USER MOD reduce.3.24.130724 H: found=0, std=0, add=728, rem=0, adj=18 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 335 TYR OH : rot 19:sc= 0.764 USER MOD Set 1.2: B 339 GLN : amide:sc= 0.401 X(o=1.2,f=1.6) USER MOD Set 2.1: A 218 MET CE :methyl -142:sc= 0 (180deg=0) USER MOD Set 2.2: B 336 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 221 ASN : amide:sc= -2.41! C(o=-2.4!,f=-6.8!) USER MOD Single : A 223 THR OG1 : rot 180:sc= 0 USER MOD Single : B 305 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : B 306 HIS : no HE2:sc= 0.876 K(o=0.88,f=-5.8!) USER MOD Single : B 309 ASN : amide:sc= -1.82! C(o=-1.8!,f=-4!) USER MOD Single : B 310 TYR OH : rot 17:sc= -0.981! USER MOD Single : B 312 ASN : amide:sc= 1.06 K(o=1.1,f=-6.4!) USER MOD Single : B 313 LYS NZ :NH3+ -169:sc= 0.804! (180deg=0.0178!) USER MOD Single : B 315 LYS NZ :NH3+ -153:sc= -0.145 (180deg=-0.699) USER MOD Single : B 316 ASN :FLIP amide:sc= 0 F(o=-0.79,f=0) USER MOD Single : B 319 GLN : amide:sc= -0.013 K(o=-0.013,f=-0.91) USER MOD Single : B 321 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : B 325 TYR OH : rot -30:sc= 0 USER MOD Single : B 326 LYS NZ :NH3+ -153:sc= 0.917 (180deg=0.819) USER MOD Single : B 333 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : B 334 THR OG1 : rot 75:sc= 1.27 USER MOD Single : B 337 LYS NZ :NH3+ -176:sc= 1.19 (180deg=1.13) USER MOD Single : B 341 ASN : amide:sc= -0.0151 K(o=-0.015,f=-1.6!) USER MOD Single : B 343 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 354 THR OG1 : rot 180:sc= 0 USER MOD Single : B 356 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : B 359 TYR OH : rot 180:sc= 0 USER MOD Single : B 361 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : B 367 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0214) USER MOD Single : B 368 ASN : amide:sc= -0.127 X(o=-0.13,f=-0.24) USER MOD Single : B 369 GLN :FLIP amide:sc= -0.304 F(o=-0.83,f=-0.3) USER MOD Single : B 374 SER OG : rot 180:sc= 0 USER MOD Single : B 378 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 178 N ARG A 208 3.164 10.266 -0.888 1.00 0.00 N ATOM 179 CA ARG A 208 4.388 9.704 -0.330 1.00 0.00 C ATOM 180 C ARG A 208 4.739 8.405 -1.058 1.00 0.00 C ATOM 181 O ARG A 208 3.879 7.815 -1.716 1.00 0.00 O ATOM 182 CB ARG A 208 4.228 9.437 1.170 1.00 0.00 C ATOM 183 CG ARG A 208 4.269 10.683 2.032 1.00 0.00 C ATOM 184 CD ARG A 208 4.259 10.322 3.507 1.00 0.00 C ATOM 185 NE ARG A 208 4.510 11.482 4.356 1.00 0.00 N ATOM 186 CZ ARG A 208 4.811 11.405 5.654 1.00 0.00 C ATOM 187 NH1 ARG A 208 4.907 10.220 6.252 1.00 0.00 N ATOM 188 NH2 ARG A 208 5.032 12.513 6.350 1.00 0.00 N ATOM 0 HA ARG A 208 5.195 10.424 -0.466 1.00 0.00 H new ATOM 0 HB2 ARG A 208 3.281 8.925 1.337 1.00 0.00 H new ATOM 0 HB3 ARG A 208 5.018 8.759 1.493 1.00 0.00 H new ATOM 0 HG2 ARG A 208 5.164 11.261 1.801 1.00 0.00 H new ATOM 0 HG3 ARG A 208 3.412 11.317 1.803 1.00 0.00 H new ATOM 0 HD2 ARG A 208 3.295 9.885 3.767 1.00 0.00 H new ATOM 0 HD3 ARG A 208 5.016 9.562 3.699 1.00 0.00 H new ATOM 0 HE ARG A 208 4.452 12.408 3.932 1.00 0.00 H new ATOM 0 HH11 ARG A 208 4.750 9.365 5.718 1.00 0.00 H new ATOM 0 HH12 ARG A 208 5.137 10.167 7.244 1.00 0.00 H new ATOM 0 HH21 ARG A 208 4.972 13.423 5.893 1.00 0.00 H new ATOM 0 HH22 ARG A 208 5.262 12.455 7.342 1.00 0.00 H new ATOM 202 N PRO A 209 6.001 7.949 -0.967 1.00 0.00 N ATOM 203 CA PRO A 209 6.443 6.701 -1.606 1.00 0.00 C ATOM 204 C PRO A 209 5.609 5.496 -1.183 1.00 0.00 C ATOM 205 O PRO A 209 5.130 4.740 -2.020 1.00 0.00 O ATOM 206 CB PRO A 209 7.883 6.532 -1.123 1.00 0.00 C ATOM 207 CG PRO A 209 8.329 7.903 -0.752 1.00 0.00 C ATOM 208 CD PRO A 209 7.105 8.621 -0.256 1.00 0.00 C ATOM 0 HA PRO A 209 6.343 6.755 -2.690 1.00 0.00 H new ATOM 0 HB2 PRO A 209 7.936 5.855 -0.270 1.00 0.00 H new ATOM 0 HB3 PRO A 209 8.514 6.110 -1.905 1.00 0.00 H new ATOM 0 HG2 PRO A 209 9.099 7.867 0.019 1.00 0.00 H new ATOM 0 HG3 PRO A 209 8.761 8.417 -1.610 1.00 0.00 H new ATOM 0 HD2 PRO A 209 6.999 8.533 0.825 1.00 0.00 H new ATOM 0 HD3 PRO A 209 7.143 9.686 -0.487 1.00 0.00 H new ATOM 216 N PHE A 210 5.422 5.323 0.115 1.00 0.00 N ATOM 217 CA PHE A 210 4.659 4.188 0.609 1.00 0.00 C ATOM 218 C PHE A 210 3.168 4.454 0.446 1.00 0.00 C ATOM 219 O PHE A 210 2.358 3.532 0.397 1.00 0.00 O ATOM 220 CB PHE A 210 5.002 3.903 2.074 1.00 0.00 C ATOM 221 CG PHE A 210 4.481 2.581 2.567 1.00 0.00 C ATOM 222 CD1 PHE A 210 5.037 1.395 2.119 1.00 0.00 C ATOM 223 CD2 PHE A 210 3.435 2.524 3.469 1.00 0.00 C ATOM 224 CE1 PHE A 210 4.560 0.178 2.564 1.00 0.00 C ATOM 225 CE2 PHE A 210 2.953 1.307 3.919 1.00 0.00 C ATOM 226 CZ PHE A 210 3.517 0.133 3.465 1.00 0.00 C ATOM 0 H PHE A 210 5.783 5.945 0.838 1.00 0.00 H new ATOM 0 HA PHE A 210 4.923 3.307 0.025 1.00 0.00 H new ATOM 0 HB2 PHE A 210 6.085 3.926 2.196 1.00 0.00 H new ATOM 0 HB3 PHE A 210 4.594 4.700 2.696 1.00 0.00 H new ATOM 0 HD1 PHE A 210 5.854 1.422 1.413 1.00 0.00 H new ATOM 0 HD2 PHE A 210 2.989 3.440 3.827 1.00 0.00 H new ATOM 0 HE1 PHE A 210 5.004 -0.739 2.206 1.00 0.00 H new ATOM 0 HE2 PHE A 210 2.136 1.277 4.625 1.00 0.00 H new ATOM 0 HZ PHE A 210 3.143 -0.818 3.814 1.00 0.00 H new ATOM 236 N GLU A 211 2.822 5.729 0.333 1.00 0.00 N ATOM 237 CA GLU A 211 1.439 6.141 0.135 1.00 0.00 C ATOM 238 C GLU A 211 0.947 5.703 -1.249 1.00 0.00 C ATOM 239 O GLU A 211 -0.192 5.249 -1.403 1.00 0.00 O ATOM 240 CB GLU A 211 1.332 7.660 0.300 1.00 0.00 C ATOM 241 CG GLU A 211 -0.073 8.221 0.157 1.00 0.00 C ATOM 242 CD GLU A 211 -1.027 7.703 1.208 1.00 0.00 C ATOM 243 OE1 GLU A 211 -0.899 8.109 2.380 1.00 0.00 O ATOM 244 OE2 GLU A 211 -1.914 6.900 0.855 1.00 0.00 O ATOM 0 H GLU A 211 3.486 6.502 0.376 1.00 0.00 H new ATOM 0 HA GLU A 211 0.806 5.662 0.882 1.00 0.00 H new ATOM 0 HB2 GLU A 211 1.718 7.932 1.282 1.00 0.00 H new ATOM 0 HB3 GLU A 211 1.975 8.137 -0.439 1.00 0.00 H new ATOM 0 HG2 GLU A 211 -0.032 9.309 0.217 1.00 0.00 H new ATOM 0 HG3 GLU A 211 -0.459 7.970 -0.831 1.00 0.00 H new ATOM 251 N LEU A 212 1.813 5.817 -2.256 1.00 0.00 N ATOM 252 CA LEU A 212 1.454 5.360 -3.593 1.00 0.00 C ATOM 253 C LEU A 212 1.410 3.836 -3.630 1.00 0.00 C ATOM 254 O LEU A 212 0.704 3.252 -4.447 1.00 0.00 O ATOM 255 CB LEU A 212 2.387 5.937 -4.685 1.00 0.00 C ATOM 256 CG LEU A 212 3.896 5.666 -4.556 1.00 0.00 C ATOM 257 CD1 LEU A 212 4.240 4.235 -4.948 1.00 0.00 C ATOM 258 CD2 LEU A 212 4.676 6.639 -5.426 1.00 0.00 C ATOM 0 H LEU A 212 2.749 6.214 -2.173 1.00 0.00 H new ATOM 0 HA LEU A 212 0.458 5.740 -3.821 1.00 0.00 H new ATOM 0 HB2 LEU A 212 2.058 5.546 -5.648 1.00 0.00 H new ATOM 0 HB3 LEU A 212 2.242 7.017 -4.713 1.00 0.00 H new ATOM 0 HG LEU A 212 4.173 5.807 -3.511 1.00 0.00 H new ATOM 0 HD11 LEU A 212 5.314 4.078 -4.845 1.00 0.00 H new ATOM 0 HD12 LEU A 212 3.708 3.541 -4.297 1.00 0.00 H new ATOM 0 HD13 LEU A 212 3.945 4.060 -5.983 1.00 0.00 H new ATOM 0 HD21 LEU A 212 5.743 6.440 -5.328 1.00 0.00 H new ATOM 0 HD22 LEU A 212 4.378 6.516 -6.467 1.00 0.00 H new ATOM 0 HD23 LEU A 212 4.467 7.660 -5.107 1.00 0.00 H new ATOM 270 N LEU A 213 2.158 3.201 -2.728 1.00 0.00 N ATOM 271 CA LEU A 213 2.111 1.751 -2.579 1.00 0.00 C ATOM 272 C LEU A 213 0.724 1.346 -2.085 1.00 0.00 C ATOM 273 O LEU A 213 0.138 0.381 -2.574 1.00 0.00 O ATOM 274 CB LEU A 213 3.203 1.286 -1.598 1.00 0.00 C ATOM 275 CG LEU A 213 3.571 -0.210 -1.624 1.00 0.00 C ATOM 276 CD1 LEU A 213 2.494 -1.062 -0.967 1.00 0.00 C ATOM 277 CD2 LEU A 213 3.814 -0.675 -3.051 1.00 0.00 C ATOM 0 H LEU A 213 2.802 3.669 -2.091 1.00 0.00 H new ATOM 0 HA LEU A 213 2.298 1.273 -3.540 1.00 0.00 H new ATOM 0 HB2 LEU A 213 4.107 1.861 -1.799 1.00 0.00 H new ATOM 0 HB3 LEU A 213 2.882 1.539 -0.588 1.00 0.00 H new ATOM 0 HG LEU A 213 4.490 -0.333 -1.051 1.00 0.00 H new ATOM 0 HD11 LEU A 213 2.787 -2.111 -1.004 1.00 0.00 H new ATOM 0 HD12 LEU A 213 2.371 -0.756 0.072 1.00 0.00 H new ATOM 0 HD13 LEU A 213 1.551 -0.930 -1.498 1.00 0.00 H new ATOM 0 HD21 LEU A 213 4.073 -1.734 -3.050 1.00 0.00 H new ATOM 0 HD22 LEU A 213 2.911 -0.523 -3.642 1.00 0.00 H new ATOM 0 HD23 LEU A 213 4.633 -0.102 -3.486 1.00 0.00 H new ATOM 289 N ILE A 214 0.200 2.106 -1.125 1.00 0.00 N ATOM 290 CA ILE A 214 -1.147 1.879 -0.609 1.00 0.00 C ATOM 291 C ILE A 214 -2.162 1.949 -1.746 1.00 0.00 C ATOM 292 O ILE A 214 -2.969 1.031 -1.942 1.00 0.00 O ATOM 293 CB ILE A 214 -1.528 2.925 0.464 1.00 0.00 C ATOM 294 CG1 ILE A 214 -0.511 2.916 1.608 1.00 0.00 C ATOM 295 CG2 ILE A 214 -2.932 2.663 0.994 1.00 0.00 C ATOM 296 CD1 ILE A 214 -0.777 3.965 2.668 1.00 0.00 C ATOM 0 H ILE A 214 0.690 2.887 -0.688 1.00 0.00 H new ATOM 0 HA ILE A 214 -1.159 0.889 -0.153 1.00 0.00 H new ATOM 0 HB ILE A 214 -1.516 3.912 0.001 1.00 0.00 H new ATOM 0 HG12 ILE A 214 -0.512 1.931 2.076 1.00 0.00 H new ATOM 0 HG13 ILE A 214 0.486 3.072 1.197 1.00 0.00 H new ATOM 0 HG21 ILE A 214 -3.181 3.410 1.748 1.00 0.00 H new ATOM 0 HG22 ILE A 214 -3.647 2.722 0.174 1.00 0.00 H new ATOM 0 HG23 ILE A 214 -2.973 1.669 1.440 1.00 0.00 H new ATOM 0 HD11 ILE A 214 -0.016 3.898 3.445 1.00 0.00 H new ATOM 0 HD12 ILE A 214 -0.746 4.956 2.215 1.00 0.00 H new ATOM 0 HD13 ILE A 214 -1.760 3.797 3.107 1.00 0.00 H new ATOM 308 N ALA A 215 -2.100 3.041 -2.501 1.00 0.00 N ATOM 309 CA ALA A 215 -2.986 3.238 -3.641 1.00 0.00 C ATOM 310 C ALA A 215 -2.829 2.113 -4.662 1.00 0.00 C ATOM 311 O ALA A 215 -3.815 1.562 -5.146 1.00 0.00 O ATOM 312 CB ALA A 215 -2.722 4.588 -4.290 1.00 0.00 C ATOM 0 H ALA A 215 -1.443 3.805 -2.343 1.00 0.00 H new ATOM 0 HA ALA A 215 -4.013 3.220 -3.278 1.00 0.00 H new ATOM 0 HB1 ALA A 215 -3.392 4.720 -5.140 1.00 0.00 H new ATOM 0 HB2 ALA A 215 -2.897 5.381 -3.563 1.00 0.00 H new ATOM 0 HB3 ALA A 215 -1.688 4.631 -4.633 1.00 0.00 H new ATOM 318 N ALA A 216 -1.582 1.771 -4.968 1.00 0.00 N ATOM 319 CA ALA A 216 -1.283 0.720 -5.933 1.00 0.00 C ATOM 320 C ALA A 216 -1.835 -0.626 -5.481 1.00 0.00 C ATOM 321 O ALA A 216 -2.393 -1.374 -6.281 1.00 0.00 O ATOM 322 CB ALA A 216 0.214 0.623 -6.153 1.00 0.00 C ATOM 0 H ALA A 216 -0.757 2.210 -4.558 1.00 0.00 H new ATOM 0 HA ALA A 216 -1.768 0.982 -6.873 1.00 0.00 H new ATOM 0 HB1 ALA A 216 0.425 -0.165 -6.876 1.00 0.00 H new ATOM 0 HB2 ALA A 216 0.588 1.574 -6.533 1.00 0.00 H new ATOM 0 HB3 ALA A 216 0.706 0.391 -5.209 1.00 0.00 H new ATOM 328 N ALA A 217 -1.675 -0.927 -4.197 1.00 0.00 N ATOM 329 CA ALA A 217 -2.183 -2.171 -3.635 1.00 0.00 C ATOM 330 C ALA A 217 -3.693 -2.283 -3.832 1.00 0.00 C ATOM 331 O ALA A 217 -4.199 -3.338 -4.208 1.00 0.00 O ATOM 332 CB ALA A 217 -1.835 -2.269 -2.160 1.00 0.00 C ATOM 0 H ALA A 217 -1.197 -0.325 -3.526 1.00 0.00 H new ATOM 0 HA ALA A 217 -1.708 -2.998 -4.162 1.00 0.00 H new ATOM 0 HB1 ALA A 217 -2.222 -3.204 -1.756 1.00 0.00 H new ATOM 0 HB2 ALA A 217 -0.752 -2.242 -2.039 1.00 0.00 H new ATOM 0 HB3 ALA A 217 -2.281 -1.431 -1.625 1.00 0.00 H new ATOM 338 N MET A 218 -4.406 -1.190 -3.583 1.00 0.00 N ATOM 339 CA MET A 218 -5.859 -1.166 -3.750 1.00 0.00 C ATOM 340 C MET A 218 -6.239 -1.178 -5.226 1.00 0.00 C ATOM 341 O MET A 218 -7.269 -1.730 -5.606 1.00 0.00 O ATOM 342 CB MET A 218 -6.457 0.049 -3.040 1.00 0.00 C ATOM 343 CG MET A 218 -6.223 0.022 -1.540 1.00 0.00 C ATOM 344 SD MET A 218 -6.986 1.403 -0.675 1.00 0.00 S ATOM 345 CE MET A 218 -6.467 1.043 1.002 1.00 0.00 C ATOM 0 H MET A 218 -4.004 -0.308 -3.265 1.00 0.00 H new ATOM 0 HA MET A 218 -6.271 -2.066 -3.294 1.00 0.00 H new ATOM 0 HB2 MET A 218 -6.023 0.958 -3.456 1.00 0.00 H new ATOM 0 HB3 MET A 218 -7.528 0.089 -3.236 1.00 0.00 H new ATOM 0 HG2 MET A 218 -6.614 -0.912 -1.135 1.00 0.00 H new ATOM 0 HG3 MET A 218 -5.150 0.029 -1.347 1.00 0.00 H new ATOM 0 HE1 MET A 218 -7.275 1.285 1.693 1.00 0.00 H new ATOM 0 HE2 MET A 218 -6.221 -0.015 1.088 1.00 0.00 H new ATOM 0 HE3 MET A 218 -5.589 1.640 1.247 1.00 0.00 H new ATOM 355 N GLU A 219 -5.399 -0.571 -6.048 1.00 0.00 N ATOM 356 CA GLU A 219 -5.604 -0.548 -7.491 1.00 0.00 C ATOM 357 C GLU A 219 -5.482 -1.957 -8.083 1.00 0.00 C ATOM 358 O GLU A 219 -6.195 -2.308 -9.025 1.00 0.00 O ATOM 359 CB GLU A 219 -4.578 0.391 -8.138 1.00 0.00 C ATOM 360 CG GLU A 219 -4.698 0.524 -9.650 1.00 0.00 C ATOM 361 CD GLU A 219 -5.992 1.177 -10.089 1.00 0.00 C ATOM 362 OE1 GLU A 219 -6.329 2.256 -9.567 1.00 0.00 O ATOM 363 OE2 GLU A 219 -6.673 0.618 -10.974 1.00 0.00 O ATOM 0 H GLU A 219 -4.559 -0.082 -5.738 1.00 0.00 H new ATOM 0 HA GLU A 219 -6.610 -0.183 -7.697 1.00 0.00 H new ATOM 0 HB2 GLU A 219 -4.679 1.380 -7.691 1.00 0.00 H new ATOM 0 HB3 GLU A 219 -3.577 0.034 -7.897 1.00 0.00 H new ATOM 0 HG2 GLU A 219 -3.858 1.108 -10.025 1.00 0.00 H new ATOM 0 HG3 GLU A 219 -4.626 -0.465 -10.102 1.00 0.00 H new ATOM 370 N ARG A 220 -4.590 -2.764 -7.516 1.00 0.00 N ATOM 371 CA ARG A 220 -4.295 -4.087 -8.052 1.00 0.00 C ATOM 372 C ARG A 220 -5.001 -5.194 -7.250 1.00 0.00 C ATOM 373 O ARG A 220 -4.658 -6.373 -7.357 1.00 0.00 O ATOM 374 CB ARG A 220 -2.773 -4.299 -8.069 1.00 0.00 C ATOM 375 CG ARG A 220 -2.320 -5.532 -8.834 1.00 0.00 C ATOM 376 CD ARG A 220 -2.843 -5.526 -10.263 1.00 0.00 C ATOM 377 NE ARG A 220 -2.390 -6.688 -11.028 1.00 0.00 N ATOM 378 CZ ARG A 220 -3.194 -7.453 -11.768 1.00 0.00 C ATOM 379 NH1 ARG A 220 -4.507 -7.242 -11.772 1.00 0.00 N ATOM 380 NH2 ARG A 220 -2.681 -8.451 -12.479 1.00 0.00 N ATOM 0 H ARG A 220 -4.057 -2.522 -6.681 1.00 0.00 H new ATOM 0 HA ARG A 220 -4.677 -4.145 -9.071 1.00 0.00 H new ATOM 0 HB2 ARG A 220 -2.301 -3.420 -8.508 1.00 0.00 H new ATOM 0 HB3 ARG A 220 -2.417 -4.373 -7.041 1.00 0.00 H new ATOM 0 HG2 ARG A 220 -1.231 -5.575 -8.844 1.00 0.00 H new ATOM 0 HG3 ARG A 220 -2.670 -6.428 -8.321 1.00 0.00 H new ATOM 0 HD2 ARG A 220 -3.933 -5.507 -10.248 1.00 0.00 H new ATOM 0 HD3 ARG A 220 -2.515 -4.615 -10.763 1.00 0.00 H new ATOM 0 HE ARG A 220 -1.399 -6.928 -10.993 1.00 0.00 H new ATOM 0 HH11 ARG A 220 -4.905 -6.492 -11.207 1.00 0.00 H new ATOM 0 HH12 ARG A 220 -5.116 -7.831 -12.340 1.00 0.00 H new ATOM 0 HH21 ARG A 220 -1.677 -8.629 -12.457 1.00 0.00 H new ATOM 0 HH22 ARG A 220 -3.291 -9.039 -13.047 1.00 0.00 H new ATOM 394 N ASN A 221 -5.994 -4.822 -6.457 1.00 0.00 N ATOM 395 CA ASN A 221 -6.784 -5.809 -5.724 1.00 0.00 C ATOM 396 C ASN A 221 -8.245 -5.365 -5.682 1.00 0.00 C ATOM 397 O ASN A 221 -8.537 -4.194 -5.908 1.00 0.00 O ATOM 398 CB ASN A 221 -6.211 -6.031 -4.308 1.00 0.00 C ATOM 399 CG ASN A 221 -6.929 -5.257 -3.214 1.00 0.00 C ATOM 400 OD1 ASN A 221 -7.876 -5.753 -2.607 1.00 0.00 O ATOM 401 ND2 ASN A 221 -6.473 -4.051 -2.942 1.00 0.00 N ATOM 0 H ASN A 221 -6.273 -3.853 -6.303 1.00 0.00 H new ATOM 0 HA ASN A 221 -6.732 -6.767 -6.241 1.00 0.00 H new ATOM 0 HB2 ASN A 221 -6.255 -7.095 -4.073 1.00 0.00 H new ATOM 0 HB3 ASN A 221 -5.158 -5.748 -4.306 1.00 0.00 H new ATOM 0 HD21 ASN A 221 -6.908 -3.495 -2.206 1.00 0.00 H new ATOM 0 HD22 ASN A 221 -5.685 -3.673 -3.468 1.00 0.00 H new ATOM 408 N PRO A 222 -9.186 -6.295 -5.416 1.00 0.00 N ATOM 409 CA PRO A 222 -10.633 -6.001 -5.415 1.00 0.00 C ATOM 410 C PRO A 222 -11.038 -4.888 -4.443 1.00 0.00 C ATOM 411 O PRO A 222 -12.154 -4.375 -4.527 1.00 0.00 O ATOM 412 CB PRO A 222 -11.277 -7.330 -4.996 1.00 0.00 C ATOM 413 CG PRO A 222 -10.171 -8.133 -4.399 1.00 0.00 C ATOM 414 CD PRO A 222 -8.925 -7.711 -5.119 1.00 0.00 C ATOM 0 HA PRO A 222 -10.952 -5.637 -6.391 1.00 0.00 H new ATOM 0 HB2 PRO A 222 -12.079 -7.168 -4.276 1.00 0.00 H new ATOM 0 HB3 PRO A 222 -11.716 -7.841 -5.853 1.00 0.00 H new ATOM 0 HG2 PRO A 222 -10.086 -7.946 -3.328 1.00 0.00 H new ATOM 0 HG3 PRO A 222 -10.352 -9.201 -4.523 1.00 0.00 H new ATOM 0 HD2 PRO A 222 -8.037 -7.838 -4.500 1.00 0.00 H new ATOM 0 HD3 PRO A 222 -8.766 -8.292 -6.027 1.00 0.00 H new ATOM 422 N THR A 223 -10.123 -4.536 -3.531 1.00 0.00 N ATOM 423 CA THR A 223 -10.312 -3.477 -2.529 1.00 0.00 C ATOM 424 C THR A 223 -11.691 -3.528 -1.860 1.00 0.00 C ATOM 425 O THR A 223 -12.655 -2.902 -2.298 1.00 0.00 O ATOM 426 CB THR A 223 -9.995 -2.052 -3.079 1.00 0.00 C ATOM 427 OG1 THR A 223 -10.275 -1.066 -2.079 1.00 0.00 O ATOM 428 CG2 THR A 223 -10.776 -1.709 -4.344 1.00 0.00 C ATOM 0 H THR A 223 -9.211 -4.988 -3.467 1.00 0.00 H new ATOM 0 HA THR A 223 -9.575 -3.685 -1.753 1.00 0.00 H new ATOM 0 HB THR A 223 -8.936 -2.052 -3.337 1.00 0.00 H new ATOM 0 HG1 THR A 223 -10.072 -0.175 -2.432 1.00 0.00 H new ATOM 0 HG21 THR A 223 -10.510 -0.705 -4.675 1.00 0.00 H new ATOM 0 HG22 THR A 223 -10.532 -2.426 -5.128 1.00 0.00 H new ATOM 0 HG23 THR A 223 -11.845 -1.750 -4.134 1.00 0.00 H new ATOM 841 N VAL B 302 5.835 7.553 -11.793 1.00 0.00 N ATOM 842 CA VAL B 302 6.539 6.395 -12.331 1.00 0.00 C ATOM 843 C VAL B 302 6.702 5.322 -11.254 1.00 0.00 C ATOM 844 O VAL B 302 6.601 4.123 -11.529 1.00 0.00 O ATOM 845 CB VAL B 302 7.932 6.787 -12.874 1.00 0.00 C ATOM 846 CG1 VAL B 302 8.678 5.563 -13.375 1.00 0.00 C ATOM 847 CG2 VAL B 302 7.801 7.824 -13.980 1.00 0.00 C ATOM 0 HA VAL B 302 5.941 6.001 -13.153 1.00 0.00 H new ATOM 0 HB VAL B 302 8.506 7.225 -12.057 1.00 0.00 H new ATOM 0 HG11 VAL B 302 9.656 5.862 -13.753 1.00 0.00 H new ATOM 0 HG12 VAL B 302 8.806 4.855 -12.556 1.00 0.00 H new ATOM 0 HG13 VAL B 302 8.108 5.092 -14.176 1.00 0.00 H new ATOM 0 HG21 VAL B 302 8.792 8.088 -14.350 1.00 0.00 H new ATOM 0 HG22 VAL B 302 7.206 7.413 -14.796 1.00 0.00 H new ATOM 0 HG23 VAL B 302 7.311 8.715 -13.587 1.00 0.00 H new ATOM 857 N GLU B 303 6.923 5.764 -10.023 1.00 0.00 N ATOM 858 CA GLU B 303 7.103 4.848 -8.908 1.00 0.00 C ATOM 859 C GLU B 303 5.783 4.144 -8.607 1.00 0.00 C ATOM 860 O GLU B 303 5.763 2.997 -8.169 1.00 0.00 O ATOM 861 CB GLU B 303 7.601 5.598 -7.671 1.00 0.00 C ATOM 862 CG GLU B 303 8.319 4.709 -6.670 1.00 0.00 C ATOM 863 CD GLU B 303 9.636 4.185 -7.208 1.00 0.00 C ATOM 864 OE1 GLU B 303 9.623 3.239 -8.022 1.00 0.00 O ATOM 865 OE2 GLU B 303 10.695 4.725 -6.835 1.00 0.00 O ATOM 0 H GLU B 303 6.982 6.751 -9.773 1.00 0.00 H new ATOM 0 HA GLU B 303 7.852 4.104 -9.178 1.00 0.00 H new ATOM 0 HB2 GLU B 303 8.275 6.395 -7.986 1.00 0.00 H new ATOM 0 HB3 GLU B 303 6.753 6.074 -7.179 1.00 0.00 H new ATOM 0 HG2 GLU B 303 8.501 5.270 -5.754 1.00 0.00 H new ATOM 0 HG3 GLU B 303 7.676 3.869 -6.407 1.00 0.00 H new ATOM 872 N PHE B 304 4.680 4.842 -8.873 1.00 0.00 N ATOM 873 CA PHE B 304 3.348 4.270 -8.715 1.00 0.00 C ATOM 874 C PHE B 304 3.169 3.095 -9.669 1.00 0.00 C ATOM 875 O PHE B 304 2.674 2.041 -9.280 1.00 0.00 O ATOM 876 CB PHE B 304 2.277 5.339 -8.969 1.00 0.00 C ATOM 877 CG PHE B 304 0.866 4.828 -8.868 1.00 0.00 C ATOM 878 CD1 PHE B 304 0.293 4.578 -7.633 1.00 0.00 C ATOM 879 CD2 PHE B 304 0.113 4.604 -10.009 1.00 0.00 C ATOM 880 CE1 PHE B 304 -1.003 4.109 -7.537 1.00 0.00 C ATOM 881 CE2 PHE B 304 -1.183 4.134 -9.921 1.00 0.00 C ATOM 882 CZ PHE B 304 -1.742 3.886 -8.682 1.00 0.00 C ATOM 0 H PHE B 304 4.685 5.808 -9.200 1.00 0.00 H new ATOM 0 HA PHE B 304 3.237 3.909 -7.693 1.00 0.00 H new ATOM 0 HB2 PHE B 304 2.411 6.150 -8.253 1.00 0.00 H new ATOM 0 HB3 PHE B 304 2.429 5.762 -9.962 1.00 0.00 H new ATOM 0 HD1 PHE B 304 0.866 4.752 -6.734 1.00 0.00 H new ATOM 0 HD2 PHE B 304 0.545 4.799 -10.980 1.00 0.00 H new ATOM 0 HE1 PHE B 304 -1.438 3.917 -6.567 1.00 0.00 H new ATOM 0 HE2 PHE B 304 -1.758 3.961 -10.819 1.00 0.00 H new ATOM 0 HZ PHE B 304 -2.755 3.518 -8.609 1.00 0.00 H new ATOM 892 N ASN B 305 3.595 3.284 -10.914 1.00 0.00 N ATOM 893 CA ASN B 305 3.554 2.217 -11.913 1.00 0.00 C ATOM 894 C ASN B 305 4.389 1.026 -11.445 1.00 0.00 C ATOM 895 O ASN B 305 3.974 -0.133 -11.570 1.00 0.00 O ATOM 896 CB ASN B 305 4.076 2.731 -13.261 1.00 0.00 C ATOM 897 CG ASN B 305 3.999 1.686 -14.362 1.00 0.00 C ATOM 898 OD1 ASN B 305 3.126 0.820 -14.358 1.00 0.00 O ATOM 899 ND2 ASN B 305 4.915 1.759 -15.318 1.00 0.00 N ATOM 0 H ASN B 305 3.973 4.167 -11.257 1.00 0.00 H new ATOM 0 HA ASN B 305 2.520 1.895 -12.038 1.00 0.00 H new ATOM 0 HB2 ASN B 305 3.500 3.607 -13.558 1.00 0.00 H new ATOM 0 HB3 ASN B 305 5.111 3.054 -13.145 1.00 0.00 H new ATOM 0 HD21 ASN B 305 4.910 1.083 -16.082 1.00 0.00 H new ATOM 0 HD22 ASN B 305 5.625 2.491 -15.289 1.00 0.00 H new ATOM 906 N HIS B 306 5.561 1.326 -10.880 1.00 0.00 N ATOM 907 CA HIS B 306 6.436 0.298 -10.315 1.00 0.00 C ATOM 908 C HIS B 306 5.722 -0.456 -9.203 1.00 0.00 C ATOM 909 O HIS B 306 5.824 -1.677 -9.098 1.00 0.00 O ATOM 910 CB HIS B 306 7.725 0.906 -9.755 1.00 0.00 C ATOM 911 CG HIS B 306 8.642 1.478 -10.789 1.00 0.00 C ATOM 912 ND1 HIS B 306 9.579 2.439 -10.501 1.00 0.00 N ATOM 913 CD2 HIS B 306 8.793 1.189 -12.102 1.00 0.00 C ATOM 914 CE1 HIS B 306 10.263 2.726 -11.592 1.00 0.00 C ATOM 915 NE2 HIS B 306 9.811 1.977 -12.582 1.00 0.00 N ATOM 0 H HIS B 306 5.926 2.275 -10.802 1.00 0.00 H new ATOM 0 HA HIS B 306 6.692 -0.388 -11.122 1.00 0.00 H new ATOM 0 HB2 HIS B 306 7.463 1.691 -9.046 1.00 0.00 H new ATOM 0 HB3 HIS B 306 8.261 0.138 -9.197 1.00 0.00 H new ATOM 0 HD1 HIS B 306 9.724 2.865 -9.586 1.00 0.00 H new ATOM 0 HD2 HIS B 306 8.219 0.471 -12.669 1.00 0.00 H new ATOM 0 HE1 HIS B 306 11.059 3.452 -11.664 1.00 0.00 H new ATOM 924 N ALA B 307 5.005 0.282 -8.372 1.00 0.00 N ATOM 925 CA ALA B 307 4.255 -0.309 -7.279 1.00 0.00 C ATOM 926 C ALA B 307 3.160 -1.226 -7.809 1.00 0.00 C ATOM 927 O ALA B 307 2.908 -2.290 -7.246 1.00 0.00 O ATOM 928 CB ALA B 307 3.669 0.778 -6.399 1.00 0.00 C ATOM 0 H ALA B 307 4.927 1.297 -8.435 1.00 0.00 H new ATOM 0 HA ALA B 307 4.935 -0.912 -6.677 1.00 0.00 H new ATOM 0 HB1 ALA B 307 3.109 0.322 -5.583 1.00 0.00 H new ATOM 0 HB2 ALA B 307 4.474 1.389 -5.990 1.00 0.00 H new ATOM 0 HB3 ALA B 307 3.002 1.405 -6.991 1.00 0.00 H new ATOM 934 N ILE B 308 2.528 -0.814 -8.904 1.00 0.00 N ATOM 935 CA ILE B 308 1.492 -1.620 -9.542 1.00 0.00 C ATOM 936 C ILE B 308 2.034 -2.996 -9.924 1.00 0.00 C ATOM 937 O ILE B 308 1.471 -4.025 -9.536 1.00 0.00 O ATOM 938 CB ILE B 308 0.917 -0.932 -10.805 1.00 0.00 C ATOM 939 CG1 ILE B 308 0.287 0.417 -10.451 1.00 0.00 C ATOM 940 CG2 ILE B 308 -0.109 -1.829 -11.488 1.00 0.00 C ATOM 941 CD1 ILE B 308 -0.914 0.310 -9.535 1.00 0.00 C ATOM 0 H ILE B 308 2.715 0.074 -9.369 1.00 0.00 H new ATOM 0 HA ILE B 308 0.688 -1.731 -8.814 1.00 0.00 H new ATOM 0 HB ILE B 308 1.741 -0.757 -11.497 1.00 0.00 H new ATOM 0 HG12 ILE B 308 1.040 1.045 -9.975 1.00 0.00 H new ATOM 0 HG13 ILE B 308 -0.013 0.920 -11.370 1.00 0.00 H new ATOM 0 HG21 ILE B 308 -0.500 -1.326 -12.373 1.00 0.00 H new ATOM 0 HG22 ILE B 308 0.365 -2.765 -11.782 1.00 0.00 H new ATOM 0 HG23 ILE B 308 -0.927 -2.038 -10.798 1.00 0.00 H new ATOM 0 HD11 ILE B 308 -1.305 1.307 -9.330 1.00 0.00 H new ATOM 0 HD12 ILE B 308 -1.686 -0.291 -10.016 1.00 0.00 H new ATOM 0 HD13 ILE B 308 -0.617 -0.163 -8.599 1.00 0.00 H new ATOM 953 N ASN B 309 3.140 -3.024 -10.666 1.00 0.00 N ATOM 954 CA ASN B 309 3.711 -4.299 -11.092 1.00 0.00 C ATOM 955 C ASN B 309 4.369 -5.023 -9.923 1.00 0.00 C ATOM 956 O ASN B 309 4.533 -6.242 -9.953 1.00 0.00 O ATOM 957 CB ASN B 309 4.704 -4.135 -12.254 1.00 0.00 C ATOM 958 CG ASN B 309 5.937 -3.321 -11.910 1.00 0.00 C ATOM 959 OD1 ASN B 309 5.958 -2.107 -12.097 1.00 0.00 O ATOM 960 ND2 ASN B 309 6.983 -3.985 -11.447 1.00 0.00 N ATOM 0 H ASN B 309 3.649 -2.197 -10.979 1.00 0.00 H new ATOM 0 HA ASN B 309 2.883 -4.907 -11.457 1.00 0.00 H new ATOM 0 HB2 ASN B 309 5.017 -5.123 -12.591 1.00 0.00 H new ATOM 0 HB3 ASN B 309 4.191 -3.661 -13.091 1.00 0.00 H new ATOM 0 HD21 ASN B 309 7.848 -3.489 -11.231 1.00 0.00 H new ATOM 0 HD22 ASN B 309 6.925 -4.993 -11.305 1.00 0.00 H new ATOM 967 N TYR B 310 4.723 -4.277 -8.885 1.00 0.00 N ATOM 968 CA TYR B 310 5.280 -4.877 -7.682 1.00 0.00 C ATOM 969 C TYR B 310 4.209 -5.666 -6.939 1.00 0.00 C ATOM 970 O TYR B 310 4.431 -6.814 -6.562 1.00 0.00 O ATOM 971 CB TYR B 310 5.884 -3.819 -6.760 1.00 0.00 C ATOM 972 CG TYR B 310 6.381 -4.398 -5.456 1.00 0.00 C ATOM 973 CD1 TYR B 310 7.492 -5.229 -5.427 1.00 0.00 C ATOM 974 CD2 TYR B 310 5.730 -4.129 -4.261 1.00 0.00 C ATOM 975 CE1 TYR B 310 7.936 -5.781 -4.243 1.00 0.00 C ATOM 976 CE2 TYR B 310 6.172 -4.672 -3.072 1.00 0.00 C ATOM 977 CZ TYR B 310 7.274 -5.498 -3.068 1.00 0.00 C ATOM 978 OH TYR B 310 7.709 -6.053 -1.888 1.00 0.00 O ATOM 0 H TYR B 310 4.635 -3.261 -8.852 1.00 0.00 H new ATOM 0 HA TYR B 310 6.077 -5.555 -7.987 1.00 0.00 H new ATOM 0 HB2 TYR B 310 6.710 -3.325 -7.272 1.00 0.00 H new ATOM 0 HB3 TYR B 310 5.136 -3.054 -6.552 1.00 0.00 H new ATOM 0 HD1 TYR B 310 8.017 -5.447 -6.345 1.00 0.00 H new ATOM 0 HD2 TYR B 310 4.863 -3.484 -4.261 1.00 0.00 H new ATOM 0 HE1 TYR B 310 8.798 -6.432 -4.237 1.00 0.00 H new ATOM 0 HE2 TYR B 310 5.656 -4.450 -2.149 1.00 0.00 H new ATOM 0 HH TYR B 310 8.623 -6.387 -2.001 1.00 0.00 H new ATOM 988 N VAL B 311 3.049 -5.049 -6.738 1.00 0.00 N ATOM 989 CA VAL B 311 1.927 -5.726 -6.093 1.00 0.00 C ATOM 990 C VAL B 311 1.523 -6.947 -6.911 1.00 0.00 C ATOM 991 O VAL B 311 1.176 -7.998 -6.365 1.00 0.00 O ATOM 992 CB VAL B 311 0.710 -4.787 -5.920 1.00 0.00 C ATOM 993 CG1 VAL B 311 -0.461 -5.522 -5.283 1.00 0.00 C ATOM 994 CG2 VAL B 311 1.090 -3.578 -5.080 1.00 0.00 C ATOM 0 H VAL B 311 2.861 -4.084 -7.011 1.00 0.00 H new ATOM 0 HA VAL B 311 2.252 -6.035 -5.100 1.00 0.00 H new ATOM 0 HB VAL B 311 0.402 -4.448 -6.909 1.00 0.00 H new ATOM 0 HG11 VAL B 311 -1.303 -4.839 -5.173 1.00 0.00 H new ATOM 0 HG12 VAL B 311 -0.753 -6.359 -5.917 1.00 0.00 H new ATOM 0 HG13 VAL B 311 -0.166 -5.895 -4.302 1.00 0.00 H new ATOM 0 HG21 VAL B 311 0.223 -2.927 -4.967 1.00 0.00 H new ATOM 0 HG22 VAL B 311 1.426 -3.909 -4.097 1.00 0.00 H new ATOM 0 HG23 VAL B 311 1.894 -3.031 -5.573 1.00 0.00 H new ATOM 1004 N ASN B 312 1.594 -6.801 -8.230 1.00 0.00 N ATOM 1005 CA ASN B 312 1.348 -7.913 -9.139 1.00 0.00 C ATOM 1006 C ASN B 312 2.342 -9.045 -8.880 1.00 0.00 C ATOM 1007 O ASN B 312 1.972 -10.221 -8.880 1.00 0.00 O ATOM 1008 CB ASN B 312 1.447 -7.441 -10.593 1.00 0.00 C ATOM 1009 CG ASN B 312 1.139 -8.540 -11.594 1.00 0.00 C ATOM 1010 OD1 ASN B 312 -0.021 -8.767 -11.936 1.00 0.00 O ATOM 1011 ND2 ASN B 312 2.170 -9.206 -12.090 1.00 0.00 N ATOM 0 H ASN B 312 1.820 -5.921 -8.693 1.00 0.00 H new ATOM 0 HA ASN B 312 0.341 -8.290 -8.961 1.00 0.00 H new ATOM 0 HB2 ASN B 312 0.757 -6.612 -10.748 1.00 0.00 H new ATOM 0 HB3 ASN B 312 2.451 -7.059 -10.778 1.00 0.00 H new ATOM 0 HD21 ASN B 312 2.018 -9.939 -12.783 1.00 0.00 H new ATOM 0 HD22 ASN B 312 3.116 -8.986 -11.779 1.00 0.00 H new ATOM 1018 N LYS B 313 3.600 -8.681 -8.640 1.00 0.00 N ATOM 1019 CA LYS B 313 4.638 -9.665 -8.358 1.00 0.00 C ATOM 1020 C LYS B 313 4.381 -10.348 -7.017 1.00 0.00 C ATOM 1021 O LYS B 313 4.627 -11.540 -6.873 1.00 0.00 O ATOM 1022 CB LYS B 313 6.032 -9.022 -8.367 1.00 0.00 C ATOM 1023 CG LYS B 313 7.156 -10.018 -8.112 1.00 0.00 C ATOM 1024 CD LYS B 313 8.520 -9.352 -8.128 1.00 0.00 C ATOM 1025 CE LYS B 313 9.620 -10.354 -7.808 1.00 0.00 C ATOM 1026 NZ LYS B 313 10.957 -9.714 -7.758 1.00 0.00 N ATOM 0 H LYS B 313 3.923 -7.713 -8.636 1.00 0.00 H new ATOM 0 HA LYS B 313 4.606 -10.416 -9.147 1.00 0.00 H new ATOM 0 HB2 LYS B 313 6.196 -8.539 -9.330 1.00 0.00 H new ATOM 0 HB3 LYS B 313 6.069 -8.241 -7.608 1.00 0.00 H new ATOM 0 HG2 LYS B 313 7.000 -10.502 -7.148 1.00 0.00 H new ATOM 0 HG3 LYS B 313 7.126 -10.801 -8.870 1.00 0.00 H new ATOM 0 HD2 LYS B 313 8.701 -8.909 -9.107 1.00 0.00 H new ATOM 0 HD3 LYS B 313 8.541 -8.540 -7.402 1.00 0.00 H new ATOM 0 HE2 LYS B 313 9.410 -10.830 -6.850 1.00 0.00 H new ATOM 0 HE3 LYS B 313 9.623 -11.142 -8.561 1.00 0.00 H new ATOM 0 HZ1 LYS B 313 11.692 -10.449 -7.724 1.00 0.00 H new ATOM 0 HZ2 LYS B 313 11.093 -9.127 -8.606 1.00 0.00 H new ATOM 0 HZ3 LYS B 313 11.025 -9.117 -6.909 1.00 0.00 H new ATOM 1040 N ILE B 314 3.883 -9.592 -6.039 1.00 0.00 N ATOM 1041 CA ILE B 314 3.541 -10.163 -4.734 1.00 0.00 C ATOM 1042 C ILE B 314 2.507 -11.276 -4.894 1.00 0.00 C ATOM 1043 O ILE B 314 2.671 -12.377 -4.360 1.00 0.00 O ATOM 1044 CB ILE B 314 2.975 -9.102 -3.761 1.00 0.00 C ATOM 1045 CG1 ILE B 314 3.946 -7.936 -3.604 1.00 0.00 C ATOM 1046 CG2 ILE B 314 2.702 -9.731 -2.405 1.00 0.00 C ATOM 1047 CD1 ILE B 314 3.394 -6.792 -2.779 1.00 0.00 C ATOM 0 H ILE B 314 3.708 -8.591 -6.123 1.00 0.00 H new ATOM 0 HA ILE B 314 4.466 -10.560 -4.315 1.00 0.00 H new ATOM 0 HB ILE B 314 2.042 -8.722 -4.176 1.00 0.00 H new ATOM 0 HG12 ILE B 314 4.863 -8.298 -3.139 1.00 0.00 H new ATOM 0 HG13 ILE B 314 4.215 -7.563 -4.592 1.00 0.00 H new ATOM 0 HG21 ILE B 314 2.304 -8.976 -1.727 1.00 0.00 H new ATOM 0 HG22 ILE B 314 1.977 -10.537 -2.517 1.00 0.00 H new ATOM 0 HG23 ILE B 314 3.630 -10.132 -1.997 1.00 0.00 H new ATOM 0 HD11 ILE B 314 4.140 -6.000 -2.711 1.00 0.00 H new ATOM 0 HD12 ILE B 314 2.493 -6.403 -3.254 1.00 0.00 H new ATOM 0 HD13 ILE B 314 3.151 -7.149 -1.778 1.00 0.00 H new ATOM 1059 N LYS B 315 1.450 -10.977 -5.644 1.00 0.00 N ATOM 1060 CA LYS B 315 0.385 -11.939 -5.899 1.00 0.00 C ATOM 1061 C LYS B 315 0.903 -13.160 -6.652 1.00 0.00 C ATOM 1062 O LYS B 315 0.491 -14.288 -6.382 1.00 0.00 O ATOM 1063 CB LYS B 315 -0.743 -11.283 -6.700 1.00 0.00 C ATOM 1064 CG LYS B 315 -1.719 -10.487 -5.852 1.00 0.00 C ATOM 1065 CD LYS B 315 -2.813 -9.866 -6.708 1.00 0.00 C ATOM 1066 CE LYS B 315 -4.050 -9.545 -5.882 1.00 0.00 C ATOM 1067 NZ LYS B 315 -4.667 -10.780 -5.327 1.00 0.00 N ATOM 0 H LYS B 315 1.309 -10.070 -6.088 1.00 0.00 H new ATOM 0 HA LYS B 315 0.002 -12.269 -4.933 1.00 0.00 H new ATOM 0 HB2 LYS B 315 -0.306 -10.623 -7.450 1.00 0.00 H new ATOM 0 HB3 LYS B 315 -1.291 -12.057 -7.237 1.00 0.00 H new ATOM 0 HG2 LYS B 315 -2.167 -11.138 -5.101 1.00 0.00 H new ATOM 0 HG3 LYS B 315 -1.184 -9.703 -5.316 1.00 0.00 H new ATOM 0 HD2 LYS B 315 -2.439 -8.955 -7.174 1.00 0.00 H new ATOM 0 HD3 LYS B 315 -3.079 -10.550 -7.514 1.00 0.00 H new ATOM 0 HE2 LYS B 315 -3.781 -8.873 -5.067 1.00 0.00 H new ATOM 0 HE3 LYS B 315 -4.777 -9.020 -6.502 1.00 0.00 H new ATOM 0 HZ1 LYS B 315 -5.685 -10.624 -5.180 1.00 0.00 H new ATOM 0 HZ2 LYS B 315 -4.530 -11.566 -5.994 1.00 0.00 H new ATOM 0 HZ3 LYS B 315 -4.218 -11.014 -4.419 1.00 0.00 H new ATOM 1081 N ASN B 316 1.799 -12.927 -7.600 1.00 0.00 N ATOM 1082 CA ASN B 316 2.353 -14.006 -8.410 1.00 0.00 C ATOM 1083 C ASN B 316 3.329 -14.851 -7.596 1.00 0.00 C ATOM 1084 O ASN B 316 3.321 -16.079 -7.681 1.00 0.00 O ATOM 1085 CB ASN B 316 3.057 -13.434 -9.647 1.00 0.00 C ATOM 1086 CG ASN B 316 3.526 -14.508 -10.616 1.00 0.00 C ATOM 1087 OD1 ASN B 316 2.748 -15.570 -10.765 1.00 0.00 O flip ATOM 1088 ND2 ASN B 316 4.569 -14.364 -11.256 1.00 0.00 N flip ATOM 0 H ASN B 316 2.159 -12.000 -7.829 1.00 0.00 H new ATOM 0 HA ASN B 316 1.531 -14.645 -8.733 1.00 0.00 H new ATOM 0 HB2 ASN B 316 2.377 -12.758 -10.165 1.00 0.00 H new ATOM 0 HB3 ASN B 316 3.914 -12.841 -9.328 1.00 0.00 H new ATOM 0 HD21 ASN B 316 5.143 -13.533 -11.115 1.00 0.00 H new ATOM 0 HD22 ASN B 316 4.858 -15.076 -11.927 1.00 0.00 H new ATOM 1095 N ARG B 317 4.151 -14.186 -6.793 1.00 0.00 N ATOM 1096 CA ARG B 317 5.166 -14.856 -5.993 1.00 0.00 C ATOM 1097 C ARG B 317 4.523 -15.814 -4.998 1.00 0.00 C ATOM 1098 O ARG B 317 4.942 -16.962 -4.856 1.00 0.00 O ATOM 1099 CB ARG B 317 6.002 -13.822 -5.235 1.00 0.00 C ATOM 1100 CG ARG B 317 7.334 -14.361 -4.753 1.00 0.00 C ATOM 1101 CD ARG B 317 8.298 -14.530 -5.915 1.00 0.00 C ATOM 1102 NE ARG B 317 9.557 -15.161 -5.523 1.00 0.00 N ATOM 1103 CZ ARG B 317 10.730 -14.880 -6.090 1.00 0.00 C ATOM 1104 NH1 ARG B 317 10.795 -13.996 -7.078 1.00 0.00 N ATOM 1105 NH2 ARG B 317 11.830 -15.504 -5.690 1.00 0.00 N ATOM 0 H ARG B 317 4.132 -13.173 -6.679 1.00 0.00 H new ATOM 0 HA ARG B 317 5.809 -15.425 -6.665 1.00 0.00 H new ATOM 0 HB2 ARG B 317 6.179 -12.963 -5.883 1.00 0.00 H new ATOM 0 HB3 ARG B 317 5.432 -13.463 -4.378 1.00 0.00 H new ATOM 0 HG2 ARG B 317 7.761 -13.682 -4.016 1.00 0.00 H new ATOM 0 HG3 ARG B 317 7.185 -15.319 -4.255 1.00 0.00 H new ATOM 0 HD2 ARG B 317 7.823 -15.131 -6.690 1.00 0.00 H new ATOM 0 HD3 ARG B 317 8.507 -13.553 -6.352 1.00 0.00 H new ATOM 0 HE ARG B 317 9.537 -15.854 -4.775 1.00 0.00 H new ATOM 0 HH11 ARG B 317 9.947 -13.532 -7.403 1.00 0.00 H new ATOM 0 HH12 ARG B 317 11.693 -13.781 -7.512 1.00 0.00 H new ATOM 0 HH21 ARG B 317 11.779 -16.201 -4.947 1.00 0.00 H new ATOM 0 HH22 ARG B 317 12.726 -15.287 -6.126 1.00 0.00 H new ATOM 1119 N PHE B 318 3.491 -15.338 -4.323 1.00 0.00 N ATOM 1120 CA PHE B 318 2.826 -16.125 -3.298 1.00 0.00 C ATOM 1121 C PHE B 318 1.511 -16.696 -3.811 1.00 0.00 C ATOM 1122 O PHE B 318 0.585 -16.935 -3.037 1.00 0.00 O ATOM 1123 CB PHE B 318 2.594 -15.274 -2.047 1.00 0.00 C ATOM 1124 CG PHE B 318 3.864 -14.955 -1.310 1.00 0.00 C ATOM 1125 CD1 PHE B 318 4.359 -15.825 -0.353 1.00 0.00 C ATOM 1126 CD2 PHE B 318 4.569 -13.794 -1.583 1.00 0.00 C ATOM 1127 CE1 PHE B 318 5.533 -15.543 0.320 1.00 0.00 C ATOM 1128 CE2 PHE B 318 5.743 -13.509 -0.916 1.00 0.00 C ATOM 1129 CZ PHE B 318 6.226 -14.384 0.037 1.00 0.00 C ATOM 0 H PHE B 318 3.095 -14.409 -4.466 1.00 0.00 H new ATOM 0 HA PHE B 318 3.473 -16.963 -3.037 1.00 0.00 H new ATOM 0 HB2 PHE B 318 2.103 -14.344 -2.333 1.00 0.00 H new ATOM 0 HB3 PHE B 318 1.914 -15.800 -1.377 1.00 0.00 H new ATOM 0 HD1 PHE B 318 3.821 -16.735 -0.130 1.00 0.00 H new ATOM 0 HD2 PHE B 318 4.196 -13.105 -2.326 1.00 0.00 H new ATOM 0 HE1 PHE B 318 5.907 -16.229 1.066 1.00 0.00 H new ATOM 0 HE2 PHE B 318 6.284 -12.601 -1.139 1.00 0.00 H new ATOM 0 HZ PHE B 318 7.144 -14.161 0.560 1.00 0.00 H new ATOM 1139 N GLN B 319 1.444 -16.925 -5.119 1.00 0.00 N ATOM 1140 CA GLN B 319 0.286 -17.561 -5.729 1.00 0.00 C ATOM 1141 C GLN B 319 0.057 -18.931 -5.106 1.00 0.00 C ATOM 1142 O GLN B 319 0.917 -19.808 -5.191 1.00 0.00 O ATOM 1143 CB GLN B 319 0.490 -17.707 -7.233 1.00 0.00 C ATOM 1144 CG GLN B 319 -0.729 -18.236 -7.969 1.00 0.00 C ATOM 1145 CD GLN B 319 -0.441 -18.535 -9.425 1.00 0.00 C ATOM 1146 OE1 GLN B 319 0.677 -18.906 -9.786 1.00 0.00 O ATOM 1147 NE2 GLN B 319 -1.444 -18.369 -10.273 1.00 0.00 N ATOM 0 H GLN B 319 2.183 -16.678 -5.778 1.00 0.00 H new ATOM 0 HA GLN B 319 -0.588 -16.934 -5.552 1.00 0.00 H new ATOM 0 HB2 GLN B 319 0.761 -16.737 -7.649 1.00 0.00 H new ATOM 0 HB3 GLN B 319 1.331 -18.377 -7.413 1.00 0.00 H new ATOM 0 HG2 GLN B 319 -1.081 -19.143 -7.478 1.00 0.00 H new ATOM 0 HG3 GLN B 319 -1.535 -17.505 -7.904 1.00 0.00 H new ATOM 0 HE21 GLN B 319 -2.354 -18.060 -9.932 1.00 0.00 H new ATOM 0 HE22 GLN B 319 -1.306 -18.550 -11.267 1.00 0.00 H new ATOM 1156 N GLY B 320 -1.087 -19.100 -4.466 1.00 0.00 N ATOM 1157 CA GLY B 320 -1.379 -20.342 -3.784 1.00 0.00 C ATOM 1158 C GLY B 320 -1.486 -20.141 -2.292 1.00 0.00 C ATOM 1159 O GLY B 320 -2.011 -20.991 -1.573 1.00 0.00 O ATOM 0 H GLY B 320 -1.823 -18.396 -4.406 1.00 0.00 H new ATOM 0 HA2 GLY B 320 -2.313 -20.757 -4.164 1.00 0.00 H new ATOM 0 HA3 GLY B 320 -0.596 -21.069 -3.999 1.00 0.00 H new ATOM 1163 N GLN B 321 -0.982 -19.008 -1.829 1.00 0.00 N ATOM 1164 CA GLN B 321 -1.071 -18.642 -0.423 1.00 0.00 C ATOM 1165 C GLN B 321 -1.709 -17.265 -0.274 1.00 0.00 C ATOM 1166 O GLN B 321 -1.017 -16.255 -0.126 1.00 0.00 O ATOM 1167 CB GLN B 321 0.313 -18.664 0.231 1.00 0.00 C ATOM 1168 CG GLN B 321 0.920 -20.057 0.314 1.00 0.00 C ATOM 1169 CD GLN B 321 2.311 -20.070 0.915 1.00 0.00 C ATOM 1170 OE1 GLN B 321 3.075 -19.013 0.684 1.00 0.00 O flip ATOM 1171 NE2 GLN B 321 2.703 -21.032 1.574 1.00 0.00 N flip ATOM 0 H GLN B 321 -0.503 -18.321 -2.411 1.00 0.00 H new ATOM 0 HA GLN B 321 -1.699 -19.374 0.084 1.00 0.00 H new ATOM 0 HB2 GLN B 321 0.984 -18.016 -0.334 1.00 0.00 H new ATOM 0 HB3 GLN B 321 0.239 -18.248 1.236 1.00 0.00 H new ATOM 0 HG2 GLN B 321 0.268 -20.695 0.911 1.00 0.00 H new ATOM 0 HG3 GLN B 321 0.960 -20.489 -0.686 1.00 0.00 H new ATOM 0 HE21 GLN B 321 2.085 -21.828 1.731 1.00 0.00 H new ATOM 0 HE22 GLN B 321 3.646 -21.033 1.964 1.00 0.00 H new ATOM 1180 N PRO B 322 -3.048 -17.212 -0.324 1.00 0.00 N ATOM 1181 CA PRO B 322 -3.801 -15.957 -0.270 1.00 0.00 C ATOM 1182 C PRO B 322 -3.714 -15.280 1.093 1.00 0.00 C ATOM 1183 O PRO B 322 -3.886 -14.066 1.205 1.00 0.00 O ATOM 1184 CB PRO B 322 -5.250 -16.381 -0.562 1.00 0.00 C ATOM 1185 CG PRO B 322 -5.163 -17.781 -1.069 1.00 0.00 C ATOM 1186 CD PRO B 322 -3.940 -18.372 -0.442 1.00 0.00 C ATOM 0 HA PRO B 322 -3.408 -15.227 -0.978 1.00 0.00 H new ATOM 0 HB2 PRO B 322 -5.863 -16.327 0.338 1.00 0.00 H new ATOM 0 HB3 PRO B 322 -5.709 -15.724 -1.301 1.00 0.00 H new ATOM 0 HG2 PRO B 322 -6.053 -18.349 -0.799 1.00 0.00 H new ATOM 0 HG3 PRO B 322 -5.091 -17.798 -2.156 1.00 0.00 H new ATOM 0 HD2 PRO B 322 -4.157 -18.817 0.529 1.00 0.00 H new ATOM 0 HD3 PRO B 322 -3.505 -19.156 -1.062 1.00 0.00 H new ATOM 1194 N ASP B 323 -3.426 -16.064 2.126 1.00 0.00 N ATOM 1195 CA ASP B 323 -3.375 -15.542 3.488 1.00 0.00 C ATOM 1196 C ASP B 323 -2.154 -14.664 3.693 1.00 0.00 C ATOM 1197 O ASP B 323 -2.157 -13.775 4.540 1.00 0.00 O ATOM 1198 CB ASP B 323 -3.387 -16.677 4.509 1.00 0.00 C ATOM 1199 CG ASP B 323 -4.709 -17.412 4.515 1.00 0.00 C ATOM 1200 OD1 ASP B 323 -5.635 -16.963 5.219 1.00 0.00 O ATOM 1201 OD2 ASP B 323 -4.836 -18.422 3.791 1.00 0.00 O ATOM 0 H ASP B 323 -3.225 -17.061 2.047 1.00 0.00 H new ATOM 0 HA ASP B 323 -4.265 -14.931 3.639 1.00 0.00 H new ATOM 0 HB2 ASP B 323 -2.583 -17.377 4.284 1.00 0.00 H new ATOM 0 HB3 ASP B 323 -3.190 -16.274 5.503 1.00 0.00 H new ATOM 1206 N ILE B 324 -1.115 -14.907 2.907 1.00 0.00 N ATOM 1207 CA ILE B 324 0.075 -14.071 2.956 1.00 0.00 C ATOM 1208 C ILE B 324 -0.270 -12.664 2.478 1.00 0.00 C ATOM 1209 O ILE B 324 0.074 -11.667 3.116 1.00 0.00 O ATOM 1210 CB ILE B 324 1.217 -14.655 2.092 1.00 0.00 C ATOM 1211 CG1 ILE B 324 1.572 -16.073 2.553 1.00 0.00 C ATOM 1212 CG2 ILE B 324 2.448 -13.755 2.142 1.00 0.00 C ATOM 1213 CD1 ILE B 324 2.041 -16.155 3.991 1.00 0.00 C ATOM 0 H ILE B 324 -1.072 -15.671 2.232 1.00 0.00 H new ATOM 0 HA ILE B 324 0.423 -14.037 3.988 1.00 0.00 H new ATOM 0 HB ILE B 324 0.870 -14.704 1.060 1.00 0.00 H new ATOM 0 HG12 ILE B 324 0.699 -16.713 2.430 1.00 0.00 H new ATOM 0 HG13 ILE B 324 2.353 -16.470 1.904 1.00 0.00 H new ATOM 0 HG21 ILE B 324 3.239 -14.185 1.527 1.00 0.00 H new ATOM 0 HG22 ILE B 324 2.191 -12.766 1.763 1.00 0.00 H new ATOM 0 HG23 ILE B 324 2.795 -13.670 3.172 1.00 0.00 H new ATOM 0 HD11 ILE B 324 2.272 -17.191 4.240 1.00 0.00 H new ATOM 0 HD12 ILE B 324 2.934 -15.543 4.118 1.00 0.00 H new ATOM 0 HD13 ILE B 324 1.254 -15.790 4.652 1.00 0.00 H new ATOM 1225 N TYR B 325 -0.988 -12.594 1.365 1.00 0.00 N ATOM 1226 CA TYR B 325 -1.419 -11.317 0.824 1.00 0.00 C ATOM 1227 C TYR B 325 -2.521 -10.719 1.700 1.00 0.00 C ATOM 1228 O TYR B 325 -2.619 -9.501 1.833 1.00 0.00 O ATOM 1229 CB TYR B 325 -1.897 -11.481 -0.620 1.00 0.00 C ATOM 1230 CG TYR B 325 -2.150 -10.168 -1.328 1.00 0.00 C ATOM 1231 CD1 TYR B 325 -1.107 -9.458 -1.919 1.00 0.00 C ATOM 1232 CD2 TYR B 325 -3.432 -9.635 -1.402 1.00 0.00 C ATOM 1233 CE1 TYR B 325 -1.339 -8.256 -2.558 1.00 0.00 C ATOM 1234 CE2 TYR B 325 -3.668 -8.436 -2.041 1.00 0.00 C ATOM 1235 CZ TYR B 325 -2.620 -7.750 -2.617 1.00 0.00 C ATOM 1236 OH TYR B 325 -2.855 -6.556 -3.252 1.00 0.00 O ATOM 0 H TYR B 325 -1.282 -13.406 0.822 1.00 0.00 H new ATOM 0 HA TYR B 325 -0.572 -10.631 0.822 1.00 0.00 H new ATOM 0 HB2 TYR B 325 -1.152 -12.047 -1.178 1.00 0.00 H new ATOM 0 HB3 TYR B 325 -2.814 -12.070 -0.625 1.00 0.00 H new ATOM 0 HD1 TYR B 325 -0.103 -9.853 -1.877 1.00 0.00 H new ATOM 0 HD2 TYR B 325 -4.256 -10.168 -0.952 1.00 0.00 H new ATOM 0 HE1 TYR B 325 -0.521 -7.715 -3.009 1.00 0.00 H new ATOM 0 HE2 TYR B 325 -4.670 -8.036 -2.090 1.00 0.00 H new ATOM 0 HH TYR B 325 -2.062 -5.985 -3.179 1.00 0.00 H new ATOM 1246 N LYS B 326 -3.342 -11.587 2.298 1.00 0.00 N ATOM 1247 CA LYS B 326 -4.358 -11.150 3.254 1.00 0.00 C ATOM 1248 C LYS B 326 -3.713 -10.351 4.379 1.00 0.00 C ATOM 1249 O LYS B 326 -4.130 -9.235 4.682 1.00 0.00 O ATOM 1250 CB LYS B 326 -5.113 -12.345 3.857 1.00 0.00 C ATOM 1251 CG LYS B 326 -6.095 -11.934 4.946 1.00 0.00 C ATOM 1252 CD LYS B 326 -6.452 -13.081 5.885 1.00 0.00 C ATOM 1253 CE LYS B 326 -7.598 -13.934 5.363 1.00 0.00 C ATOM 1254 NZ LYS B 326 -7.155 -14.967 4.390 1.00 0.00 N ATOM 0 H LYS B 326 -3.322 -12.594 2.136 1.00 0.00 H new ATOM 0 HA LYS B 326 -5.069 -10.525 2.714 1.00 0.00 H new ATOM 0 HB2 LYS B 326 -5.652 -12.865 3.065 1.00 0.00 H new ATOM 0 HB3 LYS B 326 -4.394 -13.052 4.271 1.00 0.00 H new ATOM 0 HG2 LYS B 326 -5.666 -11.116 5.526 1.00 0.00 H new ATOM 0 HG3 LYS B 326 -7.005 -11.553 4.483 1.00 0.00 H new ATOM 0 HD2 LYS B 326 -5.574 -13.710 6.033 1.00 0.00 H new ATOM 0 HD3 LYS B 326 -6.721 -12.676 6.860 1.00 0.00 H new ATOM 0 HE2 LYS B 326 -8.093 -14.422 6.203 1.00 0.00 H new ATOM 0 HE3 LYS B 326 -8.337 -13.289 4.889 1.00 0.00 H new ATOM 0 HZ1 LYS B 326 -7.939 -15.195 3.745 1.00 0.00 H new ATOM 0 HZ2 LYS B 326 -6.350 -14.604 3.841 1.00 0.00 H new ATOM 0 HZ3 LYS B 326 -6.867 -15.825 4.902 1.00 0.00 H new ATOM 1268 N ALA B 327 -2.688 -10.936 4.990 1.00 0.00 N ATOM 1269 CA ALA B 327 -1.970 -10.284 6.073 1.00 0.00 C ATOM 1270 C ALA B 327 -1.376 -8.961 5.606 1.00 0.00 C ATOM 1271 O ALA B 327 -1.527 -7.941 6.273 1.00 0.00 O ATOM 1272 CB ALA B 327 -0.884 -11.198 6.614 1.00 0.00 C ATOM 0 H ALA B 327 -2.337 -11.863 4.751 1.00 0.00 H new ATOM 0 HA ALA B 327 -2.676 -10.074 6.876 1.00 0.00 H new ATOM 0 HB1 ALA B 327 -0.356 -10.695 7.424 1.00 0.00 H new ATOM 0 HB2 ALA B 327 -1.335 -12.116 6.990 1.00 0.00 H new ATOM 0 HB3 ALA B 327 -0.181 -11.439 5.817 1.00 0.00 H new ATOM 1278 N PHE B 328 -0.717 -8.984 4.447 1.00 0.00 N ATOM 1279 CA PHE B 328 -0.132 -7.774 3.868 1.00 0.00 C ATOM 1280 C PHE B 328 -1.192 -6.688 3.699 1.00 0.00 C ATOM 1281 O PHE B 328 -0.976 -5.528 4.058 1.00 0.00 O ATOM 1282 CB PHE B 328 0.513 -8.092 2.512 1.00 0.00 C ATOM 1283 CG PHE B 328 1.098 -6.892 1.822 1.00 0.00 C ATOM 1284 CD1 PHE B 328 2.304 -6.357 2.241 1.00 0.00 C ATOM 1285 CD2 PHE B 328 0.440 -6.300 0.756 1.00 0.00 C ATOM 1286 CE1 PHE B 328 2.844 -5.252 1.611 1.00 0.00 C ATOM 1287 CE2 PHE B 328 0.973 -5.195 0.121 1.00 0.00 C ATOM 1288 CZ PHE B 328 2.177 -4.669 0.549 1.00 0.00 C ATOM 0 H PHE B 328 -0.575 -9.827 3.891 1.00 0.00 H new ATOM 0 HA PHE B 328 0.635 -7.406 4.549 1.00 0.00 H new ATOM 0 HB2 PHE B 328 1.298 -8.834 2.659 1.00 0.00 H new ATOM 0 HB3 PHE B 328 -0.235 -8.545 1.861 1.00 0.00 H new ATOM 0 HD1 PHE B 328 2.829 -6.808 3.070 1.00 0.00 H new ATOM 0 HD2 PHE B 328 -0.501 -6.707 0.417 1.00 0.00 H new ATOM 0 HE1 PHE B 328 3.786 -4.844 1.948 1.00 0.00 H new ATOM 0 HE2 PHE B 328 0.450 -4.743 -0.709 1.00 0.00 H new ATOM 0 HZ PHE B 328 2.596 -3.805 0.055 1.00 0.00 H new ATOM 1298 N LEU B 329 -2.341 -7.085 3.167 1.00 0.00 N ATOM 1299 CA LEU B 329 -3.450 -6.170 2.940 1.00 0.00 C ATOM 1300 C LEU B 329 -3.940 -5.580 4.258 1.00 0.00 C ATOM 1301 O LEU B 329 -4.194 -4.376 4.361 1.00 0.00 O ATOM 1302 CB LEU B 329 -4.597 -6.908 2.248 1.00 0.00 C ATOM 1303 CG LEU B 329 -5.754 -6.025 1.781 1.00 0.00 C ATOM 1304 CD1 LEU B 329 -5.337 -5.197 0.577 1.00 0.00 C ATOM 1305 CD2 LEU B 329 -6.976 -6.873 1.463 1.00 0.00 C ATOM 0 H LEU B 329 -2.529 -8.046 2.882 1.00 0.00 H new ATOM 0 HA LEU B 329 -3.103 -5.357 2.303 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -4.197 -7.440 1.385 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -4.989 -7.660 2.933 1.00 0.00 H new ATOM 0 HG LEU B 329 -6.018 -5.341 2.587 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -6.172 -4.574 0.257 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -4.493 -4.562 0.847 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -5.046 -5.860 -0.238 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -7.790 -6.228 1.132 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -6.731 -7.583 0.673 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -7.284 -7.417 2.356 1.00 0.00 H new ATOM 1317 N GLU B 330 -4.060 -6.435 5.264 1.00 0.00 N ATOM 1318 CA GLU B 330 -4.559 -6.021 6.565 1.00 0.00 C ATOM 1319 C GLU B 330 -3.564 -5.093 7.258 1.00 0.00 C ATOM 1320 O GLU B 330 -3.956 -4.097 7.873 1.00 0.00 O ATOM 1321 CB GLU B 330 -4.844 -7.244 7.436 1.00 0.00 C ATOM 1322 CG GLU B 330 -5.604 -6.915 8.707 1.00 0.00 C ATOM 1323 CD GLU B 330 -5.896 -8.141 9.543 1.00 0.00 C ATOM 1324 OE1 GLU B 330 -6.935 -8.794 9.309 1.00 0.00 O ATOM 1325 OE2 GLU B 330 -5.089 -8.459 10.444 1.00 0.00 O ATOM 0 H GLU B 330 -3.817 -7.424 5.202 1.00 0.00 H new ATOM 0 HA GLU B 330 -5.489 -5.472 6.417 1.00 0.00 H new ATOM 0 HB2 GLU B 330 -5.417 -7.968 6.856 1.00 0.00 H new ATOM 0 HB3 GLU B 330 -3.900 -7.721 7.699 1.00 0.00 H new ATOM 0 HG2 GLU B 330 -5.026 -6.206 9.299 1.00 0.00 H new ATOM 0 HG3 GLU B 330 -6.542 -6.424 8.448 1.00 0.00 H new ATOM 1332 N ILE B 331 -2.279 -5.418 7.155 1.00 0.00 N ATOM 1333 CA ILE B 331 -1.227 -4.567 7.704 1.00 0.00 C ATOM 1334 C ILE B 331 -1.293 -3.186 7.065 1.00 0.00 C ATOM 1335 O ILE B 331 -1.194 -2.164 7.747 1.00 0.00 O ATOM 1336 CB ILE B 331 0.183 -5.167 7.477 1.00 0.00 C ATOM 1337 CG1 ILE B 331 0.318 -6.512 8.200 1.00 0.00 C ATOM 1338 CG2 ILE B 331 1.261 -4.202 7.952 1.00 0.00 C ATOM 1339 CD1 ILE B 331 1.637 -7.215 7.940 1.00 0.00 C ATOM 0 H ILE B 331 -1.940 -6.264 6.697 1.00 0.00 H new ATOM 0 HA ILE B 331 -1.394 -4.495 8.779 1.00 0.00 H new ATOM 0 HB ILE B 331 0.314 -5.332 6.408 1.00 0.00 H new ATOM 0 HG12 ILE B 331 0.208 -6.351 9.272 1.00 0.00 H new ATOM 0 HG13 ILE B 331 -0.498 -7.164 7.890 1.00 0.00 H new ATOM 0 HG21 ILE B 331 2.244 -4.643 7.784 1.00 0.00 H new ATOM 0 HG22 ILE B 331 1.183 -3.267 7.397 1.00 0.00 H new ATOM 0 HG23 ILE B 331 1.129 -4.005 9.016 1.00 0.00 H new ATOM 0 HD11 ILE B 331 1.660 -8.159 8.484 1.00 0.00 H new ATOM 0 HD12 ILE B 331 1.742 -7.409 6.873 1.00 0.00 H new ATOM 0 HD13 ILE B 331 2.459 -6.583 8.276 1.00 0.00 H new ATOM 1351 N LEU B 332 -1.486 -3.169 5.753 1.00 0.00 N ATOM 1352 CA LEU B 332 -1.593 -1.925 5.008 1.00 0.00 C ATOM 1353 C LEU B 332 -2.789 -1.108 5.490 1.00 0.00 C ATOM 1354 O LEU B 332 -2.685 0.101 5.692 1.00 0.00 O ATOM 1355 CB LEU B 332 -1.731 -2.217 3.514 1.00 0.00 C ATOM 1356 CG LEU B 332 -1.641 -0.993 2.607 1.00 0.00 C ATOM 1357 CD1 LEU B 332 -0.239 -0.407 2.644 1.00 0.00 C ATOM 1358 CD2 LEU B 332 -2.033 -1.358 1.187 1.00 0.00 C ATOM 0 H LEU B 332 -1.572 -4.009 5.181 1.00 0.00 H new ATOM 0 HA LEU B 332 -0.686 -1.345 5.177 1.00 0.00 H new ATOM 0 HB2 LEU B 332 -0.953 -2.924 3.224 1.00 0.00 H new ATOM 0 HB3 LEU B 332 -2.689 -2.708 3.342 1.00 0.00 H new ATOM 0 HG LEU B 332 -2.337 -0.237 2.972 1.00 0.00 H new ATOM 0 HD11 LEU B 332 -0.192 0.465 1.992 1.00 0.00 H new ATOM 0 HD12 LEU B 332 0.005 -0.111 3.664 1.00 0.00 H new ATOM 0 HD13 LEU B 332 0.477 -1.155 2.302 1.00 0.00 H new ATOM 0 HD21 LEU B 332 -1.964 -0.475 0.552 1.00 0.00 H new ATOM 0 HD22 LEU B 332 -1.361 -2.129 0.811 1.00 0.00 H new ATOM 0 HD23 LEU B 332 -3.056 -1.733 1.177 1.00 0.00 H new ATOM 1370 N HIS B 333 -3.920 -1.782 5.681 1.00 0.00 N ATOM 1371 CA HIS B 333 -5.127 -1.127 6.179 1.00 0.00 C ATOM 1372 C HIS B 333 -4.881 -0.553 7.568 1.00 0.00 C ATOM 1373 O HIS B 333 -5.302 0.564 7.876 1.00 0.00 O ATOM 1374 CB HIS B 333 -6.300 -2.114 6.223 1.00 0.00 C ATOM 1375 CG HIS B 333 -7.589 -1.498 6.687 1.00 0.00 C ATOM 1376 ND1 HIS B 333 -8.199 -1.832 7.873 1.00 0.00 N ATOM 1377 CD2 HIS B 333 -8.389 -0.575 6.103 1.00 0.00 C ATOM 1378 CE1 HIS B 333 -9.320 -1.145 8.000 1.00 0.00 C ATOM 1379 NE2 HIS B 333 -9.456 -0.373 6.939 1.00 0.00 N ATOM 0 H HIS B 333 -4.026 -2.780 5.499 1.00 0.00 H new ATOM 0 HA HIS B 333 -5.380 -0.315 5.498 1.00 0.00 H new ATOM 0 HB2 HIS B 333 -6.446 -2.536 5.229 1.00 0.00 H new ATOM 0 HB3 HIS B 333 -6.043 -2.941 6.885 1.00 0.00 H new ATOM 0 HD2 HIS B 333 -8.218 -0.088 5.154 1.00 0.00 H new ATOM 0 HE1 HIS B 333 -10.008 -1.205 8.831 1.00 0.00 H new ATOM 0 HE2 HIS B 333 -10.229 0.270 6.769 1.00 0.00 H new ATOM 1388 N THR B 334 -4.194 -1.327 8.399 1.00 0.00 N ATOM 1389 CA THR B 334 -3.859 -0.898 9.742 1.00 0.00 C ATOM 1390 C THR B 334 -2.966 0.339 9.692 1.00 0.00 C ATOM 1391 O THR B 334 -3.227 1.328 10.373 1.00 0.00 O ATOM 1392 CB THR B 334 -3.155 -2.025 10.527 1.00 0.00 C ATOM 1393 OG1 THR B 334 -3.924 -3.234 10.441 1.00 0.00 O ATOM 1394 CG2 THR B 334 -2.987 -1.645 11.990 1.00 0.00 C ATOM 0 H THR B 334 -3.858 -2.260 8.160 1.00 0.00 H new ATOM 0 HA THR B 334 -4.787 -0.651 10.258 1.00 0.00 H new ATOM 0 HB THR B 334 -2.170 -2.179 10.087 1.00 0.00 H new ATOM 0 HG1 THR B 334 -3.821 -3.624 9.548 1.00 0.00 H new ATOM 0 HG21 THR B 334 -2.488 -2.456 12.522 1.00 0.00 H new ATOM 0 HG22 THR B 334 -2.386 -0.739 12.064 1.00 0.00 H new ATOM 0 HG23 THR B 334 -3.966 -1.468 12.435 1.00 0.00 H new ATOM 1402 N TYR B 335 -1.934 0.285 8.850 1.00 0.00 N ATOM 1403 CA TYR B 335 -1.014 1.404 8.686 1.00 0.00 C ATOM 1404 C TYR B 335 -1.749 2.653 8.211 1.00 0.00 C ATOM 1405 O TYR B 335 -1.542 3.737 8.748 1.00 0.00 O ATOM 1406 CB TYR B 335 0.103 1.048 7.698 1.00 0.00 C ATOM 1407 CG TYR B 335 0.979 2.231 7.321 1.00 0.00 C ATOM 1408 CD1 TYR B 335 2.040 2.623 8.127 1.00 0.00 C ATOM 1409 CD2 TYR B 335 0.734 2.962 6.162 1.00 0.00 C ATOM 1410 CE1 TYR B 335 2.833 3.706 7.790 1.00 0.00 C ATOM 1411 CE2 TYR B 335 1.520 4.046 5.820 1.00 0.00 C ATOM 1412 CZ TYR B 335 2.568 4.414 6.636 1.00 0.00 C ATOM 1413 OH TYR B 335 3.349 5.500 6.296 1.00 0.00 O ATOM 0 H TYR B 335 -1.716 -0.526 8.271 1.00 0.00 H new ATOM 0 HA TYR B 335 -0.570 1.613 9.659 1.00 0.00 H new ATOM 0 HB2 TYR B 335 0.727 0.268 8.134 1.00 0.00 H new ATOM 0 HB3 TYR B 335 -0.342 0.633 6.794 1.00 0.00 H new ATOM 0 HD1 TYR B 335 2.250 2.073 9.033 1.00 0.00 H new ATOM 0 HD2 TYR B 335 -0.085 2.677 5.518 1.00 0.00 H new ATOM 0 HE1 TYR B 335 3.655 3.996 8.427 1.00 0.00 H new ATOM 0 HE2 TYR B 335 1.314 4.602 4.917 1.00 0.00 H new ATOM 0 HH TYR B 335 4.201 5.454 6.778 1.00 0.00 H new ATOM 1423 N GLN B 336 -2.607 2.491 7.207 1.00 0.00 N ATOM 1424 CA GLN B 336 -3.364 3.612 6.652 1.00 0.00 C ATOM 1425 C GLN B 336 -4.201 4.281 7.737 1.00 0.00 C ATOM 1426 O GLN B 336 -4.296 5.509 7.800 1.00 0.00 O ATOM 1427 CB GLN B 336 -4.268 3.134 5.513 1.00 0.00 C ATOM 1428 CG GLN B 336 -4.924 4.270 4.746 1.00 0.00 C ATOM 1429 CD GLN B 336 -5.895 3.781 3.691 1.00 0.00 C ATOM 1430 OE1 GLN B 336 -6.531 2.738 3.848 1.00 0.00 O ATOM 1431 NE2 GLN B 336 -6.011 4.528 2.605 1.00 0.00 N ATOM 0 H GLN B 336 -2.796 1.594 6.760 1.00 0.00 H new ATOM 0 HA GLN B 336 -2.656 4.341 6.257 1.00 0.00 H new ATOM 0 HB2 GLN B 336 -3.680 2.530 4.821 1.00 0.00 H new ATOM 0 HB3 GLN B 336 -5.043 2.486 5.922 1.00 0.00 H new ATOM 0 HG2 GLN B 336 -5.451 4.918 5.446 1.00 0.00 H new ATOM 0 HG3 GLN B 336 -4.152 4.875 4.271 1.00 0.00 H new ATOM 0 HE21 GLN B 336 -5.465 5.385 2.515 1.00 0.00 H new ATOM 0 HE22 GLN B 336 -6.646 4.247 1.858 1.00 0.00 H new ATOM 1440 N LYS B 337 -4.791 3.463 8.597 1.00 0.00 N ATOM 1441 CA LYS B 337 -5.594 3.962 9.702 1.00 0.00 C ATOM 1442 C LYS B 337 -4.710 4.725 10.685 1.00 0.00 C ATOM 1443 O LYS B 337 -5.014 5.858 11.059 1.00 0.00 O ATOM 1444 CB LYS B 337 -6.287 2.800 10.420 1.00 0.00 C ATOM 1445 CG LYS B 337 -7.208 3.235 11.550 1.00 0.00 C ATOM 1446 CD LYS B 337 -7.195 2.230 12.689 1.00 0.00 C ATOM 1447 CE LYS B 337 -5.813 2.142 13.312 1.00 0.00 C ATOM 1448 NZ LYS B 337 -5.742 1.151 14.414 1.00 0.00 N ATOM 0 H LYS B 337 -4.727 2.446 8.549 1.00 0.00 H new ATOM 0 HA LYS B 337 -6.354 4.636 9.307 1.00 0.00 H new ATOM 0 HB2 LYS B 337 -6.865 2.229 9.693 1.00 0.00 H new ATOM 0 HB3 LYS B 337 -5.528 2.129 10.821 1.00 0.00 H new ATOM 0 HG2 LYS B 337 -6.897 4.212 11.920 1.00 0.00 H new ATOM 0 HG3 LYS B 337 -8.224 3.346 11.172 1.00 0.00 H new ATOM 0 HD2 LYS B 337 -7.923 2.522 13.446 1.00 0.00 H new ATOM 0 HD3 LYS B 337 -7.496 1.250 12.319 1.00 0.00 H new ATOM 0 HE2 LYS B 337 -5.089 1.875 12.542 1.00 0.00 H new ATOM 0 HE3 LYS B 337 -5.528 3.123 13.692 1.00 0.00 H new ATOM 0 HZ1 LYS B 337 -4.797 1.181 14.847 1.00 0.00 H new ATOM 0 HZ2 LYS B 337 -6.459 1.378 15.132 1.00 0.00 H new ATOM 0 HZ3 LYS B 337 -5.920 0.199 14.036 1.00 0.00 H new ATOM 1462 N GLU B 338 -3.604 4.093 11.077 1.00 0.00 N ATOM 1463 CA GLU B 338 -2.642 4.695 12.001 1.00 0.00 C ATOM 1464 C GLU B 338 -2.134 6.025 11.447 1.00 0.00 C ATOM 1465 O GLU B 338 -2.023 7.016 12.172 1.00 0.00 O ATOM 1466 CB GLU B 338 -1.452 3.752 12.228 1.00 0.00 C ATOM 1467 CG GLU B 338 -1.819 2.391 12.808 1.00 0.00 C ATOM 1468 CD GLU B 338 -2.219 2.454 14.267 1.00 0.00 C ATOM 1469 OE1 GLU B 338 -1.585 3.213 15.022 1.00 0.00 O ATOM 1470 OE2 GLU B 338 -3.145 1.718 14.671 1.00 0.00 O ATOM 0 H GLU B 338 -3.350 3.155 10.766 1.00 0.00 H new ATOM 0 HA GLU B 338 -3.147 4.869 12.951 1.00 0.00 H new ATOM 0 HB2 GLU B 338 -0.940 3.601 11.278 1.00 0.00 H new ATOM 0 HB3 GLU B 338 -0.743 4.238 12.898 1.00 0.00 H new ATOM 0 HG2 GLU B 338 -2.640 1.966 12.231 1.00 0.00 H new ATOM 0 HG3 GLU B 338 -0.970 1.716 12.699 1.00 0.00 H new ATOM 1477 N GLN B 339 -1.847 6.032 10.150 1.00 0.00 N ATOM 1478 CA GLN B 339 -1.322 7.204 9.467 1.00 0.00 C ATOM 1479 C GLN B 339 -2.327 8.354 9.500 1.00 0.00 C ATOM 1480 O GLN B 339 -1.956 9.501 9.741 1.00 0.00 O ATOM 1481 CB GLN B 339 -0.970 6.836 8.021 1.00 0.00 C ATOM 1482 CG GLN B 339 -0.273 7.943 7.242 1.00 0.00 C ATOM 1483 CD GLN B 339 1.021 8.394 7.893 1.00 0.00 C ATOM 1484 OE1 GLN B 339 1.034 9.327 8.692 1.00 0.00 O ATOM 1485 NE2 GLN B 339 2.117 7.727 7.569 1.00 0.00 N ATOM 0 H GLN B 339 -1.973 5.222 9.543 1.00 0.00 H new ATOM 0 HA GLN B 339 -0.422 7.538 9.983 1.00 0.00 H new ATOM 0 HB2 GLN B 339 -0.328 5.955 8.029 1.00 0.00 H new ATOM 0 HB3 GLN B 339 -1.885 6.560 7.496 1.00 0.00 H new ATOM 0 HG2 GLN B 339 -0.063 7.593 6.231 1.00 0.00 H new ATOM 0 HG3 GLN B 339 -0.945 8.796 7.151 1.00 0.00 H new ATOM 0 HE21 GLN B 339 2.067 6.958 6.901 1.00 0.00 H new ATOM 0 HE22 GLN B 339 3.012 7.982 7.987 1.00 0.00 H new ATOM 1494 N ARG B 340 -3.600 8.045 9.271 1.00 0.00 N ATOM 1495 CA ARG B 340 -4.636 9.070 9.306 1.00 0.00 C ATOM 1496 C ARG B 340 -4.815 9.601 10.725 1.00 0.00 C ATOM 1497 O ARG B 340 -4.923 10.809 10.933 1.00 0.00 O ATOM 1498 CB ARG B 340 -5.970 8.540 8.770 1.00 0.00 C ATOM 1499 CG ARG B 340 -7.074 9.588 8.791 1.00 0.00 C ATOM 1500 CD ARG B 340 -8.374 9.074 8.193 1.00 0.00 C ATOM 1501 NE ARG B 340 -9.437 10.075 8.293 1.00 0.00 N ATOM 1502 CZ ARG B 340 -10.516 10.117 7.511 1.00 0.00 C ATOM 1503 NH1 ARG B 340 -10.702 9.215 6.553 1.00 0.00 N ATOM 1504 NH2 ARG B 340 -11.425 11.063 7.690 1.00 0.00 N ATOM 0 H ARG B 340 -3.936 7.105 9.062 1.00 0.00 H new ATOM 0 HA ARG B 340 -4.313 9.886 8.659 1.00 0.00 H new ATOM 0 HB2 ARG B 340 -5.831 8.186 7.748 1.00 0.00 H new ATOM 0 HB3 ARG B 340 -6.280 7.681 9.365 1.00 0.00 H new ATOM 0 HG2 ARG B 340 -7.251 9.905 9.819 1.00 0.00 H new ATOM 0 HG3 ARG B 340 -6.746 10.468 8.238 1.00 0.00 H new ATOM 0 HD2 ARG B 340 -8.217 8.811 7.147 1.00 0.00 H new ATOM 0 HD3 ARG B 340 -8.679 8.163 8.709 1.00 0.00 H new ATOM 0 HE ARG B 340 -9.346 10.792 9.013 1.00 0.00 H new ATOM 0 HH11 ARG B 340 -10.014 8.476 6.407 1.00 0.00 H new ATOM 0 HH12 ARG B 340 -11.533 9.261 5.963 1.00 0.00 H new ATOM 0 HH21 ARG B 340 -11.299 11.758 8.425 1.00 0.00 H new ATOM 0 HH22 ARG B 340 -12.251 11.096 7.092 1.00 0.00 H new ATOM 1518 N ASN B 341 -4.827 8.693 11.696 1.00 0.00 N ATOM 1519 CA ASN B 341 -4.960 9.067 13.104 1.00 0.00 C ATOM 1520 C ASN B 341 -3.818 9.990 13.522 1.00 0.00 C ATOM 1521 O ASN B 341 -4.024 10.966 14.249 1.00 0.00 O ATOM 1522 CB ASN B 341 -4.981 7.818 14.000 1.00 0.00 C ATOM 1523 CG ASN B 341 -6.263 7.011 13.867 1.00 0.00 C ATOM 1524 OD1 ASN B 341 -6.936 7.047 12.839 1.00 0.00 O ATOM 1525 ND2 ASN B 341 -6.601 6.256 14.902 1.00 0.00 N ATOM 0 H ASN B 341 -4.746 7.689 11.535 1.00 0.00 H new ATOM 0 HA ASN B 341 -5.904 9.598 13.225 1.00 0.00 H new ATOM 0 HB2 ASN B 341 -4.131 7.183 13.749 1.00 0.00 H new ATOM 0 HB3 ASN B 341 -4.856 8.121 15.039 1.00 0.00 H new ATOM 0 HD21 ASN B 341 -7.442 5.681 14.861 1.00 0.00 H new ATOM 0 HD22 ASN B 341 -6.020 6.250 15.740 1.00 0.00 H new ATOM 1532 N ALA B 342 -2.617 9.681 13.046 1.00 0.00 N ATOM 1533 CA ALA B 342 -1.442 10.494 13.331 1.00 0.00 C ATOM 1534 C ALA B 342 -1.513 11.837 12.610 1.00 0.00 C ATOM 1535 O ALA B 342 -1.239 12.885 13.201 1.00 0.00 O ATOM 1536 CB ALA B 342 -0.180 9.746 12.935 1.00 0.00 C ATOM 0 H ALA B 342 -2.432 8.869 12.458 1.00 0.00 H new ATOM 0 HA ALA B 342 -1.416 10.690 14.403 1.00 0.00 H new ATOM 0 HB1 ALA B 342 0.692 10.363 13.152 1.00 0.00 H new ATOM 0 HB2 ALA B 342 -0.116 8.816 13.499 1.00 0.00 H new ATOM 0 HB3 ALA B 342 -0.209 9.522 11.869 1.00 0.00 H new ATOM 1542 N LYS B 343 -1.900 11.793 11.339 1.00 0.00 N ATOM 1543 CA LYS B 343 -2.011 12.995 10.514 1.00 0.00 C ATOM 1544 C LYS B 343 -3.025 13.965 11.113 1.00 0.00 C ATOM 1545 O LYS B 343 -2.778 15.168 11.196 1.00 0.00 O ATOM 1546 CB LYS B 343 -2.435 12.625 9.088 1.00 0.00 C ATOM 1547 CG LYS B 343 -2.400 13.795 8.116 1.00 0.00 C ATOM 1548 CD LYS B 343 -3.057 13.450 6.786 1.00 0.00 C ATOM 1549 CE LYS B 343 -2.402 12.250 6.116 1.00 0.00 C ATOM 1550 NZ LYS B 343 -2.961 12.003 4.759 1.00 0.00 N ATOM 0 H LYS B 343 -2.144 10.930 10.853 1.00 0.00 H new ATOM 0 HA LYS B 343 -1.034 13.478 10.484 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -1.780 11.836 8.717 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -3.445 12.215 9.113 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -2.908 14.651 8.560 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -1.366 14.092 7.943 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -4.114 13.241 6.948 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -3.001 14.311 6.120 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -1.327 12.416 6.042 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -2.545 11.364 6.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -2.490 11.178 4.335 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -3.982 11.819 4.832 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -2.802 12.839 4.161 1.00 0.00 H new ATOM 1652 N PRO B 351 1.633 6.734 15.858 1.00 0.00 N ATOM 1653 CA PRO B 351 1.047 5.568 15.196 1.00 0.00 C ATOM 1654 C PRO B 351 1.753 4.270 15.578 1.00 0.00 C ATOM 1655 O PRO B 351 2.985 4.206 15.619 1.00 0.00 O ATOM 1656 CB PRO B 351 1.236 5.866 13.704 1.00 0.00 C ATOM 1657 CG PRO B 351 2.373 6.825 13.644 1.00 0.00 C ATOM 1658 CD PRO B 351 2.286 7.645 14.900 1.00 0.00 C ATOM 0 HA PRO B 351 0.006 5.419 15.482 1.00 0.00 H new ATOM 0 HB2 PRO B 351 1.457 4.957 13.145 1.00 0.00 H new ATOM 0 HB3 PRO B 351 0.333 6.296 13.270 1.00 0.00 H new ATOM 0 HG2 PRO B 351 3.326 6.298 13.586 1.00 0.00 H new ATOM 0 HG3 PRO B 351 2.304 7.457 12.759 1.00 0.00 H new ATOM 0 HD2 PRO B 351 3.272 7.954 15.247 1.00 0.00 H new ATOM 0 HD3 PRO B 351 1.703 8.553 14.747 1.00 0.00 H new ATOM 1666 N ALA B 352 0.967 3.241 15.858 1.00 0.00 N ATOM 1667 CA ALA B 352 1.513 1.938 16.199 1.00 0.00 C ATOM 1668 C ALA B 352 2.136 1.307 14.968 1.00 0.00 C ATOM 1669 O ALA B 352 3.097 0.545 15.056 1.00 0.00 O ATOM 1670 CB ALA B 352 0.432 1.040 16.774 1.00 0.00 C ATOM 0 H ALA B 352 -0.052 3.284 15.855 1.00 0.00 H new ATOM 0 HA ALA B 352 2.284 2.064 16.959 1.00 0.00 H new ATOM 0 HB1 ALA B 352 0.860 0.069 17.023 1.00 0.00 H new ATOM 0 HB2 ALA B 352 0.020 1.497 17.674 1.00 0.00 H new ATOM 0 HB3 ALA B 352 -0.361 0.909 16.038 1.00 0.00 H new ATOM 1676 N LEU B 353 1.583 1.639 13.813 1.00 0.00 N ATOM 1677 CA LEU B 353 2.127 1.173 12.555 1.00 0.00 C ATOM 1678 C LEU B 353 2.919 2.278 11.876 1.00 0.00 C ATOM 1679 O LEU B 353 2.378 3.070 11.112 1.00 0.00 O ATOM 1680 CB LEU B 353 1.023 0.663 11.621 1.00 0.00 C ATOM 1681 CG LEU B 353 0.650 -0.816 11.780 1.00 0.00 C ATOM 1682 CD1 LEU B 353 1.833 -1.706 11.432 1.00 0.00 C ATOM 1683 CD2 LEU B 353 0.166 -1.110 13.190 1.00 0.00 C ATOM 0 H LEU B 353 0.757 2.230 13.724 1.00 0.00 H new ATOM 0 HA LEU B 353 2.795 0.340 12.772 1.00 0.00 H new ATOM 0 HB2 LEU B 353 0.128 1.264 11.783 1.00 0.00 H new ATOM 0 HB3 LEU B 353 1.337 0.831 10.591 1.00 0.00 H new ATOM 0 HG LEU B 353 -0.165 -1.031 11.089 1.00 0.00 H new ATOM 0 HD11 LEU B 353 1.549 -2.752 11.551 1.00 0.00 H new ATOM 0 HD12 LEU B 353 2.132 -1.526 10.399 1.00 0.00 H new ATOM 0 HD13 LEU B 353 2.667 -1.479 12.096 1.00 0.00 H new ATOM 0 HD21 LEU B 353 -0.091 -2.166 13.274 1.00 0.00 H new ATOM 0 HD22 LEU B 353 0.955 -0.871 13.903 1.00 0.00 H new ATOM 0 HD23 LEU B 353 -0.714 -0.504 13.407 1.00 0.00 H new ATOM 1695 N THR B 354 4.193 2.352 12.211 1.00 0.00 N ATOM 1696 CA THR B 354 5.121 3.236 11.527 1.00 0.00 C ATOM 1697 C THR B 354 5.687 2.491 10.317 1.00 0.00 C ATOM 1698 O THR B 354 5.670 1.261 10.308 1.00 0.00 O ATOM 1699 CB THR B 354 6.256 3.650 12.489 1.00 0.00 C ATOM 1700 OG1 THR B 354 5.696 4.132 13.721 1.00 0.00 O ATOM 1701 CG2 THR B 354 7.142 4.729 11.890 1.00 0.00 C ATOM 0 H THR B 354 4.614 1.804 12.961 1.00 0.00 H new ATOM 0 HA THR B 354 4.611 4.141 11.196 1.00 0.00 H new ATOM 0 HB THR B 354 6.870 2.768 12.670 1.00 0.00 H new ATOM 0 HG1 THR B 354 6.419 4.392 14.329 1.00 0.00 H new ATOM 0 HG21 THR B 354 7.927 4.991 12.600 1.00 0.00 H new ATOM 0 HG22 THR B 354 7.593 4.359 10.969 1.00 0.00 H new ATOM 0 HG23 THR B 354 6.542 5.612 11.671 1.00 0.00 H new ATOM 1709 N GLU B 355 6.174 3.198 9.299 1.00 0.00 N ATOM 1710 CA GLU B 355 6.711 2.526 8.112 1.00 0.00 C ATOM 1711 C GLU B 355 7.863 1.589 8.480 1.00 0.00 C ATOM 1712 O GLU B 355 8.098 0.587 7.804 1.00 0.00 O ATOM 1713 CB GLU B 355 7.143 3.521 7.020 1.00 0.00 C ATOM 1714 CG GLU B 355 7.775 4.808 7.527 1.00 0.00 C ATOM 1715 CD GLU B 355 6.742 5.822 7.975 1.00 0.00 C ATOM 1716 OE1 GLU B 355 6.022 6.363 7.109 1.00 0.00 O ATOM 1717 OE2 GLU B 355 6.634 6.060 9.194 1.00 0.00 O ATOM 0 H GLU B 355 6.209 4.217 9.268 1.00 0.00 H new ATOM 0 HA GLU B 355 5.900 1.927 7.698 1.00 0.00 H new ATOM 0 HB2 GLU B 355 7.852 3.024 6.358 1.00 0.00 H new ATOM 0 HB3 GLU B 355 6.271 3.776 6.418 1.00 0.00 H new ATOM 0 HG2 GLU B 355 8.440 4.579 8.360 1.00 0.00 H new ATOM 0 HG3 GLU B 355 8.389 5.243 6.738 1.00 0.00 H new ATOM 1724 N GLN B 356 8.564 1.905 9.565 1.00 0.00 N ATOM 1725 CA GLN B 356 9.603 1.021 10.085 1.00 0.00 C ATOM 1726 C GLN B 356 8.972 -0.264 10.625 1.00 0.00 C ATOM 1727 O GLN B 356 9.394 -1.368 10.278 1.00 0.00 O ATOM 1728 CB GLN B 356 10.400 1.728 11.184 1.00 0.00 C ATOM 1729 CG GLN B 356 11.549 0.900 11.736 1.00 0.00 C ATOM 1730 CD GLN B 356 12.304 1.611 12.840 1.00 0.00 C ATOM 1731 OE1 GLN B 356 11.739 2.423 13.576 1.00 0.00 O ATOM 1732 NE2 GLN B 356 13.586 1.312 12.963 1.00 0.00 N ATOM 0 H GLN B 356 8.432 2.763 10.100 1.00 0.00 H new ATOM 0 HA GLN B 356 10.286 0.763 9.276 1.00 0.00 H new ATOM 0 HB2 GLN B 356 10.795 2.664 10.789 1.00 0.00 H new ATOM 0 HB3 GLN B 356 9.725 1.987 12.000 1.00 0.00 H new ATOM 0 HG2 GLN B 356 11.161 -0.045 12.117 1.00 0.00 H new ATOM 0 HG3 GLN B 356 12.239 0.658 10.927 1.00 0.00 H new ATOM 0 HE21 GLN B 356 14.014 0.634 12.333 1.00 0.00 H new ATOM 0 HE22 GLN B 356 14.147 1.759 13.688 1.00 0.00 H new ATOM 1741 N GLU B 357 7.950 -0.101 11.467 1.00 0.00 N ATOM 1742 CA GLU B 357 7.169 -1.224 11.987 1.00 0.00 C ATOM 1743 C GLU B 357 6.655 -2.099 10.852 1.00 0.00 C ATOM 1744 O GLU B 357 6.793 -3.321 10.885 1.00 0.00 O ATOM 1745 CB GLU B 357 5.982 -0.708 12.805 1.00 0.00 C ATOM 1746 CG GLU B 357 6.358 -0.196 14.182 1.00 0.00 C ATOM 1747 CD GLU B 357 6.716 -1.322 15.125 1.00 0.00 C ATOM 1748 OE1 GLU B 357 5.796 -1.899 15.744 1.00 0.00 O ATOM 1749 OE2 GLU B 357 7.913 -1.647 15.245 1.00 0.00 O ATOM 0 H GLU B 357 7.641 0.810 11.807 1.00 0.00 H new ATOM 0 HA GLU B 357 7.821 -1.820 12.625 1.00 0.00 H new ATOM 0 HB2 GLU B 357 5.494 0.094 12.251 1.00 0.00 H new ATOM 0 HB3 GLU B 357 5.253 -1.511 12.914 1.00 0.00 H new ATOM 0 HG2 GLU B 357 7.202 0.488 14.097 1.00 0.00 H new ATOM 0 HG3 GLU B 357 5.527 0.374 14.597 1.00 0.00 H new ATOM 1756 N VAL B 358 6.073 -1.456 9.847 1.00 0.00 N ATOM 1757 CA VAL B 358 5.517 -2.159 8.699 1.00 0.00 C ATOM 1758 C VAL B 358 6.595 -2.951 7.967 1.00 0.00 C ATOM 1759 O VAL B 358 6.376 -4.095 7.583 1.00 0.00 O ATOM 1760 CB VAL B 358 4.840 -1.184 7.713 1.00 0.00 C ATOM 1761 CG1 VAL B 358 4.295 -1.922 6.499 1.00 0.00 C ATOM 1762 CG2 VAL B 358 3.729 -0.412 8.407 1.00 0.00 C ATOM 0 H VAL B 358 5.974 -0.442 9.805 1.00 0.00 H new ATOM 0 HA VAL B 358 4.764 -2.848 9.082 1.00 0.00 H new ATOM 0 HB VAL B 358 5.594 -0.477 7.368 1.00 0.00 H new ATOM 0 HG11 VAL B 358 3.824 -1.210 5.822 1.00 0.00 H new ATOM 0 HG12 VAL B 358 5.112 -2.427 5.983 1.00 0.00 H new ATOM 0 HG13 VAL B 358 3.559 -2.658 6.821 1.00 0.00 H new ATOM 0 HG21 VAL B 358 3.262 0.271 7.697 1.00 0.00 H new ATOM 0 HG22 VAL B 358 2.982 -1.110 8.784 1.00 0.00 H new ATOM 0 HG23 VAL B 358 4.146 0.157 9.238 1.00 0.00 H new ATOM 1772 N TYR B 359 7.765 -2.348 7.799 1.00 0.00 N ATOM 1773 CA TYR B 359 8.859 -3.001 7.093 1.00 0.00 C ATOM 1774 C TYR B 359 9.339 -4.228 7.867 1.00 0.00 C ATOM 1775 O TYR B 359 9.661 -5.261 7.280 1.00 0.00 O ATOM 1776 CB TYR B 359 10.014 -2.024 6.873 1.00 0.00 C ATOM 1777 CG TYR B 359 11.081 -2.553 5.940 1.00 0.00 C ATOM 1778 CD1 TYR B 359 10.758 -2.964 4.653 1.00 0.00 C ATOM 1779 CD2 TYR B 359 12.409 -2.628 6.340 1.00 0.00 C ATOM 1780 CE1 TYR B 359 11.729 -3.436 3.790 1.00 0.00 C ATOM 1781 CE2 TYR B 359 13.384 -3.101 5.483 1.00 0.00 C ATOM 1782 CZ TYR B 359 13.039 -3.503 4.209 1.00 0.00 C ATOM 1783 OH TYR B 359 14.008 -3.965 3.347 1.00 0.00 O ATOM 0 H TYR B 359 7.980 -1.411 8.141 1.00 0.00 H new ATOM 0 HA TYR B 359 8.493 -3.328 6.120 1.00 0.00 H new ATOM 0 HB2 TYR B 359 9.619 -1.092 6.469 1.00 0.00 H new ATOM 0 HB3 TYR B 359 10.468 -1.788 7.835 1.00 0.00 H new ATOM 0 HD1 TYR B 359 9.731 -2.914 4.321 1.00 0.00 H new ATOM 0 HD2 TYR B 359 12.683 -2.312 7.336 1.00 0.00 H new ATOM 0 HE1 TYR B 359 11.462 -3.751 2.792 1.00 0.00 H new ATOM 0 HE2 TYR B 359 14.412 -3.156 5.809 1.00 0.00 H new ATOM 0 HH TYR B 359 14.879 -3.949 3.795 1.00 0.00 H new ATOM 1793 N ALA B 360 9.365 -4.118 9.189 1.00 0.00 N ATOM 1794 CA ALA B 360 9.756 -5.238 10.034 1.00 0.00 C ATOM 1795 C ALA B 360 8.712 -6.348 9.969 1.00 0.00 C ATOM 1796 O ALA B 360 9.049 -7.525 9.834 1.00 0.00 O ATOM 1797 CB ALA B 360 9.963 -4.775 11.471 1.00 0.00 C ATOM 0 H ALA B 360 9.121 -3.268 9.697 1.00 0.00 H new ATOM 0 HA ALA B 360 10.700 -5.637 9.664 1.00 0.00 H new ATOM 0 HB1 ALA B 360 10.255 -5.625 12.089 1.00 0.00 H new ATOM 0 HB2 ALA B 360 10.747 -4.019 11.500 1.00 0.00 H new ATOM 0 HB3 ALA B 360 9.035 -4.350 11.854 1.00 0.00 H new ATOM 1803 N GLN B 361 7.443 -5.965 10.042 1.00 0.00 N ATOM 1804 CA GLN B 361 6.351 -6.929 9.999 1.00 0.00 C ATOM 1805 C GLN B 361 6.204 -7.544 8.610 1.00 0.00 C ATOM 1806 O GLN B 361 5.803 -8.700 8.478 1.00 0.00 O ATOM 1807 CB GLN B 361 5.035 -6.271 10.425 1.00 0.00 C ATOM 1808 CG GLN B 361 4.961 -5.964 11.913 1.00 0.00 C ATOM 1809 CD GLN B 361 3.672 -5.272 12.307 1.00 0.00 C ATOM 1810 OE1 GLN B 361 2.632 -5.451 11.671 1.00 0.00 O ATOM 1811 NE2 GLN B 361 3.724 -4.488 13.373 1.00 0.00 N ATOM 0 H GLN B 361 7.145 -4.994 10.131 1.00 0.00 H new ATOM 0 HA GLN B 361 6.591 -7.729 10.699 1.00 0.00 H new ATOM 0 HB2 GLN B 361 4.903 -5.345 9.865 1.00 0.00 H new ATOM 0 HB3 GLN B 361 4.207 -6.927 10.156 1.00 0.00 H new ATOM 0 HG2 GLN B 361 5.056 -6.893 12.476 1.00 0.00 H new ATOM 0 HG3 GLN B 361 5.806 -5.334 12.192 1.00 0.00 H new ATOM 0 HE21 GLN B 361 4.604 -4.365 13.873 1.00 0.00 H new ATOM 0 HE22 GLN B 361 2.884 -4.007 13.694 1.00 0.00 H new ATOM 1820 N VAL B 362 6.532 -6.779 7.578 1.00 0.00 N ATOM 1821 CA VAL B 362 6.424 -7.270 6.215 1.00 0.00 C ATOM 1822 C VAL B 362 7.545 -8.264 5.914 1.00 0.00 C ATOM 1823 O VAL B 362 7.343 -9.236 5.189 1.00 0.00 O ATOM 1824 CB VAL B 362 6.423 -6.117 5.178 1.00 0.00 C ATOM 1825 CG1 VAL B 362 7.832 -5.676 4.808 1.00 0.00 C ATOM 1826 CG2 VAL B 362 5.642 -6.516 3.942 1.00 0.00 C ATOM 0 H VAL B 362 6.873 -5.821 7.660 1.00 0.00 H new ATOM 0 HA VAL B 362 5.465 -7.782 6.129 1.00 0.00 H new ATOM 0 HB VAL B 362 5.933 -5.262 5.643 1.00 0.00 H new ATOM 0 HG11 VAL B 362 7.780 -4.867 4.079 1.00 0.00 H new ATOM 0 HG12 VAL B 362 8.350 -5.327 5.701 1.00 0.00 H new ATOM 0 HG13 VAL B 362 8.375 -6.517 4.378 1.00 0.00 H new ATOM 0 HG21 VAL B 362 5.652 -5.695 3.225 1.00 0.00 H new ATOM 0 HG22 VAL B 362 6.099 -7.397 3.491 1.00 0.00 H new ATOM 0 HG23 VAL B 362 4.613 -6.743 4.220 1.00 0.00 H new ATOM 1836 N ALA B 363 8.720 -8.028 6.497 1.00 0.00 N ATOM 1837 CA ALA B 363 9.836 -8.957 6.369 1.00 0.00 C ATOM 1838 C ALA B 363 9.567 -10.200 7.199 1.00 0.00 C ATOM 1839 O ALA B 363 10.029 -11.295 6.881 1.00 0.00 O ATOM 1840 CB ALA B 363 11.136 -8.295 6.794 1.00 0.00 C ATOM 0 H ALA B 363 8.921 -7.202 7.061 1.00 0.00 H new ATOM 0 HA ALA B 363 9.936 -9.248 5.323 1.00 0.00 H new ATOM 0 HB1 ALA B 363 11.957 -9.005 6.691 1.00 0.00 H new ATOM 0 HB2 ALA B 363 11.326 -7.427 6.162 1.00 0.00 H new ATOM 0 HB3 ALA B 363 11.060 -7.977 7.834 1.00 0.00 H new ATOM 1846 N ARG B 364 8.813 -10.009 8.274 1.00 0.00 N ATOM 1847 CA ARG B 364 8.360 -11.102 9.110 1.00 0.00 C ATOM 1848 C ARG B 364 7.342 -11.951 8.352 1.00 0.00 C ATOM 1849 O ARG B 364 7.278 -13.167 8.521 1.00 0.00 O ATOM 1850 CB ARG B 364 7.731 -10.533 10.384 1.00 0.00 C ATOM 1851 CG ARG B 364 7.253 -11.589 11.356 1.00 0.00 C ATOM 1852 CD ARG B 364 8.409 -12.430 11.859 1.00 0.00 C ATOM 1853 NE ARG B 364 7.974 -13.454 12.804 1.00 0.00 N ATOM 1854 CZ ARG B 364 8.434 -14.702 12.809 1.00 0.00 C ATOM 1855 NH1 ARG B 364 9.313 -15.094 11.894 1.00 0.00 N ATOM 1856 NH2 ARG B 364 8.007 -15.562 13.723 1.00 0.00 N ATOM 0 H ARG B 364 8.501 -9.090 8.587 1.00 0.00 H new ATOM 0 HA ARG B 364 9.207 -11.734 9.377 1.00 0.00 H new ATOM 0 HB2 ARG B 364 8.460 -9.896 10.884 1.00 0.00 H new ATOM 0 HB3 ARG B 364 6.889 -9.898 10.109 1.00 0.00 H new ATOM 0 HG2 ARG B 364 6.752 -11.112 12.199 1.00 0.00 H new ATOM 0 HG3 ARG B 364 6.518 -12.230 10.869 1.00 0.00 H new ATOM 0 HD2 ARG B 364 8.905 -12.906 11.013 1.00 0.00 H new ATOM 0 HD3 ARG B 364 9.145 -11.784 12.338 1.00 0.00 H new ATOM 0 HE ARG B 364 7.276 -13.197 13.502 1.00 0.00 H new ATOM 0 HH11 ARG B 364 9.638 -14.437 11.184 1.00 0.00 H new ATOM 0 HH12 ARG B 364 9.664 -16.052 11.901 1.00 0.00 H new ATOM 0 HH21 ARG B 364 7.326 -15.267 14.422 1.00 0.00 H new ATOM 0 HH22 ARG B 364 8.360 -16.519 13.727 1.00 0.00 H new ATOM 1870 N LEU B 365 6.549 -11.287 7.520 1.00 0.00 N ATOM 1871 CA LEU B 365 5.538 -11.954 6.715 1.00 0.00 C ATOM 1872 C LEU B 365 6.176 -12.671 5.534 1.00 0.00 C ATOM 1873 O LEU B 365 5.950 -13.864 5.320 1.00 0.00 O ATOM 1874 CB LEU B 365 4.511 -10.934 6.216 1.00 0.00 C ATOM 1875 CG LEU B 365 3.401 -11.496 5.330 1.00 0.00 C ATOM 1876 CD1 LEU B 365 2.551 -12.495 6.101 1.00 0.00 C ATOM 1877 CD2 LEU B 365 2.544 -10.364 4.791 1.00 0.00 C ATOM 0 H LEU B 365 6.589 -10.277 7.386 1.00 0.00 H new ATOM 0 HA LEU B 365 5.035 -12.695 7.337 1.00 0.00 H new ATOM 0 HB2 LEU B 365 4.053 -10.453 7.080 1.00 0.00 H new ATOM 0 HB3 LEU B 365 5.037 -10.157 5.661 1.00 0.00 H new ATOM 0 HG LEU B 365 3.856 -12.020 4.490 1.00 0.00 H new ATOM 0 HD11 LEU B 365 1.766 -12.883 5.451 1.00 0.00 H new ATOM 0 HD12 LEU B 365 3.178 -13.318 6.444 1.00 0.00 H new ATOM 0 HD13 LEU B 365 2.099 -12.001 6.961 1.00 0.00 H new ATOM 0 HD21 LEU B 365 1.755 -10.774 4.160 1.00 0.00 H new ATOM 0 HD22 LEU B 365 2.098 -9.818 5.622 1.00 0.00 H new ATOM 0 HD23 LEU B 365 3.164 -9.687 4.203 1.00 0.00 H new ATOM 1889 N PHE B 366 6.979 -11.946 4.767 1.00 0.00 N ATOM 1890 CA PHE B 366 7.656 -12.524 3.616 1.00 0.00 C ATOM 1891 C PHE B 366 8.920 -13.249 4.063 1.00 0.00 C ATOM 1892 O PHE B 366 10.040 -12.813 3.785 1.00 0.00 O ATOM 1893 CB PHE B 366 7.996 -11.448 2.583 1.00 0.00 C ATOM 1894 CG PHE B 366 6.796 -10.701 2.066 1.00 0.00 C ATOM 1895 CD1 PHE B 366 5.603 -11.362 1.825 1.00 0.00 C ATOM 1896 CD2 PHE B 366 6.865 -9.339 1.813 1.00 0.00 C ATOM 1897 CE1 PHE B 366 4.501 -10.683 1.342 1.00 0.00 C ATOM 1898 CE2 PHE B 366 5.764 -8.654 1.328 1.00 0.00 C ATOM 1899 CZ PHE B 366 4.581 -9.328 1.093 1.00 0.00 C ATOM 0 H PHE B 366 7.177 -10.957 4.921 1.00 0.00 H new ATOM 0 HA PHE B 366 6.983 -13.241 3.146 1.00 0.00 H new ATOM 0 HB2 PHE B 366 8.691 -10.736 3.029 1.00 0.00 H new ATOM 0 HB3 PHE B 366 8.512 -11.914 1.743 1.00 0.00 H new ATOM 0 HD1 PHE B 366 5.533 -12.422 2.017 1.00 0.00 H new ATOM 0 HD2 PHE B 366 7.787 -8.807 1.996 1.00 0.00 H new ATOM 0 HE1 PHE B 366 3.577 -11.212 1.159 1.00 0.00 H new ATOM 0 HE2 PHE B 366 5.830 -7.594 1.134 1.00 0.00 H new ATOM 0 HZ PHE B 366 3.721 -8.796 0.715 1.00 0.00 H new ATOM 1909 N LYS B 367 8.711 -14.348 4.771 1.00 0.00 N ATOM 1910 CA LYS B 367 9.787 -15.131 5.361 1.00 0.00 C ATOM 1911 C LYS B 367 10.787 -15.606 4.308 1.00 0.00 C ATOM 1912 O LYS B 367 10.449 -16.396 3.422 1.00 0.00 O ATOM 1913 CB LYS B 367 9.191 -16.323 6.123 1.00 0.00 C ATOM 1914 CG LYS B 367 10.225 -17.289 6.680 1.00 0.00 C ATOM 1915 CD LYS B 367 9.610 -18.252 7.687 1.00 0.00 C ATOM 1916 CE LYS B 367 8.460 -19.051 7.090 1.00 0.00 C ATOM 1917 NZ LYS B 367 8.897 -19.927 5.970 1.00 0.00 N ATOM 0 H LYS B 367 7.781 -14.725 4.954 1.00 0.00 H new ATOM 0 HA LYS B 367 10.335 -14.494 6.055 1.00 0.00 H new ATOM 0 HB2 LYS B 367 8.583 -15.946 6.945 1.00 0.00 H new ATOM 0 HB3 LYS B 367 8.523 -16.868 5.456 1.00 0.00 H new ATOM 0 HG2 LYS B 367 10.673 -17.854 5.863 1.00 0.00 H new ATOM 0 HG3 LYS B 367 11.028 -16.727 7.157 1.00 0.00 H new ATOM 0 HD2 LYS B 367 10.377 -18.937 8.048 1.00 0.00 H new ATOM 0 HD3 LYS B 367 9.251 -17.692 8.551 1.00 0.00 H new ATOM 0 HE2 LYS B 367 8.004 -19.662 7.869 1.00 0.00 H new ATOM 0 HE3 LYS B 367 7.692 -18.365 6.732 1.00 0.00 H new ATOM 0 HZ1 LYS B 367 8.097 -20.511 5.654 1.00 0.00 H new ATOM 0 HZ2 LYS B 367 9.230 -19.339 5.179 1.00 0.00 H new ATOM 0 HZ3 LYS B 367 9.670 -20.544 6.293 1.00 0.00 H new ATOM 1931 N ASN B 368 12.006 -15.073 4.404 1.00 0.00 N ATOM 1932 CA ASN B 368 13.133 -15.468 3.553 1.00 0.00 C ATOM 1933 C ASN B 368 12.954 -14.958 2.120 1.00 0.00 C ATOM 1934 O ASN B 368 13.789 -15.203 1.246 1.00 0.00 O ATOM 1935 CB ASN B 368 13.326 -16.996 3.585 1.00 0.00 C ATOM 1936 CG ASN B 368 14.621 -17.458 2.936 1.00 0.00 C ATOM 1937 OD1 ASN B 368 14.641 -17.854 1.770 1.00 0.00 O ATOM 1938 ND2 ASN B 368 15.713 -17.399 3.681 1.00 0.00 N ATOM 0 H ASN B 368 12.243 -14.348 5.081 1.00 0.00 H new ATOM 0 HA ASN B 368 14.036 -15.005 3.951 1.00 0.00 H new ATOM 0 HB2 ASN B 368 13.307 -17.335 4.621 1.00 0.00 H new ATOM 0 HB3 ASN B 368 12.486 -17.471 3.079 1.00 0.00 H new ATOM 0 HD21 ASN B 368 16.611 -17.687 3.293 1.00 0.00 H new ATOM 0 HD22 ASN B 368 15.657 -17.065 4.643 1.00 0.00 H new ATOM 1945 N GLN B 369 11.887 -14.206 1.885 1.00 0.00 N ATOM 1946 CA GLN B 369 11.627 -13.659 0.565 1.00 0.00 C ATOM 1947 C GLN B 369 12.315 -12.303 0.428 1.00 0.00 C ATOM 1948 O GLN B 369 11.665 -11.262 0.315 1.00 0.00 O ATOM 1949 CB GLN B 369 10.121 -13.528 0.318 1.00 0.00 C ATOM 1950 CG GLN B 369 9.762 -13.337 -1.147 1.00 0.00 C ATOM 1951 CD GLN B 369 10.093 -14.553 -1.988 1.00 0.00 C ATOM 1952 OE1 GLN B 369 11.315 -14.612 -2.490 1.00 0.00 O flip ATOM 1953 NE2 GLN B 369 9.261 -15.439 -2.174 1.00 0.00 N flip ATOM 0 H GLN B 369 11.191 -13.963 2.590 1.00 0.00 H new ATOM 0 HA GLN B 369 12.030 -14.340 -0.185 1.00 0.00 H new ATOM 0 HB2 GLN B 369 9.620 -14.420 0.693 1.00 0.00 H new ATOM 0 HB3 GLN B 369 9.739 -12.683 0.891 1.00 0.00 H new ATOM 0 HG2 GLN B 369 8.697 -13.119 -1.232 1.00 0.00 H new ATOM 0 HG3 GLN B 369 10.296 -12.472 -1.539 1.00 0.00 H new ATOM 0 HE21 GLN B 369 8.328 -15.356 -1.769 1.00 0.00 H new ATOM 0 HE22 GLN B 369 9.503 -16.257 -2.733 1.00 0.00 H new ATOM 1962 N GLU B 370 13.640 -12.333 0.444 1.00 0.00 N ATOM 1963 CA GLU B 370 14.447 -11.119 0.463 1.00 0.00 C ATOM 1964 C GLU B 370 14.379 -10.374 -0.864 1.00 0.00 C ATOM 1965 O GLU B 370 14.569 -9.162 -0.905 1.00 0.00 O ATOM 1966 CB GLU B 370 15.896 -11.459 0.789 1.00 0.00 C ATOM 1967 CG GLU B 370 16.063 -12.190 2.109 1.00 0.00 C ATOM 1968 CD GLU B 370 17.512 -12.461 2.429 1.00 0.00 C ATOM 1969 OE1 GLU B 370 18.112 -13.339 1.775 1.00 0.00 O ATOM 1970 OE2 GLU B 370 18.064 -11.786 3.320 1.00 0.00 O ATOM 0 H GLU B 370 14.185 -13.195 0.444 1.00 0.00 H new ATOM 0 HA GLU B 370 14.040 -10.466 1.235 1.00 0.00 H new ATOM 0 HB2 GLU B 370 16.306 -12.074 -0.012 1.00 0.00 H new ATOM 0 HB3 GLU B 370 16.480 -10.539 0.816 1.00 0.00 H new ATOM 0 HG2 GLU B 370 15.620 -11.597 2.910 1.00 0.00 H new ATOM 0 HG3 GLU B 370 15.518 -13.133 2.072 1.00 0.00 H new ATOM 1977 N ASP B 371 14.118 -11.101 -1.941 1.00 0.00 N ATOM 1978 CA ASP B 371 13.993 -10.497 -3.266 1.00 0.00 C ATOM 1979 C ASP B 371 12.867 -9.468 -3.265 1.00 0.00 C ATOM 1980 O ASP B 371 13.060 -8.289 -3.598 1.00 0.00 O ATOM 1981 CB ASP B 371 13.719 -11.592 -4.304 1.00 0.00 C ATOM 1982 CG ASP B 371 13.821 -11.095 -5.732 1.00 0.00 C ATOM 1983 OD1 ASP B 371 14.934 -10.716 -6.149 1.00 0.00 O ATOM 1984 OD2 ASP B 371 12.801 -11.123 -6.454 1.00 0.00 O ATOM 0 H ASP B 371 13.988 -12.113 -1.926 1.00 0.00 H new ATOM 0 HA ASP B 371 14.923 -9.990 -3.524 1.00 0.00 H new ATOM 0 HB2 ASP B 371 14.427 -12.408 -4.158 1.00 0.00 H new ATOM 0 HB3 ASP B 371 12.722 -12.001 -4.138 1.00 0.00 H new ATOM 1989 N LEU B 372 11.700 -9.924 -2.831 1.00 0.00 N ATOM 1990 CA LEU B 372 10.516 -9.087 -2.741 1.00 0.00 C ATOM 1991 C LEU B 372 10.742 -7.961 -1.725 1.00 0.00 C ATOM 1992 O LEU B 372 10.316 -6.826 -1.933 1.00 0.00 O ATOM 1993 CB LEU B 372 9.318 -9.957 -2.337 1.00 0.00 C ATOM 1994 CG LEU B 372 7.936 -9.310 -2.470 1.00 0.00 C ATOM 1995 CD1 LEU B 372 7.546 -9.163 -3.932 1.00 0.00 C ATOM 1996 CD2 LEU B 372 6.896 -10.133 -1.729 1.00 0.00 C ATOM 0 H LEU B 372 11.549 -10.887 -2.531 1.00 0.00 H new ATOM 0 HA LEU B 372 10.312 -8.629 -3.709 1.00 0.00 H new ATOM 0 HB2 LEU B 372 9.332 -10.862 -2.944 1.00 0.00 H new ATOM 0 HB3 LEU B 372 9.453 -10.266 -1.300 1.00 0.00 H new ATOM 0 HG LEU B 372 7.981 -8.315 -2.026 1.00 0.00 H new ATOM 0 HD11 LEU B 372 6.561 -8.701 -4.001 1.00 0.00 H new ATOM 0 HD12 LEU B 372 8.277 -8.536 -4.442 1.00 0.00 H new ATOM 0 HD13 LEU B 372 7.520 -10.146 -4.402 1.00 0.00 H new ATOM 0 HD21 LEU B 372 5.918 -9.662 -1.832 1.00 0.00 H new ATOM 0 HD22 LEU B 372 6.860 -11.138 -2.149 1.00 0.00 H new ATOM 0 HD23 LEU B 372 7.162 -10.190 -0.674 1.00 0.00 H new ATOM 2008 N LEU B 373 11.440 -8.284 -0.634 1.00 0.00 N ATOM 2009 CA LEU B 373 11.763 -7.299 0.401 1.00 0.00 C ATOM 2010 C LEU B 373 12.704 -6.221 -0.132 1.00 0.00 C ATOM 2011 O LEU B 373 12.560 -5.044 0.199 1.00 0.00 O ATOM 2012 CB LEU B 373 12.399 -7.983 1.615 1.00 0.00 C ATOM 2013 CG LEU B 373 11.471 -8.901 2.410 1.00 0.00 C ATOM 2014 CD1 LEU B 373 12.231 -9.566 3.545 1.00 0.00 C ATOM 2015 CD2 LEU B 373 10.281 -8.121 2.948 1.00 0.00 C ATOM 0 H LEU B 373 11.793 -9.222 -0.444 1.00 0.00 H new ATOM 0 HA LEU B 373 10.830 -6.824 0.704 1.00 0.00 H new ATOM 0 HB2 LEU B 373 13.255 -8.566 1.275 1.00 0.00 H new ATOM 0 HB3 LEU B 373 12.783 -7.213 2.285 1.00 0.00 H new ATOM 0 HG LEU B 373 11.097 -9.678 1.743 1.00 0.00 H new ATOM 0 HD11 LEU B 373 11.557 -10.217 4.102 1.00 0.00 H new ATOM 0 HD12 LEU B 373 13.051 -10.157 3.137 1.00 0.00 H new ATOM 0 HD13 LEU B 373 12.631 -8.802 4.212 1.00 0.00 H new ATOM 0 HD21 LEU B 373 9.631 -8.791 3.511 1.00 0.00 H new ATOM 0 HD22 LEU B 373 10.634 -7.324 3.602 1.00 0.00 H new ATOM 0 HD23 LEU B 373 9.724 -7.689 2.117 1.00 0.00 H new ATOM 2027 N SER B 374 13.664 -6.631 -0.955 1.00 0.00 N ATOM 2028 CA SER B 374 14.608 -5.699 -1.558 1.00 0.00 C ATOM 2029 C SER B 374 13.857 -4.666 -2.386 1.00 0.00 C ATOM 2030 O SER B 374 14.087 -3.463 -2.251 1.00 0.00 O ATOM 2031 CB SER B 374 15.619 -6.451 -2.431 1.00 0.00 C ATOM 2032 OG SER B 374 16.608 -5.575 -2.950 1.00 0.00 O ATOM 0 H SER B 374 13.808 -7.605 -1.220 1.00 0.00 H new ATOM 0 HA SER B 374 15.154 -5.187 -0.765 1.00 0.00 H new ATOM 0 HB2 SER B 374 16.097 -7.235 -1.843 1.00 0.00 H new ATOM 0 HB3 SER B 374 15.098 -6.942 -3.253 1.00 0.00 H new ATOM 0 HG SER B 374 17.239 -6.084 -3.501 1.00 0.00 H new ATOM 2038 N GLU B 375 12.935 -5.138 -3.218 1.00 0.00 N ATOM 2039 CA GLU B 375 12.119 -4.243 -4.031 1.00 0.00 C ATOM 2040 C GLU B 375 11.232 -3.372 -3.148 1.00 0.00 C ATOM 2041 O GLU B 375 10.993 -2.205 -3.446 1.00 0.00 O ATOM 2042 CB GLU B 375 11.261 -5.047 -4.995 1.00 0.00 C ATOM 2043 CG GLU B 375 12.070 -5.946 -5.906 1.00 0.00 C ATOM 2044 CD GLU B 375 11.202 -6.915 -6.669 1.00 0.00 C ATOM 2045 OE1 GLU B 375 10.596 -7.794 -6.029 1.00 0.00 O ATOM 2046 OE2 GLU B 375 11.137 -6.822 -7.910 1.00 0.00 O ATOM 0 H GLU B 375 12.734 -6.130 -3.347 1.00 0.00 H new ATOM 0 HA GLU B 375 12.785 -3.595 -4.601 1.00 0.00 H new ATOM 0 HB2 GLU B 375 10.559 -5.655 -4.425 1.00 0.00 H new ATOM 0 HB3 GLU B 375 10.670 -4.362 -5.603 1.00 0.00 H new ATOM 0 HG2 GLU B 375 12.634 -5.334 -6.610 1.00 0.00 H new ATOM 0 HG3 GLU B 375 12.797 -6.501 -5.313 1.00 0.00 H new ATOM 2053 N PHE B 376 10.756 -3.949 -2.053 1.00 0.00 N ATOM 2054 CA PHE B 376 9.909 -3.233 -1.105 1.00 0.00 C ATOM 2055 C PHE B 376 10.686 -2.091 -0.450 1.00 0.00 C ATOM 2056 O PHE B 376 10.117 -1.066 -0.075 1.00 0.00 O ATOM 2057 CB PHE B 376 9.400 -4.207 -0.040 1.00 0.00 C ATOM 2058 CG PHE B 376 8.238 -3.696 0.763 1.00 0.00 C ATOM 2059 CD1 PHE B 376 6.962 -3.695 0.229 1.00 0.00 C ATOM 2060 CD2 PHE B 376 8.420 -3.236 2.054 1.00 0.00 C ATOM 2061 CE1 PHE B 376 5.887 -3.241 0.966 1.00 0.00 C ATOM 2062 CE2 PHE B 376 7.351 -2.778 2.797 1.00 0.00 C ATOM 2063 CZ PHE B 376 6.082 -2.781 2.254 1.00 0.00 C ATOM 0 H PHE B 376 10.943 -4.918 -1.797 1.00 0.00 H new ATOM 0 HA PHE B 376 9.060 -2.806 -1.638 1.00 0.00 H new ATOM 0 HB2 PHE B 376 9.109 -5.138 -0.526 1.00 0.00 H new ATOM 0 HB3 PHE B 376 10.219 -4.444 0.639 1.00 0.00 H new ATOM 0 HD1 PHE B 376 6.805 -4.054 -0.777 1.00 0.00 H new ATOM 0 HD2 PHE B 376 9.410 -3.235 2.486 1.00 0.00 H new ATOM 0 HE1 PHE B 376 4.896 -3.245 0.537 1.00 0.00 H new ATOM 0 HE2 PHE B 376 7.507 -2.417 3.803 1.00 0.00 H new ATOM 0 HZ PHE B 376 5.244 -2.425 2.834 1.00 0.00 H new ATOM 2073 N GLY B 377 11.996 -2.278 -0.341 1.00 0.00 N ATOM 2074 CA GLY B 377 12.853 -1.305 0.309 1.00 0.00 C ATOM 2075 C GLY B 377 12.854 0.061 -0.359 1.00 0.00 C ATOM 2076 O GLY B 377 13.090 1.072 0.304 1.00 0.00 O ATOM 0 H GLY B 377 12.485 -3.099 -0.697 1.00 0.00 H new ATOM 0 HA2 GLY B 377 12.535 -1.191 1.345 1.00 0.00 H new ATOM 0 HA3 GLY B 377 13.873 -1.690 0.328 1.00 0.00 H new ATOM 2080 N GLN B 378 12.592 0.107 -1.661 1.00 0.00 N ATOM 2081 CA GLN B 378 12.614 1.376 -2.388 1.00 0.00 C ATOM 2082 C GLN B 378 11.258 2.074 -2.333 1.00 0.00 C ATOM 2083 O GLN B 378 11.127 3.219 -2.763 1.00 0.00 O ATOM 2084 CB GLN B 378 13.036 1.174 -3.845 1.00 0.00 C ATOM 2085 CG GLN B 378 12.081 0.310 -4.652 1.00 0.00 C ATOM 2086 CD GLN B 378 12.441 0.262 -6.120 1.00 0.00 C ATOM 2087 OE1 GLN B 378 13.233 -0.576 -6.552 1.00 0.00 O ATOM 2088 NE2 GLN B 378 11.859 1.155 -6.902 1.00 0.00 N ATOM 0 H GLN B 378 12.364 -0.708 -2.231 1.00 0.00 H new ATOM 0 HA GLN B 378 13.350 2.012 -1.897 1.00 0.00 H new ATOM 0 HB2 GLN B 378 13.122 2.148 -4.326 1.00 0.00 H new ATOM 0 HB3 GLN B 378 14.026 0.719 -3.866 1.00 0.00 H new ATOM 0 HG2 GLN B 378 12.083 -0.702 -4.248 1.00 0.00 H new ATOM 0 HG3 GLN B 378 11.067 0.695 -4.543 1.00 0.00 H new ATOM 0 HE21 GLN B 378 11.208 1.833 -6.506 1.00 0.00 H new ATOM 0 HE22 GLN B 378 12.061 1.166 -7.902 1.00 0.00 H new ATOM 2097 N PHE B 379 10.253 1.388 -1.805 1.00 0.00 N ATOM 2098 CA PHE B 379 8.929 1.984 -1.664 1.00 0.00 C ATOM 2099 C PHE B 379 8.809 2.679 -0.317 1.00 0.00 C ATOM 2100 O PHE B 379 7.846 3.393 -0.051 1.00 0.00 O ATOM 2101 CB PHE B 379 7.833 0.931 -1.843 1.00 0.00 C ATOM 2102 CG PHE B 379 7.769 0.390 -3.243 1.00 0.00 C ATOM 2103 CD1 PHE B 379 7.470 1.228 -4.309 1.00 0.00 C ATOM 2104 CD2 PHE B 379 8.024 -0.947 -3.500 1.00 0.00 C ATOM 2105 CE1 PHE B 379 7.425 0.740 -5.601 1.00 0.00 C ATOM 2106 CE2 PHE B 379 7.982 -1.440 -4.790 1.00 0.00 C ATOM 2107 CZ PHE B 379 7.682 -0.596 -5.842 1.00 0.00 C ATOM 0 H PHE B 379 10.326 0.427 -1.470 1.00 0.00 H new ATOM 0 HA PHE B 379 8.798 2.730 -2.448 1.00 0.00 H new ATOM 0 HB2 PHE B 379 8.008 0.109 -1.148 1.00 0.00 H new ATOM 0 HB3 PHE B 379 6.869 1.368 -1.583 1.00 0.00 H new ATOM 0 HD1 PHE B 379 7.270 2.274 -4.126 1.00 0.00 H new ATOM 0 HD2 PHE B 379 8.258 -1.612 -2.682 1.00 0.00 H new ATOM 0 HE1 PHE B 379 7.189 1.402 -6.421 1.00 0.00 H new ATOM 0 HE2 PHE B 379 8.184 -2.485 -4.976 1.00 0.00 H new ATOM 0 HZ PHE B 379 7.648 -0.980 -6.851 1.00 0.00 H new ATOM 2117 N LEU B 380 9.806 2.461 0.527 1.00 0.00 N ATOM 2118 CA LEU B 380 9.941 3.202 1.773 1.00 0.00 C ATOM 2119 C LEU B 380 11.420 3.439 2.087 1.00 0.00 C ATOM 2120 O LEU B 380 11.938 2.979 3.105 1.00 0.00 O ATOM 2121 CB LEU B 380 9.225 2.482 2.932 1.00 0.00 C ATOM 2122 CG LEU B 380 9.174 0.945 2.863 1.00 0.00 C ATOM 2123 CD1 LEU B 380 10.560 0.329 2.979 1.00 0.00 C ATOM 2124 CD2 LEU B 380 8.262 0.405 3.954 1.00 0.00 C ATOM 0 H LEU B 380 10.540 1.770 0.370 1.00 0.00 H new ATOM 0 HA LEU B 380 9.458 4.172 1.653 1.00 0.00 H new ATOM 0 HB2 LEU B 380 9.715 2.765 3.863 1.00 0.00 H new ATOM 0 HB3 LEU B 380 8.202 2.855 2.984 1.00 0.00 H new ATOM 0 HG LEU B 380 8.773 0.668 1.888 1.00 0.00 H new ATOM 0 HD11 LEU B 380 10.481 -0.757 2.926 1.00 0.00 H new ATOM 0 HD12 LEU B 380 11.187 0.688 2.163 1.00 0.00 H new ATOM 0 HD13 LEU B 380 11.006 0.614 3.932 1.00 0.00 H new ATOM 0 HD21 LEU B 380 8.232 -0.683 3.898 1.00 0.00 H new ATOM 0 HD22 LEU B 380 8.643 0.707 4.929 1.00 0.00 H new ATOM 0 HD23 LEU B 380 7.257 0.803 3.818 1.00 0.00 H new