USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 705 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 373 MET CE :methyl 156:sc= -0.233 (180deg=-1.32) USER MOD Set 1.2: B 335 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: B 305 ASN :FLIP amide:sc= -0.679 F(o=-2.6!,f=-1) USER MOD Set 2.2: B 306 HIS :FLIP no HD1:sc= -0.338 F(o=-1.6,f=-1) USER MOD Single : A 368 TYR OH : rot 180:sc= 0 USER MOD Single : A 371 SER OG : rot -42:sc= 0.445 USER MOD Single : A 372 SER OG : rot 180:sc= 0 USER MOD Single : A 376 GLN : amide:sc= -0.0447 K(o=-0.045,f=-0.67) USER MOD Single : B 309 ASN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : B 310 TYR OH : rot 170:sc= 0.712 USER MOD Single : B 312 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : B 313 LYS NZ :NH3+ 138:sc= -0.0778 (180deg=-1.81!) USER MOD Single : B 315 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 316 ASN : amide:sc= -0.222 X(o=-0.22,f=-0.0048) USER MOD Single : B 319 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 321 GLN : amide:sc= -3.34! C(o=-3.3!,f=-3.6!) USER MOD Single : B 325 TYR OH : rot 180:sc= 0 USER MOD Single : B 326 LYS NZ :NH3+ -148:sc= -0.0236 (180deg=-0.746) USER MOD Single : B 333 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 334 THR OG1 : rot 75:sc= 0.102 USER MOD Single : B 336 GLN : amide:sc= -3.21! C(o=-3.2!,f=-6!) USER MOD Single : B 337 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 339 GLN :FLIP amide:sc= -0.0721 F(o=-1.1,f=-0.072) USER MOD Single : B 341 ASN : amide:sc=-0.00147 K(o=-0.0015,f=-0.64) USER MOD Single : B 343 LYS NZ :NH3+ -168:sc= -0.0193 (180deg=-0.21) USER MOD Single : B 354 THR OG1 : rot 180:sc= 0 USER MOD Single : B 356 GLN : amide:sc= -0.0559 X(o=-0.056,f=-0.087) USER MOD Single : B 359 TYR OH : rot 180:sc= 0 USER MOD Single : B 361 GLN : amide:sc= -0.0171 X(o=-0.017,f=-0.017) USER MOD Single : B 367 LYS NZ :NH3+ -166:sc= -0.066 (180deg=-0.311) USER MOD Single : B 368 ASN : amide:sc= -0.0372 X(o=-0.037,f=0) USER MOD Single : B 369 GLN :FLIP amide:sc= -0.161 F(o=-2.2!,f=-0.16) USER MOD Single : B 374 SER OG : rot 180:sc= 0 USER MOD Single : B 378 GLN : amide:sc= -0.0246 K(o=-0.025,f=-0.71) USER MOD ----------------------------------------------------------------- ATOM 114 N ALA A 366 -0.480 -0.989 6.629 1.00 0.00 N ATOM 115 CA ALA A 366 0.104 -1.236 5.314 1.00 0.00 C ATOM 116 C ALA A 366 -0.510 -2.468 4.656 1.00 0.00 C ATOM 117 O ALA A 366 -0.853 -2.448 3.473 1.00 0.00 O ATOM 118 CB ALA A 366 1.613 -1.395 5.429 1.00 0.00 C ATOM 0 HA ALA A 366 -0.115 -0.375 4.682 1.00 0.00 H new ATOM 0 HB1 ALA A 366 2.036 -1.579 4.441 1.00 0.00 H new ATOM 0 HB2 ALA A 366 2.044 -0.484 5.845 1.00 0.00 H new ATOM 0 HB3 ALA A 366 1.841 -2.236 6.084 1.00 0.00 H new ATOM 124 N VAL A 367 -0.646 -3.540 5.428 1.00 0.00 N ATOM 125 CA VAL A 367 -1.217 -4.778 4.916 1.00 0.00 C ATOM 126 C VAL A 367 -2.701 -4.618 4.605 1.00 0.00 C ATOM 127 O VAL A 367 -3.230 -5.282 3.715 1.00 0.00 O ATOM 128 CB VAL A 367 -1.032 -5.934 5.917 1.00 0.00 C ATOM 129 CG1 VAL A 367 0.443 -6.246 6.101 1.00 0.00 C ATOM 130 CG2 VAL A 367 -1.683 -5.599 7.249 1.00 0.00 C ATOM 0 H VAL A 367 -0.369 -3.576 6.409 1.00 0.00 H new ATOM 0 HA VAL A 367 -0.684 -5.014 3.995 1.00 0.00 H new ATOM 0 HB VAL A 367 -1.522 -6.821 5.514 1.00 0.00 H new ATOM 0 HG11 VAL A 367 0.556 -7.065 6.811 1.00 0.00 H new ATOM 0 HG12 VAL A 367 0.876 -6.534 5.143 1.00 0.00 H new ATOM 0 HG13 VAL A 367 0.957 -5.363 6.481 1.00 0.00 H new ATOM 0 HG21 VAL A 367 -1.541 -6.428 7.942 1.00 0.00 H new ATOM 0 HG22 VAL A 367 -1.226 -4.699 7.661 1.00 0.00 H new ATOM 0 HG23 VAL A 367 -2.749 -5.429 7.100 1.00 0.00 H new ATOM 140 N TYR A 368 -3.369 -3.732 5.340 1.00 0.00 N ATOM 141 CA TYR A 368 -4.795 -3.493 5.141 1.00 0.00 C ATOM 142 C TYR A 368 -5.053 -2.733 3.841 1.00 0.00 C ATOM 143 O TYR A 368 -5.922 -3.112 3.053 1.00 0.00 O ATOM 144 CB TYR A 368 -5.376 -2.714 6.325 1.00 0.00 C ATOM 145 CG TYR A 368 -6.872 -2.495 6.230 1.00 0.00 C ATOM 146 CD1 TYR A 368 -7.763 -3.454 6.696 1.00 0.00 C ATOM 147 CD2 TYR A 368 -7.391 -1.333 5.673 1.00 0.00 C ATOM 148 CE1 TYR A 368 -9.128 -3.260 6.609 1.00 0.00 C ATOM 149 CE2 TYR A 368 -8.756 -1.132 5.583 1.00 0.00 C ATOM 150 CZ TYR A 368 -9.619 -2.099 6.052 1.00 0.00 C ATOM 151 OH TYR A 368 -10.978 -1.903 5.965 1.00 0.00 O ATOM 0 H TYR A 368 -2.946 -3.169 6.078 1.00 0.00 H new ATOM 0 HA TYR A 368 -5.289 -4.462 5.074 1.00 0.00 H new ATOM 0 HB2 TYR A 368 -5.153 -3.251 7.247 1.00 0.00 H new ATOM 0 HB3 TYR A 368 -4.879 -1.746 6.392 1.00 0.00 H new ATOM 0 HD1 TYR A 368 -7.382 -4.365 7.133 1.00 0.00 H new ATOM 0 HD2 TYR A 368 -6.717 -0.574 5.304 1.00 0.00 H new ATOM 0 HE1 TYR A 368 -9.807 -4.015 6.976 1.00 0.00 H new ATOM 0 HE2 TYR A 368 -9.144 -0.223 5.148 1.00 0.00 H new ATOM 0 HH TYR A 368 -11.157 -1.034 5.548 1.00 0.00 H new ATOM 161 N VAL A 369 -4.298 -1.661 3.621 1.00 0.00 N ATOM 162 CA VAL A 369 -4.457 -0.856 2.416 1.00 0.00 C ATOM 163 C VAL A 369 -4.099 -1.654 1.166 1.00 0.00 C ATOM 164 O VAL A 369 -4.855 -1.669 0.196 1.00 0.00 O ATOM 165 CB VAL A 369 -3.606 0.430 2.468 1.00 0.00 C ATOM 166 CG1 VAL A 369 -4.185 1.412 3.473 1.00 0.00 C ATOM 167 CG2 VAL A 369 -2.159 0.109 2.807 1.00 0.00 C ATOM 0 H VAL A 369 -3.573 -1.331 4.259 1.00 0.00 H new ATOM 0 HA VAL A 369 -5.508 -0.572 2.368 1.00 0.00 H new ATOM 0 HB VAL A 369 -3.628 0.892 1.481 1.00 0.00 H new ATOM 0 HG11 VAL A 369 -3.572 2.313 3.496 1.00 0.00 H new ATOM 0 HG12 VAL A 369 -5.203 1.673 3.182 1.00 0.00 H new ATOM 0 HG13 VAL A 369 -4.196 0.955 4.463 1.00 0.00 H new ATOM 0 HG21 VAL A 369 -1.579 1.032 2.838 1.00 0.00 H new ATOM 0 HG22 VAL A 369 -2.113 -0.381 3.780 1.00 0.00 H new ATOM 0 HG23 VAL A 369 -1.746 -0.554 2.047 1.00 0.00 H new ATOM 177 N LEU A 370 -2.950 -2.325 1.195 1.00 0.00 N ATOM 178 CA LEU A 370 -2.505 -3.123 0.056 1.00 0.00 C ATOM 179 C LEU A 370 -3.470 -4.270 -0.230 1.00 0.00 C ATOM 180 O LEU A 370 -3.798 -4.541 -1.387 1.00 0.00 O ATOM 181 CB LEU A 370 -1.094 -3.659 0.299 1.00 0.00 C ATOM 182 CG LEU A 370 0.031 -2.796 -0.276 1.00 0.00 C ATOM 183 CD1 LEU A 370 0.026 -1.415 0.357 1.00 0.00 C ATOM 184 CD2 LEU A 370 1.378 -3.469 -0.071 1.00 0.00 C ATOM 0 H LEU A 370 -2.313 -2.332 1.991 1.00 0.00 H new ATOM 0 HA LEU A 370 -2.488 -2.475 -0.820 1.00 0.00 H new ATOM 0 HB2 LEU A 370 -0.940 -3.762 1.373 1.00 0.00 H new ATOM 0 HB3 LEU A 370 -1.022 -4.658 -0.131 1.00 0.00 H new ATOM 0 HG LEU A 370 -0.140 -2.683 -1.347 1.00 0.00 H new ATOM 0 HD11 LEU A 370 0.834 -0.818 -0.066 1.00 0.00 H new ATOM 0 HD12 LEU A 370 -0.928 -0.927 0.158 1.00 0.00 H new ATOM 0 HD13 LEU A 370 0.169 -1.508 1.434 1.00 0.00 H new ATOM 0 HD21 LEU A 370 2.166 -2.840 -0.486 1.00 0.00 H new ATOM 0 HD22 LEU A 370 1.554 -3.614 0.995 1.00 0.00 H new ATOM 0 HD23 LEU A 370 1.382 -4.436 -0.574 1.00 0.00 H new ATOM 196 N SER A 371 -3.925 -4.940 0.826 1.00 0.00 N ATOM 197 CA SER A 371 -4.853 -6.055 0.675 1.00 0.00 C ATOM 198 C SER A 371 -6.117 -5.617 -0.059 1.00 0.00 C ATOM 199 O SER A 371 -6.431 -6.134 -1.130 1.00 0.00 O ATOM 200 CB SER A 371 -5.219 -6.637 2.042 1.00 0.00 C ATOM 201 OG SER A 371 -5.875 -5.677 2.852 1.00 0.00 O ATOM 0 H SER A 371 -3.667 -4.731 1.790 1.00 0.00 H new ATOM 0 HA SER A 371 -4.358 -6.825 0.083 1.00 0.00 H new ATOM 0 HB2 SER A 371 -5.864 -7.505 1.909 1.00 0.00 H new ATOM 0 HB3 SER A 371 -4.317 -6.985 2.545 1.00 0.00 H new ATOM 0 HG SER A 371 -5.430 -4.809 2.756 1.00 0.00 H new ATOM 207 N SER A 372 -6.831 -4.655 0.519 1.00 0.00 N ATOM 208 CA SER A 372 -8.063 -4.154 -0.084 1.00 0.00 C ATOM 209 C SER A 372 -7.789 -3.504 -1.437 1.00 0.00 C ATOM 210 O SER A 372 -8.678 -3.424 -2.285 1.00 0.00 O ATOM 211 CB SER A 372 -8.740 -3.148 0.848 1.00 0.00 C ATOM 212 OG SER A 372 -9.949 -2.666 0.286 1.00 0.00 O ATOM 0 H SER A 372 -6.579 -4.208 1.401 1.00 0.00 H new ATOM 0 HA SER A 372 -8.729 -5.003 -0.239 1.00 0.00 H new ATOM 0 HB2 SER A 372 -8.944 -3.619 1.810 1.00 0.00 H new ATOM 0 HB3 SER A 372 -8.066 -2.313 1.039 1.00 0.00 H new ATOM 0 HG SER A 372 -10.363 -2.026 0.901 1.00 0.00 H new ATOM 218 N MET A 373 -6.559 -3.041 -1.637 1.00 0.00 N ATOM 219 CA MET A 373 -6.177 -2.398 -2.890 1.00 0.00 C ATOM 220 C MET A 373 -6.234 -3.383 -4.056 1.00 0.00 C ATOM 221 O MET A 373 -6.818 -3.091 -5.100 1.00 0.00 O ATOM 222 CB MET A 373 -4.768 -1.808 -2.782 1.00 0.00 C ATOM 223 CG MET A 373 -4.351 -0.996 -3.998 1.00 0.00 C ATOM 224 SD MET A 373 -5.262 0.553 -4.145 1.00 0.00 S ATOM 225 CE MET A 373 -4.750 1.391 -2.647 1.00 0.00 C ATOM 0 H MET A 373 -5.810 -3.099 -0.948 1.00 0.00 H new ATOM 0 HA MET A 373 -6.889 -1.595 -3.080 1.00 0.00 H new ATOM 0 HB2 MET A 373 -4.716 -1.174 -1.897 1.00 0.00 H new ATOM 0 HB3 MET A 373 -4.054 -2.619 -2.635 1.00 0.00 H new ATOM 0 HG2 MET A 373 -3.284 -0.781 -3.938 1.00 0.00 H new ATOM 0 HG3 MET A 373 -4.506 -1.591 -4.898 1.00 0.00 H new ATOM 0 HE1 MET A 373 -4.859 2.468 -2.777 1.00 0.00 H new ATOM 0 HE2 MET A 373 -5.372 1.061 -1.815 1.00 0.00 H new ATOM 0 HE3 MET A 373 -3.707 1.155 -2.436 1.00 0.00 H new ATOM 235 N ALA A 374 -5.625 -4.550 -3.870 1.00 0.00 N ATOM 236 CA ALA A 374 -5.597 -5.571 -4.913 1.00 0.00 C ATOM 237 C ALA A 374 -6.848 -6.445 -4.885 1.00 0.00 C ATOM 238 O ALA A 374 -7.151 -7.133 -5.861 1.00 0.00 O ATOM 239 CB ALA A 374 -4.351 -6.432 -4.771 1.00 0.00 C ATOM 0 H ALA A 374 -5.145 -4.812 -3.009 1.00 0.00 H new ATOM 0 HA ALA A 374 -5.574 -5.059 -5.875 1.00 0.00 H new ATOM 0 HB1 ALA A 374 -4.341 -7.190 -5.554 1.00 0.00 H new ATOM 0 HB2 ALA A 374 -3.464 -5.805 -4.861 1.00 0.00 H new ATOM 0 HB3 ALA A 374 -4.354 -6.918 -3.796 1.00 0.00 H new ATOM 245 N ARG A 375 -7.572 -6.417 -3.771 1.00 0.00 N ATOM 246 CA ARG A 375 -8.784 -7.220 -3.635 1.00 0.00 C ATOM 247 C ARG A 375 -10.005 -6.463 -4.151 1.00 0.00 C ATOM 248 O ARG A 375 -11.018 -7.068 -4.501 1.00 0.00 O ATOM 249 CB ARG A 375 -8.999 -7.622 -2.173 1.00 0.00 C ATOM 250 CG ARG A 375 -9.354 -9.090 -1.988 1.00 0.00 C ATOM 251 CD ARG A 375 -10.689 -9.434 -2.630 1.00 0.00 C ATOM 252 NE ARG A 375 -11.793 -8.686 -2.035 1.00 0.00 N ATOM 253 CZ ARG A 375 -13.057 -8.790 -2.435 1.00 0.00 C ATOM 254 NH1 ARG A 375 -13.377 -9.607 -3.430 1.00 0.00 N ATOM 255 NH2 ARG A 375 -14.003 -8.076 -1.841 1.00 0.00 N ATOM 0 H ARG A 375 -7.344 -5.851 -2.954 1.00 0.00 H new ATOM 0 HA ARG A 375 -8.657 -8.120 -4.237 1.00 0.00 H new ATOM 0 HB2 ARG A 375 -8.093 -7.402 -1.608 1.00 0.00 H new ATOM 0 HB3 ARG A 375 -9.795 -7.009 -1.750 1.00 0.00 H new ATOM 0 HG2 ARG A 375 -8.571 -9.711 -2.423 1.00 0.00 H new ATOM 0 HG3 ARG A 375 -9.392 -9.323 -0.924 1.00 0.00 H new ATOM 0 HD2 ARG A 375 -10.642 -9.222 -3.698 1.00 0.00 H new ATOM 0 HD3 ARG A 375 -10.877 -10.502 -2.525 1.00 0.00 H new ATOM 0 HE ARG A 375 -11.583 -8.047 -1.268 1.00 0.00 H new ATOM 0 HH11 ARG A 375 -12.653 -10.158 -3.891 1.00 0.00 H new ATOM 0 HH12 ARG A 375 -14.347 -9.684 -3.734 1.00 0.00 H new ATOM 0 HH21 ARG A 375 -13.762 -7.446 -1.076 1.00 0.00 H new ATOM 0 HH22 ARG A 375 -14.972 -8.157 -2.149 1.00 0.00 H new ATOM 269 N GLN A 376 -9.905 -5.136 -4.194 1.00 0.00 N ATOM 270 CA GLN A 376 -11.006 -4.304 -4.667 1.00 0.00 C ATOM 271 C GLN A 376 -11.366 -4.652 -6.109 1.00 0.00 C ATOM 272 O GLN A 376 -12.293 -5.423 -6.356 1.00 0.00 O ATOM 273 CB GLN A 376 -10.641 -2.819 -4.562 1.00 0.00 C ATOM 274 CG GLN A 376 -11.772 -1.884 -4.964 1.00 0.00 C ATOM 275 CD GLN A 376 -12.977 -2.000 -4.051 1.00 0.00 C ATOM 276 OE1 GLN A 376 -12.846 -2.309 -2.867 1.00 0.00 O ATOM 277 NE2 GLN A 376 -14.160 -1.750 -4.600 1.00 0.00 N ATOM 0 H GLN A 376 -9.075 -4.616 -3.908 1.00 0.00 H new ATOM 0 HA GLN A 376 -11.873 -4.499 -4.035 1.00 0.00 H new ATOM 0 HB2 GLN A 376 -10.345 -2.598 -3.537 1.00 0.00 H new ATOM 0 HB3 GLN A 376 -9.775 -2.621 -5.194 1.00 0.00 H new ATOM 0 HG2 GLN A 376 -11.410 -0.856 -4.953 1.00 0.00 H new ATOM 0 HG3 GLN A 376 -12.074 -2.104 -5.988 1.00 0.00 H new ATOM 0 HE21 GLN A 376 -14.221 -1.497 -5.586 1.00 0.00 H new ATOM 0 HE22 GLN A 376 -15.007 -1.811 -4.035 1.00 0.00 H new ATOM 465 N VAL B 302 -4.258 -14.208 -1.476 1.00 0.00 N ATOM 466 CA VAL B 302 -3.491 -13.427 -2.439 1.00 0.00 C ATOM 467 C VAL B 302 -2.962 -12.141 -1.805 1.00 0.00 C ATOM 468 O VAL B 302 -1.795 -11.780 -1.980 1.00 0.00 O ATOM 469 CB VAL B 302 -4.339 -13.083 -3.682 1.00 0.00 C ATOM 470 CG1 VAL B 302 -5.577 -12.287 -3.294 1.00 0.00 C ATOM 471 CG2 VAL B 302 -3.507 -12.324 -4.704 1.00 0.00 C ATOM 0 HA VAL B 302 -2.646 -14.040 -2.752 1.00 0.00 H new ATOM 0 HB VAL B 302 -4.670 -14.017 -4.136 1.00 0.00 H new ATOM 0 HG11 VAL B 302 -6.157 -12.058 -4.188 1.00 0.00 H new ATOM 0 HG12 VAL B 302 -6.186 -12.874 -2.607 1.00 0.00 H new ATOM 0 HG13 VAL B 302 -5.275 -11.359 -2.809 1.00 0.00 H new ATOM 0 HG21 VAL B 302 -4.122 -12.091 -5.573 1.00 0.00 H new ATOM 0 HG22 VAL B 302 -3.140 -11.399 -4.260 1.00 0.00 H new ATOM 0 HG23 VAL B 302 -2.661 -12.938 -5.013 1.00 0.00 H new ATOM 481 N GLU B 303 -3.829 -11.461 -1.059 1.00 0.00 N ATOM 482 CA GLU B 303 -3.464 -10.215 -0.393 1.00 0.00 C ATOM 483 C GLU B 303 -2.285 -10.427 0.547 1.00 0.00 C ATOM 484 O GLU B 303 -1.447 -9.540 0.722 1.00 0.00 O ATOM 485 CB GLU B 303 -4.658 -9.674 0.393 1.00 0.00 C ATOM 486 CG GLU B 303 -5.915 -9.506 -0.443 1.00 0.00 C ATOM 487 CD GLU B 303 -7.148 -9.255 0.403 1.00 0.00 C ATOM 488 OE1 GLU B 303 -7.716 -10.235 0.929 1.00 0.00 O ATOM 489 OE2 GLU B 303 -7.549 -8.080 0.539 1.00 0.00 O ATOM 0 H GLU B 303 -4.793 -11.754 -0.901 1.00 0.00 H new ATOM 0 HA GLU B 303 -3.174 -9.493 -1.156 1.00 0.00 H new ATOM 0 HB2 GLU B 303 -4.871 -10.349 1.222 1.00 0.00 H new ATOM 0 HB3 GLU B 303 -4.390 -8.711 0.827 1.00 0.00 H new ATOM 0 HG2 GLU B 303 -5.778 -8.675 -1.135 1.00 0.00 H new ATOM 0 HG3 GLU B 303 -6.068 -10.401 -1.046 1.00 0.00 H new ATOM 496 N PHE B 304 -2.229 -11.608 1.149 1.00 0.00 N ATOM 497 CA PHE B 304 -1.161 -11.946 2.081 1.00 0.00 C ATOM 498 C PHE B 304 0.209 -11.828 1.418 1.00 0.00 C ATOM 499 O PHE B 304 0.928 -10.857 1.637 1.00 0.00 O ATOM 500 CB PHE B 304 -1.364 -13.364 2.619 1.00 0.00 C ATOM 501 CG PHE B 304 -0.380 -13.752 3.685 1.00 0.00 C ATOM 502 CD1 PHE B 304 -0.528 -13.291 4.984 1.00 0.00 C ATOM 503 CD2 PHE B 304 0.693 -14.579 3.389 1.00 0.00 C ATOM 504 CE1 PHE B 304 0.376 -13.647 5.967 1.00 0.00 C ATOM 505 CE2 PHE B 304 1.599 -14.938 4.368 1.00 0.00 C ATOM 506 CZ PHE B 304 1.440 -14.471 5.659 1.00 0.00 C ATOM 0 H PHE B 304 -2.914 -12.351 1.008 1.00 0.00 H new ATOM 0 HA PHE B 304 -1.198 -11.238 2.909 1.00 0.00 H new ATOM 0 HB2 PHE B 304 -2.374 -13.450 3.021 1.00 0.00 H new ATOM 0 HB3 PHE B 304 -1.289 -14.071 1.793 1.00 0.00 H new ATOM 0 HD1 PHE B 304 -1.359 -12.647 5.231 1.00 0.00 H new ATOM 0 HD2 PHE B 304 0.822 -14.947 2.382 1.00 0.00 H new ATOM 0 HE1 PHE B 304 0.250 -13.281 6.975 1.00 0.00 H new ATOM 0 HE2 PHE B 304 2.431 -15.583 4.125 1.00 0.00 H new ATOM 0 HZ PHE B 304 2.147 -14.750 6.426 1.00 0.00 H new ATOM 516 N ASN B 305 0.556 -12.819 0.602 1.00 0.00 N ATOM 517 CA ASN B 305 1.844 -12.835 -0.088 1.00 0.00 C ATOM 518 C ASN B 305 2.128 -11.507 -0.788 1.00 0.00 C ATOM 519 O ASN B 305 3.264 -11.034 -0.792 1.00 0.00 O ATOM 520 CB ASN B 305 1.885 -13.975 -1.108 1.00 0.00 C ATOM 521 CG ASN B 305 0.865 -13.800 -2.214 1.00 0.00 C ATOM 522 OD1 ASN B 305 -0.323 -14.358 -2.018 1.00 0.00 O flip ATOM 523 ND2 ASN B 305 1.142 -13.172 -3.235 1.00 0.00 N flip ATOM 0 H ASN B 305 -0.038 -13.624 0.401 1.00 0.00 H new ATOM 0 HA ASN B 305 2.616 -12.991 0.665 1.00 0.00 H new ATOM 0 HB2 ASN B 305 2.882 -14.033 -1.544 1.00 0.00 H new ATOM 0 HB3 ASN B 305 1.705 -14.921 -0.598 1.00 0.00 H new ATOM 0 HD21 ASN B 305 2.068 -12.759 -3.344 1.00 0.00 H new ATOM 0 HD22 ASN B 305 0.445 -13.064 -3.972 1.00 0.00 H new ATOM 530 N HIS B 306 1.098 -10.908 -1.376 1.00 0.00 N ATOM 531 CA HIS B 306 1.256 -9.641 -2.086 1.00 0.00 C ATOM 532 C HIS B 306 1.789 -8.532 -1.181 1.00 0.00 C ATOM 533 O HIS B 306 2.959 -8.153 -1.271 1.00 0.00 O ATOM 534 CB HIS B 306 -0.073 -9.207 -2.707 1.00 0.00 C ATOM 535 CG HIS B 306 -0.204 -9.585 -4.150 1.00 0.00 C ATOM 536 ND1 HIS B 306 -0.474 -10.776 -4.733 1.00 0.00 N flip ATOM 537 CD2 HIS B 306 -0.051 -8.682 -5.182 1.00 0.00 C flip ATOM 538 CE1 HIS B 306 -0.478 -10.573 -6.092 1.00 0.00 C flip ATOM 539 NE2 HIS B 306 -0.220 -9.302 -6.336 1.00 0.00 N flip ATOM 0 H HIS B 306 0.147 -11.277 -1.376 1.00 0.00 H new ATOM 0 HA HIS B 306 1.991 -9.808 -2.873 1.00 0.00 H new ATOM 0 HB2 HIS B 306 -0.892 -9.656 -2.145 1.00 0.00 H new ATOM 0 HB3 HIS B 306 -0.175 -8.126 -2.611 1.00 0.00 H new ATOM 0 HD2 HIS B 306 0.172 -7.632 -5.065 1.00 0.00 H new ATOM 0 HE1 HIS B 306 -0.662 -11.331 -6.839 1.00 0.00 H new ATOM 0 HE2 HIS B 306 -0.161 -8.872 -7.259 1.00 0.00 H new ATOM 548 N ALA B 307 0.927 -8.015 -0.310 1.00 0.00 N ATOM 549 CA ALA B 307 1.302 -6.928 0.590 1.00 0.00 C ATOM 550 C ALA B 307 2.515 -7.277 1.454 1.00 0.00 C ATOM 551 O ALA B 307 3.424 -6.464 1.610 1.00 0.00 O ATOM 552 CB ALA B 307 0.120 -6.537 1.463 1.00 0.00 C ATOM 0 H ALA B 307 -0.037 -8.332 -0.208 1.00 0.00 H new ATOM 0 HA ALA B 307 1.588 -6.079 -0.030 1.00 0.00 H new ATOM 0 HB1 ALA B 307 0.413 -5.726 2.130 1.00 0.00 H new ATOM 0 HB2 ALA B 307 -0.706 -6.208 0.832 1.00 0.00 H new ATOM 0 HB3 ALA B 307 -0.196 -7.396 2.054 1.00 0.00 H new ATOM 558 N ILE B 308 2.526 -8.482 2.014 1.00 0.00 N ATOM 559 CA ILE B 308 3.630 -8.918 2.868 1.00 0.00 C ATOM 560 C ILE B 308 4.970 -8.869 2.131 1.00 0.00 C ATOM 561 O ILE B 308 5.863 -8.104 2.505 1.00 0.00 O ATOM 562 CB ILE B 308 3.394 -10.343 3.410 1.00 0.00 C ATOM 563 CG1 ILE B 308 2.136 -10.381 4.288 1.00 0.00 C ATOM 564 CG2 ILE B 308 4.608 -10.831 4.193 1.00 0.00 C ATOM 565 CD1 ILE B 308 2.214 -9.495 5.516 1.00 0.00 C ATOM 0 H ILE B 308 1.786 -9.174 1.894 1.00 0.00 H new ATOM 0 HA ILE B 308 3.668 -8.222 3.706 1.00 0.00 H new ATOM 0 HB ILE B 308 3.245 -11.011 2.562 1.00 0.00 H new ATOM 0 HG12 ILE B 308 1.278 -10.078 3.688 1.00 0.00 H new ATOM 0 HG13 ILE B 308 1.957 -11.409 4.605 1.00 0.00 H new ATOM 0 HG21 ILE B 308 4.420 -11.838 4.566 1.00 0.00 H new ATOM 0 HG22 ILE B 308 5.481 -10.843 3.540 1.00 0.00 H new ATOM 0 HG23 ILE B 308 4.792 -10.161 5.033 1.00 0.00 H new ATOM 0 HD11 ILE B 308 1.287 -9.578 6.084 1.00 0.00 H new ATOM 0 HD12 ILE B 308 3.051 -9.810 6.139 1.00 0.00 H new ATOM 0 HD13 ILE B 308 2.360 -8.459 5.209 1.00 0.00 H new ATOM 577 N ASN B 309 5.108 -9.688 1.089 1.00 0.00 N ATOM 578 CA ASN B 309 6.346 -9.735 0.311 1.00 0.00 C ATOM 579 C ASN B 309 6.776 -8.335 -0.116 1.00 0.00 C ATOM 580 O ASN B 309 7.968 -8.023 -0.143 1.00 0.00 O ATOM 581 CB ASN B 309 6.173 -10.626 -0.921 1.00 0.00 C ATOM 582 CG ASN B 309 7.449 -10.750 -1.730 1.00 0.00 C ATOM 583 OD1 ASN B 309 8.552 -10.677 -1.188 1.00 0.00 O ATOM 584 ND2 ASN B 309 7.304 -10.938 -3.037 1.00 0.00 N ATOM 0 H ASN B 309 4.381 -10.326 0.765 1.00 0.00 H new ATOM 0 HA ASN B 309 7.124 -10.157 0.947 1.00 0.00 H new ATOM 0 HB2 ASN B 309 5.848 -11.618 -0.606 1.00 0.00 H new ATOM 0 HB3 ASN B 309 5.384 -10.218 -1.553 1.00 0.00 H new ATOM 0 HD21 ASN B 309 8.126 -11.028 -3.634 1.00 0.00 H new ATOM 0 HD22 ASN B 309 6.370 -10.992 -3.444 1.00 0.00 H new ATOM 591 N TYR B 310 5.800 -7.496 -0.450 1.00 0.00 N ATOM 592 CA TYR B 310 6.081 -6.129 -0.869 1.00 0.00 C ATOM 593 C TYR B 310 6.842 -5.376 0.219 1.00 0.00 C ATOM 594 O TYR B 310 8.000 -5.011 0.035 1.00 0.00 O ATOM 595 CB TYR B 310 4.783 -5.393 -1.205 1.00 0.00 C ATOM 596 CG TYR B 310 4.994 -3.958 -1.633 1.00 0.00 C ATOM 597 CD1 TYR B 310 5.412 -3.651 -2.922 1.00 0.00 C ATOM 598 CD2 TYR B 310 4.778 -2.910 -0.748 1.00 0.00 C ATOM 599 CE1 TYR B 310 5.608 -2.341 -3.316 1.00 0.00 C ATOM 600 CE2 TYR B 310 4.973 -1.598 -1.134 1.00 0.00 C ATOM 601 CZ TYR B 310 5.387 -1.318 -2.418 1.00 0.00 C ATOM 602 OH TYR B 310 5.584 -0.012 -2.806 1.00 0.00 O ATOM 0 H TYR B 310 4.809 -7.739 -0.438 1.00 0.00 H new ATOM 0 HA TYR B 310 6.703 -6.171 -1.763 1.00 0.00 H new ATOM 0 HB2 TYR B 310 4.267 -5.929 -2.002 1.00 0.00 H new ATOM 0 HB3 TYR B 310 4.129 -5.411 -0.333 1.00 0.00 H new ATOM 0 HD1 TYR B 310 5.587 -4.450 -3.628 1.00 0.00 H new ATOM 0 HD2 TYR B 310 4.452 -3.124 0.259 1.00 0.00 H new ATOM 0 HE1 TYR B 310 5.933 -2.120 -4.322 1.00 0.00 H new ATOM 0 HE2 TYR B 310 4.802 -0.795 -0.432 1.00 0.00 H new ATOM 0 HH TYR B 310 5.237 0.590 -2.115 1.00 0.00 H new ATOM 612 N VAL B 311 6.186 -5.155 1.353 1.00 0.00 N ATOM 613 CA VAL B 311 6.800 -4.441 2.470 1.00 0.00 C ATOM 614 C VAL B 311 8.161 -5.038 2.825 1.00 0.00 C ATOM 615 O VAL B 311 9.054 -4.336 3.303 1.00 0.00 O ATOM 616 CB VAL B 311 5.895 -4.463 3.720 1.00 0.00 C ATOM 617 CG1 VAL B 311 6.536 -3.695 4.868 1.00 0.00 C ATOM 618 CG2 VAL B 311 4.522 -3.894 3.395 1.00 0.00 C ATOM 0 H VAL B 311 5.228 -5.460 1.524 1.00 0.00 H new ATOM 0 HA VAL B 311 6.934 -3.408 2.149 1.00 0.00 H new ATOM 0 HB VAL B 311 5.773 -5.500 4.033 1.00 0.00 H new ATOM 0 HG11 VAL B 311 5.879 -3.725 5.737 1.00 0.00 H new ATOM 0 HG12 VAL B 311 7.493 -4.151 5.121 1.00 0.00 H new ATOM 0 HG13 VAL B 311 6.695 -2.659 4.569 1.00 0.00 H new ATOM 0 HG21 VAL B 311 3.898 -3.918 4.288 1.00 0.00 H new ATOM 0 HG22 VAL B 311 4.627 -2.865 3.052 1.00 0.00 H new ATOM 0 HG23 VAL B 311 4.057 -4.492 2.611 1.00 0.00 H new ATOM 628 N ASN B 312 8.318 -6.336 2.580 1.00 0.00 N ATOM 629 CA ASN B 312 9.570 -7.025 2.878 1.00 0.00 C ATOM 630 C ASN B 312 10.719 -6.502 2.016 1.00 0.00 C ATOM 631 O ASN B 312 11.738 -6.044 2.540 1.00 0.00 O ATOM 632 CB ASN B 312 9.409 -8.531 2.664 1.00 0.00 C ATOM 633 CG ASN B 312 10.677 -9.300 2.985 1.00 0.00 C ATOM 634 OD1 ASN B 312 11.535 -9.492 2.124 1.00 0.00 O ATOM 635 ND2 ASN B 312 10.798 -9.750 4.230 1.00 0.00 N ATOM 0 H ASN B 312 7.595 -6.931 2.176 1.00 0.00 H new ATOM 0 HA ASN B 312 9.813 -6.829 3.922 1.00 0.00 H new ATOM 0 HB2 ASN B 312 8.596 -8.899 3.290 1.00 0.00 H new ATOM 0 HB3 ASN B 312 9.125 -8.720 1.629 1.00 0.00 H new ATOM 0 HD21 ASN B 312 11.627 -10.278 4.503 1.00 0.00 H new ATOM 0 HD22 ASN B 312 10.062 -9.568 4.912 1.00 0.00 H new ATOM 642 N LYS B 313 10.554 -6.566 0.697 1.00 0.00 N ATOM 643 CA LYS B 313 11.593 -6.107 -0.224 1.00 0.00 C ATOM 644 C LYS B 313 11.815 -4.600 -0.116 1.00 0.00 C ATOM 645 O LYS B 313 12.916 -4.110 -0.364 1.00 0.00 O ATOM 646 CB LYS B 313 11.245 -6.492 -1.666 1.00 0.00 C ATOM 647 CG LYS B 313 9.811 -6.184 -2.066 1.00 0.00 C ATOM 648 CD LYS B 313 9.673 -4.776 -2.626 1.00 0.00 C ATOM 649 CE LYS B 313 10.364 -4.639 -3.975 1.00 0.00 C ATOM 650 NZ LYS B 313 9.805 -5.577 -4.984 1.00 0.00 N ATOM 0 H LYS B 313 9.716 -6.929 0.243 1.00 0.00 H new ATOM 0 HA LYS B 313 12.522 -6.602 0.058 1.00 0.00 H new ATOM 0 HB2 LYS B 313 11.919 -5.967 -2.343 1.00 0.00 H new ATOM 0 HB3 LYS B 313 11.426 -7.559 -1.799 1.00 0.00 H new ATOM 0 HG2 LYS B 313 9.478 -6.906 -2.811 1.00 0.00 H new ATOM 0 HG3 LYS B 313 9.159 -6.297 -1.200 1.00 0.00 H new ATOM 0 HD2 LYS B 313 8.617 -4.527 -2.731 1.00 0.00 H new ATOM 0 HD3 LYS B 313 10.101 -4.061 -1.923 1.00 0.00 H new ATOM 0 HE2 LYS B 313 10.259 -3.615 -4.334 1.00 0.00 H new ATOM 0 HE3 LYS B 313 11.431 -4.827 -3.857 1.00 0.00 H new ATOM 0 HZ1 LYS B 313 9.703 -5.086 -5.895 1.00 0.00 H new ATOM 0 HZ2 LYS B 313 10.447 -6.388 -5.097 1.00 0.00 H new ATOM 0 HZ3 LYS B 313 8.874 -5.914 -4.666 1.00 0.00 H new ATOM 664 N ILE B 314 10.769 -3.869 0.254 1.00 0.00 N ATOM 665 CA ILE B 314 10.861 -2.420 0.396 1.00 0.00 C ATOM 666 C ILE B 314 11.761 -2.046 1.568 1.00 0.00 C ATOM 667 O ILE B 314 12.607 -1.158 1.457 1.00 0.00 O ATOM 668 CB ILE B 314 9.472 -1.788 0.608 1.00 0.00 C ATOM 669 CG1 ILE B 314 8.545 -2.145 -0.559 1.00 0.00 C ATOM 670 CG2 ILE B 314 9.590 -0.277 0.765 1.00 0.00 C ATOM 671 CD1 ILE B 314 8.874 -1.428 -1.847 1.00 0.00 C ATOM 0 H ILE B 314 9.848 -4.256 0.461 1.00 0.00 H new ATOM 0 HA ILE B 314 11.289 -2.034 -0.529 1.00 0.00 H new ATOM 0 HB ILE B 314 9.041 -2.190 1.525 1.00 0.00 H new ATOM 0 HG12 ILE B 314 8.593 -3.220 -0.731 1.00 0.00 H new ATOM 0 HG13 ILE B 314 7.518 -1.912 -0.278 1.00 0.00 H new ATOM 0 HG21 ILE B 314 8.599 0.152 0.914 1.00 0.00 H new ATOM 0 HG22 ILE B 314 10.217 -0.049 1.627 1.00 0.00 H new ATOM 0 HG23 ILE B 314 10.038 0.148 -0.133 1.00 0.00 H new ATOM 0 HD11 ILE B 314 8.173 -1.735 -2.623 1.00 0.00 H new ATOM 0 HD12 ILE B 314 8.798 -0.352 -1.694 1.00 0.00 H new ATOM 0 HD13 ILE B 314 9.889 -1.680 -2.155 1.00 0.00 H new ATOM 683 N LYS B 315 11.571 -2.729 2.692 1.00 0.00 N ATOM 684 CA LYS B 315 12.363 -2.472 3.888 1.00 0.00 C ATOM 685 C LYS B 315 13.820 -2.877 3.674 1.00 0.00 C ATOM 686 O LYS B 315 14.737 -2.158 4.073 1.00 0.00 O ATOM 687 CB LYS B 315 11.769 -3.225 5.083 1.00 0.00 C ATOM 688 CG LYS B 315 12.301 -2.767 6.435 1.00 0.00 C ATOM 689 CD LYS B 315 13.625 -3.433 6.784 1.00 0.00 C ATOM 690 CE LYS B 315 13.469 -4.936 6.966 1.00 0.00 C ATOM 691 NZ LYS B 315 14.776 -5.600 7.226 1.00 0.00 N ATOM 0 H LYS B 315 10.874 -3.466 2.799 1.00 0.00 H new ATOM 0 HA LYS B 315 12.337 -1.402 4.095 1.00 0.00 H new ATOM 0 HB2 LYS B 315 10.686 -3.105 5.072 1.00 0.00 H new ATOM 0 HB3 LYS B 315 11.973 -4.289 4.966 1.00 0.00 H new ATOM 0 HG2 LYS B 315 12.431 -1.685 6.425 1.00 0.00 H new ATOM 0 HG3 LYS B 315 11.567 -2.993 7.209 1.00 0.00 H new ATOM 0 HD2 LYS B 315 14.351 -3.235 5.995 1.00 0.00 H new ATOM 0 HD3 LYS B 315 14.022 -2.995 7.700 1.00 0.00 H new ATOM 0 HE2 LYS B 315 12.790 -5.133 7.795 1.00 0.00 H new ATOM 0 HE3 LYS B 315 13.015 -5.365 6.073 1.00 0.00 H new ATOM 0 HZ1 LYS B 315 14.628 -6.623 7.344 1.00 0.00 H new ATOM 0 HZ2 LYS B 315 15.416 -5.433 6.423 1.00 0.00 H new ATOM 0 HZ3 LYS B 315 15.198 -5.209 8.092 1.00 0.00 H new ATOM 705 N ASN B 316 14.027 -4.028 3.039 1.00 0.00 N ATOM 706 CA ASN B 316 15.376 -4.527 2.779 1.00 0.00 C ATOM 707 C ASN B 316 16.166 -3.560 1.900 1.00 0.00 C ATOM 708 O ASN B 316 17.265 -3.138 2.261 1.00 0.00 O ATOM 709 CB ASN B 316 15.319 -5.904 2.114 1.00 0.00 C ATOM 710 CG ASN B 316 16.698 -6.486 1.872 1.00 0.00 C ATOM 711 OD1 ASN B 316 17.235 -7.210 2.710 1.00 0.00 O ATOM 712 ND2 ASN B 316 17.281 -6.169 0.721 1.00 0.00 N ATOM 0 H ASN B 316 13.280 -4.632 2.695 1.00 0.00 H new ATOM 0 HA ASN B 316 15.886 -4.613 3.738 1.00 0.00 H new ATOM 0 HB2 ASN B 316 14.745 -6.585 2.743 1.00 0.00 H new ATOM 0 HB3 ASN B 316 14.789 -5.824 1.165 1.00 0.00 H new ATOM 0 HD21 ASN B 316 18.210 -6.529 0.504 1.00 0.00 H new ATOM 0 HD22 ASN B 316 16.799 -5.565 0.055 1.00 0.00 H new ATOM 719 N ARG B 317 15.605 -3.215 0.744 1.00 0.00 N ATOM 720 CA ARG B 317 16.264 -2.299 -0.184 1.00 0.00 C ATOM 721 C ARG B 317 16.519 -0.944 0.469 1.00 0.00 C ATOM 722 O ARG B 317 17.415 -0.206 0.061 1.00 0.00 O ATOM 723 CB ARG B 317 15.421 -2.122 -1.449 1.00 0.00 C ATOM 724 CG ARG B 317 15.266 -3.395 -2.267 1.00 0.00 C ATOM 725 CD ARG B 317 16.612 -3.924 -2.741 1.00 0.00 C ATOM 726 NE ARG B 317 17.336 -2.939 -3.539 1.00 0.00 N ATOM 727 CZ ARG B 317 18.559 -3.134 -4.023 1.00 0.00 C ATOM 728 NH1 ARG B 317 19.195 -4.276 -3.790 1.00 0.00 N ATOM 729 NH2 ARG B 317 19.147 -2.188 -4.742 1.00 0.00 N ATOM 0 H ARG B 317 14.697 -3.555 0.427 1.00 0.00 H new ATOM 0 HA ARG B 317 17.226 -2.733 -0.457 1.00 0.00 H new ATOM 0 HB2 ARG B 317 14.432 -1.759 -1.168 1.00 0.00 H new ATOM 0 HB3 ARG B 317 15.877 -1.353 -2.073 1.00 0.00 H new ATOM 0 HG2 ARG B 317 14.767 -4.155 -1.667 1.00 0.00 H new ATOM 0 HG3 ARG B 317 14.628 -3.199 -3.128 1.00 0.00 H new ATOM 0 HD2 ARG B 317 17.215 -4.206 -1.878 1.00 0.00 H new ATOM 0 HD3 ARG B 317 16.459 -4.827 -3.331 1.00 0.00 H new ATOM 0 HE ARG B 317 16.877 -2.050 -3.737 1.00 0.00 H new ATOM 0 HH11 ARG B 317 18.745 -5.007 -3.238 1.00 0.00 H new ATOM 0 HH12 ARG B 317 20.133 -4.423 -4.163 1.00 0.00 H new ATOM 0 HH21 ARG B 317 18.661 -1.310 -4.924 1.00 0.00 H new ATOM 0 HH22 ARG B 317 20.085 -2.338 -5.113 1.00 0.00 H new ATOM 743 N PHE B 318 15.723 -0.623 1.484 1.00 0.00 N ATOM 744 CA PHE B 318 15.863 0.641 2.197 1.00 0.00 C ATOM 745 C PHE B 318 16.294 0.404 3.640 1.00 0.00 C ATOM 746 O PHE B 318 15.870 1.113 4.553 1.00 0.00 O ATOM 747 CB PHE B 318 14.547 1.420 2.158 1.00 0.00 C ATOM 748 CG PHE B 318 14.250 2.015 0.812 1.00 0.00 C ATOM 749 CD1 PHE B 318 13.867 1.209 -0.248 1.00 0.00 C ATOM 750 CD2 PHE B 318 14.357 3.381 0.607 1.00 0.00 C ATOM 751 CE1 PHE B 318 13.597 1.753 -1.488 1.00 0.00 C ATOM 752 CE2 PHE B 318 14.089 3.932 -0.632 1.00 0.00 C ATOM 753 CZ PHE B 318 13.709 3.116 -1.680 1.00 0.00 C ATOM 0 H PHE B 318 14.974 -1.222 1.831 1.00 0.00 H new ATOM 0 HA PHE B 318 16.635 1.229 1.702 1.00 0.00 H new ATOM 0 HB2 PHE B 318 13.731 0.756 2.442 1.00 0.00 H new ATOM 0 HB3 PHE B 318 14.582 2.217 2.900 1.00 0.00 H new ATOM 0 HD1 PHE B 318 13.779 0.142 -0.103 1.00 0.00 H new ATOM 0 HD2 PHE B 318 14.653 4.022 1.424 1.00 0.00 H new ATOM 0 HE1 PHE B 318 13.299 1.114 -2.306 1.00 0.00 H new ATOM 0 HE2 PHE B 318 14.176 4.998 -0.780 1.00 0.00 H new ATOM 0 HZ PHE B 318 13.500 3.544 -2.649 1.00 0.00 H new ATOM 763 N GLN B 319 17.149 -0.595 3.834 1.00 0.00 N ATOM 764 CA GLN B 319 17.646 -0.935 5.162 1.00 0.00 C ATOM 765 C GLN B 319 18.489 0.201 5.735 1.00 0.00 C ATOM 766 O GLN B 319 18.723 0.266 6.941 1.00 0.00 O ATOM 767 CB GLN B 319 18.472 -2.221 5.102 1.00 0.00 C ATOM 768 CG GLN B 319 18.759 -2.828 6.465 1.00 0.00 C ATOM 769 CD GLN B 319 19.663 -4.042 6.382 1.00 0.00 C ATOM 770 OE1 GLN B 319 20.885 -3.928 6.477 1.00 0.00 O ATOM 771 NE2 GLN B 319 19.065 -5.212 6.200 1.00 0.00 N ATOM 0 H GLN B 319 17.513 -1.185 3.086 1.00 0.00 H new ATOM 0 HA GLN B 319 16.789 -1.091 5.817 1.00 0.00 H new ATOM 0 HB2 GLN B 319 17.943 -2.954 4.492 1.00 0.00 H new ATOM 0 HB3 GLN B 319 19.417 -2.012 4.601 1.00 0.00 H new ATOM 0 HG2 GLN B 319 19.223 -2.076 7.103 1.00 0.00 H new ATOM 0 HG3 GLN B 319 17.819 -3.111 6.938 1.00 0.00 H new ATOM 0 HE21 GLN B 319 18.049 -5.259 6.127 1.00 0.00 H new ATOM 0 HE22 GLN B 319 19.621 -6.064 6.133 1.00 0.00 H new ATOM 780 N GLY B 320 18.943 1.094 4.859 1.00 0.00 N ATOM 781 CA GLY B 320 19.756 2.216 5.293 1.00 0.00 C ATOM 782 C GLY B 320 19.077 3.553 5.059 1.00 0.00 C ATOM 783 O GLY B 320 19.746 4.573 4.891 1.00 0.00 O ATOM 0 H GLY B 320 18.762 1.060 3.856 1.00 0.00 H new ATOM 0 HA2 GLY B 320 19.981 2.108 6.354 1.00 0.00 H new ATOM 0 HA3 GLY B 320 20.707 2.198 4.761 1.00 0.00 H new ATOM 787 N GLN B 321 17.748 3.548 5.048 1.00 0.00 N ATOM 788 CA GLN B 321 16.980 4.770 4.834 1.00 0.00 C ATOM 789 C GLN B 321 15.649 4.711 5.585 1.00 0.00 C ATOM 790 O GLN B 321 14.644 4.253 5.041 1.00 0.00 O ATOM 791 CB GLN B 321 16.731 4.985 3.339 1.00 0.00 C ATOM 792 CG GLN B 321 16.132 6.344 3.008 1.00 0.00 C ATOM 793 CD GLN B 321 17.177 7.439 2.873 1.00 0.00 C ATOM 794 OE1 GLN B 321 16.992 8.395 2.121 1.00 0.00 O ATOM 795 NE2 GLN B 321 18.282 7.308 3.600 1.00 0.00 N ATOM 0 H GLN B 321 17.180 2.712 5.185 1.00 0.00 H new ATOM 0 HA GLN B 321 17.558 5.609 5.221 1.00 0.00 H new ATOM 0 HB2 GLN B 321 17.673 4.873 2.803 1.00 0.00 H new ATOM 0 HB3 GLN B 321 16.062 4.205 2.975 1.00 0.00 H new ATOM 0 HG2 GLN B 321 15.570 6.270 2.077 1.00 0.00 H new ATOM 0 HG3 GLN B 321 15.422 6.621 3.788 1.00 0.00 H new ATOM 0 HE21 GLN B 321 18.397 6.500 4.212 1.00 0.00 H new ATOM 0 HE22 GLN B 321 19.015 8.015 3.546 1.00 0.00 H new ATOM 804 N PRO B 322 15.628 5.167 6.852 1.00 0.00 N ATOM 805 CA PRO B 322 14.416 5.158 7.674 1.00 0.00 C ATOM 806 C PRO B 322 13.494 6.338 7.382 1.00 0.00 C ATOM 807 O PRO B 322 12.297 6.283 7.663 1.00 0.00 O ATOM 808 CB PRO B 322 14.973 5.256 9.092 1.00 0.00 C ATOM 809 CG PRO B 322 16.215 6.064 8.943 1.00 0.00 C ATOM 810 CD PRO B 322 16.783 5.721 7.589 1.00 0.00 C ATOM 0 HA PRO B 322 13.802 4.277 7.490 1.00 0.00 H new ATOM 0 HB2 PRO B 322 14.264 5.737 9.766 1.00 0.00 H new ATOM 0 HB3 PRO B 322 15.187 4.270 9.505 1.00 0.00 H new ATOM 0 HG2 PRO B 322 15.997 7.130 9.014 1.00 0.00 H new ATOM 0 HG3 PRO B 322 16.928 5.831 9.734 1.00 0.00 H new ATOM 0 HD2 PRO B 322 17.190 6.601 7.091 1.00 0.00 H new ATOM 0 HD3 PRO B 322 17.593 4.996 7.667 1.00 0.00 H new ATOM 818 N ASP B 323 14.055 7.404 6.820 1.00 0.00 N ATOM 819 CA ASP B 323 13.276 8.597 6.500 1.00 0.00 C ATOM 820 C ASP B 323 12.286 8.324 5.369 1.00 0.00 C ATOM 821 O ASP B 323 11.089 8.568 5.512 1.00 0.00 O ATOM 822 CB ASP B 323 14.203 9.754 6.122 1.00 0.00 C ATOM 823 CG ASP B 323 15.174 9.384 5.018 1.00 0.00 C ATOM 824 OD1 ASP B 323 16.147 8.657 5.305 1.00 0.00 O ATOM 825 OD2 ASP B 323 14.961 9.821 3.868 1.00 0.00 O ATOM 0 H ASP B 323 15.044 7.467 6.577 1.00 0.00 H new ATOM 0 HA ASP B 323 12.708 8.874 7.388 1.00 0.00 H new ATOM 0 HB2 ASP B 323 13.603 10.606 5.803 1.00 0.00 H new ATOM 0 HB3 ASP B 323 14.762 10.070 7.003 1.00 0.00 H new ATOM 830 N ILE B 324 12.790 7.816 4.248 1.00 0.00 N ATOM 831 CA ILE B 324 11.941 7.513 3.100 1.00 0.00 C ATOM 832 C ILE B 324 10.950 6.402 3.431 1.00 0.00 C ATOM 833 O ILE B 324 9.768 6.492 3.098 1.00 0.00 O ATOM 834 CB ILE B 324 12.774 7.103 1.869 1.00 0.00 C ATOM 835 CG1 ILE B 324 13.689 8.255 1.443 1.00 0.00 C ATOM 836 CG2 ILE B 324 11.858 6.687 0.723 1.00 0.00 C ATOM 837 CD1 ILE B 324 14.514 7.961 0.209 1.00 0.00 C ATOM 0 H ILE B 324 13.779 7.606 4.110 1.00 0.00 H new ATOM 0 HA ILE B 324 11.394 8.425 2.862 1.00 0.00 H new ATOM 0 HB ILE B 324 13.397 6.249 2.134 1.00 0.00 H new ATOM 0 HG12 ILE B 324 13.080 9.140 1.258 1.00 0.00 H new ATOM 0 HG13 ILE B 324 14.360 8.496 2.267 1.00 0.00 H new ATOM 0 HG21 ILE B 324 12.461 6.400 -0.139 1.00 0.00 H new ATOM 0 HG22 ILE B 324 11.246 5.841 1.035 1.00 0.00 H new ATOM 0 HG23 ILE B 324 11.212 7.522 0.452 1.00 0.00 H new ATOM 0 HD11 ILE B 324 15.135 8.825 -0.028 1.00 0.00 H new ATOM 0 HD12 ILE B 324 15.151 7.096 0.395 1.00 0.00 H new ATOM 0 HD13 ILE B 324 13.851 7.750 -0.630 1.00 0.00 H new ATOM 849 N TYR B 325 11.440 5.356 4.089 1.00 0.00 N ATOM 850 CA TYR B 325 10.595 4.230 4.466 1.00 0.00 C ATOM 851 C TYR B 325 9.446 4.695 5.351 1.00 0.00 C ATOM 852 O TYR B 325 8.299 4.277 5.173 1.00 0.00 O ATOM 853 CB TYR B 325 11.423 3.168 5.192 1.00 0.00 C ATOM 854 CG TYR B 325 10.671 1.882 5.449 1.00 0.00 C ATOM 855 CD1 TYR B 325 10.146 1.139 4.396 1.00 0.00 C ATOM 856 CD2 TYR B 325 10.488 1.408 6.741 1.00 0.00 C ATOM 857 CE1 TYR B 325 9.459 -0.036 4.626 1.00 0.00 C ATOM 858 CE2 TYR B 325 9.802 0.231 6.979 1.00 0.00 C ATOM 859 CZ TYR B 325 9.290 -0.487 5.920 1.00 0.00 C ATOM 860 OH TYR B 325 8.607 -1.659 6.153 1.00 0.00 O ATOM 0 H TYR B 325 12.416 5.265 4.371 1.00 0.00 H new ATOM 0 HA TYR B 325 10.178 3.793 3.559 1.00 0.00 H new ATOM 0 HB2 TYR B 325 12.312 2.947 4.601 1.00 0.00 H new ATOM 0 HB3 TYR B 325 11.765 3.575 6.144 1.00 0.00 H new ATOM 0 HD1 TYR B 325 10.278 1.487 3.382 1.00 0.00 H new ATOM 0 HD2 TYR B 325 10.888 1.968 7.574 1.00 0.00 H new ATOM 0 HE1 TYR B 325 9.056 -0.600 3.798 1.00 0.00 H new ATOM 0 HE2 TYR B 325 9.668 -0.124 7.990 1.00 0.00 H new ATOM 0 HH TYR B 325 8.578 -1.835 7.117 1.00 0.00 H new ATOM 870 N LYS B 326 9.760 5.565 6.306 1.00 0.00 N ATOM 871 CA LYS B 326 8.753 6.096 7.214 1.00 0.00 C ATOM 872 C LYS B 326 7.711 6.895 6.444 1.00 0.00 C ATOM 873 O LYS B 326 6.512 6.763 6.684 1.00 0.00 O ATOM 874 CB LYS B 326 9.409 6.976 8.282 1.00 0.00 C ATOM 875 CG LYS B 326 8.425 7.551 9.288 1.00 0.00 C ATOM 876 CD LYS B 326 9.138 8.333 10.379 1.00 0.00 C ATOM 877 CE LYS B 326 8.159 8.870 11.411 1.00 0.00 C ATOM 878 NZ LYS B 326 7.139 9.765 10.800 1.00 0.00 N ATOM 0 H LYS B 326 10.704 5.916 6.470 1.00 0.00 H new ATOM 0 HA LYS B 326 8.257 5.259 7.706 1.00 0.00 H new ATOM 0 HB2 LYS B 326 10.158 6.389 8.814 1.00 0.00 H new ATOM 0 HB3 LYS B 326 9.935 7.795 7.792 1.00 0.00 H new ATOM 0 HG2 LYS B 326 7.717 8.202 8.775 1.00 0.00 H new ATOM 0 HG3 LYS B 326 7.847 6.743 9.736 1.00 0.00 H new ATOM 0 HD2 LYS B 326 9.869 7.691 10.870 1.00 0.00 H new ATOM 0 HD3 LYS B 326 9.689 9.161 9.933 1.00 0.00 H new ATOM 0 HE2 LYS B 326 7.660 8.036 11.905 1.00 0.00 H new ATOM 0 HE3 LYS B 326 8.706 9.416 12.180 1.00 0.00 H new ATOM 0 HZ1 LYS B 326 6.864 10.497 11.486 1.00 0.00 H new ATOM 0 HZ2 LYS B 326 7.537 10.217 9.952 1.00 0.00 H new ATOM 0 HZ3 LYS B 326 6.302 9.207 10.535 1.00 0.00 H new ATOM 892 N ALA B 327 8.179 7.721 5.512 1.00 0.00 N ATOM 893 CA ALA B 327 7.288 8.536 4.697 1.00 0.00 C ATOM 894 C ALA B 327 6.265 7.665 3.978 1.00 0.00 C ATOM 895 O ALA B 327 5.076 7.986 3.937 1.00 0.00 O ATOM 896 CB ALA B 327 8.089 9.353 3.694 1.00 0.00 C ATOM 0 H ALA B 327 9.170 7.842 5.304 1.00 0.00 H new ATOM 0 HA ALA B 327 6.751 9.220 5.355 1.00 0.00 H new ATOM 0 HB1 ALA B 327 7.410 9.957 3.092 1.00 0.00 H new ATOM 0 HB2 ALA B 327 8.781 10.006 4.226 1.00 0.00 H new ATOM 0 HB3 ALA B 327 8.651 8.682 3.044 1.00 0.00 H new ATOM 902 N PHE B 328 6.739 6.556 3.415 1.00 0.00 N ATOM 903 CA PHE B 328 5.871 5.630 2.701 1.00 0.00 C ATOM 904 C PHE B 328 4.797 5.076 3.635 1.00 0.00 C ATOM 905 O PHE B 328 3.605 5.104 3.320 1.00 0.00 O ATOM 906 CB PHE B 328 6.693 4.480 2.112 1.00 0.00 C ATOM 907 CG PHE B 328 5.892 3.544 1.253 1.00 0.00 C ATOM 908 CD1 PHE B 328 5.637 3.848 -0.074 1.00 0.00 C ATOM 909 CD2 PHE B 328 5.394 2.360 1.772 1.00 0.00 C ATOM 910 CE1 PHE B 328 4.901 2.989 -0.868 1.00 0.00 C ATOM 911 CE2 PHE B 328 4.657 1.497 0.984 1.00 0.00 C ATOM 912 CZ PHE B 328 4.410 1.812 -0.338 1.00 0.00 C ATOM 0 H PHE B 328 7.720 6.279 3.441 1.00 0.00 H new ATOM 0 HA PHE B 328 5.385 6.171 1.889 1.00 0.00 H new ATOM 0 HB2 PHE B 328 7.509 4.894 1.520 1.00 0.00 H new ATOM 0 HB3 PHE B 328 7.146 3.914 2.926 1.00 0.00 H new ATOM 0 HD1 PHE B 328 6.018 4.767 -0.493 1.00 0.00 H new ATOM 0 HD2 PHE B 328 5.584 2.109 2.805 1.00 0.00 H new ATOM 0 HE1 PHE B 328 4.710 3.238 -1.901 1.00 0.00 H new ATOM 0 HE2 PHE B 328 4.274 0.577 1.401 1.00 0.00 H new ATOM 0 HZ PHE B 328 3.834 1.139 -0.956 1.00 0.00 H new ATOM 922 N LEU B 329 5.234 4.577 4.790 1.00 0.00 N ATOM 923 CA LEU B 329 4.319 4.021 5.781 1.00 0.00 C ATOM 924 C LEU B 329 3.291 5.060 6.214 1.00 0.00 C ATOM 925 O LEU B 329 2.170 4.718 6.592 1.00 0.00 O ATOM 926 CB LEU B 329 5.095 3.519 7.001 1.00 0.00 C ATOM 927 CG LEU B 329 6.031 2.336 6.740 1.00 0.00 C ATOM 928 CD1 LEU B 329 6.827 2.005 7.993 1.00 0.00 C ATOM 929 CD2 LEU B 329 5.243 1.121 6.273 1.00 0.00 C ATOM 0 H LEU B 329 6.217 4.547 5.061 1.00 0.00 H new ATOM 0 HA LEU B 329 3.794 3.183 5.322 1.00 0.00 H new ATOM 0 HB2 LEU B 329 5.683 4.345 7.402 1.00 0.00 H new ATOM 0 HB3 LEU B 329 4.381 3.232 7.773 1.00 0.00 H new ATOM 0 HG LEU B 329 6.728 2.616 5.950 1.00 0.00 H new ATOM 0 HD11 LEU B 329 7.488 1.162 7.792 1.00 0.00 H new ATOM 0 HD12 LEU B 329 7.421 2.870 8.286 1.00 0.00 H new ATOM 0 HD13 LEU B 329 6.143 1.745 8.801 1.00 0.00 H new ATOM 0 HD21 LEU B 329 5.927 0.291 6.093 1.00 0.00 H new ATOM 0 HD22 LEU B 329 4.523 0.838 7.040 1.00 0.00 H new ATOM 0 HD23 LEU B 329 4.715 1.362 5.351 1.00 0.00 H new ATOM 941 N GLU B 330 3.680 6.331 6.156 1.00 0.00 N ATOM 942 CA GLU B 330 2.788 7.419 6.540 1.00 0.00 C ATOM 943 C GLU B 330 1.704 7.630 5.489 1.00 0.00 C ATOM 944 O GLU B 330 0.543 7.859 5.825 1.00 0.00 O ATOM 945 CB GLU B 330 3.579 8.710 6.750 1.00 0.00 C ATOM 946 CG GLU B 330 4.436 8.697 8.005 1.00 0.00 C ATOM 947 CD GLU B 330 5.226 9.979 8.183 1.00 0.00 C ATOM 948 OE1 GLU B 330 6.364 10.051 7.673 1.00 0.00 O ATOM 949 OE2 GLU B 330 4.706 10.911 8.833 1.00 0.00 O ATOM 0 H GLU B 330 4.605 6.631 5.848 1.00 0.00 H new ATOM 0 HA GLU B 330 2.306 7.146 7.479 1.00 0.00 H new ATOM 0 HB2 GLU B 330 4.219 8.880 5.884 1.00 0.00 H new ATOM 0 HB3 GLU B 330 2.884 9.548 6.802 1.00 0.00 H new ATOM 0 HG2 GLU B 330 3.798 8.544 8.875 1.00 0.00 H new ATOM 0 HG3 GLU B 330 5.124 7.853 7.962 1.00 0.00 H new ATOM 956 N ILE B 331 2.087 7.556 4.216 1.00 0.00 N ATOM 957 CA ILE B 331 1.131 7.725 3.127 1.00 0.00 C ATOM 958 C ILE B 331 0.068 6.637 3.182 1.00 0.00 C ATOM 959 O ILE B 331 -1.124 6.910 3.031 1.00 0.00 O ATOM 960 CB ILE B 331 1.822 7.686 1.749 1.00 0.00 C ATOM 961 CG1 ILE B 331 2.879 8.788 1.656 1.00 0.00 C ATOM 962 CG2 ILE B 331 0.793 7.831 0.631 1.00 0.00 C ATOM 963 CD1 ILE B 331 3.780 8.662 0.447 1.00 0.00 C ATOM 0 H ILE B 331 3.046 7.381 3.916 1.00 0.00 H new ATOM 0 HA ILE B 331 0.668 8.704 3.254 1.00 0.00 H new ATOM 0 HB ILE B 331 2.317 6.722 1.634 1.00 0.00 H new ATOM 0 HG12 ILE B 331 2.380 9.757 1.628 1.00 0.00 H new ATOM 0 HG13 ILE B 331 3.491 8.770 2.558 1.00 0.00 H new ATOM 0 HG21 ILE B 331 1.298 7.801 -0.334 1.00 0.00 H new ATOM 0 HG22 ILE B 331 0.074 7.014 0.690 1.00 0.00 H new ATOM 0 HG23 ILE B 331 0.271 8.782 0.738 1.00 0.00 H new ATOM 0 HD11 ILE B 331 4.504 9.477 0.446 1.00 0.00 H new ATOM 0 HD12 ILE B 331 4.307 7.708 0.483 1.00 0.00 H new ATOM 0 HD13 ILE B 331 3.179 8.710 -0.461 1.00 0.00 H new ATOM 975 N LEU B 332 0.507 5.402 3.402 1.00 0.00 N ATOM 976 CA LEU B 332 -0.409 4.271 3.486 1.00 0.00 C ATOM 977 C LEU B 332 -1.252 4.356 4.753 1.00 0.00 C ATOM 978 O LEU B 332 -2.421 3.969 4.758 1.00 0.00 O ATOM 979 CB LEU B 332 0.364 2.952 3.457 1.00 0.00 C ATOM 980 CG LEU B 332 0.614 2.374 2.061 1.00 0.00 C ATOM 981 CD1 LEU B 332 1.331 3.383 1.175 1.00 0.00 C ATOM 982 CD2 LEU B 332 1.413 1.083 2.163 1.00 0.00 C ATOM 0 H LEU B 332 1.490 5.159 3.525 1.00 0.00 H new ATOM 0 HA LEU B 332 -1.073 4.306 2.623 1.00 0.00 H new ATOM 0 HB2 LEU B 332 1.325 3.102 3.948 1.00 0.00 H new ATOM 0 HB3 LEU B 332 -0.183 2.215 4.045 1.00 0.00 H new ATOM 0 HG LEU B 332 -0.350 2.152 1.602 1.00 0.00 H new ATOM 0 HD11 LEU B 332 1.497 2.948 0.189 1.00 0.00 H new ATOM 0 HD12 LEU B 332 0.720 4.281 1.078 1.00 0.00 H new ATOM 0 HD13 LEU B 332 2.290 3.643 1.623 1.00 0.00 H new ATOM 0 HD21 LEU B 332 1.585 0.681 1.164 1.00 0.00 H new ATOM 0 HD22 LEU B 332 2.371 1.285 2.642 1.00 0.00 H new ATOM 0 HD23 LEU B 332 0.857 0.357 2.755 1.00 0.00 H new ATOM 994 N HIS B 333 -0.652 4.861 5.827 1.00 0.00 N ATOM 995 CA HIS B 333 -1.357 5.005 7.094 1.00 0.00 C ATOM 996 C HIS B 333 -2.528 5.969 6.941 1.00 0.00 C ATOM 997 O HIS B 333 -3.666 5.635 7.269 1.00 0.00 O ATOM 998 CB HIS B 333 -0.405 5.505 8.184 1.00 0.00 C ATOM 999 CG HIS B 333 -1.076 5.750 9.500 1.00 0.00 C ATOM 1000 ND1 HIS B 333 -1.401 7.010 9.955 1.00 0.00 N ATOM 1001 CD2 HIS B 333 -1.485 4.888 10.462 1.00 0.00 C ATOM 1002 CE1 HIS B 333 -1.980 6.914 11.138 1.00 0.00 C ATOM 1003 NE2 HIS B 333 -2.044 5.636 11.468 1.00 0.00 N ATOM 0 H HIS B 333 0.318 5.176 5.844 1.00 0.00 H new ATOM 0 HA HIS B 333 -1.740 4.028 7.387 1.00 0.00 H new ATOM 0 HB2 HIS B 333 0.391 4.774 8.322 1.00 0.00 H new ATOM 0 HB3 HIS B 333 0.065 6.429 7.848 1.00 0.00 H new ATOM 0 HD2 HIS B 333 -1.389 3.812 10.441 1.00 0.00 H new ATOM 0 HE1 HIS B 333 -2.340 7.739 11.734 1.00 0.00 H new ATOM 0 HE2 HIS B 333 -2.444 5.266 12.330 1.00 0.00 H new ATOM 1012 N THR B 334 -2.236 7.165 6.440 1.00 0.00 N ATOM 1013 CA THR B 334 -3.261 8.176 6.227 1.00 0.00 C ATOM 1014 C THR B 334 -4.320 7.660 5.260 1.00 0.00 C ATOM 1015 O THR B 334 -5.512 7.912 5.433 1.00 0.00 O ATOM 1016 CB THR B 334 -2.657 9.480 5.673 1.00 0.00 C ATOM 1017 OG1 THR B 334 -1.672 9.989 6.581 1.00 0.00 O ATOM 1018 CG2 THR B 334 -3.737 10.530 5.452 1.00 0.00 C ATOM 0 H THR B 334 -1.295 7.456 6.174 1.00 0.00 H new ATOM 0 HA THR B 334 -3.719 8.389 7.193 1.00 0.00 H new ATOM 0 HB THR B 334 -2.189 9.256 4.714 1.00 0.00 H new ATOM 0 HG1 THR B 334 -0.856 9.450 6.515 1.00 0.00 H new ATOM 0 HG21 THR B 334 -3.284 11.441 5.061 1.00 0.00 H new ATOM 0 HG22 THR B 334 -4.470 10.154 4.738 1.00 0.00 H new ATOM 0 HG23 THR B 334 -4.231 10.748 6.399 1.00 0.00 H new ATOM 1026 N TYR B 335 -3.870 6.934 4.240 1.00 0.00 N ATOM 1027 CA TYR B 335 -4.773 6.367 3.247 1.00 0.00 C ATOM 1028 C TYR B 335 -5.732 5.383 3.908 1.00 0.00 C ATOM 1029 O TYR B 335 -6.909 5.310 3.556 1.00 0.00 O ATOM 1030 CB TYR B 335 -3.974 5.663 2.146 1.00 0.00 C ATOM 1031 CG TYR B 335 -4.818 5.210 0.976 1.00 0.00 C ATOM 1032 CD1 TYR B 335 -5.060 6.058 -0.095 1.00 0.00 C ATOM 1033 CD2 TYR B 335 -5.373 3.935 0.943 1.00 0.00 C ATOM 1034 CE1 TYR B 335 -5.832 5.652 -1.168 1.00 0.00 C ATOM 1035 CE2 TYR B 335 -6.146 3.522 -0.125 1.00 0.00 C ATOM 1036 CZ TYR B 335 -6.373 4.383 -1.177 1.00 0.00 C ATOM 1037 OH TYR B 335 -7.143 3.975 -2.242 1.00 0.00 O ATOM 0 H TYR B 335 -2.884 6.725 4.081 1.00 0.00 H new ATOM 0 HA TYR B 335 -5.352 7.175 2.800 1.00 0.00 H new ATOM 0 HB2 TYR B 335 -3.199 6.339 1.783 1.00 0.00 H new ATOM 0 HB3 TYR B 335 -3.468 4.798 2.574 1.00 0.00 H new ATOM 0 HD1 TYR B 335 -4.638 7.052 -0.091 1.00 0.00 H new ATOM 0 HD2 TYR B 335 -5.197 3.257 1.765 1.00 0.00 H new ATOM 0 HE1 TYR B 335 -6.010 6.324 -1.994 1.00 0.00 H new ATOM 0 HE2 TYR B 335 -6.570 2.529 -0.135 1.00 0.00 H new ATOM 0 HH TYR B 335 -7.446 3.055 -2.093 1.00 0.00 H new ATOM 1047 N GLN B 336 -5.213 4.631 4.876 1.00 0.00 N ATOM 1048 CA GLN B 336 -6.010 3.650 5.600 1.00 0.00 C ATOM 1049 C GLN B 336 -7.105 4.344 6.403 1.00 0.00 C ATOM 1050 O GLN B 336 -8.269 3.945 6.361 1.00 0.00 O ATOM 1051 CB GLN B 336 -5.113 2.827 6.530 1.00 0.00 C ATOM 1052 CG GLN B 336 -5.748 1.533 7.019 1.00 0.00 C ATOM 1053 CD GLN B 336 -6.824 1.758 8.063 1.00 0.00 C ATOM 1054 OE1 GLN B 336 -7.793 1.003 8.144 1.00 0.00 O ATOM 1055 NE2 GLN B 336 -6.656 2.795 8.877 1.00 0.00 N ATOM 0 H GLN B 336 -4.240 4.685 5.176 1.00 0.00 H new ATOM 0 HA GLN B 336 -6.479 2.980 4.879 1.00 0.00 H new ATOM 0 HB2 GLN B 336 -4.186 2.590 6.008 1.00 0.00 H new ATOM 0 HB3 GLN B 336 -4.845 3.437 7.393 1.00 0.00 H new ATOM 0 HG2 GLN B 336 -6.179 1.003 6.170 1.00 0.00 H new ATOM 0 HG3 GLN B 336 -4.973 0.890 7.437 1.00 0.00 H new ATOM 0 HE21 GLN B 336 -5.838 3.396 8.775 1.00 0.00 H new ATOM 0 HE22 GLN B 336 -7.345 2.990 9.603 1.00 0.00 H new ATOM 1064 N LYS B 337 -6.716 5.384 7.135 1.00 0.00 N ATOM 1065 CA LYS B 337 -7.654 6.148 7.945 1.00 0.00 C ATOM 1066 C LYS B 337 -8.809 6.659 7.092 1.00 0.00 C ATOM 1067 O LYS B 337 -9.976 6.522 7.461 1.00 0.00 O ATOM 1068 CB LYS B 337 -6.935 7.322 8.605 1.00 0.00 C ATOM 1069 CG LYS B 337 -7.825 8.146 9.523 1.00 0.00 C ATOM 1070 CD LYS B 337 -7.080 9.335 10.111 1.00 0.00 C ATOM 1071 CE LYS B 337 -6.670 10.329 9.033 1.00 0.00 C ATOM 1072 NZ LYS B 337 -6.080 11.567 9.612 1.00 0.00 N ATOM 0 H LYS B 337 -5.753 5.716 7.182 1.00 0.00 H new ATOM 0 HA LYS B 337 -8.058 5.493 8.717 1.00 0.00 H new ATOM 0 HB2 LYS B 337 -6.089 6.943 9.178 1.00 0.00 H new ATOM 0 HB3 LYS B 337 -6.529 7.971 7.829 1.00 0.00 H new ATOM 0 HG2 LYS B 337 -8.693 8.500 8.967 1.00 0.00 H new ATOM 0 HG3 LYS B 337 -8.198 7.515 10.330 1.00 0.00 H new ATOM 0 HD2 LYS B 337 -7.712 9.834 10.845 1.00 0.00 H new ATOM 0 HD3 LYS B 337 -6.193 8.984 10.639 1.00 0.00 H new ATOM 0 HE2 LYS B 337 -5.947 9.861 8.364 1.00 0.00 H new ATOM 0 HE3 LYS B 337 -7.540 10.589 8.430 1.00 0.00 H new ATOM 0 HZ1 LYS B 337 -5.815 12.217 8.845 1.00 0.00 H new ATOM 0 HZ2 LYS B 337 -6.778 12.028 10.230 1.00 0.00 H new ATOM 0 HZ3 LYS B 337 -5.235 11.322 10.166 1.00 0.00 H new ATOM 1086 N GLU B 338 -8.472 7.251 5.951 1.00 0.00 N ATOM 1087 CA GLU B 338 -9.478 7.779 5.038 1.00 0.00 C ATOM 1088 C GLU B 338 -10.406 6.669 4.558 1.00 0.00 C ATOM 1089 O GLU B 338 -11.617 6.863 4.444 1.00 0.00 O ATOM 1090 CB GLU B 338 -8.807 8.453 3.842 1.00 0.00 C ATOM 1091 CG GLU B 338 -7.947 9.648 4.221 1.00 0.00 C ATOM 1092 CD GLU B 338 -8.752 10.776 4.835 1.00 0.00 C ATOM 1093 OE1 GLU B 338 -9.228 11.646 4.077 1.00 0.00 O ATOM 1094 OE2 GLU B 338 -8.909 10.786 6.075 1.00 0.00 O ATOM 0 H GLU B 338 -7.510 7.377 5.637 1.00 0.00 H new ATOM 0 HA GLU B 338 -10.071 8.519 5.575 1.00 0.00 H new ATOM 0 HB2 GLU B 338 -8.189 7.721 3.323 1.00 0.00 H new ATOM 0 HB3 GLU B 338 -9.575 8.777 3.140 1.00 0.00 H new ATOM 0 HG2 GLU B 338 -7.179 9.329 4.926 1.00 0.00 H new ATOM 0 HG3 GLU B 338 -7.432 10.016 3.334 1.00 0.00 H new ATOM 1101 N GLN B 339 -9.830 5.502 4.276 1.00 0.00 N ATOM 1102 CA GLN B 339 -10.605 4.358 3.810 1.00 0.00 C ATOM 1103 C GLN B 339 -11.682 3.986 4.824 1.00 0.00 C ATOM 1104 O GLN B 339 -12.829 3.733 4.459 1.00 0.00 O ATOM 1105 CB GLN B 339 -9.689 3.159 3.556 1.00 0.00 C ATOM 1106 CG GLN B 339 -10.414 1.947 2.991 1.00 0.00 C ATOM 1107 CD GLN B 339 -11.069 2.226 1.650 1.00 0.00 C ATOM 1108 OE1 GLN B 339 -10.466 3.115 0.868 1.00 0.00 O flip ATOM 1109 NE2 GLN B 339 -12.102 1.645 1.320 1.00 0.00 N flip ATOM 0 H GLN B 339 -8.829 5.326 4.363 1.00 0.00 H new ATOM 0 HA GLN B 339 -11.090 4.636 2.874 1.00 0.00 H new ATOM 0 HB2 GLN B 339 -8.900 3.455 2.864 1.00 0.00 H new ATOM 0 HB3 GLN B 339 -9.204 2.878 4.491 1.00 0.00 H new ATOM 0 HG2 GLN B 339 -9.707 1.125 2.881 1.00 0.00 H new ATOM 0 HG3 GLN B 339 -11.174 1.621 3.701 1.00 0.00 H new ATOM 0 HE21 GLN B 339 -12.531 0.969 1.952 1.00 0.00 H new ATOM 0 HE22 GLN B 339 -12.529 1.839 0.414 1.00 0.00 H new ATOM 1118 N ARG B 340 -11.303 3.952 6.099 1.00 0.00 N ATOM 1119 CA ARG B 340 -12.242 3.615 7.163 1.00 0.00 C ATOM 1120 C ARG B 340 -13.371 4.636 7.219 1.00 0.00 C ATOM 1121 O ARG B 340 -14.549 4.278 7.184 1.00 0.00 O ATOM 1122 CB ARG B 340 -11.523 3.559 8.512 1.00 0.00 C ATOM 1123 CG ARG B 340 -10.502 2.447 8.610 1.00 0.00 C ATOM 1124 CD ARG B 340 -10.008 2.262 10.035 1.00 0.00 C ATOM 1125 NE ARG B 340 -11.048 1.727 10.910 1.00 0.00 N ATOM 1126 CZ ARG B 340 -10.815 1.265 12.136 1.00 0.00 C ATOM 1127 NH1 ARG B 340 -9.586 1.289 12.636 1.00 0.00 N ATOM 1128 NH2 ARG B 340 -11.812 0.781 12.865 1.00 0.00 N ATOM 0 H ARG B 340 -10.356 4.153 6.419 1.00 0.00 H new ATOM 0 HA ARG B 340 -12.665 2.634 6.948 1.00 0.00 H new ATOM 0 HB2 ARG B 340 -11.027 4.513 8.689 1.00 0.00 H new ATOM 0 HB3 ARG B 340 -12.262 3.433 9.303 1.00 0.00 H new ATOM 0 HG2 ARG B 340 -10.943 1.516 8.254 1.00 0.00 H new ATOM 0 HG3 ARG B 340 -9.657 2.670 7.958 1.00 0.00 H new ATOM 0 HD2 ARG B 340 -9.151 1.589 10.037 1.00 0.00 H new ATOM 0 HD3 ARG B 340 -9.662 3.219 10.426 1.00 0.00 H new ATOM 0 HE ARG B 340 -12.007 1.706 10.562 1.00 0.00 H new ATOM 0 HH11 ARG B 340 -8.817 1.662 12.080 1.00 0.00 H new ATOM 0 HH12 ARG B 340 -9.411 0.934 13.576 1.00 0.00 H new ATOM 0 HH21 ARG B 340 -12.759 0.763 12.486 1.00 0.00 H new ATOM 0 HH22 ARG B 340 -11.632 0.427 13.805 1.00 0.00 H new ATOM 1142 N ASN B 341 -12.998 5.907 7.310 1.00 0.00 N ATOM 1143 CA ASN B 341 -13.971 6.993 7.358 1.00 0.00 C ATOM 1144 C ASN B 341 -14.936 6.900 6.182 1.00 0.00 C ATOM 1145 O ASN B 341 -16.105 7.275 6.291 1.00 0.00 O ATOM 1146 CB ASN B 341 -13.254 8.344 7.342 1.00 0.00 C ATOM 1147 CG ASN B 341 -12.372 8.547 8.559 1.00 0.00 C ATOM 1148 OD1 ASN B 341 -12.665 8.042 9.642 1.00 0.00 O ATOM 1149 ND2 ASN B 341 -11.285 9.290 8.385 1.00 0.00 N ATOM 0 H ASN B 341 -12.026 6.212 7.352 1.00 0.00 H new ATOM 0 HA ASN B 341 -14.541 6.905 8.283 1.00 0.00 H new ATOM 0 HB2 ASN B 341 -12.646 8.419 6.440 1.00 0.00 H new ATOM 0 HB3 ASN B 341 -13.993 9.144 7.295 1.00 0.00 H new ATOM 0 HD21 ASN B 341 -10.654 9.461 9.168 1.00 0.00 H new ATOM 0 HD22 ASN B 341 -11.081 9.689 7.469 1.00 0.00 H new ATOM 1156 N ALA B 342 -14.437 6.395 5.058 1.00 0.00 N ATOM 1157 CA ALA B 342 -15.248 6.247 3.856 1.00 0.00 C ATOM 1158 C ALA B 342 -16.224 5.082 3.991 1.00 0.00 C ATOM 1159 O ALA B 342 -17.392 5.191 3.620 1.00 0.00 O ATOM 1160 CB ALA B 342 -14.353 6.048 2.642 1.00 0.00 C ATOM 0 H ALA B 342 -13.472 6.081 4.955 1.00 0.00 H new ATOM 0 HA ALA B 342 -15.829 7.159 3.723 1.00 0.00 H new ATOM 0 HB1 ALA B 342 -14.969 5.939 1.750 1.00 0.00 H new ATOM 0 HB2 ALA B 342 -13.698 6.912 2.527 1.00 0.00 H new ATOM 0 HB3 ALA B 342 -13.749 5.151 2.778 1.00 0.00 H new ATOM 1166 N LYS B 343 -15.735 3.967 4.528 1.00 0.00 N ATOM 1167 CA LYS B 343 -16.561 2.780 4.713 1.00 0.00 C ATOM 1168 C LYS B 343 -17.505 2.959 5.898 1.00 0.00 C ATOM 1169 O LYS B 343 -18.434 2.174 6.092 1.00 0.00 O ATOM 1170 CB LYS B 343 -15.674 1.549 4.923 1.00 0.00 C ATOM 1171 CG LYS B 343 -16.440 0.236 4.930 1.00 0.00 C ATOM 1172 CD LYS B 343 -15.502 -0.954 5.027 1.00 0.00 C ATOM 1173 CE LYS B 343 -16.265 -2.269 5.047 1.00 0.00 C ATOM 1174 NZ LYS B 343 -17.150 -2.380 6.239 1.00 0.00 N ATOM 0 H LYS B 343 -14.770 3.862 4.842 1.00 0.00 H new ATOM 0 HA LYS B 343 -17.162 2.634 3.815 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -14.922 1.516 4.135 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -15.141 1.653 5.868 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -17.134 0.223 5.770 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -17.037 0.157 4.022 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -14.814 -0.945 4.182 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -14.898 -0.869 5.931 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -16.864 -2.355 4.141 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -15.558 -3.099 5.041 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -17.494 -3.358 6.326 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -16.615 -2.123 7.093 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -17.960 -1.737 6.131 1.00 0.00 H new ATOM 1188 N GLU B 344 -17.262 4.003 6.685 1.00 0.00 N ATOM 1189 CA GLU B 344 -18.083 4.298 7.847 1.00 0.00 C ATOM 1190 C GLU B 344 -19.207 5.265 7.476 1.00 0.00 C ATOM 1191 O GLU B 344 -20.343 5.112 7.925 1.00 0.00 O ATOM 1192 CB GLU B 344 -17.202 4.870 8.964 1.00 0.00 C ATOM 1193 CG GLU B 344 -17.837 6.017 9.721 1.00 0.00 C ATOM 1194 CD GLU B 344 -18.930 5.565 10.671 1.00 0.00 C ATOM 1195 OE1 GLU B 344 -18.605 4.891 11.671 1.00 0.00 O ATOM 1196 OE2 GLU B 344 -20.109 5.885 10.415 1.00 0.00 O ATOM 0 H GLU B 344 -16.497 4.661 6.535 1.00 0.00 H new ATOM 0 HA GLU B 344 -18.546 3.379 8.206 1.00 0.00 H new ATOM 0 HB2 GLU B 344 -16.961 4.073 9.667 1.00 0.00 H new ATOM 0 HB3 GLU B 344 -16.260 5.210 8.532 1.00 0.00 H new ATOM 0 HG2 GLU B 344 -17.067 6.544 10.285 1.00 0.00 H new ATOM 0 HG3 GLU B 344 -18.253 6.729 9.009 1.00 0.00 H new ATOM 1203 N ALA B 345 -18.882 6.255 6.648 1.00 0.00 N ATOM 1204 CA ALA B 345 -19.862 7.244 6.215 1.00 0.00 C ATOM 1205 C ALA B 345 -21.003 6.583 5.448 1.00 0.00 C ATOM 1206 O ALA B 345 -22.119 7.100 5.409 1.00 0.00 O ATOM 1207 CB ALA B 345 -19.195 8.308 5.357 1.00 0.00 C ATOM 0 H ALA B 345 -17.947 6.392 6.264 1.00 0.00 H new ATOM 0 HA ALA B 345 -20.280 7.719 7.103 1.00 0.00 H new ATOM 0 HB1 ALA B 345 -19.939 9.040 5.041 1.00 0.00 H new ATOM 0 HB2 ALA B 345 -18.418 8.807 5.936 1.00 0.00 H new ATOM 0 HB3 ALA B 345 -18.750 7.841 4.479 1.00 0.00 H new ATOM 1276 N PRO B 351 -12.921 10.694 0.092 1.00 0.00 N ATOM 1277 CA PRO B 351 -11.655 10.711 0.837 1.00 0.00 C ATOM 1278 C PRO B 351 -10.671 11.737 0.288 1.00 0.00 C ATOM 1279 O PRO B 351 -10.859 12.268 -0.808 1.00 0.00 O ATOM 1280 CB PRO B 351 -11.103 9.293 0.648 1.00 0.00 C ATOM 1281 CG PRO B 351 -12.294 8.459 0.328 1.00 0.00 C ATOM 1282 CD PRO B 351 -13.226 9.352 -0.439 1.00 0.00 C ATOM 0 HA PRO B 351 -11.807 10.988 1.880 1.00 0.00 H new ATOM 0 HB2 PRO B 351 -10.369 9.259 -0.157 1.00 0.00 H new ATOM 0 HB3 PRO B 351 -10.604 8.940 1.550 1.00 0.00 H new ATOM 0 HG2 PRO B 351 -12.013 7.587 -0.263 1.00 0.00 H new ATOM 0 HG3 PRO B 351 -12.768 8.089 1.237 1.00 0.00 H new ATOM 0 HD2 PRO B 351 -13.047 9.294 -1.513 1.00 0.00 H new ATOM 0 HD3 PRO B 351 -14.269 9.081 -0.275 1.00 0.00 H new ATOM 1290 N ALA B 352 -9.621 12.012 1.055 1.00 0.00 N ATOM 1291 CA ALA B 352 -8.605 12.973 0.644 1.00 0.00 C ATOM 1292 C ALA B 352 -7.581 12.325 -0.281 1.00 0.00 C ATOM 1293 O ALA B 352 -7.452 12.706 -1.445 1.00 0.00 O ATOM 1294 CB ALA B 352 -7.915 13.567 1.863 1.00 0.00 C ATOM 0 H ALA B 352 -9.452 11.583 1.965 1.00 0.00 H new ATOM 0 HA ALA B 352 -9.099 13.774 0.094 1.00 0.00 H new ATOM 0 HB1 ALA B 352 -7.159 14.283 1.540 1.00 0.00 H new ATOM 0 HB2 ALA B 352 -8.651 14.073 2.487 1.00 0.00 H new ATOM 0 HB3 ALA B 352 -7.440 12.771 2.436 1.00 0.00 H new ATOM 1300 N LEU B 353 -6.858 11.341 0.244 1.00 0.00 N ATOM 1301 CA LEU B 353 -5.844 10.638 -0.534 1.00 0.00 C ATOM 1302 C LEU B 353 -6.448 9.458 -1.285 1.00 0.00 C ATOM 1303 O LEU B 353 -6.946 8.510 -0.677 1.00 0.00 O ATOM 1304 CB LEU B 353 -4.712 10.150 0.371 1.00 0.00 C ATOM 1305 CG LEU B 353 -3.821 11.247 0.949 1.00 0.00 C ATOM 1306 CD1 LEU B 353 -4.451 11.854 2.193 1.00 0.00 C ATOM 1307 CD2 LEU B 353 -2.442 10.693 1.256 1.00 0.00 C ATOM 0 H LEU B 353 -6.955 11.012 1.205 1.00 0.00 H new ATOM 0 HA LEU B 353 -5.440 11.342 -1.261 1.00 0.00 H new ATOM 0 HB2 LEU B 353 -5.146 9.585 1.196 1.00 0.00 H new ATOM 0 HB3 LEU B 353 -4.088 9.459 -0.196 1.00 0.00 H new ATOM 0 HG LEU B 353 -3.718 12.039 0.207 1.00 0.00 H new ATOM 0 HD11 LEU B 353 -3.799 12.633 2.588 1.00 0.00 H new ATOM 0 HD12 LEU B 353 -5.419 12.286 1.937 1.00 0.00 H new ATOM 0 HD13 LEU B 353 -4.588 11.079 2.947 1.00 0.00 H new ATOM 0 HD21 LEU B 353 -1.815 11.484 1.668 1.00 0.00 H new ATOM 0 HD22 LEU B 353 -2.528 9.884 1.981 1.00 0.00 H new ATOM 0 HD23 LEU B 353 -1.991 10.312 0.340 1.00 0.00 H new ATOM 1319 N THR B 354 -6.402 9.524 -2.611 1.00 0.00 N ATOM 1320 CA THR B 354 -6.930 8.461 -3.453 1.00 0.00 C ATOM 1321 C THR B 354 -5.793 7.741 -4.170 1.00 0.00 C ATOM 1322 O THR B 354 -4.627 7.902 -3.811 1.00 0.00 O ATOM 1323 CB THR B 354 -7.920 9.009 -4.501 1.00 0.00 C ATOM 1324 OG1 THR B 354 -7.237 9.874 -5.416 1.00 0.00 O ATOM 1325 CG2 THR B 354 -9.054 9.769 -3.831 1.00 0.00 C ATOM 0 H THR B 354 -6.002 10.308 -3.127 1.00 0.00 H new ATOM 0 HA THR B 354 -7.460 7.764 -2.804 1.00 0.00 H new ATOM 0 HB THR B 354 -8.341 8.164 -5.045 1.00 0.00 H new ATOM 0 HG1 THR B 354 -7.872 10.216 -6.079 1.00 0.00 H new ATOM 0 HG21 THR B 354 -9.739 10.146 -4.591 1.00 0.00 H new ATOM 0 HG22 THR B 354 -9.591 9.101 -3.157 1.00 0.00 H new ATOM 0 HG23 THR B 354 -8.646 10.606 -3.264 1.00 0.00 H new ATOM 1333 N GLU B 355 -6.135 6.948 -5.178 1.00 0.00 N ATOM 1334 CA GLU B 355 -5.130 6.215 -5.942 1.00 0.00 C ATOM 1335 C GLU B 355 -4.100 7.173 -6.534 1.00 0.00 C ATOM 1336 O GLU B 355 -2.897 6.903 -6.511 1.00 0.00 O ATOM 1337 CB GLU B 355 -5.798 5.412 -7.059 1.00 0.00 C ATOM 1338 CG GLU B 355 -6.778 6.222 -7.892 1.00 0.00 C ATOM 1339 CD GLU B 355 -7.472 5.389 -8.949 1.00 0.00 C ATOM 1340 OE1 GLU B 355 -8.511 4.772 -8.632 1.00 0.00 O ATOM 1341 OE2 GLU B 355 -6.979 5.353 -10.097 1.00 0.00 O ATOM 0 H GLU B 355 -7.096 6.796 -5.485 1.00 0.00 H new ATOM 0 HA GLU B 355 -4.619 5.529 -5.267 1.00 0.00 H new ATOM 0 HB2 GLU B 355 -5.027 5.006 -7.714 1.00 0.00 H new ATOM 0 HB3 GLU B 355 -6.323 4.563 -6.620 1.00 0.00 H new ATOM 0 HG2 GLU B 355 -7.526 6.666 -7.236 1.00 0.00 H new ATOM 0 HG3 GLU B 355 -6.248 7.044 -8.373 1.00 0.00 H new ATOM 1348 N GLN B 356 -4.584 8.294 -7.056 1.00 0.00 N ATOM 1349 CA GLN B 356 -3.719 9.301 -7.659 1.00 0.00 C ATOM 1350 C GLN B 356 -2.842 9.984 -6.610 1.00 0.00 C ATOM 1351 O GLN B 356 -1.654 10.207 -6.837 1.00 0.00 O ATOM 1352 CB GLN B 356 -4.557 10.348 -8.395 1.00 0.00 C ATOM 1353 CG GLN B 356 -5.405 9.774 -9.519 1.00 0.00 C ATOM 1354 CD GLN B 356 -4.570 9.175 -10.634 1.00 0.00 C ATOM 1355 OE1 GLN B 356 -4.236 7.990 -10.607 1.00 0.00 O ATOM 1356 NE2 GLN B 356 -4.230 9.993 -11.623 1.00 0.00 N ATOM 0 H GLN B 356 -5.576 8.529 -7.074 1.00 0.00 H new ATOM 0 HA GLN B 356 -3.067 8.794 -8.370 1.00 0.00 H new ATOM 0 HB2 GLN B 356 -5.209 10.847 -7.678 1.00 0.00 H new ATOM 0 HB3 GLN B 356 -3.893 11.109 -8.805 1.00 0.00 H new ATOM 0 HG2 GLN B 356 -6.067 9.008 -9.115 1.00 0.00 H new ATOM 0 HG3 GLN B 356 -6.040 10.560 -9.928 1.00 0.00 H new ATOM 0 HE21 GLN B 356 -4.529 10.968 -11.604 1.00 0.00 H new ATOM 0 HE22 GLN B 356 -3.670 9.646 -12.402 1.00 0.00 H new ATOM 1365 N GLU B 357 -3.433 10.311 -5.463 1.00 0.00 N ATOM 1366 CA GLU B 357 -2.696 10.976 -4.391 1.00 0.00 C ATOM 1367 C GLU B 357 -1.530 10.118 -3.913 1.00 0.00 C ATOM 1368 O GLU B 357 -0.394 10.588 -3.836 1.00 0.00 O ATOM 1369 CB GLU B 357 -3.621 11.296 -3.214 1.00 0.00 C ATOM 1370 CG GLU B 357 -3.168 12.494 -2.395 1.00 0.00 C ATOM 1371 CD GLU B 357 -3.039 13.755 -3.227 1.00 0.00 C ATOM 1372 OE1 GLU B 357 -4.076 14.396 -3.497 1.00 0.00 O ATOM 1373 OE2 GLU B 357 -1.900 14.102 -3.604 1.00 0.00 O ATOM 0 H GLU B 357 -4.414 10.128 -5.253 1.00 0.00 H new ATOM 0 HA GLU B 357 -2.300 11.908 -4.793 1.00 0.00 H new ATOM 0 HB2 GLU B 357 -4.626 11.484 -3.592 1.00 0.00 H new ATOM 0 HB3 GLU B 357 -3.683 10.424 -2.563 1.00 0.00 H new ATOM 0 HG2 GLU B 357 -3.880 12.667 -1.588 1.00 0.00 H new ATOM 0 HG3 GLU B 357 -2.208 12.270 -1.931 1.00 0.00 H new ATOM 1380 N VAL B 358 -1.816 8.860 -3.591 1.00 0.00 N ATOM 1381 CA VAL B 358 -0.788 7.940 -3.122 1.00 0.00 C ATOM 1382 C VAL B 358 0.303 7.750 -4.170 1.00 0.00 C ATOM 1383 O VAL B 358 1.467 8.049 -3.917 1.00 0.00 O ATOM 1384 CB VAL B 358 -1.385 6.565 -2.745 1.00 0.00 C ATOM 1385 CG1 VAL B 358 -0.323 5.475 -2.786 1.00 0.00 C ATOM 1386 CG2 VAL B 358 -2.023 6.622 -1.368 1.00 0.00 C ATOM 0 H VAL B 358 -2.751 8.456 -3.647 1.00 0.00 H new ATOM 0 HA VAL B 358 -0.349 8.386 -2.230 1.00 0.00 H new ATOM 0 HB VAL B 358 -2.152 6.321 -3.480 1.00 0.00 H new ATOM 0 HG11 VAL B 358 -0.772 4.519 -2.516 1.00 0.00 H new ATOM 0 HG12 VAL B 358 0.093 5.410 -3.791 1.00 0.00 H new ATOM 0 HG13 VAL B 358 0.472 5.715 -2.080 1.00 0.00 H new ATOM 0 HG21 VAL B 358 -2.438 5.646 -1.119 1.00 0.00 H new ATOM 0 HG22 VAL B 358 -1.270 6.895 -0.629 1.00 0.00 H new ATOM 0 HG23 VAL B 358 -2.820 7.366 -1.367 1.00 0.00 H new ATOM 1396 N TYR B 359 -0.080 7.262 -5.348 1.00 0.00 N ATOM 1397 CA TYR B 359 0.882 7.025 -6.419 1.00 0.00 C ATOM 1398 C TYR B 359 1.726 8.269 -6.683 1.00 0.00 C ATOM 1399 O TYR B 359 2.892 8.167 -7.063 1.00 0.00 O ATOM 1400 CB TYR B 359 0.168 6.589 -7.701 1.00 0.00 C ATOM 1401 CG TYR B 359 1.053 5.793 -8.637 1.00 0.00 C ATOM 1402 CD1 TYR B 359 2.068 6.407 -9.360 1.00 0.00 C ATOM 1403 CD2 TYR B 359 0.877 4.423 -8.788 1.00 0.00 C ATOM 1404 CE1 TYR B 359 2.881 5.680 -10.208 1.00 0.00 C ATOM 1405 CE2 TYR B 359 1.686 3.689 -9.635 1.00 0.00 C ATOM 1406 CZ TYR B 359 2.686 4.322 -10.342 1.00 0.00 C ATOM 1407 OH TYR B 359 3.494 3.595 -11.186 1.00 0.00 O ATOM 0 H TYR B 359 -1.044 7.025 -5.583 1.00 0.00 H new ATOM 0 HA TYR B 359 1.546 6.222 -6.099 1.00 0.00 H new ATOM 0 HB2 TYR B 359 -0.703 5.989 -7.438 1.00 0.00 H new ATOM 0 HB3 TYR B 359 -0.199 7.473 -8.223 1.00 0.00 H new ATOM 0 HD1 TYR B 359 2.224 7.471 -9.257 1.00 0.00 H new ATOM 0 HD2 TYR B 359 0.095 3.924 -8.235 1.00 0.00 H new ATOM 0 HE1 TYR B 359 3.665 6.173 -10.763 1.00 0.00 H new ATOM 0 HE2 TYR B 359 1.535 2.625 -9.742 1.00 0.00 H new ATOM 0 HH TYR B 359 3.225 2.653 -11.165 1.00 0.00 H new ATOM 1417 N ALA B 360 1.135 9.443 -6.476 1.00 0.00 N ATOM 1418 CA ALA B 360 1.845 10.701 -6.688 1.00 0.00 C ATOM 1419 C ALA B 360 2.953 10.883 -5.655 1.00 0.00 C ATOM 1420 O ALA B 360 4.128 11.001 -6.007 1.00 0.00 O ATOM 1421 CB ALA B 360 0.875 11.872 -6.637 1.00 0.00 C ATOM 0 H ALA B 360 0.170 9.549 -6.163 1.00 0.00 H new ATOM 0 HA ALA B 360 2.304 10.669 -7.676 1.00 0.00 H new ATOM 0 HB1 ALA B 360 1.419 12.803 -6.797 1.00 0.00 H new ATOM 0 HB2 ALA B 360 0.121 11.754 -7.416 1.00 0.00 H new ATOM 0 HB3 ALA B 360 0.388 11.899 -5.662 1.00 0.00 H new ATOM 1427 N GLN B 361 2.572 10.905 -4.381 1.00 0.00 N ATOM 1428 CA GLN B 361 3.532 11.066 -3.296 1.00 0.00 C ATOM 1429 C GLN B 361 4.646 10.030 -3.403 1.00 0.00 C ATOM 1430 O GLN B 361 5.817 10.337 -3.176 1.00 0.00 O ATOM 1431 CB GLN B 361 2.823 10.944 -1.948 1.00 0.00 C ATOM 1432 CG GLN B 361 1.730 11.980 -1.745 1.00 0.00 C ATOM 1433 CD GLN B 361 2.281 13.381 -1.565 1.00 0.00 C ATOM 1434 OE1 GLN B 361 2.438 14.127 -2.531 1.00 0.00 O ATOM 1435 NE2 GLN B 361 2.584 13.743 -0.324 1.00 0.00 N ATOM 0 H GLN B 361 1.603 10.813 -4.075 1.00 0.00 H new ATOM 0 HA GLN B 361 3.979 12.057 -3.373 1.00 0.00 H new ATOM 0 HB2 GLN B 361 2.389 9.948 -1.863 1.00 0.00 H new ATOM 0 HB3 GLN B 361 3.558 11.041 -1.149 1.00 0.00 H new ATOM 0 HG2 GLN B 361 1.057 11.966 -2.602 1.00 0.00 H new ATOM 0 HG3 GLN B 361 1.138 11.711 -0.870 1.00 0.00 H new ATOM 0 HE21 GLN B 361 2.437 13.092 0.447 1.00 0.00 H new ATOM 0 HE22 GLN B 361 2.963 14.672 -0.142 1.00 0.00 H new ATOM 1444 N VAL B 362 4.275 8.802 -3.753 1.00 0.00 N ATOM 1445 CA VAL B 362 5.247 7.725 -3.900 1.00 0.00 C ATOM 1446 C VAL B 362 6.139 7.977 -5.110 1.00 0.00 C ATOM 1447 O VAL B 362 7.334 7.681 -5.083 1.00 0.00 O ATOM 1448 CB VAL B 362 4.560 6.354 -4.048 1.00 0.00 C ATOM 1449 CG1 VAL B 362 5.591 5.244 -4.159 1.00 0.00 C ATOM 1450 CG2 VAL B 362 3.629 6.094 -2.877 1.00 0.00 C ATOM 0 H VAL B 362 3.310 8.529 -3.940 1.00 0.00 H new ATOM 0 HA VAL B 362 5.853 7.709 -2.994 1.00 0.00 H new ATOM 0 HB VAL B 362 3.970 6.368 -4.964 1.00 0.00 H new ATOM 0 HG11 VAL B 362 5.083 4.285 -4.263 1.00 0.00 H new ATOM 0 HG12 VAL B 362 6.220 5.418 -5.032 1.00 0.00 H new ATOM 0 HG13 VAL B 362 6.210 5.232 -3.262 1.00 0.00 H new ATOM 0 HG21 VAL B 362 3.153 5.121 -3.000 1.00 0.00 H new ATOM 0 HG22 VAL B 362 4.200 6.104 -1.949 1.00 0.00 H new ATOM 0 HG23 VAL B 362 2.864 6.870 -2.841 1.00 0.00 H new ATOM 1460 N ALA B 363 5.550 8.523 -6.171 1.00 0.00 N ATOM 1461 CA ALA B 363 6.300 8.830 -7.383 1.00 0.00 C ATOM 1462 C ALA B 363 7.406 9.827 -7.072 1.00 0.00 C ATOM 1463 O ALA B 363 8.495 9.767 -7.645 1.00 0.00 O ATOM 1464 CB ALA B 363 5.375 9.375 -8.462 1.00 0.00 C ATOM 0 H ALA B 363 4.559 8.761 -6.215 1.00 0.00 H new ATOM 0 HA ALA B 363 6.752 7.911 -7.757 1.00 0.00 H new ATOM 0 HB1 ALA B 363 5.953 9.598 -9.359 1.00 0.00 H new ATOM 0 HB2 ALA B 363 4.613 8.632 -8.697 1.00 0.00 H new ATOM 0 HB3 ALA B 363 4.895 10.286 -8.104 1.00 0.00 H new ATOM 1470 N ARG B 364 7.112 10.747 -6.158 1.00 0.00 N ATOM 1471 CA ARG B 364 8.080 11.753 -5.745 1.00 0.00 C ATOM 1472 C ARG B 364 8.957 11.198 -4.628 1.00 0.00 C ATOM 1473 O ARG B 364 10.053 11.698 -4.371 1.00 0.00 O ATOM 1474 CB ARG B 364 7.362 13.023 -5.276 1.00 0.00 C ATOM 1475 CG ARG B 364 8.304 14.155 -4.903 1.00 0.00 C ATOM 1476 CD ARG B 364 7.539 15.413 -4.523 1.00 0.00 C ATOM 1477 NE ARG B 364 8.433 16.521 -4.192 1.00 0.00 N ATOM 1478 CZ ARG B 364 8.020 17.766 -3.972 1.00 0.00 C ATOM 1479 NH1 ARG B 364 6.728 18.064 -4.045 1.00 0.00 N ATOM 1480 NH2 ARG B 364 8.897 18.716 -3.678 1.00 0.00 N ATOM 0 H ARG B 364 6.209 10.815 -5.689 1.00 0.00 H new ATOM 0 HA ARG B 364 8.710 12.008 -6.597 1.00 0.00 H new ATOM 0 HB2 ARG B 364 6.693 13.364 -6.066 1.00 0.00 H new ATOM 0 HB3 ARG B 364 6.740 12.781 -4.414 1.00 0.00 H new ATOM 0 HG2 ARG B 364 8.935 13.845 -4.070 1.00 0.00 H new ATOM 0 HG3 ARG B 364 8.967 14.370 -5.741 1.00 0.00 H new ATOM 0 HD2 ARG B 364 6.890 15.705 -5.349 1.00 0.00 H new ATOM 0 HD3 ARG B 364 6.894 15.201 -3.670 1.00 0.00 H new ATOM 0 HE ARG B 364 9.432 16.328 -4.126 1.00 0.00 H new ATOM 0 HH11 ARG B 364 6.049 17.337 -4.270 1.00 0.00 H new ATOM 0 HH12 ARG B 364 6.415 19.020 -3.876 1.00 0.00 H new ATOM 0 HH21 ARG B 364 9.891 18.493 -3.620 1.00 0.00 H new ATOM 0 HH22 ARG B 364 8.578 19.670 -3.510 1.00 0.00 H new ATOM 1494 N LEU B 365 8.458 10.154 -3.970 1.00 0.00 N ATOM 1495 CA LEU B 365 9.182 9.505 -2.883 1.00 0.00 C ATOM 1496 C LEU B 365 10.451 8.844 -3.410 1.00 0.00 C ATOM 1497 O LEU B 365 11.510 8.924 -2.788 1.00 0.00 O ATOM 1498 CB LEU B 365 8.284 8.464 -2.210 1.00 0.00 C ATOM 1499 CG LEU B 365 8.817 7.887 -0.900 1.00 0.00 C ATOM 1500 CD1 LEU B 365 8.824 8.951 0.186 1.00 0.00 C ATOM 1501 CD2 LEU B 365 7.984 6.690 -0.468 1.00 0.00 C ATOM 0 H LEU B 365 7.549 9.738 -4.174 1.00 0.00 H new ATOM 0 HA LEU B 365 9.465 10.259 -2.148 1.00 0.00 H new ATOM 0 HB2 LEU B 365 7.312 8.918 -2.018 1.00 0.00 H new ATOM 0 HB3 LEU B 365 8.121 7.644 -2.909 1.00 0.00 H new ATOM 0 HG LEU B 365 9.842 7.553 -1.062 1.00 0.00 H new ATOM 0 HD11 LEU B 365 9.207 8.523 1.112 1.00 0.00 H new ATOM 0 HD12 LEU B 365 9.462 9.780 -0.121 1.00 0.00 H new ATOM 0 HD13 LEU B 365 7.809 9.314 0.346 1.00 0.00 H new ATOM 0 HD21 LEU B 365 8.378 6.291 0.467 1.00 0.00 H new ATOM 0 HD22 LEU B 365 6.949 7.000 -0.323 1.00 0.00 H new ATOM 0 HD23 LEU B 365 8.028 5.920 -1.238 1.00 0.00 H new ATOM 1513 N PHE B 366 10.333 8.188 -4.561 1.00 0.00 N ATOM 1514 CA PHE B 366 11.470 7.521 -5.186 1.00 0.00 C ATOM 1515 C PHE B 366 11.842 8.220 -6.490 1.00 0.00 C ATOM 1516 O PHE B 366 10.969 8.708 -7.209 1.00 0.00 O ATOM 1517 CB PHE B 366 11.145 6.049 -5.460 1.00 0.00 C ATOM 1518 CG PHE B 366 10.549 5.325 -4.284 1.00 0.00 C ATOM 1519 CD1 PHE B 366 11.239 5.228 -3.086 1.00 0.00 C ATOM 1520 CD2 PHE B 366 9.297 4.737 -4.382 1.00 0.00 C ATOM 1521 CE1 PHE B 366 10.690 4.559 -2.007 1.00 0.00 C ATOM 1522 CE2 PHE B 366 8.746 4.067 -3.306 1.00 0.00 C ATOM 1523 CZ PHE B 366 9.443 3.978 -2.118 1.00 0.00 C ATOM 0 H PHE B 366 9.459 8.104 -5.080 1.00 0.00 H new ATOM 0 HA PHE B 366 12.316 7.572 -4.501 1.00 0.00 H new ATOM 0 HB2 PHE B 366 10.452 5.991 -6.299 1.00 0.00 H new ATOM 0 HB3 PHE B 366 12.058 5.537 -5.765 1.00 0.00 H new ATOM 0 HD1 PHE B 366 12.216 5.680 -2.994 1.00 0.00 H new ATOM 0 HD2 PHE B 366 8.747 4.803 -5.309 1.00 0.00 H new ATOM 0 HE1 PHE B 366 11.237 4.491 -1.078 1.00 0.00 H new ATOM 0 HE2 PHE B 366 7.770 3.613 -3.395 1.00 0.00 H new ATOM 0 HZ PHE B 366 9.013 3.455 -1.277 1.00 0.00 H new ATOM 1533 N LYS B 367 13.136 8.271 -6.791 1.00 0.00 N ATOM 1534 CA LYS B 367 13.606 8.920 -8.011 1.00 0.00 C ATOM 1535 C LYS B 367 14.373 7.944 -8.900 1.00 0.00 C ATOM 1536 O LYS B 367 13.830 7.421 -9.874 1.00 0.00 O ATOM 1537 CB LYS B 367 14.490 10.121 -7.670 1.00 0.00 C ATOM 1538 CG LYS B 367 13.771 11.200 -6.875 1.00 0.00 C ATOM 1539 CD LYS B 367 14.637 12.439 -6.694 1.00 0.00 C ATOM 1540 CE LYS B 367 15.883 12.140 -5.874 1.00 0.00 C ATOM 1541 NZ LYS B 367 15.547 11.584 -4.535 1.00 0.00 N ATOM 0 H LYS B 367 13.875 7.873 -6.211 1.00 0.00 H new ATOM 0 HA LYS B 367 12.731 9.265 -8.561 1.00 0.00 H new ATOM 0 HB2 LYS B 367 15.353 9.776 -7.101 1.00 0.00 H new ATOM 0 HB3 LYS B 367 14.871 10.555 -8.594 1.00 0.00 H new ATOM 0 HG2 LYS B 367 12.847 11.473 -7.385 1.00 0.00 H new ATOM 0 HG3 LYS B 367 13.491 10.806 -5.898 1.00 0.00 H new ATOM 0 HD2 LYS B 367 14.928 12.825 -7.671 1.00 0.00 H new ATOM 0 HD3 LYS B 367 14.057 13.220 -6.203 1.00 0.00 H new ATOM 0 HE2 LYS B 367 16.511 11.432 -6.414 1.00 0.00 H new ATOM 0 HE3 LYS B 367 16.465 13.054 -5.752 1.00 0.00 H new ATOM 0 HZ1 LYS B 367 16.389 11.615 -3.925 1.00 0.00 H new ATOM 0 HZ2 LYS B 367 14.787 12.149 -4.105 1.00 0.00 H new ATOM 0 HZ3 LYS B 367 15.231 10.599 -4.638 1.00 0.00 H new ATOM 1555 N ASN B 368 15.636 7.705 -8.561 1.00 0.00 N ATOM 1556 CA ASN B 368 16.475 6.794 -9.333 1.00 0.00 C ATOM 1557 C ASN B 368 16.033 5.348 -9.137 1.00 0.00 C ATOM 1558 O ASN B 368 16.425 4.462 -9.896 1.00 0.00 O ATOM 1559 CB ASN B 368 17.942 6.954 -8.929 1.00 0.00 C ATOM 1560 CG ASN B 368 18.446 8.368 -9.136 1.00 0.00 C ATOM 1561 OD1 ASN B 368 18.946 8.712 -10.208 1.00 0.00 O ATOM 1562 ND2 ASN B 368 18.320 9.197 -8.107 1.00 0.00 N ATOM 0 H ASN B 368 16.101 8.129 -7.758 1.00 0.00 H new ATOM 0 HA ASN B 368 16.367 7.045 -10.388 1.00 0.00 H new ATOM 0 HB2 ASN B 368 18.060 6.679 -7.881 1.00 0.00 H new ATOM 0 HB3 ASN B 368 18.554 6.264 -9.510 1.00 0.00 H new ATOM 0 HD21 ASN B 368 18.644 10.161 -8.186 1.00 0.00 H new ATOM 0 HD22 ASN B 368 17.900 8.870 -7.237 1.00 0.00 H new ATOM 1569 N GLN B 369 15.216 5.118 -8.115 1.00 0.00 N ATOM 1570 CA GLN B 369 14.718 3.780 -7.818 1.00 0.00 C ATOM 1571 C GLN B 369 13.241 3.655 -8.175 1.00 0.00 C ATOM 1572 O GLN B 369 12.366 3.993 -7.376 1.00 0.00 O ATOM 1573 CB GLN B 369 14.930 3.450 -6.340 1.00 0.00 C ATOM 1574 CG GLN B 369 16.395 3.307 -5.958 1.00 0.00 C ATOM 1575 CD GLN B 369 16.614 3.303 -4.456 1.00 0.00 C ATOM 1576 OE1 GLN B 369 15.781 4.042 -3.733 1.00 0.00 O flip ATOM 1577 NE2 GLN B 369 17.528 2.651 -3.953 1.00 0.00 N flip ATOM 0 H GLN B 369 14.884 5.842 -7.478 1.00 0.00 H new ATOM 0 HA GLN B 369 15.279 3.069 -8.425 1.00 0.00 H new ATOM 0 HB2 GLN B 369 14.478 4.234 -5.732 1.00 0.00 H new ATOM 0 HB3 GLN B 369 14.408 2.523 -6.104 1.00 0.00 H new ATOM 0 HG2 GLN B 369 16.787 2.382 -6.380 1.00 0.00 H new ATOM 0 HG3 GLN B 369 16.963 4.125 -6.401 1.00 0.00 H new ATOM 0 HE21 GLN B 369 18.145 2.096 -4.546 1.00 0.00 H new ATOM 0 HE22 GLN B 369 17.669 2.665 -2.943 1.00 0.00 H new ATOM 1586 N GLU B 370 12.972 3.174 -9.383 1.00 0.00 N ATOM 1587 CA GLU B 370 11.603 3.002 -9.855 1.00 0.00 C ATOM 1588 C GLU B 370 11.104 1.588 -9.580 1.00 0.00 C ATOM 1589 O GLU B 370 9.940 1.273 -9.831 1.00 0.00 O ATOM 1590 CB GLU B 370 11.516 3.310 -11.351 1.00 0.00 C ATOM 1591 CG GLU B 370 11.908 4.736 -11.700 1.00 0.00 C ATOM 1592 CD GLU B 370 11.735 5.045 -13.174 1.00 0.00 C ATOM 1593 OE1 GLU B 370 12.676 4.778 -13.951 1.00 0.00 O ATOM 1594 OE2 GLU B 370 10.658 5.555 -13.551 1.00 0.00 O ATOM 0 H GLU B 370 13.686 2.895 -10.056 1.00 0.00 H new ATOM 0 HA GLU B 370 10.967 3.700 -9.311 1.00 0.00 H new ATOM 0 HB2 GLU B 370 12.163 2.621 -11.894 1.00 0.00 H new ATOM 0 HB3 GLU B 370 10.497 3.128 -11.693 1.00 0.00 H new ATOM 0 HG2 GLU B 370 11.304 5.429 -11.114 1.00 0.00 H new ATOM 0 HG3 GLU B 370 12.947 4.902 -11.417 1.00 0.00 H new ATOM 1601 N ASP B 371 11.994 0.741 -9.074 1.00 0.00 N ATOM 1602 CA ASP B 371 11.654 -0.645 -8.765 1.00 0.00 C ATOM 1603 C ASP B 371 10.342 -0.735 -7.986 1.00 0.00 C ATOM 1604 O ASP B 371 9.364 -1.306 -8.467 1.00 0.00 O ATOM 1605 CB ASP B 371 12.783 -1.297 -7.965 1.00 0.00 C ATOM 1606 CG ASP B 371 14.117 -1.219 -8.682 1.00 0.00 C ATOM 1607 OD1 ASP B 371 14.431 -2.149 -9.456 1.00 0.00 O ATOM 1608 OD2 ASP B 371 14.849 -0.230 -8.469 1.00 0.00 O ATOM 0 H ASP B 371 12.961 0.991 -8.868 1.00 0.00 H new ATOM 0 HA ASP B 371 11.525 -1.178 -9.707 1.00 0.00 H new ATOM 0 HB2 ASP B 371 12.866 -0.809 -6.994 1.00 0.00 H new ATOM 0 HB3 ASP B 371 12.535 -2.342 -7.776 1.00 0.00 H new ATOM 1613 N LEU B 372 10.331 -0.173 -6.780 1.00 0.00 N ATOM 1614 CA LEU B 372 9.147 -0.189 -5.933 1.00 0.00 C ATOM 1615 C LEU B 372 7.964 0.479 -6.627 1.00 0.00 C ATOM 1616 O LEU B 372 6.814 0.085 -6.431 1.00 0.00 O ATOM 1617 CB LEU B 372 9.429 0.533 -4.611 1.00 0.00 C ATOM 1618 CG LEU B 372 10.835 0.349 -4.017 1.00 0.00 C ATOM 1619 CD1 LEU B 372 11.373 -1.061 -4.243 1.00 0.00 C ATOM 1620 CD2 LEU B 372 11.794 1.397 -4.562 1.00 0.00 C ATOM 0 H LEU B 372 11.135 0.301 -6.368 1.00 0.00 H new ATOM 0 HA LEU B 372 8.896 -1.231 -5.736 1.00 0.00 H new ATOM 0 HB2 LEU B 372 9.259 1.599 -4.761 1.00 0.00 H new ATOM 0 HB3 LEU B 372 8.700 0.194 -3.875 1.00 0.00 H new ATOM 0 HG LEU B 372 10.753 0.488 -2.939 1.00 0.00 H new ATOM 0 HD11 LEU B 372 12.368 -1.145 -3.807 1.00 0.00 H new ATOM 0 HD12 LEU B 372 10.708 -1.784 -3.771 1.00 0.00 H new ATOM 0 HD13 LEU B 372 11.428 -1.262 -5.313 1.00 0.00 H new ATOM 0 HD21 LEU B 372 12.782 1.247 -4.128 1.00 0.00 H new ATOM 0 HD22 LEU B 372 11.856 1.304 -5.646 1.00 0.00 H new ATOM 0 HD23 LEU B 372 11.431 2.392 -4.303 1.00 0.00 H new ATOM 1632 N LEU B 373 8.256 1.493 -7.434 1.00 0.00 N ATOM 1633 CA LEU B 373 7.221 2.229 -8.150 1.00 0.00 C ATOM 1634 C LEU B 373 6.406 1.303 -9.050 1.00 0.00 C ATOM 1635 O LEU B 373 5.177 1.277 -8.977 1.00 0.00 O ATOM 1636 CB LEU B 373 7.856 3.349 -8.977 1.00 0.00 C ATOM 1637 CG LEU B 373 7.098 4.677 -8.975 1.00 0.00 C ATOM 1638 CD1 LEU B 373 6.973 5.228 -7.559 1.00 0.00 C ATOM 1639 CD2 LEU B 373 7.793 5.685 -9.878 1.00 0.00 C ATOM 0 H LEU B 373 9.205 1.825 -7.609 1.00 0.00 H new ATOM 0 HA LEU B 373 6.542 2.665 -7.417 1.00 0.00 H new ATOM 0 HB2 LEU B 373 8.865 3.526 -8.604 1.00 0.00 H new ATOM 0 HB3 LEU B 373 7.952 3.007 -10.007 1.00 0.00 H new ATOM 0 HG LEU B 373 6.094 4.498 -9.360 1.00 0.00 H new ATOM 0 HD11 LEU B 373 6.430 6.173 -7.583 1.00 0.00 H new ATOM 0 HD12 LEU B 373 6.432 4.514 -6.937 1.00 0.00 H new ATOM 0 HD13 LEU B 373 7.967 5.391 -7.143 1.00 0.00 H new ATOM 0 HD21 LEU B 373 7.242 6.625 -9.866 1.00 0.00 H new ATOM 0 HD22 LEU B 373 8.808 5.855 -9.520 1.00 0.00 H new ATOM 0 HD23 LEU B 373 7.828 5.298 -10.896 1.00 0.00 H new ATOM 1651 N SER B 374 7.096 0.545 -9.899 1.00 0.00 N ATOM 1652 CA SER B 374 6.432 -0.385 -10.809 1.00 0.00 C ATOM 1653 C SER B 374 5.729 -1.490 -10.026 1.00 0.00 C ATOM 1654 O SER B 374 4.573 -1.823 -10.298 1.00 0.00 O ATOM 1655 CB SER B 374 7.445 -0.995 -11.781 1.00 0.00 C ATOM 1656 OG SER B 374 6.816 -1.892 -12.678 1.00 0.00 O ATOM 0 H SER B 374 8.113 0.556 -9.976 1.00 0.00 H new ATOM 0 HA SER B 374 5.686 0.168 -11.379 1.00 0.00 H new ATOM 0 HB2 SER B 374 7.938 -0.201 -12.342 1.00 0.00 H new ATOM 0 HB3 SER B 374 8.220 -1.519 -11.222 1.00 0.00 H new ATOM 0 HG SER B 374 7.485 -2.266 -13.289 1.00 0.00 H new ATOM 1662 N GLU B 375 6.440 -2.051 -9.051 1.00 0.00 N ATOM 1663 CA GLU B 375 5.895 -3.113 -8.216 1.00 0.00 C ATOM 1664 C GLU B 375 4.580 -2.672 -7.585 1.00 0.00 C ATOM 1665 O GLU B 375 3.665 -3.475 -7.407 1.00 0.00 O ATOM 1666 CB GLU B 375 6.896 -3.497 -7.126 1.00 0.00 C ATOM 1667 CG GLU B 375 6.434 -4.649 -6.251 1.00 0.00 C ATOM 1668 CD GLU B 375 6.192 -5.921 -7.040 1.00 0.00 C ATOM 1669 OE1 GLU B 375 7.155 -6.691 -7.236 1.00 0.00 O ATOM 1670 OE2 GLU B 375 5.039 -6.146 -7.462 1.00 0.00 O ATOM 0 H GLU B 375 7.398 -1.785 -8.821 1.00 0.00 H new ATOM 0 HA GLU B 375 5.707 -3.984 -8.844 1.00 0.00 H new ATOM 0 HB2 GLU B 375 7.844 -3.765 -7.593 1.00 0.00 H new ATOM 0 HB3 GLU B 375 7.085 -2.628 -6.496 1.00 0.00 H new ATOM 0 HG2 GLU B 375 7.183 -4.840 -5.483 1.00 0.00 H new ATOM 0 HG3 GLU B 375 5.516 -4.364 -5.737 1.00 0.00 H new ATOM 1677 N PHE B 376 4.496 -1.389 -7.250 1.00 0.00 N ATOM 1678 CA PHE B 376 3.291 -0.836 -6.649 1.00 0.00 C ATOM 1679 C PHE B 376 2.235 -0.598 -7.719 1.00 0.00 C ATOM 1680 O PHE B 376 1.036 -0.717 -7.463 1.00 0.00 O ATOM 1681 CB PHE B 376 3.606 0.474 -5.923 1.00 0.00 C ATOM 1682 CG PHE B 376 2.420 1.070 -5.219 1.00 0.00 C ATOM 1683 CD1 PHE B 376 1.995 0.562 -4.001 1.00 0.00 C ATOM 1684 CD2 PHE B 376 1.729 2.134 -5.775 1.00 0.00 C ATOM 1685 CE1 PHE B 376 0.903 1.106 -3.352 1.00 0.00 C ATOM 1686 CE2 PHE B 376 0.636 2.682 -5.130 1.00 0.00 C ATOM 1687 CZ PHE B 376 0.223 2.167 -3.917 1.00 0.00 C ATOM 0 H PHE B 376 5.249 -0.714 -7.385 1.00 0.00 H new ATOM 0 HA PHE B 376 2.906 -1.552 -5.923 1.00 0.00 H new ATOM 0 HB2 PHE B 376 4.398 0.296 -5.196 1.00 0.00 H new ATOM 0 HB3 PHE B 376 3.991 1.196 -6.643 1.00 0.00 H new ATOM 0 HD1 PHE B 376 2.523 -0.268 -3.555 1.00 0.00 H new ATOM 0 HD2 PHE B 376 2.048 2.540 -6.724 1.00 0.00 H new ATOM 0 HE1 PHE B 376 0.582 0.702 -2.404 1.00 0.00 H new ATOM 0 HE2 PHE B 376 0.106 3.512 -5.574 1.00 0.00 H new ATOM 0 HZ PHE B 376 -0.631 2.593 -3.411 1.00 0.00 H new ATOM 1697 N GLY B 377 2.693 -0.258 -8.920 1.00 0.00 N ATOM 1698 CA GLY B 377 1.782 -0.015 -10.020 1.00 0.00 C ATOM 1699 C GLY B 377 0.958 -1.241 -10.355 1.00 0.00 C ATOM 1700 O GLY B 377 -0.213 -1.130 -10.719 1.00 0.00 O ATOM 0 H GLY B 377 3.681 -0.147 -9.150 1.00 0.00 H new ATOM 0 HA2 GLY B 377 1.117 0.810 -9.765 1.00 0.00 H new ATOM 0 HA3 GLY B 377 2.349 0.292 -10.899 1.00 0.00 H new ATOM 1704 N GLN B 378 1.576 -2.415 -10.234 1.00 0.00 N ATOM 1705 CA GLN B 378 0.887 -3.671 -10.517 1.00 0.00 C ATOM 1706 C GLN B 378 -0.383 -3.789 -9.680 1.00 0.00 C ATOM 1707 O GLN B 378 -1.345 -4.444 -10.082 1.00 0.00 O ATOM 1708 CB GLN B 378 1.805 -4.863 -10.246 1.00 0.00 C ATOM 1709 CG GLN B 378 3.042 -4.890 -11.129 1.00 0.00 C ATOM 1710 CD GLN B 378 3.854 -6.159 -10.959 1.00 0.00 C ATOM 1711 OE1 GLN B 378 3.876 -6.757 -9.883 1.00 0.00 O ATOM 1712 NE2 GLN B 378 4.526 -6.577 -12.025 1.00 0.00 N ATOM 0 H GLN B 378 2.548 -2.522 -9.943 1.00 0.00 H new ATOM 0 HA GLN B 378 0.612 -3.674 -11.572 1.00 0.00 H new ATOM 0 HB2 GLN B 378 2.115 -4.842 -9.201 1.00 0.00 H new ATOM 0 HB3 GLN B 378 1.243 -5.785 -10.394 1.00 0.00 H new ATOM 0 HG2 GLN B 378 2.741 -4.793 -12.172 1.00 0.00 H new ATOM 0 HG3 GLN B 378 3.668 -4.029 -10.897 1.00 0.00 H new ATOM 0 HE21 GLN B 378 4.479 -6.050 -12.897 1.00 0.00 H new ATOM 0 HE22 GLN B 378 5.090 -7.426 -11.972 1.00 0.00 H new ATOM 1721 N PHE B 379 -0.376 -3.153 -8.511 1.00 0.00 N ATOM 1722 CA PHE B 379 -1.530 -3.174 -7.621 1.00 0.00 C ATOM 1723 C PHE B 379 -2.652 -2.302 -8.183 1.00 0.00 C ATOM 1724 O PHE B 379 -2.825 -2.216 -9.399 1.00 0.00 O ATOM 1725 CB PHE B 379 -1.130 -2.690 -6.221 1.00 0.00 C ATOM 1726 CG PHE B 379 -0.258 -3.659 -5.473 1.00 0.00 C ATOM 1727 CD1 PHE B 379 1.101 -3.732 -5.732 1.00 0.00 C ATOM 1728 CD2 PHE B 379 -0.799 -4.497 -4.511 1.00 0.00 C ATOM 1729 CE1 PHE B 379 1.904 -4.622 -5.044 1.00 0.00 C ATOM 1730 CE2 PHE B 379 0.000 -5.388 -3.820 1.00 0.00 C ATOM 1731 CZ PHE B 379 1.354 -5.451 -4.088 1.00 0.00 C ATOM 0 H PHE B 379 0.417 -2.617 -8.159 1.00 0.00 H new ATOM 0 HA PHE B 379 -1.892 -4.199 -7.546 1.00 0.00 H new ATOM 0 HB2 PHE B 379 -0.606 -1.738 -6.311 1.00 0.00 H new ATOM 0 HB3 PHE B 379 -2.033 -2.503 -5.639 1.00 0.00 H new ATOM 0 HD1 PHE B 379 1.538 -3.086 -6.480 1.00 0.00 H new ATOM 0 HD2 PHE B 379 -1.857 -4.453 -4.299 1.00 0.00 H new ATOM 0 HE1 PHE B 379 2.962 -4.669 -5.255 1.00 0.00 H new ATOM 0 HE2 PHE B 379 -0.433 -6.034 -3.071 1.00 0.00 H new ATOM 0 HZ PHE B 379 1.980 -6.148 -3.550 1.00 0.00 H new ATOM 1741 N LEU B 380 -3.413 -1.664 -7.292 1.00 0.00 N ATOM 1742 CA LEU B 380 -4.522 -0.800 -7.695 1.00 0.00 C ATOM 1743 C LEU B 380 -5.643 -1.617 -8.339 1.00 0.00 C ATOM 1744 O LEU B 380 -5.381 -2.582 -9.057 1.00 0.00 O ATOM 1745 CB LEU B 380 -4.045 0.286 -8.666 1.00 0.00 C ATOM 1746 CG LEU B 380 -2.885 1.151 -8.167 1.00 0.00 C ATOM 1747 CD1 LEU B 380 -2.330 1.998 -9.302 1.00 0.00 C ATOM 1748 CD2 LEU B 380 -3.333 2.040 -7.014 1.00 0.00 C ATOM 0 H LEU B 380 -3.280 -1.730 -6.283 1.00 0.00 H new ATOM 0 HA LEU B 380 -4.910 -0.320 -6.797 1.00 0.00 H new ATOM 0 HB2 LEU B 380 -3.745 -0.191 -9.599 1.00 0.00 H new ATOM 0 HB3 LEU B 380 -4.888 0.937 -8.898 1.00 0.00 H new ATOM 0 HG LEU B 380 -2.097 0.491 -7.805 1.00 0.00 H new ATOM 0 HD11 LEU B 380 -1.506 2.608 -8.932 1.00 0.00 H new ATOM 0 HD12 LEU B 380 -1.970 1.347 -10.099 1.00 0.00 H new ATOM 0 HD13 LEU B 380 -3.116 2.647 -9.690 1.00 0.00 H new ATOM 0 HD21 LEU B 380 -2.493 2.646 -6.675 1.00 0.00 H new ATOM 0 HD22 LEU B 380 -4.139 2.692 -7.349 1.00 0.00 H new ATOM 0 HD23 LEU B 380 -3.687 1.418 -6.192 1.00 0.00 H new ATOM 1760 N PRO B 381 -6.912 -1.242 -8.089 1.00 0.00 N ATOM 1761 CA PRO B 381 -8.069 -1.948 -8.650 1.00 0.00 C ATOM 1762 C PRO B 381 -7.984 -2.090 -10.166 1.00 0.00 C ATOM 1763 O PRO B 381 -7.981 -1.096 -10.893 1.00 0.00 O ATOM 1764 CB PRO B 381 -9.253 -1.059 -8.266 1.00 0.00 C ATOM 1765 CG PRO B 381 -8.797 -0.318 -7.059 1.00 0.00 C ATOM 1766 CD PRO B 381 -7.320 -0.109 -7.237 1.00 0.00 C ATOM 0 HA PRO B 381 -8.143 -2.967 -8.271 1.00 0.00 H new ATOM 0 HB2 PRO B 381 -9.513 -0.376 -9.075 1.00 0.00 H new ATOM 0 HB3 PRO B 381 -10.141 -1.654 -8.053 1.00 0.00 H new ATOM 0 HG2 PRO B 381 -9.318 0.635 -6.966 1.00 0.00 H new ATOM 0 HG3 PRO B 381 -9.005 -0.885 -6.151 1.00 0.00 H new ATOM 0 HD2 PRO B 381 -7.104 0.848 -7.712 1.00 0.00 H new ATOM 0 HD3 PRO B 381 -6.796 -0.116 -6.281 1.00 0.00 H new