O ATOM 1143 CB GLN B 319 -0.541 -17.259 -7.110 1.00 0.00 C ATOM 1144 CG GLN B 319 -1.798 -17.596 -7.894 1.00 0.00 C ATOM 1145 CD GLN B 319 -1.507 -17.855 -9.359 1.00 0.00 C ATOM 1146 OE1 GLN B 319 -1.224 -18.982 -9.760 1.00 0.00 O ATOM 1147 NE2 GLN B 319 -1.577 -16.811 -10.167 1.00 0.00 N ATOM 0 H GLN B 319 1.301 -16.757 -5.612 1.00 0.00 H new ATOM 0 HA GLN B 319 -1.391 -16.019 -5.556 1.00 0.00 H new ATOM 0 HB2 GLN B 319 -0.046 -16.413 -7.587 1.00 0.00 H new ATOM 0 HB3 GLN B 319 0.145 -18.104 -7.168 1.00 0.00 H new ATOM 0 HG2 GLN B 319 -2.271 -18.476 -7.458 1.00 0.00 H new ATOM 0 HG3 GLN B 319 -2.510 -16.775 -7.806 1.00 0.00 H new ATOM 0 HE21 GLN B 319 -1.815 -15.892 -9.794 1.00 0.00 H new ATOM 0 HE22 GLN B 319 -1.393 -16.924 -11.164 1.00 0.00 H new ATOM 1156 N GLY B 320 -0.838 -19.006 -4.391 1.00 0.00 N ATOM 1157 CA GLY B 320 -1.480 -20.136 -3.748 1.00 0.00 C ATOM 1158 C GLY B 320 -1.913 -19.840 -2.325 1.00 0.00 C ATOM 1159 O GLY B 320 -2.749 -20.552 -1.763 1.00 0.00 O ATOM 0 H GLY B 320 0.182 -19.021 -4.368 1.00 0.00 H new ATOM 0 HA2 GLY B 320 -2.351 -20.433 -4.333 1.00 0.00 H new ATOM 0 HA3 GLY B 320 -0.794 -20.983 -3.745 1.00 0.00 H new ATOM 1163 N GLN B 321 -1.361 -18.788 -1.734 1.00 0.00 N ATOM 1164 CA GLN B 321 -1.646 -18.461 -0.344 1.00 0.00 C ATOM 1165 C GLN B 321 -1.911 -16.969 -0.174 1.00 0.00 C ATOM 1166 O GLN B 321 -0.989 -16.191 0.079 1.00 0.00 O ATOM 1167 CB GLN B 321 -0.488 -18.891 0.561 1.00 0.00 C ATOM 1168 CG GLN B 321 -0.199 -20.384 0.513 1.00 0.00 C ATOM 1169 CD GLN B 321 0.941 -20.803 1.421 1.00 0.00 C ATOM 1170 OE1 GLN B 321 1.900 -19.914 1.633 1.00 0.00 O flip ATOM 1171 NE2 GLN B 321 0.965 -21.925 1.922 1.00 0.00 N flip ATOM 0 H GLN B 321 -0.714 -18.148 -2.195 1.00 0.00 H new ATOM 0 HA GLN B 321 -2.544 -19.007 -0.053 1.00 0.00 H new ATOM 0 HB2 GLN B 321 0.410 -18.346 0.271 1.00 0.00 H new ATOM 0 HB3 GLN B 321 -0.716 -18.606 1.588 1.00 0.00 H new ATOM 0 HG2 GLN B 321 -1.099 -20.931 0.795 1.00 0.00 H new ATOM 0 HG3 GLN B 321 0.039 -20.668 -0.512 1.00 0.00 H new ATOM 0 HE21 GLN B 321 0.208 -22.583 1.736 1.00 0.00 H new ATOM 0 HE22 GLN B 321 1.742 -22.198 2.524 1.00 0.00 H new ATOM 1180 N PRO B 322 -3.182 -16.551 -0.310 1.00 0.00 N ATOM 1181 CA PRO B 322 -3.584 -15.147 -0.160 1.00 0.00 C ATOM 1182 C PRO B 322 -3.417 -14.654 1.275 1.00 0.00 C ATOM 1183 O PRO B 322 -3.442 -13.453 1.539 1.00 0.00 O ATOM 1184 CB PRO B 322 -5.067 -15.142 -0.557 1.00 0.00 C ATOM 1185 CG PRO B 322 -5.298 -16.441 -1.250 1.00 0.00 C ATOM 1186 CD PRO B 322 -4.330 -17.410 -0.640 1.00 0.00 C ATOM 0 HA PRO B 322 -2.971 -14.484 -0.770 1.00 0.00 H new ATOM 0 HB2 PRO B 322 -5.708 -15.045 0.320 1.00 0.00 H new ATOM 0 HB3 PRO B 322 -5.295 -14.301 -1.212 1.00 0.00 H new ATOM 0 HG2 PRO B 322 -6.326 -16.778 -1.115 1.00 0.00 H new ATOM 0 HG3 PRO B 322 -5.132 -16.346 -2.323 1.00 0.00 H new ATOM 0 HD2 PRO B 322 -4.743 -17.893 0.246 1.00 0.00 H new ATOM 0 HD3 PRO B 322 -4.056 -18.203 -1.336 1.00 0.00 H new ATOM 1194 N ASP B 323 -3.246 -15.602 2.189 1.00 0.00 N ATOM 1195 CA ASP B 323 -3.028 -15.311 3.606 1.00 0.00 C ATOM 1196 C ASP B 323 -1.866 -14.346 3.792 1.00 0.00 C ATOM 1197 O ASP B 323 -1.973 -13.352 4.511 1.00 0.00 O ATOM 1198 CB ASP B 323 -2.738 -16.611 4.357 1.00 0.00 C ATOM 1199 CG ASP B 323 -2.442 -16.397 5.827 1.00 0.00 C ATOM 1200 OD1 ASP B 323 -3.396 -16.392 6.631 1.00 0.00 O ATOM 1201 OD2 ASP B 323 -1.253 -16.273 6.192 1.00 0.00 O ATOM 0 H ASP B 323 -3.254 -16.598 1.970 1.00 0.00 H new ATOM 0 HA ASP B 323 -3.930 -14.846 4.004 1.00 0.00 H new ATOM 0 HB2 ASP B 323 -3.594 -17.279 4.259 1.00 0.00 H new ATOM 0 HB3 ASP B 323 -1.889 -17.111 3.891 1.00 0.00 H new ATOM 1206 N ILE B 324 -0.766 -14.646 3.117 1.00 0.00 N ATOM 1207 CA ILE B 324 0.439 -13.836 3.195 1.00 0.00 C ATOM 1208 C ILE B 324 0.182 -12.431 2.649 1.00 0.00 C ATOM 1209 O ILE B 324 0.606 -11.429 3.241 1.00 0.00 O ATOM 1210 CB ILE B 324 1.591 -14.511 2.419 1.00 0.00 C ATOM 1211 CG1 ILE B 324 1.874 -15.896 3.014 1.00 0.00 C ATOM 1212 CG2 ILE B 324 2.845 -13.649 2.447 1.00 0.00 C ATOM 1213 CD1 ILE B 324 2.949 -16.672 2.283 1.00 0.00 C ATOM 0 H ILE B 324 -0.684 -15.455 2.502 1.00 0.00 H new ATOM 0 HA ILE B 324 0.727 -13.750 4.243 1.00 0.00 H new ATOM 0 HB ILE B 324 1.290 -14.626 1.378 1.00 0.00 H new ATOM 0 HG12 ILE B 324 2.170 -15.779 4.056 1.00 0.00 H new ATOM 0 HG13 ILE B 324 0.952 -16.478 3.008 1.00 0.00 H new ATOM 0 HG21 ILE B 324 3.641 -14.147 1.894 1.00 0.00 H new ATOM 0 HG22 ILE B 324 2.633 -12.683 1.988 1.00 0.00 H new ATOM 0 HG23 ILE B 324 3.160 -13.499 3.480 1.00 0.00 H new ATOM 0 HD11 ILE B 324 3.090 -17.640 2.764 1.00 0.00 H new ATOM 0 HD12 ILE B 324 2.648 -16.823 1.246 1.00 0.00 H new ATOM 0 HD13 ILE B 324 3.884 -16.113 2.311 1.00 0.00 H new ATOM 1225 N TYR B 325 -0.542 -12.361 1.538 1.00 0.00 N ATOM 1226 CA TYR B 325 -0.881 -11.083 0.934 1.00 0.00 C ATOM 1227 C TYR B 325 -1.803 -10.294 1.854 1.00 0.00 C ATOM 1228 O TYR B 325 -1.652 -9.084 1.995 1.00 0.00 O ATOM 1229 CB TYR B 325 -1.547 -11.276 -0.433 1.00 0.00 C ATOM 1230 CG TYR B 325 -1.832 -9.975 -1.159 1.00 0.00 C ATOM 1231 CD1 TYR B 325 -3.029 -9.292 -0.963 1.00 0.00 C ATOM 1232 CD2 TYR B 325 -0.901 -9.427 -2.036 1.00 0.00 C ATOM 1233 CE1 TYR B 325 -3.288 -8.107 -1.617 1.00 0.00 C ATOM 1234 CE2 TYR B 325 -1.156 -8.240 -2.694 1.00 0.00 C ATOM 1235 CZ TYR B 325 -2.351 -7.585 -2.479 1.00 0.00 C ATOM 1236 OH TYR B 325 -2.614 -6.402 -3.127 1.00 0.00 O ATOM 0 H TYR B 325 -0.904 -13.174 1.040 1.00 0.00 H new ATOM 0 HA TYR B 325 0.044 -10.525 0.787 1.00 0.00 H new ATOM 0 HB2 TYR B 325 -0.904 -11.897 -1.057 1.00 0.00 H new ATOM 0 HB3 TYR B 325 -2.482 -11.820 -0.299 1.00 0.00 H new ATOM 0 HD1 TYR B 325 -3.767 -9.698 -0.287 1.00 0.00 H new ATOM 0 HD2 TYR B 325 0.035 -9.938 -2.205 1.00 0.00 H new ATOM 0 HE1 TYR B 325 -4.222 -7.590 -1.454 1.00 0.00 H new ATOM 0 HE2 TYR B 325 -0.424 -7.827 -3.373 1.00 0.00 H new ATOM 0 HH TYR B 325 -2.037 -5.697 -2.767 1.00 0.00 H new ATOM 1246 N LYS B 326 -2.752 -10.982 2.486 1.00 0.00 N ATOM 1247 CA LYS B 326 -3.696 -10.317 3.373 1.00 0.00 C ATOM 1248 C LYS B 326 -2.981 -9.783 4.605 1.00 0.00 C ATOM 1249 O LYS B 326 -3.331 -8.726 5.112 1.00 0.00 O ATOM 1250 CB LYS B 326 -4.842 -11.244 3.791 1.00 0.00 C ATOM 1251 CG LYS B 326 -6.003 -10.495 4.440 1.00 0.00 C ATOM 1252 CD LYS B 326 -7.135 -11.430 4.836 1.00 0.00 C ATOM 1253 CE LYS B 326 -8.401 -10.660 5.189 1.00 0.00 C ATOM 1254 NZ LYS B 326 -8.233 -9.800 6.391 1.00 0.00 N ATOM 0 H LYS B 326 -2.885 -11.990 2.400 1.00 0.00 H new ATOM 0 HA LYS B 326 -4.130 -9.485 2.819 1.00 0.00 H new ATOM 0 HB2 LYS B 326 -5.206 -11.781 2.915 1.00 0.00 H new ATOM 0 HB3 LYS B 326 -4.463 -11.991 4.488 1.00 0.00 H new ATOM 0 HG2 LYS B 326 -5.644 -9.966 5.323 1.00 0.00 H new ATOM 0 HG3 LYS B 326 -6.380 -9.742 3.748 1.00 0.00 H new ATOM 0 HD2 LYS B 326 -7.343 -12.118 4.016 1.00 0.00 H new ATOM 0 HD3 LYS B 326 -6.827 -12.035 5.689 1.00 0.00 H new ATOM 0 HE2 LYS B 326 -8.692 -10.040 4.341 1.00 0.00 H new ATOM 0 HE3 LYS B 326 -9.214 -11.365 5.362 1.00 0.00 H new ATOM 0 HZ1 LYS B 326 -9.123 -9.299 6.587 1.00 0.00 H new ATOM 0 HZ2 LYS B 326 -7.982 -10.391 7.209 1.00 0.00 H new ATOM 0 HZ3 LYS B 326 -7.477 -9.107 6.219 1.00 0.00 H new ATOM 1268 N ALA B 327 -1.980 -10.511 5.081 1.00 0.00 N ATOM 1269 CA ALA B 327 -1.168 -10.042 6.198 1.00 0.00 C ATOM 1270 C ALA B 327 -0.499 -8.720 5.840 1.00 0.00 C ATOM 1271 O ALA B 327 -0.536 -7.753 6.609 1.00 0.00 O ATOM 1272 CB ALA B 327 -0.130 -11.088 6.571 1.00 0.00 C ATOM 0 H ALA B 327 -1.711 -11.424 4.714 1.00 0.00 H new ATOM 0 HA ALA B 327 -1.814 -9.879 7.061 1.00 0.00 H new ATOM 0 HB1 ALA B 327 0.469 -10.725 7.406 1.00 0.00 H new ATOM 0 HB2 ALA B 327 -0.632 -12.012 6.859 1.00 0.00 H new ATOM 0 HB3 ALA B 327 0.518 -11.279 5.716 1.00 0.00 H new ATOM 1278 N PHE B 328 0.093 -8.682 4.653 1.00 0.00 N ATOM 1279 CA PHE B 328 0.692 -7.460 4.131 1.00 0.00 C ATOM 1280 C PHE B 328 -0.378 -6.380 3.943 1.00 0.00 C ATOM 1281 O PHE B 328 -0.152 -5.200 4.210 1.00 0.00 O ATOM 1282 CB PHE B 328 1.400 -7.757 2.805 1.00 0.00 C ATOM 1283 CG PHE B 328 2.042 -6.557 2.173 1.00 0.00 C ATOM 1284 CD1 PHE B 328 3.165 -5.978 2.739 1.00 0.00 C ATOM 1285 CD2 PHE B 328 1.524 -6.013 1.007 1.00 0.00 C ATOM 1286 CE1 PHE B 328 3.760 -4.876 2.155 1.00 0.00 C ATOM 1287 CE2 PHE B 328 2.115 -4.913 0.421 1.00 0.00 C ATOM 1288 CZ PHE B 328 3.234 -4.343 0.996 1.00 0.00 C ATOM 0 H PHE B 328 0.171 -9.487 4.031 1.00 0.00 H new ATOM 0 HA PHE B 328 1.426 -7.089 4.846 1.00 0.00 H new ATOM 0 HB2 PHE B 328 2.163 -8.517 2.975 1.00 0.00 H new ATOM 0 HB3 PHE B 328 0.678 -8.180 2.106 1.00 0.00 H new ATOM 0 HD1 PHE B 328 3.580 -6.392 3.646 1.00 0.00 H new ATOM 0 HD2 PHE B 328 0.649 -6.455 0.553 1.00 0.00 H new ATOM 0 HE1 PHE B 328 4.636 -4.432 2.605 1.00 0.00 H new ATOM 0 HE2 PHE B 328 1.703 -4.498 -0.487 1.00 0.00 H new ATOM 0 HZ PHE B 328 3.697 -3.481 0.539 1.00 0.00 H new ATOM 1298 N LEU B 329 -1.551 -6.803 3.501 1.00 0.00 N ATOM 1299 CA LEU B 329 -2.671 -5.898 3.291 1.00 0.00 C ATOM 1300 C LEU B 329 -3.114 -5.280 4.617 1.00 0.00 C ATOM 1301 O LEU B 329 -3.440 -4.095 4.686 1.00 0.00 O ATOM 1302 CB LEU B 329 -3.838 -6.660 2.658 1.00 0.00 C ATOM 1303 CG LEU B 329 -4.890 -5.797 1.965 1.00 0.00 C ATOM 1304 CD1 LEU B 329 -4.333 -5.228 0.669 1.00 0.00 C ATOM 1305 CD2 LEU B 329 -6.151 -6.605 1.697 1.00 0.00 C ATOM 0 H LEU B 329 -1.754 -7.778 3.279 1.00 0.00 H new ATOM 0 HA LEU B 329 -2.355 -5.098 2.622 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -3.436 -7.366 1.931 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -4.329 -7.247 3.434 1.00 0.00 H new ATOM 0 HG LEU B 329 -5.150 -4.968 2.624 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -5.093 -4.615 0.185 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -3.458 -4.616 0.887 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -4.049 -6.045 0.005 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -6.889 -5.974 1.203 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -5.910 -7.453 1.055 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -6.558 -6.968 2.641 1.00 0.00 H new ATOM 1317 N GLU B 330 -3.101 -6.091 5.669 1.00 0.00 N ATOM 1318 CA GLU B 330 -3.553 -5.660 6.986 1.00 0.00 C ATOM 1319 C GLU B 330 -2.581 -4.684 7.631 1.00 0.00 C ATOM 1320 O GLU B 330 -3.000 -3.771 8.340 1.00 0.00 O ATOM 1321 CB GLU B 330 -3.766 -6.862 7.904 1.00 0.00 C ATOM 1322 CG GLU B 330 -4.942 -7.735 7.498 1.00 0.00 C ATOM 1323 CD GLU B 330 -6.289 -7.094 7.777 1.00 0.00 C ATOM 1324 OE1 GLU B 330 -6.425 -5.860 7.635 1.00 0.00 O ATOM 1325 OE2 GLU B 330 -7.225 -7.836 8.131 1.00 0.00 O ATOM 0 H GLU B 330 -2.779 -7.058 5.634 1.00 0.00 H new ATOM 0 HA GLU B 330 -4.502 -5.143 6.844 1.00 0.00 H new ATOM 0 HB2 GLU B 330 -2.860 -7.468 7.912 1.00 0.00 H new ATOM 0 HB3 GLU B 330 -3.922 -6.508 8.923 1.00 0.00 H new ATOM 0 HG2 GLU B 330 -4.868 -7.961 6.434 1.00 0.00 H new ATOM 0 HG3 GLU B 330 -4.882 -8.684 8.030 1.00 0.00 H new ATOM 1332 N ILE B 331 -1.287 -4.862 7.407 1.00 0.00 N ATOM 1333 CA ILE B 331 -0.325 -3.908 7.941 1.00 0.00 C ATOM 1334 C ILE B 331 -0.407 -2.584 7.179 1.00 0.00 C ATOM 1335 O ILE B 331 -0.206 -1.518 7.758 1.00 0.00 O ATOM 1336 CB ILE B 331 1.123 -4.446 7.956 1.00 0.00 C ATOM 1337 CG1 ILE B 331 1.580 -4.868 6.561 1.00 0.00 C ATOM 1338 CG2 ILE B 331 1.235 -5.609 8.929 1.00 0.00 C ATOM 1339 CD1 ILE B 331 2.978 -5.447 6.530 1.00 0.00 C ATOM 0 H ILE B 331 -0.887 -5.635 6.875 1.00 0.00 H new ATOM 0 HA ILE B 331 -0.597 -3.740 8.983 1.00 0.00 H new ATOM 0 HB ILE B 331 1.779 -3.640 8.285 1.00 0.00 H new ATOM 0 HG12 ILE B 331 0.881 -5.606 6.167 1.00 0.00 H new ATOM 0 HG13 ILE B 331 1.539 -4.004 5.898 1.00 0.00 H new ATOM 0 HG21 ILE B 331 2.259 -5.982 8.933 1.00 0.00 H new ATOM 0 HG22 ILE B 331 0.967 -5.273 9.931 1.00 0.00 H new ATOM 0 HG23 ILE B 331 0.559 -6.407 8.621 1.00 0.00 H new ATOM 0 HD11 ILE B 331 3.234 -5.724 5.507 1.00 0.00 H new ATOM 0 HD12 ILE B 331 3.688 -4.704 6.893 1.00 0.00 H new ATOM 0 HD13 ILE B 331 3.020 -6.331 7.167 1.00 0.00 H new ATOM 1351 N LEU B 332 -0.734 -2.646 5.890 1.00 0.00 N ATOM 1352 CA LEU B 332 -1.044 -1.433 5.133 1.00 0.00 C ATOM 1353 C LEU B 332 -2.304 -0.791 5.708 1.00 0.00 C ATOM 1354 O LEU B 332 -2.371 0.419 5.926 1.00 0.00 O ATOM 1355 CB LEU B 332 -1.271 -1.754 3.652 1.00 0.00 C ATOM 1356 CG LEU B 332 -0.097 -2.407 2.925 1.00 0.00 C ATOM 1357 CD1 LEU B 332 -0.480 -2.737 1.491 1.00 0.00 C ATOM 1358 CD2 LEU B 332 1.121 -1.503 2.953 1.00 0.00 C ATOM 0 H LEU B 332 -0.791 -3.511 5.352 1.00 0.00 H new ATOM 0 HA LEU B 332 -0.200 -0.748 5.213 1.00 0.00 H new ATOM 0 HB2 LEU B 332 -2.136 -2.413 3.571 1.00 0.00 H new ATOM 0 HB3 LEU B 332 -1.525 -0.829 3.134 1.00 0.00 H new ATOM 0 HG LEU B 332 0.153 -3.334 3.441 1.00 0.00 H new ATOM 0 HD11 LEU B 332 0.367 -3.202 0.986 1.00 0.00 H new ATOM 0 HD12 LEU B 332 -1.326 -3.425 1.489 1.00 0.00 H new ATOM 0 HD13 LEU B 332 -0.756 -1.821 0.968 1.00 0.00 H new ATOM 0 HD21 LEU B 332 1.946 -1.987 2.430 1.00 0.00 H new ATOM 0 HD22 LEU B 332 0.885 -0.559 2.463 1.00 0.00 H new ATOM 0 HD23 LEU B 332 1.409 -1.313 3.987 1.00 0.00 H new ATOM 1370 N HIS B 333 -3.293 -1.640 5.953 1.00 0.00 N ATOM 1371 CA HIS B 333 -4.564 -1.246 6.551 1.00 0.00 C ATOM 1372 C HIS B 333 -4.351 -0.567 7.908 1.00 0.00 C ATOM 1373 O HIS B 333 -4.938 0.478 8.186 1.00 0.00 O ATOM 1374 CB HIS B 333 -5.439 -2.505 6.682 1.00 0.00 C ATOM 1375 CG HIS B 333 -6.729 -2.342 7.431 1.00 0.00 C ATOM 1376 ND1 HIS B 333 -7.376 -3.406 8.017 1.00 0.00 N ATOM 1377 CD2 HIS B 333 -7.497 -1.255 7.682 1.00 0.00 C ATOM 1378 CE1 HIS B 333 -8.484 -2.984 8.590 1.00 0.00 C ATOM 1379 NE2 HIS B 333 -8.583 -1.679 8.406 1.00 0.00 N ATOM 0 H HIS B 333 -3.235 -2.636 5.739 1.00 0.00 H new ATOM 0 HA HIS B 333 -5.064 -0.515 5.916 1.00 0.00 H new ATOM 0 HB2 HIS B 333 -5.668 -2.868 5.680 1.00 0.00 H new ATOM 0 HB3 HIS B 333 -4.852 -3.280 7.175 1.00 0.00 H new ATOM 0 HD1 HIS B 333 -7.048 -4.372 8.009 1.00 0.00 H new ATOM 0 HD2 HIS B 333 -7.292 -0.241 7.370 1.00 0.00 H new ATOM 0 HE1 HIS B 333 -9.193 -3.601 9.121 1.00 0.00 H new ATOM 1388 N THR B 334 -3.504 -1.154 8.736 1.00 0.00 N ATOM 1389 CA THR B 334 -3.243 -0.626 10.065 1.00 0.00 C ATOM 1390 C THR B 334 -2.485 0.703 9.996 1.00 0.00 C ATOM 1391 O THR B 334 -2.805 1.642 10.727 1.00 0.00 O ATOM 1392 CB THR B 334 -2.458 -1.645 10.912 1.00 0.00 C ATOM 1393 OG1 THR B 334 -3.162 -2.896 10.934 1.00 0.00 O ATOM 1394 CG2 THR B 334 -2.269 -1.145 12.337 1.00 0.00 C ATOM 0 H THR B 334 -2.983 -2.001 8.510 1.00 0.00 H new ATOM 0 HA THR B 334 -4.206 -0.443 10.543 1.00 0.00 H new ATOM 0 HB THR B 334 -1.475 -1.778 10.461 1.00 0.00 H new ATOM 0 HG1 THR B 334 -3.037 -3.357 10.078 1.00 0.00 H new ATOM 0 HG21 THR B 334 -1.712 -1.885 12.911 1.00 0.00 H new ATOM 0 HG22 THR B 334 -1.717 -0.206 12.323 1.00 0.00 H new ATOM 0 HG23 THR B 334 -3.243 -0.986 12.799 1.00 0.00 H new ATOM 1402 N TYR B 335 -1.503 0.784 9.100 1.00 0.00 N ATOM 1403 CA TYR B 335 -0.732 2.010 8.920 1.00 0.00 C ATOM 1404 C TYR B 335 -1.649 3.160 8.510 1.00 0.00 C ATOM 1405 O TYR B 335 -1.617 4.234 9.106 1.00 0.00 O ATOM 1406 CB TYR B 335 0.366 1.804 7.867 1.00 0.00 C ATOM 1407 CG TYR B 335 1.211 3.036 7.609 1.00 0.00 C ATOM 1408 CD1 TYR B 335 2.320 3.322 8.398 1.00 0.00 C ATOM 1409 CD2 TYR B 335 0.899 3.915 6.577 1.00 0.00 C ATOM 1410 CE1 TYR B 335 3.090 4.446 8.167 1.00 0.00 C ATOM 1411 CE2 TYR B 335 1.665 5.040 6.342 1.00 0.00 C ATOM 1412 CZ TYR B 335 2.759 5.301 7.138 1.00 0.00 C ATOM 1413 OH TYR B 335 3.523 6.424 6.906 1.00 0.00 O ATOM 0 H TYR B 335 -1.224 0.016 8.489 1.00 0.00 H new ATOM 0 HA TYR B 335 -0.260 2.263 9.869 1.00 0.00 H new ATOM 0 HB2 TYR B 335 1.016 0.991 8.189 1.00 0.00 H new ATOM 0 HB3 TYR B 335 -0.096 1.491 6.931 1.00 0.00 H new ATOM 0 HD1 TYR B 335 2.584 2.654 9.205 1.00 0.00 H new ATOM 0 HD2 TYR B 335 0.044 3.714 5.949 1.00 0.00 H new ATOM 0 HE1 TYR B 335 3.947 4.654 8.790 1.00 0.00 H new ATOM 0 HE2 TYR B 335 1.407 5.713 5.537 1.00 0.00 H new ATOM 0 HH TYR B 335 3.155 6.918 6.144 1.00 0.00 H new ATOM 1423 N GLN B 336 -2.477 2.917 7.499 1.00 0.00 N ATOM 1424 CA GLN B 336 -3.415 3.923 7.013 1.00 0.00 C ATOM 1425 C GLN B 336 -4.439 4.291 8.079 1.00 0.00 C ATOM 1426 O GLN B 336 -4.901 5.432 8.135 1.00 0.00 O ATOM 1427 CB GLN B 336 -4.130 3.431 5.754 1.00 0.00 C ATOM 1428 CG GLN B 336 -3.240 3.411 4.523 1.00 0.00 C ATOM 1429 CD GLN B 336 -2.730 4.792 4.159 1.00 0.00 C ATOM 1430 OE1 GLN B 336 -1.671 5.219 4.614 1.00 0.00 O ATOM 1431 NE2 GLN B 336 -3.490 5.505 3.342 1.00 0.00 N ATOM 0 H GLN B 336 -2.517 2.029 6.999 1.00 0.00 H new ATOM 0 HA GLN B 336 -2.839 4.816 6.770 1.00 0.00 H new ATOM 0 HB2 GLN B 336 -4.514 2.426 5.932 1.00 0.00 H new ATOM 0 HB3 GLN B 336 -4.991 4.071 5.560 1.00 0.00 H new ATOM 0 HG2 GLN B 336 -2.393 2.748 4.701 1.00 0.00 H new ATOM 0 HG3 GLN B 336 -3.797 2.998 3.682 1.00 0.00 H new ATOM 0 HE21 GLN B 336 -4.362 5.114 2.986 1.00 0.00 H new ATOM 0 HE22 GLN B 336 -3.203 6.445 3.069 1.00 0.00 H new ATOM 1440 N LYS B 337 -4.789 3.326 8.923 1.00 0.00 N ATOM 1441 CA LYS B 337 -5.740 3.566 10.000 1.00 0.00 C ATOM 1442 C LYS B 337 -5.184 4.605 10.962 1.00 0.00 C ATOM 1443 O LYS B 337 -5.847 5.587 11.291 1.00 0.00 O ATOM 1444 CB LYS B 337 -6.036 2.274 10.766 1.00 0.00 C ATOM 1445 CG LYS B 337 -7.178 2.412 11.762 1.00 0.00 C ATOM 1446 CD LYS B 337 -7.086 1.381 12.877 1.00 0.00 C ATOM 1447 CE LYS B 337 -5.903 1.661 13.793 1.00 0.00 C ATOM 1448 NZ LYS B 337 -5.877 0.754 14.969 1.00 0.00 N ATOM 0 H LYS B 337 -4.429 2.373 8.881 1.00 0.00 H new ATOM 0 HA LYS B 337 -6.667 3.932 9.558 1.00 0.00 H new ATOM 0 HB2 LYS B 337 -6.278 1.485 10.054 1.00 0.00 H new ATOM 0 HB3 LYS B 337 -5.137 1.960 11.296 1.00 0.00 H new ATOM 0 HG2 LYS B 337 -7.166 3.414 12.192 1.00 0.00 H new ATOM 0 HG3 LYS B 337 -8.129 2.300 11.242 1.00 0.00 H new ATOM 0 HD2 LYS B 337 -8.008 1.387 13.458 1.00 0.00 H new ATOM 0 HD3 LYS B 337 -6.987 0.384 12.447 1.00 0.00 H new ATOM 0 HE2 LYS B 337 -4.976 1.550 13.230 1.00 0.00 H new ATOM 0 HE3 LYS B 337 -5.947 2.695 14.135 1.00 0.00 H new ATOM 0 HZ1 LYS B 337 -5.055 0.981 15.564 1.00 0.00 H new ATOM 0 HZ2 LYS B 337 -6.749 0.877 15.522 1.00 0.00 H new ATOM 0 HZ3 LYS B 337 -5.808 -0.232 14.645 1.00 0.00 H new ATOM 1462 N GLU B 338 -3.948 4.389 11.395 1.00 0.00 N ATOM 1463 CA GLU B 338 -3.309 5.288 12.339 1.00 0.00 C ATOM 1464 C GLU B 338 -2.881 6.586 11.659 1.00 0.00 C ATOM 1465 O GLU B 338 -2.820 7.630 12.299 1.00 0.00 O ATOM 1466 CB GLU B 338 -2.111 4.609 13.004 1.00 0.00 C ATOM 1467 CG GLU B 338 -2.490 3.411 13.861 1.00 0.00 C ATOM 1468 CD GLU B 338 -1.352 2.944 14.739 1.00 0.00 C ATOM 1469 OE1 GLU B 338 -1.182 3.508 15.840 1.00 0.00 O ATOM 1470 OE2 GLU B 338 -0.622 2.017 14.341 1.00 0.00 O ATOM 0 H GLU B 338 -3.371 3.599 11.106 1.00 0.00 H new ATOM 0 HA GLU B 338 -4.037 5.537 13.111 1.00 0.00 H new ATOM 0 HB2 GLU B 338 -1.412 4.287 12.232 1.00 0.00 H new ATOM 0 HB3 GLU B 338 -1.588 5.338 13.623 1.00 0.00 H new ATOM 0 HG2 GLU B 338 -3.344 3.671 14.486 1.00 0.00 H new ATOM 0 HG3 GLU B 338 -2.806 2.592 13.215 1.00 0.00 H new ATOM 1477 N GLN B 339 -2.595 6.517 10.362 1.00 0.00 N ATOM 1478 CA GLN B 339 -2.242 7.703 9.593 1.00 0.00 C ATOM 1479 C GLN B 339 -3.445 8.637 9.492 1.00 0.00 C ATOM 1480 O GLN B 339 -3.338 9.847 9.728 1.00 0.00 O ATOM 1481 CB GLN B 339 -1.747 7.286 8.201 1.00 0.00 C ATOM 1482 CG GLN B 339 -1.180 8.425 7.361 1.00 0.00 C ATOM 1483 CD GLN B 339 -2.149 8.937 6.307 1.00 0.00 C ATOM 1484 OE1 GLN B 339 -3.364 8.894 6.482 1.00 0.00 O ATOM 1485 NE2 GLN B 339 -1.611 9.422 5.199 1.00 0.00 N ATOM 0 H GLN B 339 -2.601 5.651 9.823 1.00 0.00 H new ATOM 0 HA GLN B 339 -1.439 8.240 10.098 1.00 0.00 H new ATOM 0 HB2 GLN B 339 -0.979 6.521 8.317 1.00 0.00 H new ATOM 0 HB3 GLN B 339 -2.574 6.828 7.658 1.00 0.00 H new ATOM 0 HG2 GLN B 339 -0.902 9.248 8.019 1.00 0.00 H new ATOM 0 HG3 GLN B 339 -0.267 8.086 6.871 1.00 0.00 H new ATOM 0 HE21 GLN B 339 -0.597 9.441 5.090 1.00 0.00 H new ATOM 0 HE22 GLN B 339 -2.210 9.777 4.454 1.00 0.00 H new ATOM 1494 N ARG B 340 -4.599 8.064 9.159 1.00 0.00 N ATOM 1495 CA ARG B 340 -5.832 8.831 9.086 1.00 0.00 C ATOM 1496 C ARG B 340 -6.208 9.343 10.471 1.00 0.00 C ATOM 1497 O ARG B 340 -6.590 10.498 10.630 1.00 0.00 O ATOM 1498 CB ARG B 340 -6.972 7.985 8.512 1.00 0.00 C ATOM 1499 CG ARG B 340 -8.264 8.765 8.329 1.00 0.00 C ATOM 1500 CD ARG B 340 -8.106 9.871 7.296 1.00 0.00 C ATOM 1501 NE ARG B 340 -9.205 10.834 7.345 1.00 0.00 N ATOM 1502 CZ ARG B 340 -9.812 11.331 6.270 1.00 0.00 C ATOM 1503 NH1 ARG B 340 -9.510 10.878 5.061 1.00 0.00 N ATOM 1504 NH2 ARG B 340 -10.732 12.280 6.411 1.00 0.00 N ATOM 0 H ARG B 340 -4.702 7.074 8.937 1.00 0.00 H new ATOM 0 HA ARG B 340 -5.669 9.679 8.420 1.00 0.00 H new ATOM 0 HB2 ARG B 340 -6.663 7.576 7.550 1.00 0.00 H new ATOM 0 HB3 ARG B 340 -7.157 7.139 9.174 1.00 0.00 H new ATOM 0 HG2 ARG B 340 -9.059 8.087 8.019 1.00 0.00 H new ATOM 0 HG3 ARG B 340 -8.568 9.197 9.283 1.00 0.00 H new ATOM 0 HD2 ARG B 340 -7.162 10.390 7.464 1.00 0.00 H new ATOM 0 HD3 ARG B 340 -8.055 9.431 6.300 1.00 0.00 H new ATOM 0 HE ARG B 340 -9.527 11.145 8.262 1.00 0.00 H new ATOM 0 HH11 ARG B 340 -8.809 10.145 4.951 1.00 0.00 H new ATOM 0 HH12 ARG B 340 -9.978 11.263 4.241 1.00 0.00 H new ATOM 0 HH21 ARG B 340 -10.971 12.625 7.341 1.00 0.00 H new ATOM 0 HH22 ARG B 340 -11.199 12.663 5.589 1.00 0.00 H new ATOM 1518 N ASN B 341 -6.077 8.474 11.468 1.00 0.00 N ATOM 1519 CA ASN B 341 -6.381 8.828 12.850 1.00 0.00 C ATOM 1520 C ASN B 341 -5.457 9.947 13.327 1.00 0.00 C ATOM 1521 O ASN B 341 -5.858 10.811 14.105 1.00 0.00 O ATOM 1522 CB ASN B 341 -6.236 7.597 13.752 1.00 0.00 C ATOM 1523 CG ASN B 341 -6.784 7.809 15.154 1.00 0.00 C ATOM 1524 OD1 ASN B 341 -7.869 8.562 15.272 1.00 0.00 O flip ATOM 1525 ND2 ASN B 341 -6.253 7.267 16.124 1.00 0.00 N flip ATOM 0 H ASN B 341 -5.760 7.513 11.343 1.00 0.00 H new ATOM 0 HA ASN B 341 -7.410 9.183 12.903 1.00 0.00 H new ATOM 0 HB2 ASN B 341 -6.753 6.755 13.291 1.00 0.00 H new ATOM 0 HB3 ASN B 341 -5.182 7.326 13.819 1.00 0.00 H new ATOM 0 HD21 ASN B 341 -5.419 6.694 15.995 1.00 0.00 H new ATOM 0 HD22 ASN B 341 -6.647 7.391 17.056 1.00 0.00 H new ATOM 1532 N ALA B 342 -4.221 9.932 12.835 1.00 0.00 N ATOM 1533 CA ALA B 342 -3.250 10.966 13.162 1.00 0.00 C ATOM 1534 C ALA B 342 -3.721 12.325 12.666 1.00 0.00 C ATOM 1535 O ALA B 342 -3.788 13.285 13.434 1.00 0.00 O ATOM 1536 CB ALA B 342 -1.895 10.629 12.560 1.00 0.00 C ATOM 0 H ALA B 342 -3.869 9.210 12.206 1.00 0.00 H new ATOM 0 HA ALA B 342 -3.152 11.010 14.247 1.00 0.00 H new ATOM 0 HB1 ALA B 342 -1.180 11.411 12.813 1.00 0.00 H new ATOM 0 HB2 ALA B 342 -1.547 9.676 12.958 1.00 0.00 H new ATOM 0 HB3 ALA B 342 -1.986 10.558 11.476 1.00 0.00 H new ATOM 1542 N LYS B 343 -4.078 12.398 11.386 1.00 0.00 N ATOM 1543 CA LYS B 343 -4.573 13.645 10.807 1.00 0.00 C ATOM 1544 C LYS B 343 -5.929 14.020 11.390 1.00 0.00 C ATOM 1545 O LYS B 343 -6.239 15.198 11.552 1.00 0.00 O ATOM 1546 CB LYS B 343 -4.661 13.548 9.281 1.00 0.00 C ATOM 1547 CG LYS B 343 -3.325 13.743 8.581 1.00 0.00 C ATOM 1548 CD LYS B 343 -2.763 15.133 8.845 1.00 0.00 C ATOM 1549 CE LYS B 343 -1.455 15.362 8.108 1.00 0.00 C ATOM 1550 NZ LYS B 343 -0.889 16.710 8.388 1.00 0.00 N ATOM 0 H LYS B 343 -4.035 11.615 10.734 1.00 0.00 H new ATOM 0 HA LYS B 343 -3.860 14.430 11.061 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -5.065 12.573 9.010 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -5.365 14.297 8.918 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -2.617 12.990 8.927 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -3.449 13.596 7.508 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -3.490 15.884 8.536 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -2.605 15.264 9.915 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -0.735 14.598 8.401 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -1.618 15.252 7.036 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 0.003 16.827 7.867 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -1.565 17.440 8.086 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -0.709 16.806 9.408 1.00 0.00 H new ATOM 1652 N PRO B 351 1.209 7.358 14.816 1.00 0.00 N ATOM 1653 CA PRO B 351 0.980 5.952 14.470 1.00 0.00 C ATOM 1654 C PRO B 351 1.972 5.012 15.147 1.00 0.00 C ATOM 1655 O PRO B 351 3.191 5.190 15.047 1.00 0.00 O ATOM 1656 CB PRO B 351 1.162 5.915 12.947 1.00 0.00 C ATOM 1657 CG PRO B 351 1.949 7.137 12.621 1.00 0.00 C ATOM 1658 CD PRO B 351 1.541 8.168 13.632 1.00 0.00 C ATOM 0 HA PRO B 351 -0.002 5.614 14.802 1.00 0.00 H new ATOM 0 HB2 PRO B 351 1.687 5.013 12.634 1.00 0.00 H new ATOM 0 HB3 PRO B 351 0.200 5.917 12.435 1.00 0.00 H new ATOM 0 HG2 PRO B 351 3.019 6.939 12.675 1.00 0.00 H new ATOM 0 HG3 PRO B 351 1.739 7.479 11.607 1.00 0.00 H new ATOM 0 HD2 PRO B 351 2.347 8.872 13.838 1.00 0.00 H new ATOM 0 HD3 PRO B 351 0.687 8.752 13.290 1.00 0.00 H new ATOM 1666 N ALA B 352 1.439 4.015 15.838 1.00 0.00 N ATOM 1667 CA ALA B 352 2.254 3.014 16.501 1.00 0.00 C ATOM 1668 C ALA B 352 2.911 2.111 15.471 1.00 0.00 C ATOM 1669 O ALA B 352 4.101 1.802 15.565 1.00 0.00 O ATOM 1670 CB ALA B 352 1.409 2.198 17.466 1.00 0.00 C ATOM 0 H ALA B 352 0.435 3.879 15.953 1.00 0.00 H new ATOM 0 HA ALA B 352 3.035 3.517 17.071 1.00 0.00 H new ATOM 0 HB1 ALA B 352 2.034 1.451 17.956 1.00 0.00 H new ATOM 0 HB2 ALA B 352 0.976 2.858 18.218 1.00 0.00 H new ATOM 0 HB3 ALA B 352 0.610 1.699 16.918 1.00 0.00 H new ATOM 1676 N LEU B 353 2.134 1.695 14.480 1.00 0.00 N ATOM 1677 CA LEU B 353 2.669 0.898 13.392 1.00 0.00 C ATOM 1678 C LEU B 353 3.346 1.812 12.380 1.00 0.00 C ATOM 1679 O LEU B 353 2.772 2.164 11.351 1.00 0.00 O ATOM 1680 CB LEU B 353 1.576 0.076 12.707 1.00 0.00 C ATOM 1681 CG LEU B 353 2.091 -0.965 11.709 1.00 0.00 C ATOM 1682 CD1 LEU B 353 2.052 -2.359 12.314 1.00 0.00 C ATOM 1683 CD2 LEU B 353 1.290 -0.909 10.422 1.00 0.00 C ATOM 0 H LEU B 353 1.137 1.896 14.410 1.00 0.00 H new ATOM 0 HA LEU B 353 3.397 0.200 13.805 1.00 0.00 H new ATOM 0 HB2 LEU B 353 0.989 -0.433 13.472 1.00 0.00 H new ATOM 0 HB3 LEU B 353 0.901 0.756 12.187 1.00 0.00 H new ATOM 0 HG LEU B 353 3.129 -0.731 11.474 1.00 0.00 H new ATOM 0 HD11 LEU B 353 2.422 -3.082 11.587 1.00 0.00 H new ATOM 0 HD12 LEU B 353 2.679 -2.387 13.205 1.00 0.00 H new ATOM 0 HD13 LEU B 353 1.026 -2.610 12.585 1.00 0.00 H new ATOM 0 HD21 LEU B 353 1.670 -1.655 9.724 1.00 0.00 H new ATOM 0 HD22 LEU B 353 0.241 -1.114 10.637 1.00 0.00 H new ATOM 0 HD23 LEU B 353 1.383 0.082 9.979 1.00 0.00 H new ATOM 1695 N THR B 354 4.554 2.230 12.704 1.00 0.00 N ATOM 1696 CA THR B 354 5.307 3.122 11.848 1.00 0.00 C ATOM 1697 C THR B 354 5.882 2.351 10.659 1.00 0.00 C ATOM 1698 O THR B 354 5.959 1.123 10.692 1.00 0.00 O ATOM 1699 CB THR B 354 6.432 3.790 12.657 1.00 0.00 C ATOM 1700 OG1 THR B 354 5.930 4.142 13.951 1.00 0.00 O ATOM 1701 CG2 THR B 354 6.951 5.043 11.970 1.00 0.00 C ATOM 0 H THR B 354 5.037 1.963 13.562 1.00 0.00 H new ATOM 0 HA THR B 354 4.644 3.897 11.464 1.00 0.00 H new ATOM 0 HB THR B 354 7.257 3.082 12.740 1.00 0.00 H new ATOM 0 HG1 THR B 354 4.998 4.434 13.872 1.00 0.00 H new ATOM 0 HG21 THR B 354 7.744 5.486 12.572 1.00 0.00 H new ATOM 0 HG22 THR B 354 7.344 4.783 10.987 1.00 0.00 H new ATOM 0 HG23 THR B 354 6.138 5.760 11.858 1.00 0.00 H new ATOM 1709 N GLU B 355 6.272 3.071 9.611 1.00 0.00 N ATOM 1710 CA GLU B 355 6.820 2.456 8.402 1.00 0.00 C ATOM 1711 C GLU B 355 8.002 1.531 8.715 1.00 0.00 C ATOM 1712 O GLU B 355 8.193 0.510 8.053 1.00 0.00 O ATOM 1713 CB GLU B 355 7.239 3.541 7.408 1.00 0.00 C ATOM 1714 CG GLU B 355 8.203 4.563 7.987 1.00 0.00 C ATOM 1715 CD GLU B 355 8.575 5.642 6.991 1.00 0.00 C ATOM 1716 OE1 GLU B 355 9.528 5.440 6.218 1.00 0.00 O ATOM 1717 OE2 GLU B 355 7.915 6.699 6.983 1.00 0.00 O ATOM 0 H GLU B 355 6.219 4.089 9.573 1.00 0.00 H new ATOM 0 HA GLU B 355 6.037 1.841 7.957 1.00 0.00 H new ATOM 0 HB2 GLU B 355 7.702 3.068 6.542 1.00 0.00 H new ATOM 0 HB3 GLU B 355 6.348 4.057 7.051 1.00 0.00 H new ATOM 0 HG2 GLU B 355 7.753 5.025 8.866 1.00 0.00 H new ATOM 0 HG3 GLU B 355 9.107 4.055 8.322 1.00 0.00 H new ATOM 1724 N GLN B 356 8.778 1.881 9.737 1.00 0.00 N ATOM 1725 CA GLN B 356 9.913 1.064 10.150 1.00 0.00 C ATOM 1726 C GLN B 356 9.426 -0.275 10.698 1.00 0.00 C ATOM 1727 O GLN B 356 9.989 -1.328 10.392 1.00 0.00 O ATOM 1728 CB GLN B 356 10.734 1.797 11.209 1.00 0.00 C ATOM 1729 CG GLN B 356 12.034 1.097 11.563 1.00 0.00 C ATOM 1730 CD GLN B 356 12.787 1.804 12.670 1.00 0.00 C ATOM 1731 OE1 GLN B 356 12.681 3.020 12.827 1.00 0.00 O ATOM 1732 NE2 GLN B 356 13.572 1.056 13.425 1.00 0.00 N ATOM 0 H GLN B 356 8.641 2.725 10.294 1.00 0.00 H new ATOM 0 HA GLN B 356 10.545 0.880 9.281 1.00 0.00 H new ATOM 0 HB2 GLN B 356 10.958 2.802 10.852 1.00 0.00 H new ATOM 0 HB3 GLN B 356 10.133 1.906 12.111 1.00 0.00 H new ATOM 0 HG2 GLN B 356 11.820 0.073 11.869 1.00 0.00 H new ATOM 0 HG3 GLN B 356 12.666 1.040 10.677 1.00 0.00 H new ATOM 0 HE21 GLN B 356 13.631 0.051 13.261 1.00 0.00 H new ATOM 0 HE22 GLN B 356 14.119 1.484 14.172 1.00 0.00 H new ATOM 1741 N GLU B 357 8.365 -0.221 11.500 1.00 0.00 N ATOM 1742 CA GLU B 357 7.750 -1.422 12.052 1.00 0.00 C ATOM 1743 C GLU B 357 7.240 -2.299 10.918 1.00 0.00 C ATOM 1744 O GLU B 357 7.437 -3.516 10.922 1.00 0.00 O ATOM 1745 CB GLU B 357 6.595 -1.053 12.989 1.00 0.00 C ATOM 1746 CG GLU B 357 6.083 -2.220 13.817 1.00 0.00 C ATOM 1747 CD GLU B 357 7.125 -2.728 14.788 1.00 0.00 C ATOM 1748 OE1 GLU B 357 7.352 -2.067 15.820 1.00 0.00 O ATOM 1749 OE2 GLU B 357 7.727 -3.789 14.527 1.00 0.00 O ATOM 0 H GLU B 357 7.912 0.648 11.782 1.00 0.00 H new ATOM 0 HA GLU B 357 8.498 -1.969 12.626 1.00 0.00 H new ATOM 0 HB2 GLU B 357 6.923 -0.259 13.660 1.00 0.00 H new ATOM 0 HB3 GLU B 357 5.773 -0.651 12.397 1.00 0.00 H new ATOM 0 HG2 GLU B 357 5.195 -1.911 14.368 1.00 0.00 H new ATOM 0 HG3 GLU B 357 5.781 -3.030 13.153 1.00 0.00 H new ATOM 1756 N VAL B 358 6.598 -1.661 9.940 1.00 0.00 N ATOM 1757 CA VAL B 358 6.114 -2.355 8.755 1.00 0.00 C ATOM 1758 C VAL B 358 7.243 -3.111 8.079 1.00 0.00 C ATOM 1759 O VAL B 358 7.150 -4.314 7.883 1.00 0.00 O ATOM 1760 CB VAL B 358 5.480 -1.385 7.734 1.00 0.00 C ATOM 1761 CG1 VAL B 358 5.145 -2.105 6.438 1.00 0.00 C ATOM 1762 CG2 VAL B 358 4.232 -0.751 8.306 1.00 0.00 C ATOM 0 H VAL B 358 6.402 -0.660 9.949 1.00 0.00 H new ATOM 0 HA VAL B 358 5.348 -3.053 9.092 1.00 0.00 H new ATOM 0 HB VAL B 358 6.208 -0.603 7.520 1.00 0.00 H new ATOM 0 HG11 VAL B 358 4.700 -1.401 5.735 1.00 0.00 H new ATOM 0 HG12 VAL B 358 6.056 -2.521 6.007 1.00 0.00 H new ATOM 0 HG13 VAL B 358 4.439 -2.910 6.641 1.00 0.00 H new ATOM 0 HG21 VAL B 358 3.800 -0.071 7.572 1.00 0.00 H new ATOM 0 HG22 VAL B 358 3.508 -1.528 8.550 1.00 0.00 H new ATOM 0 HG23 VAL B 358 4.487 -0.196 9.209 1.00 0.00 H new ATOM 1772 N TYR B 359 8.317 -2.400 7.752 1.00 0.00 N ATOM 1773 CA TYR B 359 9.446 -2.991 7.046 1.00 0.00 C ATOM 1774 C TYR B 359 10.003 -4.201 7.798 1.00 0.00 C ATOM 1775 O TYR B 359 10.322 -5.221 7.188 1.00 0.00 O ATOM 1776 CB TYR B 359 10.543 -1.947 6.830 1.00 0.00 C ATOM 1777 CG TYR B 359 11.740 -2.482 6.079 1.00 0.00 C ATOM 1778 CD1 TYR B 359 11.673 -2.730 4.714 1.00 0.00 C ATOM 1779 CD2 TYR B 359 12.932 -2.748 6.738 1.00 0.00 C ATOM 1780 CE1 TYR B 359 12.764 -3.232 4.027 1.00 0.00 C ATOM 1781 CE2 TYR B 359 14.025 -3.245 6.058 1.00 0.00 C ATOM 1782 CZ TYR B 359 13.938 -3.487 4.706 1.00 0.00 C ATOM 1783 OH TYR B 359 15.028 -3.995 4.035 1.00 0.00 O ATOM 0 H TYR B 359 8.428 -1.409 7.966 1.00 0.00 H new ATOM 0 HA TYR B 359 9.090 -3.336 6.075 1.00 0.00 H new ATOM 0 HB2 TYR B 359 10.127 -1.102 6.282 1.00 0.00 H new ATOM 0 HB3 TYR B 359 10.870 -1.569 7.798 1.00 0.00 H new ATOM 0 HD1 TYR B 359 10.756 -2.528 4.181 1.00 0.00 H new ATOM 0 HD2 TYR B 359 13.005 -2.563 7.800 1.00 0.00 H new ATOM 0 HE1 TYR B 359 12.697 -3.423 2.966 1.00 0.00 H new ATOM 0 HE2 TYR B 359 14.946 -3.444 6.585 1.00 0.00 H new ATOM 0 HH TYR B 359 15.772 -4.114 4.662 1.00 0.00 H new ATOM 1793 N ALA B 360 10.099 -4.091 9.119 1.00 0.00 N ATOM 1794 CA ALA B 360 10.603 -5.185 9.944 1.00 0.00 C ATOM 1795 C ALA B 360 9.682 -6.401 9.857 1.00 0.00 C ATOM 1796 O ALA B 360 10.132 -7.525 9.601 1.00 0.00 O ATOM 1797 CB ALA B 360 10.755 -4.733 11.389 1.00 0.00 C ATOM 0 H ALA B 360 9.835 -3.256 9.642 1.00 0.00 H new ATOM 0 HA ALA B 360 11.583 -5.475 9.565 1.00 0.00 H new ATOM 0 HB1 ALA B 360 11.132 -5.560 11.991 1.00 0.00 H new ATOM 0 HB2 ALA B 360 11.456 -3.900 11.438 1.00 0.00 H new ATOM 0 HB3 ALA B 360 9.786 -4.415 11.775 1.00 0.00 H new ATOM 1803 N GLN B 361 8.388 -6.170 10.053 1.00 0.00 N ATOM 1804 CA GLN B 361 7.403 -7.241 9.975 1.00 0.00 C ATOM 1805 C GLN B 361 7.336 -7.805 8.563 1.00 0.00 C ATOM 1806 O GLN B 361 7.172 -9.007 8.377 1.00 0.00 O ATOM 1807 CB GLN B 361 6.022 -6.744 10.409 1.00 0.00 C ATOM 1808 CG GLN B 361 5.946 -6.329 11.870 1.00 0.00 C ATOM 1809 CD GLN B 361 6.276 -7.462 12.824 1.00 0.00 C ATOM 1810 OE1 GLN B 361 5.405 -8.241 13.204 1.00 0.00 O ATOM 1811 NE2 GLN B 361 7.530 -7.547 13.243 1.00 0.00 N ATOM 0 H GLN B 361 7.998 -5.252 10.267 1.00 0.00 H new ATOM 0 HA GLN B 361 7.714 -8.034 10.655 1.00 0.00 H new ATOM 0 HB2 GLN B 361 5.740 -5.896 9.786 1.00 0.00 H new ATOM 0 HB3 GLN B 361 5.290 -7.531 10.227 1.00 0.00 H new ATOM 0 HG2 GLN B 361 6.635 -5.502 12.044 1.00 0.00 H new ATOM 0 HG3 GLN B 361 4.944 -5.959 12.086 1.00 0.00 H new ATOM 0 HE21 GLN B 361 8.227 -6.882 12.906 1.00 0.00 H new ATOM 0 HE22 GLN B 361 7.799 -8.277 13.903 1.00 0.00 H new ATOM 1820 N VAL B 362 7.477 -6.924 7.581 1.00 0.00 N ATOM 1821 CA VAL B 362 7.493 -7.307 6.175 1.00 0.00 C ATOM 1822 C VAL B 362 8.698 -8.188 5.864 1.00 0.00 C ATOM 1823 O VAL B 362 8.587 -9.151 5.113 1.00 0.00 O ATOM 1824 CB VAL B 362 7.493 -6.052 5.265 1.00 0.00 C ATOM 1825 CG1 VAL B 362 7.922 -6.374 3.849 1.00 0.00 C ATOM 1826 CG2 VAL B 362 6.117 -5.428 5.232 1.00 0.00 C ATOM 0 H VAL B 362 7.584 -5.922 7.737 1.00 0.00 H new ATOM 0 HA VAL B 362 6.589 -7.881 5.973 1.00 0.00 H new ATOM 0 HB VAL B 362 8.213 -5.353 5.690 1.00 0.00 H new ATOM 0 HG11 VAL B 362 7.907 -5.464 3.248 1.00 0.00 H new ATOM 0 HG12 VAL B 362 8.931 -6.785 3.859 1.00 0.00 H new ATOM 0 HG13 VAL B 362 7.237 -7.105 3.419 1.00 0.00 H new ATOM 0 HG21 VAL B 362 6.132 -4.548 4.589 1.00 0.00 H new ATOM 0 HG22 VAL B 362 5.399 -6.150 4.842 1.00 0.00 H new ATOM 0 HG23 VAL B 362 5.826 -5.136 6.241 1.00 0.00 H new ATOM 1836 N ALA B 363 9.841 -7.864 6.457 1.00 0.00 N ATOM 1837 CA ALA B 363 11.048 -8.662 6.274 1.00 0.00 C ATOM 1838 C ALA B 363 10.854 -10.076 6.816 1.00 0.00 C ATOM 1839 O ALA B 363 11.279 -11.054 6.203 1.00 0.00 O ATOM 1840 CB ALA B 363 12.239 -7.988 6.941 1.00 0.00 C ATOM 0 H ALA B 363 9.958 -7.056 7.068 1.00 0.00 H new ATOM 0 HA ALA B 363 11.249 -8.736 5.205 1.00 0.00 H new ATOM 0 HB1 ALA B 363 13.131 -8.597 6.794 1.00 0.00 H new ATOM 0 HB2 ALA B 363 12.395 -7.004 6.499 1.00 0.00 H new ATOM 0 HB3 ALA B 363 12.045 -7.879 8.008 1.00 0.00 H new ATOM 1846 N ARG B 364 10.209 -10.180 7.972 1.00 0.00 N ATOM 1847 CA ARG B 364 9.912 -11.482 8.563 1.00 0.00 C ATOM 1848 C ARG B 364 8.771 -12.175 7.823 1.00 0.00 C ATOM 1849 O ARG B 364 8.652 -13.399 7.850 1.00 0.00 O ATOM 1850 CB ARG B 364 9.553 -11.334 10.041 1.00 0.00 C ATOM 1851 CG ARG B 364 10.688 -10.780 10.882 1.00 0.00 C ATOM 1852 CD ARG B 364 10.316 -10.720 12.354 1.00 0.00 C ATOM 1853 NE ARG B 364 11.384 -10.133 13.158 1.00 0.00 N ATOM 1854 CZ ARG B 364 11.213 -9.637 14.381 1.00 0.00 C ATOM 1855 NH1 ARG B 364 10.046 -9.760 14.997 1.00 0.00 N ATOM 1856 NH2 ARG B 364 12.225 -9.048 15.003 1.00 0.00 N ATOM 0 H ARG B 364 9.882 -9.383 8.518 1.00 0.00 H new ATOM 0 HA ARG B 364 10.808 -12.096 8.474 1.00 0.00 H new ATOM 0 HB2 ARG B 364 8.688 -10.678 10.134 1.00 0.00 H new ATOM 0 HB3 ARG B 364 9.259 -12.307 10.435 1.00 0.00 H new ATOM 0 HG2 ARG B 364 11.573 -11.403 10.755 1.00 0.00 H new ATOM 0 HG3 ARG B 364 10.948 -9.781 10.531 1.00 0.00 H new ATOM 0 HD2 ARG B 364 9.405 -10.134 12.475 1.00 0.00 H new ATOM 0 HD3 ARG B 364 10.099 -11.725 12.716 1.00 0.00 H new ATOM 0 HE ARG B 364 12.321 -10.101 12.757 1.00 0.00 H new ATOM 0 HH11 ARG B 364 9.273 -10.237 14.534 1.00 0.00 H new ATOM 0 HH12 ARG B 364 9.921 -9.378 15.934 1.00 0.00 H new ATOM 0 HH21 ARG B 364 13.133 -8.976 14.544 1.00 0.00 H new ATOM 0 HH22 ARG B 364 12.095 -8.667 15.940 1.00 0.00 H new ATOM 1870 N LEU B 365 7.933 -11.378 7.175 1.00 0.00 N ATOM 1871 CA LEU B 365 6.761 -11.887 6.479 1.00 0.00 C ATOM 1872 C LEU B 365 7.159 -12.422 5.103 1.00 0.00 C ATOM 1873 O LEU B 365 6.815 -13.550 4.741 1.00 0.00 O ATOM 1874 CB LEU B 365 5.712 -10.763 6.376 1.00 0.00 C ATOM 1875 CG LEU B 365 4.296 -11.165 5.943 1.00 0.00 C ATOM 1876 CD1 LEU B 365 4.192 -11.233 4.432 1.00 0.00 C ATOM 1877 CD2 LEU B 365 3.889 -12.494 6.570 1.00 0.00 C ATOM 0 H LEU B 365 8.046 -10.366 7.117 1.00 0.00 H new ATOM 0 HA LEU B 365 6.323 -12.716 7.034 1.00 0.00 H new ATOM 0 HB2 LEU B 365 5.643 -10.275 7.348 1.00 0.00 H new ATOM 0 HB3 LEU B 365 6.082 -10.018 5.671 1.00 0.00 H new ATOM 0 HG LEU B 365 3.608 -10.398 6.298 1.00 0.00 H new ATOM 0 HD11 LEU B 365 3.179 -11.520 4.150 1.00 0.00 H new ATOM 0 HD12 LEU B 365 4.424 -10.257 4.007 1.00 0.00 H new ATOM 0 HD13 LEU B 365 4.898 -11.972 4.052 1.00 0.00 H new ATOM 0 HD21 LEU B 365 2.881 -12.755 6.247 1.00 0.00 H new ATOM 0 HD22 LEU B 365 4.584 -13.273 6.256 1.00 0.00 H new ATOM 0 HD23 LEU B 365 3.910 -12.405 7.656 1.00 0.00 H new ATOM 1889 N PHE B 366 7.901 -11.620 4.349 1.00 0.00 N ATOM 1890 CA PHE B 366 8.392 -12.042 3.046 1.00 0.00 C ATOM 1891 C PHE B 366 9.755 -12.707 3.184 1.00 0.00 C ATOM 1892 O PHE B 366 10.794 -12.109 2.894 1.00 0.00 O ATOM 1893 CB PHE B 366 8.478 -10.865 2.067 1.00 0.00 C ATOM 1894 CG PHE B 366 7.149 -10.247 1.731 1.00 0.00 C ATOM 1895 CD1 PHE B 366 6.060 -11.039 1.406 1.00 0.00 C ATOM 1896 CD2 PHE B 366 6.993 -8.872 1.738 1.00 0.00 C ATOM 1897 CE1 PHE B 366 4.840 -10.470 1.093 1.00 0.00 C ATOM 1898 CE2 PHE B 366 5.775 -8.297 1.424 1.00 0.00 C ATOM 1899 CZ PHE B 366 4.698 -9.097 1.102 1.00 0.00 C ATOM 0 H PHE B 366 8.175 -10.675 4.618 1.00 0.00 H new ATOM 0 HA PHE B 366 7.680 -12.762 2.643 1.00 0.00 H new ATOM 0 HB2 PHE B 366 9.126 -10.099 2.493 1.00 0.00 H new ATOM 0 HB3 PHE B 366 8.951 -11.206 1.146 1.00 0.00 H new ATOM 0 HD1 PHE B 366 6.166 -12.114 1.397 1.00 0.00 H new ATOM 0 HD2 PHE B 366 7.832 -8.241 1.992 1.00 0.00 H new ATOM 0 HE1 PHE B 366 3.999 -11.099 0.842 1.00 0.00 H new ATOM 0 HE2 PHE B 366 5.667 -7.222 1.431 1.00 0.00 H new ATOM 0 HZ PHE B 366 3.746 -8.650 0.857 1.00 0.00 H new ATOM 1909 N LYS B 367 9.740 -13.936 3.663 1.00 0.00 N ATOM 1910 CA LYS B 367 10.953 -14.716 3.814 1.00 0.00 C ATOM 1911 C LYS B 367 11.040 -15.766 2.716 1.00 0.00 C ATOM 1912 O LYS B 367 10.036 -16.073 2.068 1.00 0.00 O ATOM 1913 CB LYS B 367 10.999 -15.369 5.200 1.00 0.00 C ATOM 1914 CG LYS B 367 9.693 -16.026 5.617 1.00 0.00 C ATOM 1915 CD LYS B 367 9.820 -16.733 6.955 1.00 0.00 C ATOM 1916 CE LYS B 367 8.469 -17.221 7.452 1.00 0.00 C ATOM 1917 NZ LYS B 367 7.791 -18.103 6.464 1.00 0.00 N ATOM 0 H LYS B 367 8.891 -14.420 3.957 1.00 0.00 H new ATOM 0 HA LYS B 367 11.813 -14.052 3.724 1.00 0.00 H new ATOM 0 HB2 LYS B 367 11.791 -16.118 5.211 1.00 0.00 H new ATOM 0 HB3 LYS B 367 11.265 -14.613 5.938 1.00 0.00 H new ATOM 0 HG2 LYS B 367 8.909 -15.271 5.678 1.00 0.00 H new ATOM 0 HG3 LYS B 367 9.387 -16.743 4.855 1.00 0.00 H new ATOM 0 HD2 LYS B 367 10.502 -17.578 6.859 1.00 0.00 H new ATOM 0 HD3 LYS B 367 10.256 -16.054 7.688 1.00 0.00 H new ATOM 0 HE2 LYS B 367 8.602 -17.763 8.388 1.00 0.00 H new ATOM 0 HE3 LYS B 367 7.832 -16.363 7.668 1.00 0.00 H new ATOM 0 HZ1 LYS B 367 6.951 -18.533 6.901 1.00 0.00 H new ATOM 0 HZ2 LYS B 367 7.502 -17.541 5.638 1.00 0.00 H new ATOM 0 HZ3 LYS B 367 8.445 -18.853 6.161 1.00 0.00 H new ATOM 1931 N ASN B 368 12.248 -16.291 2.507 1.00 0.00 N ATOM 1932 CA ASN B 368 12.538 -17.261 1.441 1.00 0.00 C ATOM 1933 C ASN B 368 12.603 -16.561 0.089 1.00 0.00 C ATOM 1934 O ASN B 368 13.607 -16.644 -0.620 1.00 0.00 O ATOM 1935 CB ASN B 368 11.517 -18.407 1.411 1.00 0.00 C ATOM 1936 CG ASN B 368 11.803 -19.420 0.317 1.00 0.00 C ATOM 1937 OD1 ASN B 368 11.281 -19.321 -0.793 1.00 0.00 O ATOM 1938 ND2 ASN B 368 12.638 -20.399 0.622 1.00 0.00 N ATOM 0 H ASN B 368 13.062 -16.055 3.075 1.00 0.00 H new ATOM 0 HA ASN B 368 13.511 -17.703 1.657 1.00 0.00 H new ATOM 0 HB2 ASN B 368 11.516 -18.912 2.377 1.00 0.00 H new ATOM 0 HB3 ASN B 368 10.519 -17.994 1.266 1.00 0.00 H new ATOM 0 HD21 ASN B 368 12.870 -21.107 -0.075 1.00 0.00 H new ATOM 0 HD22 ASN B 368 13.050 -20.446 1.554 1.00 0.00 H new ATOM 1945 N GLN B 369 11.541 -15.853 -0.253 1.00 0.00 N ATOM 1946 CA GLN B 369 11.507 -15.066 -1.472 1.00 0.00 C ATOM 1947 C GLN B 369 12.165 -13.711 -1.229 1.00 0.00 C ATOM 1948 O GLN B 369 11.508 -12.671 -1.259 1.00 0.00 O ATOM 1949 CB GLN B 369 10.064 -14.891 -1.948 1.00 0.00 C ATOM 1950 CG GLN B 369 9.368 -16.209 -2.251 1.00 0.00 C ATOM 1951 CD GLN B 369 10.024 -16.964 -3.393 1.00 0.00 C ATOM 1952 OE1 GLN B 369 10.570 -16.362 -4.317 1.00 0.00 O ATOM 1953 NE2 GLN B 369 9.990 -18.286 -3.330 1.00 0.00 N ATOM 0 H GLN B 369 10.686 -15.807 0.301 1.00 0.00 H new ATOM 0 HA GLN B 369 12.061 -15.588 -2.252 1.00 0.00 H new ATOM 0 HB2 GLN B 369 9.499 -14.356 -1.184 1.00 0.00 H new ATOM 0 HB3 GLN B 369 10.057 -14.270 -2.843 1.00 0.00 H new ATOM 0 HG2 GLN B 369 9.373 -16.833 -1.357 1.00 0.00 H new ATOM 0 HG3 GLN B 369 8.324 -16.016 -2.499 1.00 0.00 H new ATOM 0 HE21 GLN B 369 9.527 -18.748 -2.547 1.00 0.00 H new ATOM 0 HE22 GLN B 369 10.427 -18.843 -4.065 1.00 0.00 H new ATOM 1962 N GLU B 370 13.471 -13.747 -0.983 1.00 0.00 N ATOM 1963 CA GLU B 370 14.235 -12.557 -0.614 1.00 0.00 C ATOM 1964 C GLU B 370 14.146 -11.479 -1.686 1.00 0.00 C ATOM 1965 O GLU B 370 14.178 -10.286 -1.386 1.00 0.00 O ATOM 1966 CB GLU B 370 15.703 -12.923 -0.381 1.00 0.00 C ATOM 1967 CG GLU B 370 15.905 -14.065 0.604 1.00 0.00 C ATOM 1968 CD GLU B 370 15.258 -13.807 1.950 1.00 0.00 C ATOM 1969 OE1 GLU B 370 15.194 -12.633 2.368 1.00 0.00 O ATOM 1970 OE2 GLU B 370 14.814 -14.782 2.596 1.00 0.00 O ATOM 0 H GLU B 370 14.030 -14.599 -1.033 1.00 0.00 H new ATOM 0 HA GLU B 370 13.803 -12.162 0.306 1.00 0.00 H new ATOM 0 HB2 GLU B 370 16.155 -13.195 -1.335 1.00 0.00 H new ATOM 0 HB3 GLU B 370 16.233 -12.043 -0.016 1.00 0.00 H new ATOM 0 HG2 GLU B 370 15.494 -14.981 0.179 1.00 0.00 H new ATOM 0 HG3 GLU B 370 16.973 -14.230 0.746 1.00 0.00 H new ATOM 1977 N ASP B 371 14.022 -11.909 -2.934 1.00 0.00 N ATOM 1978 CA ASP B 371 13.951 -10.994 -4.069 1.00 0.00 C ATOM 1979 C ASP B 371 12.751 -10.054 -3.952 1.00 0.00 C ATOM 1980 O ASP B 371 12.814 -8.895 -4.368 1.00 0.00 O ATOM 1981 CB ASP B 371 13.879 -11.788 -5.373 1.00 0.00 C ATOM 1982 CG ASP B 371 13.708 -10.901 -6.589 1.00 0.00 C ATOM 1983 OD1 ASP B 371 14.620 -10.103 -6.885 1.00 0.00 O ATOM 1984 OD2 ASP B 371 12.661 -11.015 -7.265 1.00 0.00 O ATOM 0 H ASP B 371 13.968 -12.895 -3.189 1.00 0.00 H new ATOM 0 HA ASP B 371 14.853 -10.382 -4.070 1.00 0.00 H new ATOM 0 HB2 ASP B 371 14.788 -12.379 -5.484 1.00 0.00 H new ATOM 0 HB3 ASP B 371 13.047 -12.490 -5.321 1.00 0.00 H new ATOM 1989 N LEU B 372 11.671 -10.547 -3.358 1.00 0.00 N ATOM 1990 CA LEU B 372 10.465 -9.750 -3.185 1.00 0.00 C ATOM 1991 C LEU B 372 10.731 -8.599 -2.214 1.00 0.00 C ATOM 1992 O LEU B 372 10.454 -7.442 -2.518 1.00 0.00 O ATOM 1993 CB LEU B 372 9.321 -10.632 -2.675 1.00 0.00 C ATOM 1994 CG LEU B 372 7.940 -9.975 -2.653 1.00 0.00 C ATOM 1995 CD1 LEU B 372 7.473 -9.654 -4.062 1.00 0.00 C ATOM 1996 CD2 LEU B 372 6.935 -10.875 -1.959 1.00 0.00 C ATOM 0 H LEU B 372 11.607 -11.495 -2.988 1.00 0.00 H new ATOM 0 HA LEU B 372 10.175 -9.330 -4.148 1.00 0.00 H new ATOM 0 HB2 LEU B 372 9.269 -11.525 -3.298 1.00 0.00 H new ATOM 0 HB3 LEU B 372 9.563 -10.962 -1.665 1.00 0.00 H new ATOM 0 HG LEU B 372 8.017 -9.042 -2.095 1.00 0.00 H new ATOM 0 HD11 LEU B 372 6.489 -9.187 -4.022 1.00 0.00 H new ATOM 0 HD12 LEU B 372 8.180 -8.970 -4.533 1.00 0.00 H new ATOM 0 HD13 LEU B 372 7.415 -10.574 -4.644 1.00 0.00 H new ATOM 0 HD21 LEU B 372 5.958 -10.392 -1.952 1.00 0.00 H new ATOM 0 HD22 LEU B 372 6.867 -11.824 -2.492 1.00 0.00 H new ATOM 0 HD23 LEU B 372 7.257 -11.057 -0.934 1.00 0.00 H new ATOM 2008 N LEU B 373 11.304 -8.924 -1.059 1.00 0.00 N ATOM 2009 CA LEU B 373 11.634 -7.915 -0.056 1.00 0.00 C ATOM 2010 C LEU B 373 12.740 -6.989 -0.563 1.00 0.00 C ATOM 2011 O LEU B 373 12.772 -5.800 -0.237 1.00 0.00 O ATOM 2012 CB LEU B 373 12.057 -8.587 1.257 1.00 0.00 C ATOM 2013 CG LEU B 373 12.653 -7.651 2.312 1.00 0.00 C ATOM 2014 CD1 LEU B 373 11.602 -6.694 2.845 1.00 0.00 C ATOM 2015 CD2 LEU B 373 13.267 -8.453 3.446 1.00 0.00 C ATOM 0 H LEU B 373 11.550 -9.878 -0.794 1.00 0.00 H new ATOM 0 HA LEU B 373 10.745 -7.313 0.131 1.00 0.00 H new ATOM 0 HB2 LEU B 373 11.188 -9.085 1.687 1.00 0.00 H new ATOM 0 HB3 LEU B 373 12.788 -9.363 1.029 1.00 0.00 H new ATOM 0 HG LEU B 373 13.438 -7.061 1.838 1.00 0.00 H new ATOM 0 HD11 LEU B 373 12.051 -6.040 3.593 1.00 0.00 H new ATOM 0 HD12 LEU B 373 11.209 -6.092 2.026 1.00 0.00 H new ATOM 0 HD13 LEU B 373 10.790 -7.262 3.300 1.00 0.00 H new ATOM 0 HD21 LEU B 373 13.686 -7.773 4.187 1.00 0.00 H new ATOM 0 HD22 LEU B 373 12.499 -9.070 3.913 1.00 0.00 H new ATOM 0 HD23 LEU B 373 14.057 -9.093 3.053 1.00 0.00 H new ATOM 2027 N SER B 374 13.639 -7.531 -1.372 1.00 0.00 N ATOM 2028 CA SER B 374 14.705 -6.734 -1.957 1.00 0.00 C ATOM 2029 C SER B 374 14.110 -5.661 -2.872 1.00 0.00 C ATOM 2030 O SER B 374 14.587 -4.525 -2.907 1.00 0.00 O ATOM 2031 CB SER B 374 15.676 -7.629 -2.731 1.00 0.00 C ATOM 2032 OG SER B 374 16.946 -7.014 -2.862 1.00 0.00 O ATOM 0 H SER B 374 13.651 -8.516 -1.637 1.00 0.00 H new ATOM 0 HA SER B 374 15.260 -6.242 -1.158 1.00 0.00 H new ATOM 0 HB2 SER B 374 15.783 -8.584 -2.217 1.00 0.00 H new ATOM 0 HB3 SER B 374 15.269 -7.843 -3.719 1.00 0.00 H new ATOM 0 HG SER B 374 17.547 -7.608 -3.359 1.00 0.00 H new ATOM 2038 N GLU B 375 13.047 -6.022 -3.589 1.00 0.00 N ATOM 2039 CA GLU B 375 12.325 -5.075 -4.433 1.00 0.00 C ATOM 2040 C GLU B 375 11.570 -4.075 -3.557 1.00 0.00 C ATOM 2041 O GLU B 375 11.438 -2.899 -3.897 1.00 0.00 O ATOM 2042 CB GLU B 375 11.354 -5.833 -5.348 1.00 0.00 C ATOM 2043 CG GLU B 375 10.615 -4.954 -6.348 1.00 0.00 C ATOM 2044 CD GLU B 375 11.539 -4.303 -7.353 1.00 0.00 C ATOM 2045 OE1 GLU B 375 12.071 -5.013 -8.227 1.00 0.00 O ATOM 2046 OE2 GLU B 375 11.737 -3.076 -7.278 1.00 0.00 O ATOM 0 H GLU B 375 12.666 -6.968 -3.601 1.00 0.00 H new ATOM 0 HA GLU B 375 13.033 -4.527 -5.055 1.00 0.00 H new ATOM 0 HB2 GLU B 375 11.909 -6.596 -5.894 1.00 0.00 H new ATOM 0 HB3 GLU B 375 10.622 -6.353 -4.730 1.00 0.00 H new ATOM 0 HG2 GLU B 375 9.877 -5.556 -6.877 1.00 0.00 H new ATOM 0 HG3 GLU B 375 10.068 -4.180 -5.810 1.00 0.00 H new ATOM 2053 N PHE B 376 11.104 -4.558 -2.409 1.00 0.00 N ATOM 2054 CA PHE B 376 10.395 -3.728 -1.443 1.00 0.00 C ATOM 2055 C PHE B 376 11.326 -2.667 -0.857 1.00 0.00 C ATOM 2056 O PHE B 376 10.871 -1.620 -0.397 1.00 0.00 O ATOM 2057 CB PHE B 376 9.818 -4.592 -0.320 1.00 0.00 C ATOM 2058 CG PHE B 376 8.815 -3.875 0.540 1.00 0.00 C ATOM 2059 CD1 PHE B 376 7.514 -3.713 0.100 1.00 0.00 C ATOM 2060 CD2 PHE B 376 9.171 -3.365 1.778 1.00 0.00 C ATOM 2061 CE1 PHE B 376 6.582 -3.056 0.874 1.00 0.00 C ATOM 2062 CE2 PHE B 376 8.243 -2.705 2.561 1.00 0.00 C ATOM 2063 CZ PHE B 376 6.945 -2.550 2.108 1.00 0.00 C ATOM 0 H PHE B 376 11.207 -5.532 -2.124 1.00 0.00 H new ATOM 0 HA PHE B 376 9.577 -3.227 -1.961 1.00 0.00 H new ATOM 0 HB2 PHE B 376 9.346 -5.472 -0.757 1.00 0.00 H new ATOM 0 HB3 PHE B 376 10.634 -4.947 0.309 1.00 0.00 H new ATOM 0 HD1 PHE B 376 7.224 -4.107 -0.863 1.00 0.00 H new ATOM 0 HD2 PHE B 376 10.183 -3.484 2.135 1.00 0.00 H new ATOM 0 HE1 PHE B 376 5.570 -2.937 0.517 1.00 0.00 H new ATOM 0 HE2 PHE B 376 8.530 -2.311 3.525 1.00 0.00 H new ATOM 0 HZ PHE B 376 6.217 -2.035 2.717 1.00 0.00 H new ATOM 2073 N GLY B 377 12.624 -2.966 -0.859 1.00 0.00 N ATOM 2074 CA GLY B 377 13.628 -2.051 -0.333 1.00 0.00 C ATOM 2075 C GLY B 377 13.453 -0.610 -0.791 1.00 0.00 C ATOM 2076 O GLY B 377 13.466 0.305 0.027 1.00 0.00 O ATOM 0 H GLY B 377 13.004 -3.840 -1.222 1.00 0.00 H new ATOM 0 HA2 GLY B 377 13.597 -2.081 0.756 1.00 0.00 H new ATOM 0 HA3 GLY B 377 14.616 -2.400 -0.634 1.00 0.00 H new ATOM 2080 N GLN B 378 13.283 -0.398 -2.092 1.00 0.00 N ATOM 2081 CA GLN B 378 13.121 0.952 -2.628 1.00 0.00 C ATOM 2082 C GLN B 378 11.738 1.535 -2.337 1.00 0.00 C ATOM 2083 O GLN B 378 11.486 2.706 -2.614 1.00 0.00 O ATOM 2084 CB GLN B 378 13.390 0.979 -4.132 1.00 0.00 C ATOM 2085 CG GLN B 378 14.852 0.770 -4.491 1.00 0.00 C ATOM 2086 CD GLN B 378 15.331 -0.652 -4.283 1.00 0.00 C ATOM 2087 OE1 GLN B 378 14.566 -1.608 -4.408 1.00 0.00 O ATOM 2088 NE2 GLN B 378 16.605 -0.799 -3.961 1.00 0.00 N ATOM 0 H GLN B 378 13.254 -1.138 -2.793 1.00 0.00 H new ATOM 0 HA GLN B 378 13.856 1.576 -2.120 1.00 0.00 H new ATOM 0 HB2 GLN B 378 12.792 0.206 -4.614 1.00 0.00 H new ATOM 0 HB3 GLN B 378 13.058 1.936 -4.535 1.00 0.00 H new ATOM 0 HG2 GLN B 378 15.004 1.047 -5.534 1.00 0.00 H new ATOM 0 HG3 GLN B 378 15.465 1.442 -3.890 1.00 0.00 H new ATOM 0 HE21 GLN B 378 17.205 0.020 -3.867 1.00 0.00 H new ATOM 0 HE22 GLN B 378 16.988 -1.732 -3.806 1.00 0.00 H new ATOM 2097 N PHE B 379 10.839 0.732 -1.788 1.00 0.00 N ATOM 2098 CA PHE B 379 9.540 1.240 -1.367 1.00 0.00 C ATOM 2099 C PHE B 379 9.619 1.722 0.076 1.00 0.00 C ATOM 2100 O PHE B 379 8.805 2.530 0.524 1.00 0.00 O ATOM 2101 CB PHE B 379 8.453 0.173 -1.507 1.00 0.00 C ATOM 2102 CG PHE B 379 8.081 -0.126 -2.931 1.00 0.00 C ATOM 2103 CD1 PHE B 379 7.243 0.725 -3.632 1.00 0.00 C ATOM 2104 CD2 PHE B 379 8.560 -1.258 -3.564 1.00 0.00 C ATOM 2105 CE1 PHE B 379 6.891 0.452 -4.938 1.00 0.00 C ATOM 2106 CE2 PHE B 379 8.213 -1.538 -4.871 1.00 0.00 C ATOM 2107 CZ PHE B 379 7.375 -0.682 -5.558 1.00 0.00 C ATOM 0 H PHE B 379 10.982 -0.265 -1.624 1.00 0.00 H new ATOM 0 HA PHE B 379 9.274 2.075 -2.015 1.00 0.00 H new ATOM 0 HB2 PHE B 379 8.794 -0.745 -1.029 1.00 0.00 H new ATOM 0 HB3 PHE B 379 7.563 0.501 -0.969 1.00 0.00 H new ATOM 0 HD1 PHE B 379 6.860 1.613 -3.151 1.00 0.00 H new ATOM 0 HD2 PHE B 379 9.214 -1.932 -3.030 1.00 0.00 H new ATOM 0 HE1 PHE B 379 6.238 1.125 -5.474 1.00 0.00 H new ATOM 0 HE2 PHE B 379 8.596 -2.424 -5.355 1.00 0.00 H new ATOM 0 HZ PHE B 379 7.099 -0.900 -6.579 1.00 0.00 H new ATOM 2117 N LEU B 380 10.621 1.229 0.793 1.00 0.00 N ATOM 2118 CA LEU B 380 10.861 1.633 2.172 1.00 0.00 C ATOM 2119 C LEU B 380 12.349 1.955 2.358 1.00 0.00 C ATOM 2120 O LEU B 380 13.054 1.271 3.102 1.00 0.00 O ATOM 2121 CB LEU B 380 10.435 0.509 3.129 1.00 0.00 C ATOM 2122 CG LEU B 380 9.760 0.951 4.436 1.00 0.00 C ATOM 2123 CD1 LEU B 380 10.642 1.906 5.230 1.00 0.00 C ATOM 2124 CD2 LEU B 380 8.410 1.589 4.147 1.00 0.00 C ATOM 0 H LEU B 380 11.286 0.542 0.438 1.00 0.00 H new ATOM 0 HA LEU B 380 10.273 2.523 2.397 1.00 0.00 H new ATOM 0 HB2 LEU B 380 9.752 -0.153 2.597 1.00 0.00 H new ATOM 0 HB3 LEU B 380 11.317 -0.079 3.381 1.00 0.00 H new ATOM 0 HG LEU B 380 9.606 0.061 5.046 1.00 0.00 H new ATOM 0 HD11 LEU B 380 10.130 2.196 6.148 1.00 0.00 H new ATOM 0 HD12 LEU B 380 11.581 1.412 5.479 1.00 0.00 H new ATOM 0 HD13 LEU B 380 10.847 2.794 4.632 1.00 0.00 H new ATOM 0 HD21 LEU B 380 7.945 1.897 5.084 1.00 0.00 H new ATOM 0 HD22 LEU B 380 8.549 2.461 3.507 1.00 0.00 H new ATOM 0 HD23 LEU B 380 7.767 0.868 3.642 1.00 0.00 H new