USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=21 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 372 SER OG : rot 140:sc= -0.226 USER MOD Set 1.2: B 339 GLN : amide:sc= -0.232 X(o=-0.46,f=-0.6) USER MOD Set 2.1: B 315 LYS NZ :NH3+ -142:sc= 0.439 (180deg=-0.405) USER MOD Set 2.2: B 325 TYR OH : rot -136:sc= 0.473 USER MOD Single : A 368 TYR OH : rot 180:sc= 0 USER MOD Single : A 371 SER OG : rot 140:sc= 0.392 USER MOD Single : A 373 MET CE :methyl 155:sc= -0.0132 (180deg=-1.39) USER MOD Single : A 376 GLN : amide:sc= -0.703 X(o=-0.7,f=-0.34) USER MOD Single : B 305 ASN : amide:sc= -0.0109 K(o=-0.011,f=-0.57) USER MOD Single : B 306 HIS : no HE2:sc= -1.13 K(o=-1.1,f=-2.4) USER MOD Single : B 309 ASN :FLIP amide:sc= -0.0721 F(o=-2.4!,f=-0.072) USER MOD Single : B 310 TYR OH : rot 177:sc= 0.621 USER MOD Single : B 312 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 313 LYS NZ :NH3+ -148:sc= -1.8! (180deg=-2!) USER MOD Single : B 316 ASN : amide:sc= -0.0111 X(o=-0.011,f=-0.045) USER MOD Single : B 319 GLN :FLIP amide:sc= 1.17 F(o=0,f=1.2) USER MOD Single : B 321 GLN :FLIP amide:sc= -1.07 F(o=-3.3!,f=-1.1) USER MOD Single : B 326 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 333 HIS : no HD1:sc= -0.0278 X(o=-0.028,f=-0.41) USER MOD Single : B 334 THR OG1 : rot 79:sc= 0.0924 USER MOD Single : B 335 TYR OH : rot 180:sc= 0 USER MOD Single : B 336 GLN :FLIP amide:sc= -0.427 F(o=-1.5,f=-0.43) USER MOD Single : B 337 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 341 ASN : amide:sc= -0.69 K(o=-0.69,f=-3.1!) USER MOD Single : B 343 LYS NZ :NH3+ -171:sc=-0.00478 (180deg=-0.172) USER MOD Single : B 354 THR OG1 : rot 180:sc= 0 USER MOD Single : B 356 GLN :FLIP amide:sc= -0.107 F(o=-1.1,f=-0.11) USER MOD Single : B 359 TYR OH : rot 94:sc= 0.424 USER MOD Single : B 361 GLN : amide:sc= -0.164 K(o=-0.16,f=-1.4) USER MOD Single : B 367 LYS NZ :NH3+ 167:sc= -0.0429 (180deg=-0.25) USER MOD Single : B 368 ASN : amide:sc= -0.082 X(o=-0.082,f=-0.2) USER MOD Single : B 369 GLN : amide:sc= -0.959 K(o=-0.96,f=-3.5!) USER MOD Single : B 374 SER OG : rot 180:sc= 0 USER MOD Single : B 378 GLN : amide:sc= -0.853 K(o=-0.85,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 114 N ALA A 366 -0.396 -1.907 8.027 1.00 0.00 N ATOM 115 CA ALA A 366 0.097 -1.926 6.653 1.00 0.00 C ATOM 116 C ALA A 366 -0.516 -3.076 5.860 1.00 0.00 C ATOM 117 O ALA A 366 -0.869 -2.918 4.693 1.00 0.00 O ATOM 118 CB ALA A 366 1.614 -2.022 6.636 1.00 0.00 C ATOM 0 HA ALA A 366 -0.203 -0.993 6.177 1.00 0.00 H new ATOM 0 HB1 ALA A 366 1.966 -2.035 5.605 1.00 0.00 H new ATOM 0 HB2 ALA A 366 2.039 -1.162 7.154 1.00 0.00 H new ATOM 0 HB3 ALA A 366 1.926 -2.938 7.138 1.00 0.00 H new ATOM 124 N VAL A 367 -0.638 -4.233 6.499 1.00 0.00 N ATOM 125 CA VAL A 367 -1.212 -5.404 5.849 1.00 0.00 C ATOM 126 C VAL A 367 -2.665 -5.158 5.455 1.00 0.00 C ATOM 127 O VAL A 367 -3.173 -5.764 4.511 1.00 0.00 O ATOM 128 CB VAL A 367 -1.139 -6.647 6.756 1.00 0.00 C ATOM 129 CG1 VAL A 367 0.301 -7.106 6.920 1.00 0.00 C ATOM 130 CG2 VAL A 367 -1.769 -6.357 8.110 1.00 0.00 C ATOM 0 H VAL A 367 -0.348 -4.385 7.465 1.00 0.00 H new ATOM 0 HA VAL A 367 -0.621 -5.587 4.951 1.00 0.00 H new ATOM 0 HB VAL A 367 -1.701 -7.452 6.283 1.00 0.00 H new ATOM 0 HG11 VAL A 367 0.332 -7.985 7.564 1.00 0.00 H new ATOM 0 HG12 VAL A 367 0.716 -7.357 5.944 1.00 0.00 H new ATOM 0 HG13 VAL A 367 0.889 -6.306 7.370 1.00 0.00 H new ATOM 0 HG21 VAL A 367 -1.708 -7.246 8.737 1.00 0.00 H new ATOM 0 HG22 VAL A 367 -1.236 -5.537 8.591 1.00 0.00 H new ATOM 0 HG23 VAL A 367 -2.814 -6.080 7.973 1.00 0.00 H new ATOM 140 N TYR A 368 -3.327 -4.259 6.179 1.00 0.00 N ATOM 141 CA TYR A 368 -4.723 -3.936 5.906 1.00 0.00 C ATOM 142 C TYR A 368 -4.857 -3.099 4.637 1.00 0.00 C ATOM 143 O TYR A 368 -5.595 -3.464 3.722 1.00 0.00 O ATOM 144 CB TYR A 368 -5.341 -3.192 7.091 1.00 0.00 C ATOM 145 CG TYR A 368 -6.848 -3.085 7.018 1.00 0.00 C ATOM 146 CD1 TYR A 368 -7.660 -4.098 7.514 1.00 0.00 C ATOM 147 CD2 TYR A 368 -7.459 -1.972 6.453 1.00 0.00 C ATOM 148 CE1 TYR A 368 -9.037 -4.005 7.450 1.00 0.00 C ATOM 149 CE2 TYR A 368 -8.836 -1.872 6.385 1.00 0.00 C ATOM 150 CZ TYR A 368 -9.620 -2.891 6.885 1.00 0.00 C ATOM 151 OH TYR A 368 -10.991 -2.795 6.819 1.00 0.00 O ATOM 0 H TYR A 368 -2.919 -3.742 6.958 1.00 0.00 H new ATOM 0 HA TYR A 368 -5.259 -4.873 5.756 1.00 0.00 H new ATOM 0 HB2 TYR A 368 -5.065 -3.703 8.014 1.00 0.00 H new ATOM 0 HB3 TYR A 368 -4.916 -2.190 7.142 1.00 0.00 H new ATOM 0 HD1 TYR A 368 -7.207 -4.973 7.957 1.00 0.00 H new ATOM 0 HD2 TYR A 368 -6.848 -1.172 6.061 1.00 0.00 H new ATOM 0 HE1 TYR A 368 -9.653 -4.801 7.841 1.00 0.00 H new ATOM 0 HE2 TYR A 368 -9.296 -1.001 5.943 1.00 0.00 H new ATOM 0 HH TYR A 368 -11.240 -1.948 6.393 1.00 0.00 H new ATOM 161 N VAL A 369 -4.145 -1.974 4.586 1.00 0.00 N ATOM 162 CA VAL A 369 -4.195 -1.095 3.422 1.00 0.00 C ATOM 163 C VAL A 369 -3.781 -1.845 2.158 1.00 0.00 C ATOM 164 O VAL A 369 -4.399 -1.692 1.103 1.00 0.00 O ATOM 165 CB VAL A 369 -3.302 0.151 3.606 1.00 0.00 C ATOM 166 CG1 VAL A 369 -1.866 -0.248 3.901 1.00 0.00 C ATOM 167 CG2 VAL A 369 -3.373 1.048 2.379 1.00 0.00 C ATOM 0 H VAL A 369 -3.530 -1.652 5.334 1.00 0.00 H new ATOM 0 HA VAL A 369 -5.227 -0.760 3.318 1.00 0.00 H new ATOM 0 HB VAL A 369 -3.677 0.713 4.462 1.00 0.00 H new ATOM 0 HG11 VAL A 369 -1.258 0.648 4.026 1.00 0.00 H new ATOM 0 HG12 VAL A 369 -1.833 -0.840 4.816 1.00 0.00 H new ATOM 0 HG13 VAL A 369 -1.475 -0.839 3.073 1.00 0.00 H new ATOM 0 HG21 VAL A 369 -2.737 1.920 2.529 1.00 0.00 H new ATOM 0 HG22 VAL A 369 -3.031 0.495 1.504 1.00 0.00 H new ATOM 0 HG23 VAL A 369 -4.402 1.372 2.224 1.00 0.00 H new ATOM 177 N LEU A 370 -2.734 -2.659 2.272 1.00 0.00 N ATOM 178 CA LEU A 370 -2.254 -3.445 1.142 1.00 0.00 C ATOM 179 C LEU A 370 -3.327 -4.434 0.697 1.00 0.00 C ATOM 180 O LEU A 370 -3.615 -4.565 -0.494 1.00 0.00 O ATOM 181 CB LEU A 370 -0.970 -4.196 1.513 1.00 0.00 C ATOM 182 CG LEU A 370 0.346 -3.490 1.162 1.00 0.00 C ATOM 183 CD1 LEU A 370 0.370 -3.075 -0.302 1.00 0.00 C ATOM 184 CD2 LEU A 370 0.566 -2.288 2.065 1.00 0.00 C ATOM 0 H LEU A 370 -2.204 -2.790 3.134 1.00 0.00 H new ATOM 0 HA LEU A 370 -2.033 -2.765 0.319 1.00 0.00 H new ATOM 0 HB2 LEU A 370 -0.982 -4.388 2.586 1.00 0.00 H new ATOM 0 HB3 LEU A 370 -0.983 -5.166 1.016 1.00 0.00 H new ATOM 0 HG LEU A 370 1.161 -4.195 1.324 1.00 0.00 H new ATOM 0 HD11 LEU A 370 1.314 -2.577 -0.524 1.00 0.00 H new ATOM 0 HD12 LEU A 370 0.269 -3.959 -0.932 1.00 0.00 H new ATOM 0 HD13 LEU A 370 -0.456 -2.392 -0.500 1.00 0.00 H new ATOM 0 HD21 LEU A 370 1.504 -1.801 1.800 1.00 0.00 H new ATOM 0 HD22 LEU A 370 -0.256 -1.584 1.940 1.00 0.00 H new ATOM 0 HD23 LEU A 370 0.608 -2.616 3.104 1.00 0.00 H new ATOM 196 N SER A 371 -3.919 -5.124 1.669 1.00 0.00 N ATOM 197 CA SER A 371 -4.972 -6.094 1.391 1.00 0.00 C ATOM 198 C SER A 371 -6.203 -5.401 0.813 1.00 0.00 C ATOM 199 O SER A 371 -7.006 -6.019 0.115 1.00 0.00 O ATOM 200 CB SER A 371 -5.351 -6.847 2.667 1.00 0.00 C ATOM 201 OG SER A 371 -6.467 -7.692 2.449 1.00 0.00 O ATOM 0 H SER A 371 -3.686 -5.028 2.657 1.00 0.00 H new ATOM 0 HA SER A 371 -4.595 -6.806 0.657 1.00 0.00 H new ATOM 0 HB2 SER A 371 -4.503 -7.441 3.008 1.00 0.00 H new ATOM 0 HB3 SER A 371 -5.580 -6.134 3.459 1.00 0.00 H new ATOM 0 HG SER A 371 -6.330 -8.542 2.917 1.00 0.00 H new ATOM 207 N SER A 372 -6.343 -4.112 1.110 1.00 0.00 N ATOM 208 CA SER A 372 -7.475 -3.332 0.622 1.00 0.00 C ATOM 209 C SER A 372 -7.335 -3.056 -0.870 1.00 0.00 C ATOM 210 O SER A 372 -8.264 -3.287 -1.642 1.00 0.00 O ATOM 211 CB SER A 372 -7.585 -2.014 1.391 1.00 0.00 C ATOM 212 OG SER A 372 -8.688 -1.250 0.934 1.00 0.00 O ATOM 0 H SER A 372 -5.686 -3.586 1.686 1.00 0.00 H new ATOM 0 HA SER A 372 -8.384 -3.912 0.784 1.00 0.00 H new ATOM 0 HB2 SER A 372 -7.696 -2.218 2.456 1.00 0.00 H new ATOM 0 HB3 SER A 372 -6.666 -1.441 1.270 1.00 0.00 H new ATOM 0 HG SER A 372 -9.135 -0.831 1.699 1.00 0.00 H new ATOM 218 N MET A 373 -6.169 -2.556 -1.269 1.00 0.00 N ATOM 219 CA MET A 373 -5.906 -2.255 -2.672 1.00 0.00 C ATOM 220 C MET A 373 -5.980 -3.522 -3.520 1.00 0.00 C ATOM 221 O MET A 373 -6.524 -3.513 -4.624 1.00 0.00 O ATOM 222 CB MET A 373 -4.526 -1.610 -2.827 1.00 0.00 C ATOM 223 CG MET A 373 -4.375 -0.296 -2.079 1.00 0.00 C ATOM 224 SD MET A 373 -2.741 0.435 -2.292 1.00 0.00 S ATOM 225 CE MET A 373 -2.890 1.904 -1.279 1.00 0.00 C ATOM 0 H MET A 373 -5.392 -2.351 -0.641 1.00 0.00 H new ATOM 0 HA MET A 373 -6.669 -1.557 -3.018 1.00 0.00 H new ATOM 0 HB2 MET A 373 -3.767 -2.308 -2.473 1.00 0.00 H new ATOM 0 HB3 MET A 373 -4.332 -1.439 -3.886 1.00 0.00 H new ATOM 0 HG2 MET A 373 -5.132 0.406 -2.428 1.00 0.00 H new ATOM 0 HG3 MET A 373 -4.560 -0.462 -1.018 1.00 0.00 H new ATOM 0 HE1 MET A 373 -1.901 2.217 -0.944 1.00 0.00 H new ATOM 0 HE2 MET A 373 -3.345 2.704 -1.863 1.00 0.00 H new ATOM 0 HE3 MET A 373 -3.515 1.687 -0.413 1.00 0.00 H new ATOM 235 N ALA A 374 -5.432 -4.613 -2.991 1.00 0.00 N ATOM 236 CA ALA A 374 -5.419 -5.889 -3.699 1.00 0.00 C ATOM 237 C ALA A 374 -6.826 -6.453 -3.889 1.00 0.00 C ATOM 238 O ALA A 374 -7.241 -6.739 -5.011 1.00 0.00 O ATOM 239 CB ALA A 374 -4.547 -6.890 -2.955 1.00 0.00 C ATOM 0 H ALA A 374 -4.990 -4.638 -2.072 1.00 0.00 H new ATOM 0 HA ALA A 374 -5.003 -5.711 -4.690 1.00 0.00 H new ATOM 0 HB1 ALA A 374 -4.544 -7.839 -3.491 1.00 0.00 H new ATOM 0 HB2 ALA A 374 -3.529 -6.507 -2.889 1.00 0.00 H new ATOM 0 HB3 ALA A 374 -4.943 -7.042 -1.951 1.00 0.00 H new ATOM 245 N ARG A 375 -7.553 -6.616 -2.789 1.00 0.00 N ATOM 246 CA ARG A 375 -8.909 -7.157 -2.841 1.00 0.00 C ATOM 247 C ARG A 375 -9.831 -6.287 -3.693 1.00 0.00 C ATOM 248 O ARG A 375 -10.599 -6.797 -4.508 1.00 0.00 O ATOM 249 CB ARG A 375 -9.479 -7.290 -1.428 1.00 0.00 C ATOM 250 CG ARG A 375 -8.864 -8.426 -0.628 1.00 0.00 C ATOM 251 CD ARG A 375 -9.258 -9.782 -1.193 1.00 0.00 C ATOM 252 NE ARG A 375 -10.706 -9.973 -1.184 1.00 0.00 N ATOM 253 CZ ARG A 375 -11.319 -11.004 -1.757 1.00 0.00 C ATOM 254 NH1 ARG A 375 -10.614 -11.933 -2.389 1.00 0.00 N ATOM 255 NH2 ARG A 375 -12.640 -11.105 -1.700 1.00 0.00 N ATOM 0 H ARG A 375 -7.228 -6.382 -1.851 1.00 0.00 H new ATOM 0 HA ARG A 375 -8.853 -8.142 -3.305 1.00 0.00 H new ATOM 0 HB2 ARG A 375 -9.323 -6.354 -0.893 1.00 0.00 H new ATOM 0 HB3 ARG A 375 -10.556 -7.444 -1.493 1.00 0.00 H new ATOM 0 HG2 ARG A 375 -7.778 -8.330 -0.633 1.00 0.00 H new ATOM 0 HG3 ARG A 375 -9.185 -8.356 0.411 1.00 0.00 H new ATOM 0 HD2 ARG A 375 -8.886 -9.873 -2.213 1.00 0.00 H new ATOM 0 HD3 ARG A 375 -8.784 -10.571 -0.609 1.00 0.00 H new ATOM 0 HE ARG A 375 -11.280 -9.275 -0.711 1.00 0.00 H new ATOM 0 HH11 ARG A 375 -9.598 -11.858 -2.437 1.00 0.00 H new ATOM 0 HH12 ARG A 375 -11.088 -12.723 -2.827 1.00 0.00 H new ATOM 0 HH21 ARG A 375 -13.186 -10.392 -1.217 1.00 0.00 H new ATOM 0 HH22 ARG A 375 -13.110 -11.896 -2.140 1.00 0.00 H new ATOM 269 N GLN A 376 -9.749 -4.975 -3.502 1.00 0.00 N ATOM 270 CA GLN A 376 -10.586 -4.038 -4.245 1.00 0.00 C ATOM 271 C GLN A 376 -10.237 -4.021 -5.731 1.00 0.00 C ATOM 272 O GLN A 376 -10.959 -3.433 -6.536 1.00 0.00 O ATOM 273 CB GLN A 376 -10.452 -2.629 -3.665 1.00 0.00 C ATOM 274 CG GLN A 376 -11.174 -2.448 -2.340 1.00 0.00 C ATOM 275 CD GLN A 376 -12.675 -2.624 -2.469 1.00 0.00 C ATOM 276 OE1 GLN A 376 -13.405 -1.664 -2.716 1.00 0.00 O ATOM 277 NE2 GLN A 376 -13.143 -3.856 -2.304 1.00 0.00 N ATOM 0 H GLN A 376 -9.111 -4.535 -2.839 1.00 0.00 H new ATOM 0 HA GLN A 376 -11.618 -4.375 -4.146 1.00 0.00 H new ATOM 0 HB2 GLN A 376 -9.395 -2.400 -3.528 1.00 0.00 H new ATOM 0 HB3 GLN A 376 -10.844 -1.910 -4.384 1.00 0.00 H new ATOM 0 HG2 GLN A 376 -10.788 -3.167 -1.618 1.00 0.00 H new ATOM 0 HG3 GLN A 376 -10.960 -1.454 -1.946 1.00 0.00 H new ATOM 0 HE21 GLN A 376 -12.501 -4.622 -2.100 1.00 0.00 H new ATOM 0 HE22 GLN A 376 -14.144 -4.036 -2.381 1.00 0.00 H new ATOM 465 N VAL B 302 -3.367 -13.740 -2.996 1.00 0.00 N ATOM 466 CA VAL B 302 -2.805 -12.587 -3.690 1.00 0.00 C ATOM 467 C VAL B 302 -2.285 -11.533 -2.712 1.00 0.00 C ATOM 468 O VAL B 302 -1.101 -11.198 -2.726 1.00 0.00 O ATOM 469 CB VAL B 302 -3.836 -11.942 -4.641 1.00 0.00 C ATOM 470 CG1 VAL B 302 -4.014 -12.793 -5.889 1.00 0.00 C ATOM 471 CG2 VAL B 302 -5.172 -11.740 -3.940 1.00 0.00 C ATOM 0 HA VAL B 302 -1.966 -12.959 -4.278 1.00 0.00 H new ATOM 0 HB VAL B 302 -3.457 -10.964 -4.937 1.00 0.00 H new ATOM 0 HG11 VAL B 302 -4.744 -12.324 -6.548 1.00 0.00 H new ATOM 0 HG12 VAL B 302 -3.060 -12.881 -6.408 1.00 0.00 H new ATOM 0 HG13 VAL B 302 -4.366 -13.785 -5.606 1.00 0.00 H new ATOM 0 HG21 VAL B 302 -5.881 -11.284 -4.632 1.00 0.00 H new ATOM 0 HG22 VAL B 302 -5.558 -12.704 -3.608 1.00 0.00 H new ATOM 0 HG23 VAL B 302 -5.035 -11.087 -3.078 1.00 0.00 H new ATOM 481 N GLU B 303 -3.169 -11.023 -1.860 1.00 0.00 N ATOM 482 CA GLU B 303 -2.800 -9.996 -0.889 1.00 0.00 C ATOM 483 C GLU B 303 -1.663 -10.458 0.019 1.00 0.00 C ATOM 484 O GLU B 303 -0.764 -9.683 0.341 1.00 0.00 O ATOM 485 CB GLU B 303 -4.016 -9.610 -0.043 1.00 0.00 C ATOM 486 CG GLU B 303 -4.656 -10.790 0.668 1.00 0.00 C ATOM 487 CD GLU B 303 -5.832 -10.387 1.534 1.00 0.00 C ATOM 488 OE1 GLU B 303 -6.954 -10.272 0.998 1.00 0.00 O ATOM 489 OE2 GLU B 303 -5.632 -10.187 2.751 1.00 0.00 O ATOM 0 H GLU B 303 -4.149 -11.304 -1.822 1.00 0.00 H new ATOM 0 HA GLU B 303 -2.451 -9.126 -1.446 1.00 0.00 H new ATOM 0 HB2 GLU B 303 -3.714 -8.870 0.698 1.00 0.00 H new ATOM 0 HB3 GLU B 303 -4.759 -9.135 -0.684 1.00 0.00 H new ATOM 0 HG2 GLU B 303 -4.989 -11.517 -0.072 1.00 0.00 H new ATOM 0 HG3 GLU B 303 -3.908 -11.285 1.287 1.00 0.00 H new ATOM 496 N PHE B 304 -1.703 -11.722 0.424 1.00 0.00 N ATOM 497 CA PHE B 304 -0.681 -12.274 1.308 1.00 0.00 C ATOM 498 C PHE B 304 0.712 -12.203 0.688 1.00 0.00 C ATOM 499 O PHE B 304 1.515 -11.341 1.041 1.00 0.00 O ATOM 500 CB PHE B 304 -1.014 -13.724 1.667 1.00 0.00 C ATOM 501 CG PHE B 304 -2.191 -13.860 2.590 1.00 0.00 C ATOM 502 CD1 PHE B 304 -3.482 -13.907 2.089 1.00 0.00 C ATOM 503 CD2 PHE B 304 -2.005 -13.942 3.961 1.00 0.00 C ATOM 504 CE1 PHE B 304 -4.565 -14.034 2.937 1.00 0.00 C ATOM 505 CE2 PHE B 304 -3.084 -14.068 4.814 1.00 0.00 C ATOM 506 CZ PHE B 304 -4.366 -14.114 4.302 1.00 0.00 C ATOM 0 H PHE B 304 -2.431 -12.384 0.155 1.00 0.00 H new ATOM 0 HA PHE B 304 -0.675 -11.666 2.212 1.00 0.00 H new ATOM 0 HB2 PHE B 304 -1.215 -14.279 0.751 1.00 0.00 H new ATOM 0 HB3 PHE B 304 -0.142 -14.183 2.133 1.00 0.00 H new ATOM 0 HD1 PHE B 304 -3.643 -13.844 1.023 1.00 0.00 H new ATOM 0 HD2 PHE B 304 -1.005 -13.907 4.367 1.00 0.00 H new ATOM 0 HE1 PHE B 304 -5.566 -14.071 2.534 1.00 0.00 H new ATOM 0 HE2 PHE B 304 -2.925 -14.131 5.880 1.00 0.00 H new ATOM 0 HZ PHE B 304 -5.211 -14.212 4.967 1.00 0.00 H new ATOM 516 N ASN B 305 0.988 -13.110 -0.241 1.00 0.00 N ATOM 517 CA ASN B 305 2.292 -13.179 -0.897 1.00 0.00 C ATOM 518 C ASN B 305 2.752 -11.826 -1.445 1.00 0.00 C ATOM 519 O ASN B 305 3.906 -11.438 -1.260 1.00 0.00 O ATOM 520 CB ASN B 305 2.253 -14.205 -2.031 1.00 0.00 C ATOM 521 CG ASN B 305 3.570 -14.290 -2.779 1.00 0.00 C ATOM 522 OD1 ASN B 305 4.638 -14.067 -2.207 1.00 0.00 O ATOM 523 ND2 ASN B 305 3.500 -14.612 -4.065 1.00 0.00 N ATOM 0 H ASN B 305 0.322 -13.814 -0.560 1.00 0.00 H new ATOM 0 HA ASN B 305 3.013 -13.483 -0.138 1.00 0.00 H new ATOM 0 HB2 ASN B 305 2.006 -15.185 -1.622 1.00 0.00 H new ATOM 0 HB3 ASN B 305 1.458 -13.941 -2.729 1.00 0.00 H new ATOM 0 HD21 ASN B 305 4.353 -14.683 -4.620 1.00 0.00 H new ATOM 0 HD22 ASN B 305 2.593 -14.788 -4.498 1.00 0.00 H new ATOM 530 N HIS B 306 1.853 -11.111 -2.115 1.00 0.00 N ATOM 531 CA HIS B 306 2.197 -9.820 -2.710 1.00 0.00 C ATOM 532 C HIS B 306 2.568 -8.775 -1.656 1.00 0.00 C ATOM 533 O HIS B 306 3.709 -8.315 -1.608 1.00 0.00 O ATOM 534 CB HIS B 306 1.039 -9.310 -3.572 1.00 0.00 C ATOM 535 CG HIS B 306 1.478 -8.634 -4.837 1.00 0.00 C ATOM 536 ND1 HIS B 306 0.751 -7.634 -5.447 1.00 0.00 N ATOM 537 CD2 HIS B 306 2.573 -8.825 -5.614 1.00 0.00 C ATOM 538 CE1 HIS B 306 1.377 -7.240 -6.542 1.00 0.00 C ATOM 539 NE2 HIS B 306 2.485 -7.946 -6.665 1.00 0.00 N ATOM 0 H HIS B 306 0.886 -11.400 -2.260 1.00 0.00 H new ATOM 0 HA HIS B 306 3.076 -9.977 -3.335 1.00 0.00 H new ATOM 0 HB2 HIS B 306 0.390 -10.148 -3.825 1.00 0.00 H new ATOM 0 HB3 HIS B 306 0.442 -8.611 -2.986 1.00 0.00 H new ATOM 0 HD1 HIS B 306 -0.133 -7.257 -5.106 1.00 0.00 H new ATOM 0 HD2 HIS B 306 3.367 -9.536 -5.439 1.00 0.00 H new ATOM 0 HE1 HIS B 306 1.039 -6.471 -7.221 1.00 0.00 H new ATOM 548 N ALA B 307 1.606 -8.401 -0.815 1.00 0.00 N ATOM 549 CA ALA B 307 1.841 -7.391 0.219 1.00 0.00 C ATOM 550 C ALA B 307 3.026 -7.747 1.114 1.00 0.00 C ATOM 551 O ALA B 307 3.895 -6.911 1.360 1.00 0.00 O ATOM 552 CB ALA B 307 0.589 -7.184 1.057 1.00 0.00 C ATOM 0 H ALA B 307 0.659 -8.780 -0.828 1.00 0.00 H new ATOM 0 HA ALA B 307 2.087 -6.460 -0.291 1.00 0.00 H new ATOM 0 HB1 ALA B 307 0.782 -6.430 1.820 1.00 0.00 H new ATOM 0 HB2 ALA B 307 -0.227 -6.850 0.416 1.00 0.00 H new ATOM 0 HB3 ALA B 307 0.313 -8.123 1.537 1.00 0.00 H new ATOM 558 N ILE B 308 3.057 -8.981 1.607 1.00 0.00 N ATOM 559 CA ILE B 308 4.143 -9.424 2.475 1.00 0.00 C ATOM 560 C ILE B 308 5.500 -9.227 1.802 1.00 0.00 C ATOM 561 O ILE B 308 6.392 -8.585 2.360 1.00 0.00 O ATOM 562 CB ILE B 308 3.980 -10.905 2.880 1.00 0.00 C ATOM 563 CG1 ILE B 308 2.717 -11.086 3.727 1.00 0.00 C ATOM 564 CG2 ILE B 308 5.209 -11.390 3.640 1.00 0.00 C ATOM 565 CD1 ILE B 308 2.373 -12.534 4.005 1.00 0.00 C ATOM 0 H ILE B 308 2.347 -9.689 1.422 1.00 0.00 H new ATOM 0 HA ILE B 308 4.098 -8.811 3.375 1.00 0.00 H new ATOM 0 HB ILE B 308 3.880 -11.504 1.975 1.00 0.00 H new ATOM 0 HG12 ILE B 308 2.848 -10.564 4.675 1.00 0.00 H new ATOM 0 HG13 ILE B 308 1.877 -10.614 3.217 1.00 0.00 H new ATOM 0 HG21 ILE B 308 5.076 -12.436 3.917 1.00 0.00 H new ATOM 0 HG22 ILE B 308 6.091 -11.292 3.007 1.00 0.00 H new ATOM 0 HG23 ILE B 308 5.340 -10.790 4.540 1.00 0.00 H new ATOM 0 HD11 ILE B 308 1.467 -12.583 4.610 1.00 0.00 H new ATOM 0 HD12 ILE B 308 2.209 -13.056 3.063 1.00 0.00 H new ATOM 0 HD13 ILE B 308 3.195 -13.006 4.543 1.00 0.00 H new ATOM 577 N ASN B 309 5.650 -9.776 0.599 1.00 0.00 N ATOM 578 CA ASN B 309 6.901 -9.656 -0.144 1.00 0.00 C ATOM 579 C ASN B 309 7.195 -8.198 -0.488 1.00 0.00 C ATOM 580 O ASN B 309 8.343 -7.829 -0.732 1.00 0.00 O ATOM 581 CB ASN B 309 6.848 -10.495 -1.424 1.00 0.00 C ATOM 582 CG ASN B 309 6.944 -11.987 -1.155 1.00 0.00 C ATOM 583 OD1 ASN B 309 6.462 -12.419 0.006 1.00 0.00 O flip ATOM 584 ND2 ASN B 309 7.447 -12.745 -1.984 1.00 0.00 N flip ATOM 0 H ASN B 309 4.923 -10.307 0.119 1.00 0.00 H new ATOM 0 HA ASN B 309 7.704 -10.030 0.491 1.00 0.00 H new ATOM 0 HB2 ASN B 309 5.918 -10.285 -1.952 1.00 0.00 H new ATOM 0 HB3 ASN B 309 7.663 -10.196 -2.083 1.00 0.00 H new ATOM 0 HD21 ASN B 309 7.806 -12.373 -2.864 1.00 0.00 H new ATOM 0 HD22 ASN B 309 7.505 -13.745 -1.791 1.00 0.00 H new ATOM 591 N TYR B 310 6.150 -7.376 -0.504 1.00 0.00 N ATOM 592 CA TYR B 310 6.290 -5.956 -0.815 1.00 0.00 C ATOM 593 C TYR B 310 7.004 -5.220 0.317 1.00 0.00 C ATOM 594 O TYR B 310 8.081 -4.650 0.123 1.00 0.00 O ATOM 595 CB TYR B 310 4.910 -5.340 -1.061 1.00 0.00 C ATOM 596 CG TYR B 310 4.947 -3.921 -1.584 1.00 0.00 C ATOM 597 CD1 TYR B 310 5.283 -3.657 -2.906 1.00 0.00 C ATOM 598 CD2 TYR B 310 4.638 -2.848 -0.758 1.00 0.00 C ATOM 599 CE1 TYR B 310 5.311 -2.363 -3.390 1.00 0.00 C ATOM 600 CE2 TYR B 310 4.661 -1.551 -1.235 1.00 0.00 C ATOM 601 CZ TYR B 310 4.999 -1.314 -2.551 1.00 0.00 C ATOM 602 OH TYR B 310 5.024 -0.024 -3.030 1.00 0.00 O ATOM 0 H TYR B 310 5.194 -7.670 -0.305 1.00 0.00 H new ATOM 0 HA TYR B 310 6.893 -5.856 -1.718 1.00 0.00 H new ATOM 0 HB2 TYR B 310 4.368 -5.963 -1.772 1.00 0.00 H new ATOM 0 HB3 TYR B 310 4.346 -5.357 -0.128 1.00 0.00 H new ATOM 0 HD1 TYR B 310 5.526 -4.476 -3.566 1.00 0.00 H new ATOM 0 HD2 TYR B 310 4.376 -3.030 0.274 1.00 0.00 H new ATOM 0 HE1 TYR B 310 5.576 -2.174 -4.420 1.00 0.00 H new ATOM 0 HE2 TYR B 310 4.416 -0.728 -0.581 1.00 0.00 H new ATOM 0 HH TYR B 310 4.732 0.592 -2.326 1.00 0.00 H new ATOM 612 N VAL B 311 6.401 -5.241 1.502 1.00 0.00 N ATOM 613 CA VAL B 311 6.980 -4.580 2.665 1.00 0.00 C ATOM 614 C VAL B 311 8.327 -5.200 3.025 1.00 0.00 C ATOM 615 O VAL B 311 9.204 -4.531 3.573 1.00 0.00 O ATOM 616 CB VAL B 311 6.038 -4.663 3.886 1.00 0.00 C ATOM 617 CG1 VAL B 311 6.627 -3.919 5.077 1.00 0.00 C ATOM 618 CG2 VAL B 311 4.663 -4.113 3.534 1.00 0.00 C ATOM 0 H VAL B 311 5.512 -5.708 1.681 1.00 0.00 H new ATOM 0 HA VAL B 311 7.123 -3.532 2.403 1.00 0.00 H new ATOM 0 HB VAL B 311 5.930 -5.711 4.164 1.00 0.00 H new ATOM 0 HG11 VAL B 311 5.946 -3.992 5.925 1.00 0.00 H new ATOM 0 HG12 VAL B 311 7.587 -4.361 5.344 1.00 0.00 H new ATOM 0 HG13 VAL B 311 6.771 -2.871 4.816 1.00 0.00 H new ATOM 0 HG21 VAL B 311 4.011 -4.179 4.405 1.00 0.00 H new ATOM 0 HG22 VAL B 311 4.755 -3.071 3.228 1.00 0.00 H new ATOM 0 HG23 VAL B 311 4.237 -4.695 2.717 1.00 0.00 H new ATOM 628 N ASN B 312 8.486 -6.481 2.701 1.00 0.00 N ATOM 629 CA ASN B 312 9.724 -7.199 2.990 1.00 0.00 C ATOM 630 C ASN B 312 10.875 -6.695 2.123 1.00 0.00 C ATOM 631 O ASN B 312 11.921 -6.295 2.636 1.00 0.00 O ATOM 632 CB ASN B 312 9.527 -8.700 2.768 1.00 0.00 C ATOM 633 CG ASN B 312 10.802 -9.492 2.987 1.00 0.00 C ATOM 634 OD1 ASN B 312 11.579 -9.708 2.058 1.00 0.00 O ATOM 635 ND2 ASN B 312 11.023 -9.930 4.221 1.00 0.00 N ATOM 0 H ASN B 312 7.772 -7.043 2.238 1.00 0.00 H new ATOM 0 HA ASN B 312 9.979 -7.017 4.034 1.00 0.00 H new ATOM 0 HB2 ASN B 312 8.755 -9.066 3.445 1.00 0.00 H new ATOM 0 HB3 ASN B 312 9.167 -8.870 1.753 1.00 0.00 H new ATOM 0 HD21 ASN B 312 11.864 -10.469 4.428 1.00 0.00 H new ATOM 0 HD22 ASN B 312 10.352 -9.728 4.962 1.00 0.00 H new ATOM 642 N LYS B 313 10.678 -6.718 0.807 1.00 0.00 N ATOM 643 CA LYS B 313 11.705 -6.272 -0.129 1.00 0.00 C ATOM 644 C LYS B 313 12.107 -4.823 0.136 1.00 0.00 C ATOM 645 O LYS B 313 13.292 -4.489 0.128 1.00 0.00 O ATOM 646 CB LYS B 313 11.218 -6.418 -1.574 1.00 0.00 C ATOM 647 CG LYS B 313 10.034 -5.532 -1.915 1.00 0.00 C ATOM 648 CD LYS B 313 9.880 -5.366 -3.414 1.00 0.00 C ATOM 649 CE LYS B 313 8.507 -4.830 -3.771 1.00 0.00 C ATOM 650 NZ LYS B 313 8.318 -4.727 -5.243 1.00 0.00 N ATOM 0 H LYS B 313 9.817 -7.041 0.366 1.00 0.00 H new ATOM 0 HA LYS B 313 12.580 -6.905 0.019 1.00 0.00 H new ATOM 0 HB2 LYS B 313 12.041 -6.185 -2.250 1.00 0.00 H new ATOM 0 HB3 LYS B 313 10.944 -7.458 -1.752 1.00 0.00 H new ATOM 0 HG2 LYS B 313 9.123 -5.964 -1.500 1.00 0.00 H new ATOM 0 HG3 LYS B 313 10.164 -4.554 -1.451 1.00 0.00 H new ATOM 0 HD2 LYS B 313 10.646 -4.687 -3.787 1.00 0.00 H new ATOM 0 HD3 LYS B 313 10.037 -6.326 -3.906 1.00 0.00 H new ATOM 0 HE2 LYS B 313 7.742 -5.483 -3.351 1.00 0.00 H new ATOM 0 HE3 LYS B 313 8.371 -3.848 -3.318 1.00 0.00 H new ATOM 0 HZ1 LYS B 313 7.692 -3.925 -5.457 1.00 0.00 H new ATOM 0 HZ2 LYS B 313 9.240 -4.579 -5.702 1.00 0.00 H new ATOM 0 HZ3 LYS B 313 7.890 -5.605 -5.600 1.00 0.00 H new ATOM 664 N ILE B 314 11.117 -3.968 0.373 1.00 0.00 N ATOM 665 CA ILE B 314 11.377 -2.557 0.628 1.00 0.00 C ATOM 666 C ILE B 314 12.077 -2.354 1.969 1.00 0.00 C ATOM 667 O ILE B 314 12.916 -1.464 2.109 1.00 0.00 O ATOM 668 CB ILE B 314 10.075 -1.733 0.588 1.00 0.00 C ATOM 669 CG1 ILE B 314 9.445 -1.823 -0.805 1.00 0.00 C ATOM 670 CG2 ILE B 314 10.350 -0.281 0.958 1.00 0.00 C ATOM 671 CD1 ILE B 314 8.060 -1.219 -0.885 1.00 0.00 C ATOM 0 H ILE B 314 10.131 -4.227 0.394 1.00 0.00 H new ATOM 0 HA ILE B 314 12.037 -2.205 -0.165 1.00 0.00 H new ATOM 0 HB ILE B 314 9.376 -2.143 1.317 1.00 0.00 H new ATOM 0 HG12 ILE B 314 10.094 -1.319 -1.521 1.00 0.00 H new ATOM 0 HG13 ILE B 314 9.393 -2.870 -1.104 1.00 0.00 H new ATOM 0 HG21 ILE B 314 9.419 0.286 0.924 1.00 0.00 H new ATOM 0 HG22 ILE B 314 10.767 -0.235 1.964 1.00 0.00 H new ATOM 0 HG23 ILE B 314 11.061 0.146 0.251 1.00 0.00 H new ATOM 0 HD11 ILE B 314 7.677 -1.319 -1.901 1.00 0.00 H new ATOM 0 HD12 ILE B 314 7.396 -1.739 -0.194 1.00 0.00 H new ATOM 0 HD13 ILE B 314 8.107 -0.163 -0.618 1.00 0.00 H new ATOM 683 N LYS B 315 11.734 -3.180 2.952 1.00 0.00 N ATOM 684 CA LYS B 315 12.346 -3.080 4.272 1.00 0.00 C ATOM 685 C LYS B 315 13.827 -3.442 4.209 1.00 0.00 C ATOM 686 O LYS B 315 14.653 -2.843 4.899 1.00 0.00 O ATOM 687 CB LYS B 315 11.632 -3.994 5.269 1.00 0.00 C ATOM 688 CG LYS B 315 12.209 -3.924 6.674 1.00 0.00 C ATOM 689 CD LYS B 315 11.614 -4.991 7.580 1.00 0.00 C ATOM 690 CE LYS B 315 10.132 -4.758 7.825 1.00 0.00 C ATOM 691 NZ LYS B 315 9.865 -3.398 8.371 1.00 0.00 N ATOM 0 H LYS B 315 11.040 -3.922 2.861 1.00 0.00 H new ATOM 0 HA LYS B 315 12.250 -2.048 4.609 1.00 0.00 H new ATOM 0 HB2 LYS B 315 10.576 -3.726 5.304 1.00 0.00 H new ATOM 0 HB3 LYS B 315 11.688 -5.022 4.912 1.00 0.00 H new ATOM 0 HG2 LYS B 315 13.291 -4.046 6.630 1.00 0.00 H new ATOM 0 HG3 LYS B 315 12.017 -2.938 7.098 1.00 0.00 H new ATOM 0 HD2 LYS B 315 11.758 -5.973 7.129 1.00 0.00 H new ATOM 0 HD3 LYS B 315 12.144 -4.996 8.533 1.00 0.00 H new ATOM 0 HE2 LYS B 315 9.585 -4.888 6.891 1.00 0.00 H new ATOM 0 HE3 LYS B 315 9.757 -5.508 8.521 1.00 0.00 H new ATOM 0 HZ1 LYS B 315 9.106 -3.451 9.080 1.00 0.00 H new ATOM 0 HZ2 LYS B 315 10.729 -3.027 8.816 1.00 0.00 H new ATOM 0 HZ3 LYS B 315 9.574 -2.765 7.599 1.00 0.00 H new ATOM 705 N ASN B 316 14.153 -4.427 3.377 1.00 0.00 N ATOM 706 CA ASN B 316 15.532 -4.876 3.222 1.00 0.00 C ATOM 707 C ASN B 316 16.285 -3.995 2.230 1.00 0.00 C ATOM 708 O ASN B 316 17.515 -3.940 2.244 1.00 0.00 O ATOM 709 CB ASN B 316 15.562 -6.333 2.754 1.00 0.00 C ATOM 710 CG ASN B 316 16.969 -6.891 2.687 1.00 0.00 C ATOM 711 OD1 ASN B 316 17.641 -6.793 1.659 1.00 0.00 O ATOM 712 ND2 ASN B 316 17.422 -7.483 3.785 1.00 0.00 N ATOM 0 H ASN B 316 13.479 -4.930 2.799 1.00 0.00 H new ATOM 0 HA ASN B 316 16.025 -4.800 4.191 1.00 0.00 H new ATOM 0 HB2 ASN B 316 14.965 -6.942 3.433 1.00 0.00 H new ATOM 0 HB3 ASN B 316 15.099 -6.405 1.770 1.00 0.00 H new ATOM 0 HD21 ASN B 316 18.362 -7.880 3.800 1.00 0.00 H new ATOM 0 HD22 ASN B 316 16.831 -7.541 4.614 1.00 0.00 H new ATOM 719 N ARG B 317 15.540 -3.306 1.371 1.00 0.00 N ATOM 720 CA ARG B 317 16.141 -2.428 0.373 1.00 0.00 C ATOM 721 C ARG B 317 16.626 -1.129 1.009 1.00 0.00 C ATOM 722 O ARG B 317 17.826 -0.856 1.049 1.00 0.00 O ATOM 723 CB ARG B 317 15.135 -2.122 -0.740 1.00 0.00 C ATOM 724 CG ARG B 317 15.675 -1.191 -1.816 1.00 0.00 C ATOM 725 CD ARG B 317 16.831 -1.825 -2.575 1.00 0.00 C ATOM 726 NE ARG B 317 17.364 -0.932 -3.601 1.00 0.00 N ATOM 727 CZ ARG B 317 18.168 -1.332 -4.583 1.00 0.00 C ATOM 728 NH1 ARG B 317 18.534 -2.604 -4.669 1.00 0.00 N ATOM 729 NH2 ARG B 317 18.607 -0.458 -5.479 1.00 0.00 N ATOM 0 H ARG B 317 14.521 -3.339 1.346 1.00 0.00 H new ATOM 0 HA ARG B 317 17.001 -2.943 -0.055 1.00 0.00 H new ATOM 0 HB2 ARG B 317 14.825 -3.058 -1.205 1.00 0.00 H new ATOM 0 HB3 ARG B 317 14.244 -1.675 -0.299 1.00 0.00 H new ATOM 0 HG2 ARG B 317 14.876 -0.938 -2.513 1.00 0.00 H new ATOM 0 HG3 ARG B 317 16.007 -0.259 -1.359 1.00 0.00 H new ATOM 0 HD2 ARG B 317 17.624 -2.088 -1.875 1.00 0.00 H new ATOM 0 HD3 ARG B 317 16.495 -2.752 -3.039 1.00 0.00 H new ATOM 0 HE ARG B 317 17.105 0.054 -3.562 1.00 0.00 H new ATOM 0 HH11 ARG B 317 18.199 -3.279 -3.981 1.00 0.00 H new ATOM 0 HH12 ARG B 317 19.150 -2.907 -5.423 1.00 0.00 H new ATOM 0 HH21 ARG B 317 18.328 0.521 -5.415 1.00 0.00 H new ATOM 0 HH22 ARG B 317 19.223 -0.765 -6.232 1.00 0.00 H new ATOM 743 N PHE B 318 15.684 -0.332 1.503 1.00 0.00 N ATOM 744 CA PHE B 318 16.010 0.941 2.139 1.00 0.00 C ATOM 745 C PHE B 318 16.207 0.765 3.641 1.00 0.00 C ATOM 746 O PHE B 318 15.859 1.644 4.430 1.00 0.00 O ATOM 747 CB PHE B 318 14.904 1.963 1.873 1.00 0.00 C ATOM 748 CG PHE B 318 14.738 2.298 0.419 1.00 0.00 C ATOM 749 CD1 PHE B 318 15.527 3.269 -0.177 1.00 0.00 C ATOM 750 CD2 PHE B 318 13.792 1.642 -0.352 1.00 0.00 C ATOM 751 CE1 PHE B 318 15.375 3.579 -1.515 1.00 0.00 C ATOM 752 CE2 PHE B 318 13.636 1.948 -1.690 1.00 0.00 C ATOM 753 CZ PHE B 318 14.429 2.917 -2.273 1.00 0.00 C ATOM 0 H PHE B 318 14.687 -0.545 1.475 1.00 0.00 H new ATOM 0 HA PHE B 318 16.944 1.305 1.710 1.00 0.00 H new ATOM 0 HB2 PHE B 318 13.961 1.575 2.259 1.00 0.00 H new ATOM 0 HB3 PHE B 318 15.123 2.876 2.426 1.00 0.00 H new ATOM 0 HD1 PHE B 318 16.269 3.789 0.411 1.00 0.00 H new ATOM 0 HD2 PHE B 318 13.170 0.883 0.098 1.00 0.00 H new ATOM 0 HE1 PHE B 318 15.995 4.338 -1.968 1.00 0.00 H new ATOM 0 HE2 PHE B 318 12.894 1.430 -2.280 1.00 0.00 H new ATOM 0 HZ PHE B 318 14.310 3.157 -3.319 1.00 0.00 H new ATOM 763 N GLN B 319 16.776 -0.373 4.027 1.00 0.00 N ATOM 764 CA GLN B 319 17.026 -0.673 5.422 1.00 0.00 C ATOM 765 C GLN B 319 17.917 0.388 6.063 1.00 0.00 C ATOM 766 O GLN B 319 17.976 0.504 7.288 1.00 0.00 O ATOM 767 CB GLN B 319 17.682 -2.045 5.526 1.00 0.00 C ATOM 768 CG GLN B 319 19.014 -2.139 4.800 1.00 0.00 C ATOM 769 CD GLN B 319 19.685 -3.485 4.984 1.00 0.00 C ATOM 770 OE1 GLN B 319 20.498 -3.603 6.028 1.00 0.00 O flip ATOM 771 NE2 GLN B 319 19.476 -4.409 4.198 1.00 0.00 N flip ATOM 0 H GLN B 319 17.073 -1.105 3.382 1.00 0.00 H new ATOM 0 HA GLN B 319 16.077 -0.675 5.958 1.00 0.00 H new ATOM 0 HB2 GLN B 319 17.833 -2.287 6.578 1.00 0.00 H new ATOM 0 HB3 GLN B 319 17.003 -2.795 5.120 1.00 0.00 H new ATOM 0 HG2 GLN B 319 18.857 -1.958 3.737 1.00 0.00 H new ATOM 0 HG3 GLN B 319 19.677 -1.354 5.163 1.00 0.00 H new ATOM 0 HE21 GLN B 319 18.844 -4.274 3.409 1.00 0.00 H new ATOM 0 HE22 GLN B 319 19.935 -5.309 4.336 1.00 0.00 H new ATOM 780 N GLY B 320 18.610 1.157 5.227 1.00 0.00 N ATOM 781 CA GLY B 320 19.487 2.198 5.729 1.00 0.00 C ATOM 782 C GLY B 320 18.820 3.560 5.753 1.00 0.00 C ATOM 783 O GLY B 320 19.232 4.446 6.503 1.00 0.00 O ATOM 0 H GLY B 320 18.579 1.077 4.211 1.00 0.00 H new ATOM 0 HA2 GLY B 320 19.813 1.939 6.736 1.00 0.00 H new ATOM 0 HA3 GLY B 320 20.381 2.246 5.107 1.00 0.00 H new ATOM 787 N GLN B 321 17.788 3.728 4.931 1.00 0.00 N ATOM 788 CA GLN B 321 17.063 4.993 4.860 1.00 0.00 C ATOM 789 C GLN B 321 15.670 4.857 5.478 1.00 0.00 C ATOM 790 O GLN B 321 14.733 4.412 4.814 1.00 0.00 O ATOM 791 CB GLN B 321 16.946 5.452 3.405 1.00 0.00 C ATOM 792 CG GLN B 321 16.465 6.886 3.252 1.00 0.00 C ATOM 793 CD GLN B 321 17.425 7.893 3.856 1.00 0.00 C ATOM 794 OE1 GLN B 321 16.897 9.034 4.283 1.00 0.00 O flip ATOM 795 NE2 GLN B 321 18.630 7.650 3.933 1.00 0.00 N flip ATOM 0 H GLN B 321 17.435 3.004 4.305 1.00 0.00 H new ATOM 0 HA GLN B 321 17.621 5.739 5.427 1.00 0.00 H new ATOM 0 HB2 GLN B 321 17.918 5.351 2.922 1.00 0.00 H new ATOM 0 HB3 GLN B 321 16.259 4.790 2.879 1.00 0.00 H new ATOM 0 HG2 GLN B 321 16.330 7.109 2.194 1.00 0.00 H new ATOM 0 HG3 GLN B 321 15.489 6.990 3.727 1.00 0.00 H new ATOM 0 HE21 GLN B 321 18.994 6.760 3.592 1.00 0.00 H new ATOM 0 HE22 GLN B 321 19.264 8.339 4.337 1.00 0.00 H new ATOM 804 N PRO B 322 15.515 5.236 6.762 1.00 0.00 N ATOM 805 CA PRO B 322 14.232 5.147 7.462 1.00 0.00 C ATOM 806 C PRO B 322 13.309 6.325 7.160 1.00 0.00 C ATOM 807 O PRO B 322 12.122 6.292 7.486 1.00 0.00 O ATOM 808 CB PRO B 322 14.648 5.158 8.930 1.00 0.00 C ATOM 809 CG PRO B 322 15.888 5.986 8.961 1.00 0.00 C ATOM 810 CD PRO B 322 16.579 5.771 7.637 1.00 0.00 C ATOM 0 HA PRO B 322 13.662 4.268 7.162 1.00 0.00 H new ATOM 0 HB2 PRO B 322 13.869 5.587 9.560 1.00 0.00 H new ATOM 0 HB3 PRO B 322 14.835 4.149 9.297 1.00 0.00 H new ATOM 0 HG2 PRO B 322 15.648 7.039 9.107 1.00 0.00 H new ATOM 0 HG3 PRO B 322 16.533 5.689 9.788 1.00 0.00 H new ATOM 0 HD2 PRO B 322 16.988 6.702 7.244 1.00 0.00 H new ATOM 0 HD3 PRO B 322 17.410 5.071 7.729 1.00 0.00 H new ATOM 818 N ASP B 323 13.857 7.364 6.538 1.00 0.00 N ATOM 819 CA ASP B 323 13.076 8.551 6.200 1.00 0.00 C ATOM 820 C ASP B 323 12.079 8.255 5.085 1.00 0.00 C ATOM 821 O ASP B 323 10.878 8.475 5.240 1.00 0.00 O ATOM 822 CB ASP B 323 13.999 9.695 5.779 1.00 0.00 C ATOM 823 CG ASP B 323 14.942 10.117 6.888 1.00 0.00 C ATOM 824 OD1 ASP B 323 16.048 9.543 6.978 1.00 0.00 O ATOM 825 OD2 ASP B 323 14.576 11.023 7.666 1.00 0.00 O ATOM 0 H ASP B 323 14.837 7.409 6.258 1.00 0.00 H new ATOM 0 HA ASP B 323 12.520 8.848 7.089 1.00 0.00 H new ATOM 0 HB2 ASP B 323 14.580 9.388 4.909 1.00 0.00 H new ATOM 0 HB3 ASP B 323 13.396 10.550 5.474 1.00 0.00 H new ATOM 830 N ILE B 324 12.584 7.758 3.961 1.00 0.00 N ATOM 831 CA ILE B 324 11.734 7.438 2.820 1.00 0.00 C ATOM 832 C ILE B 324 10.777 6.297 3.152 1.00 0.00 C ATOM 833 O ILE B 324 9.623 6.297 2.721 1.00 0.00 O ATOM 834 CB ILE B 324 12.572 7.057 1.584 1.00 0.00 C ATOM 835 CG1 ILE B 324 13.587 8.160 1.271 1.00 0.00 C ATOM 836 CG2 ILE B 324 11.663 6.808 0.388 1.00 0.00 C ATOM 837 CD1 ILE B 324 14.529 7.821 0.135 1.00 0.00 C ATOM 0 H ILE B 324 13.576 7.568 3.816 1.00 0.00 H new ATOM 0 HA ILE B 324 11.157 8.334 2.591 1.00 0.00 H new ATOM 0 HB ILE B 324 13.118 6.138 1.799 1.00 0.00 H new ATOM 0 HG12 ILE B 324 13.050 9.075 1.024 1.00 0.00 H new ATOM 0 HG13 ILE B 324 14.173 8.366 2.167 1.00 0.00 H new ATOM 0 HG21 ILE B 324 12.267 6.540 -0.479 1.00 0.00 H new ATOM 0 HG22 ILE B 324 10.975 5.994 0.617 1.00 0.00 H new ATOM 0 HG23 ILE B 324 11.095 7.712 0.168 1.00 0.00 H new ATOM 0 HD11 ILE B 324 15.217 8.651 -0.027 1.00 0.00 H new ATOM 0 HD12 ILE B 324 15.095 6.924 0.387 1.00 0.00 H new ATOM 0 HD13 ILE B 324 13.954 7.644 -0.774 1.00 0.00 H new ATOM 849 N TYR B 325 11.262 5.329 3.922 1.00 0.00 N ATOM 850 CA TYR B 325 10.450 4.182 4.313 1.00 0.00 C ATOM 851 C TYR B 325 9.274 4.627 5.181 1.00 0.00 C ATOM 852 O TYR B 325 8.123 4.268 4.921 1.00 0.00 O ATOM 853 CB TYR B 325 11.311 3.163 5.065 1.00 0.00 C ATOM 854 CG TYR B 325 10.609 1.851 5.342 1.00 0.00 C ATOM 855 CD1 TYR B 325 10.041 1.112 4.311 1.00 0.00 C ATOM 856 CD2 TYR B 325 10.521 1.349 6.634 1.00 0.00 C ATOM 857 CE1 TYR B 325 9.404 -0.088 4.561 1.00 0.00 C ATOM 858 CE2 TYR B 325 9.886 0.149 6.892 1.00 0.00 C ATOM 859 CZ TYR B 325 9.329 -0.565 5.853 1.00 0.00 C ATOM 860 OH TYR B 325 8.695 -1.760 6.106 1.00 0.00 O ATOM 0 H TYR B 325 12.214 5.316 4.288 1.00 0.00 H new ATOM 0 HA TYR B 325 10.053 3.713 3.413 1.00 0.00 H new ATOM 0 HB2 TYR B 325 12.213 2.966 4.485 1.00 0.00 H new ATOM 0 HB3 TYR B 325 11.630 3.600 6.011 1.00 0.00 H new ATOM 0 HD1 TYR B 325 10.099 1.482 3.298 1.00 0.00 H new ATOM 0 HD2 TYR B 325 10.956 1.906 7.451 1.00 0.00 H new ATOM 0 HE1 TYR B 325 8.967 -0.650 3.749 1.00 0.00 H new ATOM 0 HE2 TYR B 325 9.827 -0.227 7.903 1.00 0.00 H new ATOM 0 HH TYR B 325 8.124 -1.666 6.897 1.00 0.00 H new ATOM 870 N LYS B 326 9.573 5.418 6.209 1.00 0.00 N ATOM 871 CA LYS B 326 8.546 5.922 7.112 1.00 0.00 C ATOM 872 C LYS B 326 7.535 6.776 6.355 1.00 0.00 C ATOM 873 O LYS B 326 6.337 6.719 6.624 1.00 0.00 O ATOM 874 CB LYS B 326 9.184 6.737 8.241 1.00 0.00 C ATOM 875 CG LYS B 326 8.175 7.392 9.170 1.00 0.00 C ATOM 876 CD LYS B 326 8.859 8.118 10.319 1.00 0.00 C ATOM 877 CE LYS B 326 9.529 7.146 11.278 1.00 0.00 C ATOM 878 NZ LYS B 326 10.271 7.854 12.358 1.00 0.00 N ATOM 0 H LYS B 326 10.520 5.723 6.436 1.00 0.00 H new ATOM 0 HA LYS B 326 8.023 5.069 7.545 1.00 0.00 H new ATOM 0 HB2 LYS B 326 9.832 6.085 8.826 1.00 0.00 H new ATOM 0 HB3 LYS B 326 9.818 7.509 7.806 1.00 0.00 H new ATOM 0 HG2 LYS B 326 7.564 8.097 8.606 1.00 0.00 H new ATOM 0 HG3 LYS B 326 7.501 6.634 9.568 1.00 0.00 H new ATOM 0 HD2 LYS B 326 9.603 8.809 9.922 1.00 0.00 H new ATOM 0 HD3 LYS B 326 8.126 8.716 10.860 1.00 0.00 H new ATOM 0 HE2 LYS B 326 8.775 6.496 11.722 1.00 0.00 H new ATOM 0 HE3 LYS B 326 10.216 6.506 10.725 1.00 0.00 H new ATOM 0 HZ1 LYS B 326 10.713 7.157 12.990 1.00 0.00 H new ATOM 0 HZ2 LYS B 326 11.008 8.455 11.937 1.00 0.00 H new ATOM 0 HZ3 LYS B 326 9.611 8.445 12.902 1.00 0.00 H new ATOM 892 N ALA B 327 8.028 7.564 5.403 1.00 0.00 N ATOM 893 CA ALA B 327 7.168 8.429 4.604 1.00 0.00 C ATOM 894 C ALA B 327 6.116 7.614 3.861 1.00 0.00 C ATOM 895 O ALA B 327 4.917 7.870 3.983 1.00 0.00 O ATOM 896 CB ALA B 327 8.000 9.243 3.624 1.00 0.00 C ATOM 0 H ALA B 327 9.019 7.621 5.167 1.00 0.00 H new ATOM 0 HA ALA B 327 6.653 9.114 5.278 1.00 0.00 H new ATOM 0 HB1 ALA B 327 7.344 9.884 3.035 1.00 0.00 H new ATOM 0 HB2 ALA B 327 8.711 9.859 4.174 1.00 0.00 H new ATOM 0 HB3 ALA B 327 8.542 8.570 2.960 1.00 0.00 H new ATOM 902 N PHE B 328 6.573 6.630 3.091 1.00 0.00 N ATOM 903 CA PHE B 328 5.674 5.771 2.331 1.00 0.00 C ATOM 904 C PHE B 328 4.615 5.157 3.246 1.00 0.00 C ATOM 905 O PHE B 328 3.416 5.211 2.957 1.00 0.00 O ATOM 906 CB PHE B 328 6.468 4.663 1.631 1.00 0.00 C ATOM 907 CG PHE B 328 5.610 3.693 0.869 1.00 0.00 C ATOM 908 CD1 PHE B 328 5.173 3.992 -0.411 1.00 0.00 C ATOM 909 CD2 PHE B 328 5.242 2.482 1.434 1.00 0.00 C ATOM 910 CE1 PHE B 328 4.384 3.101 -1.114 1.00 0.00 C ATOM 911 CE2 PHE B 328 4.454 1.588 0.737 1.00 0.00 C ATOM 912 CZ PHE B 328 4.024 1.897 -0.539 1.00 0.00 C ATOM 0 H PHE B 328 7.562 6.409 2.978 1.00 0.00 H new ATOM 0 HA PHE B 328 5.172 6.379 1.578 1.00 0.00 H new ATOM 0 HB2 PHE B 328 7.183 5.118 0.945 1.00 0.00 H new ATOM 0 HB3 PHE B 328 7.045 4.116 2.376 1.00 0.00 H new ATOM 0 HD1 PHE B 328 5.452 4.932 -0.865 1.00 0.00 H new ATOM 0 HD2 PHE B 328 5.576 2.235 2.431 1.00 0.00 H new ATOM 0 HE1 PHE B 328 4.049 3.345 -2.111 1.00 0.00 H new ATOM 0 HE2 PHE B 328 4.174 0.648 1.189 1.00 0.00 H new ATOM 0 HZ PHE B 328 3.408 1.199 -1.086 1.00 0.00 H new ATOM 922 N LEU B 329 5.070 4.576 4.355 1.00 0.00 N ATOM 923 CA LEU B 329 4.168 3.953 5.317 1.00 0.00 C ATOM 924 C LEU B 329 3.144 4.958 5.835 1.00 0.00 C ATOM 925 O LEU B 329 1.993 4.608 6.091 1.00 0.00 O ATOM 926 CB LEU B 329 4.961 3.363 6.485 1.00 0.00 C ATOM 927 CG LEU B 329 5.916 2.227 6.112 1.00 0.00 C ATOM 928 CD1 LEU B 329 6.731 1.799 7.322 1.00 0.00 C ATOM 929 CD2 LEU B 329 5.144 1.044 5.543 1.00 0.00 C ATOM 0 H LEU B 329 6.057 4.525 4.608 1.00 0.00 H new ATOM 0 HA LEU B 329 3.634 3.150 4.809 1.00 0.00 H new ATOM 0 HB2 LEU B 329 5.536 4.161 6.954 1.00 0.00 H new ATOM 0 HB3 LEU B 329 4.258 2.995 7.233 1.00 0.00 H new ATOM 0 HG LEU B 329 6.601 2.591 5.346 1.00 0.00 H new ATOM 0 HD11 LEU B 329 7.405 0.990 7.039 1.00 0.00 H new ATOM 0 HD12 LEU B 329 7.313 2.646 7.687 1.00 0.00 H new ATOM 0 HD13 LEU B 329 6.060 1.454 8.109 1.00 0.00 H new ATOM 0 HD21 LEU B 329 5.840 0.246 5.284 1.00 0.00 H new ATOM 0 HD22 LEU B 329 4.436 0.680 6.287 1.00 0.00 H new ATOM 0 HD23 LEU B 329 4.603 1.358 4.650 1.00 0.00 H new ATOM 941 N GLU B 330 3.572 6.208 5.991 1.00 0.00 N ATOM 942 CA GLU B 330 2.687 7.262 6.472 1.00 0.00 C ATOM 943 C GLU B 330 1.609 7.570 5.440 1.00 0.00 C ATOM 944 O GLU B 330 0.473 7.887 5.791 1.00 0.00 O ATOM 945 CB GLU B 330 3.483 8.528 6.793 1.00 0.00 C ATOM 946 CG GLU B 330 4.277 8.435 8.085 1.00 0.00 C ATOM 947 CD GLU B 330 5.122 9.668 8.339 1.00 0.00 C ATOM 948 OE1 GLU B 330 6.238 9.748 7.784 1.00 0.00 O ATOM 949 OE2 GLU B 330 4.668 10.555 9.093 1.00 0.00 O ATOM 0 H GLU B 330 4.524 6.514 5.792 1.00 0.00 H new ATOM 0 HA GLU B 330 2.206 6.911 7.385 1.00 0.00 H new ATOM 0 HB2 GLU B 330 4.167 8.736 5.970 1.00 0.00 H new ATOM 0 HB3 GLU B 330 2.797 9.372 6.858 1.00 0.00 H new ATOM 0 HG2 GLU B 330 3.591 8.291 8.919 1.00 0.00 H new ATOM 0 HG3 GLU B 330 4.923 7.558 8.048 1.00 0.00 H new ATOM 956 N ILE B 331 1.974 7.476 4.163 1.00 0.00 N ATOM 957 CA ILE B 331 1.030 7.737 3.084 1.00 0.00 C ATOM 958 C ILE B 331 -0.080 6.694 3.074 1.00 0.00 C ATOM 959 O ILE B 331 -1.261 7.035 3.026 1.00 0.00 O ATOM 960 CB ILE B 331 1.722 7.747 1.706 1.00 0.00 C ATOM 961 CG1 ILE B 331 2.837 8.796 1.675 1.00 0.00 C ATOM 962 CG2 ILE B 331 0.700 8.019 0.609 1.00 0.00 C ATOM 963 CD1 ILE B 331 3.730 8.695 0.457 1.00 0.00 C ATOM 0 H ILE B 331 2.912 7.222 3.853 1.00 0.00 H new ATOM 0 HA ILE B 331 0.606 8.724 3.268 1.00 0.00 H new ATOM 0 HB ILE B 331 2.169 6.768 1.531 1.00 0.00 H new ATOM 0 HG12 ILE B 331 2.390 9.790 1.706 1.00 0.00 H new ATOM 0 HG13 ILE B 331 3.447 8.692 2.572 1.00 0.00 H new ATOM 0 HG21 ILE B 331 1.199 8.024 -0.360 1.00 0.00 H new ATOM 0 HG22 ILE B 331 -0.062 7.240 0.621 1.00 0.00 H new ATOM 0 HG23 ILE B 331 0.231 8.988 0.781 1.00 0.00 H new ATOM 0 HD11 ILE B 331 4.496 9.469 0.503 1.00 0.00 H new ATOM 0 HD12 ILE B 331 4.205 7.714 0.435 1.00 0.00 H new ATOM 0 HD13 ILE B 331 3.132 8.829 -0.445 1.00 0.00 H new ATOM 975 N LEU B 332 0.305 5.421 3.119 1.00 0.00 N ATOM 976 CA LEU B 332 -0.668 4.332 3.116 1.00 0.00 C ATOM 977 C LEU B 332 -1.486 4.323 4.403 1.00 0.00 C ATOM 978 O LEU B 332 -2.646 3.914 4.406 1.00 0.00 O ATOM 979 CB LEU B 332 0.029 2.983 2.931 1.00 0.00 C ATOM 980 CG LEU B 332 -0.042 2.406 1.514 1.00 0.00 C ATOM 981 CD1 LEU B 332 0.686 3.307 0.528 1.00 0.00 C ATOM 982 CD2 LEU B 332 0.535 0.998 1.483 1.00 0.00 C ATOM 0 H LEU B 332 1.279 5.119 3.158 1.00 0.00 H new ATOM 0 HA LEU B 332 -1.345 4.496 2.278 1.00 0.00 H new ATOM 0 HB2 LEU B 332 1.077 3.091 3.211 1.00 0.00 H new ATOM 0 HB3 LEU B 332 -0.413 2.265 3.622 1.00 0.00 H new ATOM 0 HG LEU B 332 -1.089 2.355 1.217 1.00 0.00 H new ATOM 0 HD11 LEU B 332 0.623 2.878 -0.472 1.00 0.00 H new ATOM 0 HD12 LEU B 332 0.225 4.295 0.529 1.00 0.00 H new ATOM 0 HD13 LEU B 332 1.733 3.395 0.820 1.00 0.00 H new ATOM 0 HD21 LEU B 332 0.477 0.603 0.469 1.00 0.00 H new ATOM 0 HD22 LEU B 332 1.577 1.025 1.803 1.00 0.00 H new ATOM 0 HD23 LEU B 332 -0.035 0.356 2.155 1.00 0.00 H new ATOM 994 N HIS B 333 -0.875 4.771 5.495 1.00 0.00 N ATOM 995 CA HIS B 333 -1.559 4.819 6.782 1.00 0.00 C ATOM 996 C HIS B 333 -2.711 5.815 6.731 1.00 0.00 C ATOM 997 O HIS B 333 -3.859 5.469 7.015 1.00 0.00 O ATOM 998 CB HIS B 333 -0.580 5.202 7.894 1.00 0.00 C ATOM 999 CG HIS B 333 -1.221 5.306 9.243 1.00 0.00 C ATOM 1000 ND1 HIS B 333 -1.812 6.462 9.706 1.00 0.00 N ATOM 1001 CD2 HIS B 333 -1.367 4.390 10.229 1.00 0.00 C ATOM 1002 CE1 HIS B 333 -2.292 6.253 10.919 1.00 0.00 C ATOM 1003 NE2 HIS B 333 -2.036 5.003 11.259 1.00 0.00 N ATOM 0 H HIS B 333 0.089 5.105 5.515 1.00 0.00 H new ATOM 0 HA HIS B 333 -1.960 3.829 6.997 1.00 0.00 H new ATOM 0 HB2 HIS B 333 0.218 4.461 7.936 1.00 0.00 H new ATOM 0 HB3 HIS B 333 -0.116 6.157 7.646 1.00 0.00 H new ATOM 0 HD2 HIS B 333 -1.021 3.367 10.209 1.00 0.00 H new ATOM 0 HE1 HIS B 333 -2.806 6.981 11.529 1.00 0.00 H new ATOM 0 HE2 HIS B 333 -2.293 4.564 12.143 1.00 0.00 H new ATOM 1012 N THR B 334 -2.394 7.053 6.366 1.00 0.00 N ATOM 1013 CA THR B 334 -3.399 8.101 6.265 1.00 0.00 C ATOM 1014 C THR B 334 -4.420 7.754 5.187 1.00 0.00 C ATOM 1015 O THR B 334 -5.609 8.034 5.328 1.00 0.00 O ATOM 1016 CB THR B 334 -2.757 9.464 5.944 1.00 0.00 C ATOM 1017 OG1 THR B 334 -1.782 9.794 6.941 1.00 0.00 O ATOM 1018 CG2 THR B 334 -3.809 10.562 5.878 1.00 0.00 C ATOM 0 H THR B 334 -1.447 7.354 6.135 1.00 0.00 H new ATOM 0 HA THR B 334 -3.899 8.173 7.231 1.00 0.00 H new ATOM 0 HB THR B 334 -2.273 9.388 4.970 1.00 0.00 H new ATOM 0 HG1 THR B 334 -0.953 9.302 6.764 1.00 0.00 H new ATOM 0 HG21 THR B 334 -3.328 11.513 5.650 1.00 0.00 H new ATOM 0 HG22 THR B 334 -4.533 10.325 5.099 1.00 0.00 H new ATOM 0 HG23 THR B 334 -4.320 10.635 6.838 1.00 0.00 H new ATOM 1026 N TYR B 335 -3.940 7.138 4.111 1.00 0.00 N ATOM 1027 CA TYR B 335 -4.803 6.736 3.007 1.00 0.00 C ATOM 1028 C TYR B 335 -5.757 5.636 3.455 1.00 0.00 C ATOM 1029 O TYR B 335 -6.898 5.558 2.995 1.00 0.00 O ATOM 1030 CB TYR B 335 -3.956 6.253 1.825 1.00 0.00 C ATOM 1031 CG TYR B 335 -4.767 5.824 0.624 1.00 0.00 C ATOM 1032 CD1 TYR B 335 -5.369 6.765 -0.200 1.00 0.00 C ATOM 1033 CD2 TYR B 335 -4.928 4.478 0.313 1.00 0.00 C ATOM 1034 CE1 TYR B 335 -6.111 6.379 -1.300 1.00 0.00 C ATOM 1035 CE2 TYR B 335 -5.669 4.083 -0.786 1.00 0.00 C ATOM 1036 CZ TYR B 335 -6.258 5.038 -1.589 1.00 0.00 C ATOM 1037 OH TYR B 335 -6.996 4.652 -2.683 1.00 0.00 O ATOM 0 H TYR B 335 -2.955 6.906 3.981 1.00 0.00 H new ATOM 0 HA TYR B 335 -5.390 7.598 2.690 1.00 0.00 H new ATOM 0 HB2 TYR B 335 -3.278 7.052 1.526 1.00 0.00 H new ATOM 0 HB3 TYR B 335 -3.338 5.416 2.151 1.00 0.00 H new ATOM 0 HD1 TYR B 335 -5.256 7.816 0.022 1.00 0.00 H new ATOM 0 HD2 TYR B 335 -4.467 3.729 0.940 1.00 0.00 H new ATOM 0 HE1 TYR B 335 -6.574 7.124 -1.931 1.00 0.00 H new ATOM 0 HE2 TYR B 335 -5.786 3.034 -1.014 1.00 0.00 H new ATOM 0 HH TYR B 335 -7.000 3.674 -2.746 1.00 0.00 H new ATOM 1047 N GLN B 336 -5.281 4.791 4.365 1.00 0.00 N ATOM 1048 CA GLN B 336 -6.083 3.693 4.888 1.00 0.00 C ATOM 1049 C GLN B 336 -7.226 4.223 5.746 1.00 0.00 C ATOM 1050 O GLN B 336 -8.379 3.833 5.570 1.00 0.00 O ATOM 1051 CB GLN B 336 -5.210 2.746 5.713 1.00 0.00 C ATOM 1052 CG GLN B 336 -5.959 1.531 6.238 1.00 0.00 C ATOM 1053 CD GLN B 336 -5.127 0.698 7.195 1.00 0.00 C ATOM 1054 OE1 GLN B 336 -3.813 0.696 6.996 1.00 0.00 O flip ATOM 1055 NE2 GLN B 336 -5.660 0.062 8.104 1.00 0.00 N flip ATOM 0 H GLN B 336 -4.340 4.847 4.756 1.00 0.00 H new ATOM 0 HA GLN B 336 -6.504 3.146 4.045 1.00 0.00 H new ATOM 0 HB2 GLN B 336 -4.373 2.410 5.100 1.00 0.00 H new ATOM 0 HB3 GLN B 336 -4.788 3.295 6.555 1.00 0.00 H new ATOM 0 HG2 GLN B 336 -6.867 1.860 6.744 1.00 0.00 H new ATOM 0 HG3 GLN B 336 -6.269 0.910 5.398 1.00 0.00 H new ATOM 0 HE21 GLN B 336 -6.673 0.091 8.221 1.00 0.00 H new ATOM 0 HE22 GLN B 336 -5.089 -0.494 8.740 1.00 0.00 H new ATOM 1064 N LYS B 337 -6.894 5.111 6.680 1.00 0.00 N ATOM 1065 CA LYS B 337 -7.888 5.699 7.569 1.00 0.00 C ATOM 1066 C LYS B 337 -8.913 6.513 6.784 1.00 0.00 C ATOM 1067 O LYS B 337 -10.096 6.536 7.123 1.00 0.00 O ATOM 1068 CB LYS B 337 -7.198 6.589 8.601 1.00 0.00 C ATOM 1069 CG LYS B 337 -8.138 7.148 9.658 1.00 0.00 C ATOM 1070 CD LYS B 337 -7.402 8.041 10.648 1.00 0.00 C ATOM 1071 CE LYS B 337 -6.831 9.281 9.974 1.00 0.00 C ATOM 1072 NZ LYS B 337 -6.075 10.136 10.932 1.00 0.00 N ATOM 0 H LYS B 337 -5.941 5.439 6.840 1.00 0.00 H new ATOM 0 HA LYS B 337 -8.412 4.890 8.078 1.00 0.00 H new ATOM 0 HB2 LYS B 337 -6.412 6.016 9.094 1.00 0.00 H new ATOM 0 HB3 LYS B 337 -6.713 7.418 8.085 1.00 0.00 H new ATOM 0 HG2 LYS B 337 -8.932 7.717 9.175 1.00 0.00 H new ATOM 0 HG3 LYS B 337 -8.615 6.326 10.193 1.00 0.00 H new ATOM 0 HD2 LYS B 337 -8.084 8.341 11.444 1.00 0.00 H new ATOM 0 HD3 LYS B 337 -6.595 7.477 11.116 1.00 0.00 H new ATOM 0 HE2 LYS B 337 -6.173 8.980 9.158 1.00 0.00 H new ATOM 0 HE3 LYS B 337 -7.642 9.860 9.532 1.00 0.00 H new ATOM 0 HZ1 LYS B 337 -5.703 10.970 10.434 1.00 0.00 H new ATOM 0 HZ2 LYS B 337 -6.709 10.444 11.697 1.00 0.00 H new ATOM 0 HZ3 LYS B 337 -5.285 9.592 11.335 1.00 0.00 H new ATOM 1086 N GLU B 338 -8.453 7.194 5.741 1.00 0.00 N ATOM 1087 CA GLU B 338 -9.343 7.994 4.911 1.00 0.00 C ATOM 1088 C GLU B 338 -10.243 7.089 4.079 1.00 0.00 C ATOM 1089 O GLU B 338 -11.392 7.427 3.794 1.00 0.00 O ATOM 1090 CB GLU B 338 -8.539 8.926 4.002 1.00 0.00 C ATOM 1091 CG GLU B 338 -7.867 10.069 4.747 1.00 0.00 C ATOM 1092 CD GLU B 338 -8.851 10.906 5.542 1.00 0.00 C ATOM 1093 OE1 GLU B 338 -9.435 11.845 4.963 1.00 0.00 O ATOM 1094 OE2 GLU B 338 -9.038 10.621 6.744 1.00 0.00 O ATOM 0 H GLU B 338 -7.475 7.208 5.452 1.00 0.00 H new ATOM 0 HA GLU B 338 -9.967 8.605 5.563 1.00 0.00 H new ATOM 0 HB2 GLU B 338 -7.778 8.345 3.481 1.00 0.00 H new ATOM 0 HB3 GLU B 338 -9.201 9.339 3.241 1.00 0.00 H new ATOM 0 HG2 GLU B 338 -7.112 9.664 5.421 1.00 0.00 H new ATOM 0 HG3 GLU B 338 -7.347 10.707 4.033 1.00 0.00 H new ATOM 1101 N GLN B 339 -9.709 5.931 3.701 1.00 0.00 N ATOM 1102 CA GLN B 339 -10.456 4.962 2.911 1.00 0.00 C ATOM 1103 C GLN B 339 -11.531 4.287 3.759 1.00 0.00 C ATOM 1104 O GLN B 339 -12.666 4.110 3.313 1.00 0.00 O ATOM 1105 CB GLN B 339 -9.502 3.915 2.333 1.00 0.00 C ATOM 1106 CG GLN B 339 -10.203 2.786 1.596 1.00 0.00 C ATOM 1107 CD GLN B 339 -9.228 1.790 0.999 1.00 0.00 C ATOM 1108 OE1 GLN B 339 -8.136 1.579 1.527 1.00 0.00 O ATOM 1109 NE2 GLN B 339 -9.618 1.174 -0.110 1.00 0.00 N ATOM 0 H GLN B 339 -8.758 5.642 3.931 1.00 0.00 H new ATOM 0 HA GLN B 339 -10.948 5.487 2.092 1.00 0.00 H new ATOM 0 HB2 GLN B 339 -8.809 4.406 1.650 1.00 0.00 H new ATOM 0 HB3 GLN B 339 -8.907 3.493 3.143 1.00 0.00 H new ATOM 0 HG2 GLN B 339 -10.872 2.268 2.283 1.00 0.00 H new ATOM 0 HG3 GLN B 339 -10.822 3.204 0.802 1.00 0.00 H new ATOM 0 HE21 GLN B 339 -10.532 1.380 -0.513 1.00 0.00 H new ATOM 0 HE22 GLN B 339 -9.004 0.495 -0.559 1.00 0.00 H new ATOM 1118 N ARG B 340 -11.169 3.915 4.984 1.00 0.00 N ATOM 1119 CA ARG B 340 -12.105 3.262 5.891 1.00 0.00 C ATOM 1120 C ARG B 340 -13.260 4.194 6.239 1.00 0.00 C ATOM 1121 O ARG B 340 -14.428 3.841 6.084 1.00 0.00 O ATOM 1122 CB ARG B 340 -11.389 2.792 7.162 1.00 0.00 C ATOM 1123 CG ARG B 340 -10.966 3.899 8.087 1.00 0.00 C ATOM 1124 CD ARG B 340 -10.323 3.359 9.354 1.00 0.00 C ATOM 1125 NE ARG B 340 -9.965 4.427 10.282 1.00 0.00 N ATOM 1126 CZ ARG B 340 -9.548 4.216 11.527 1.00 0.00 C ATOM 1127 NH1 ARG B 340 -9.433 2.979 11.993 1.00 0.00 N ATOM 1128 NH2 ARG B 340 -9.243 5.245 12.306 1.00 0.00 N ATOM 0 H ARG B 340 -10.235 4.055 5.370 1.00 0.00 H new ATOM 0 HA ARG B 340 -12.514 2.387 5.385 1.00 0.00 H new ATOM 0 HB2 ARG B 340 -12.048 2.114 7.705 1.00 0.00 H new ATOM 0 HB3 ARG B 340 -10.507 2.218 6.876 1.00 0.00 H new ATOM 0 HG2 ARG B 340 -10.263 4.554 7.573 1.00 0.00 H new ATOM 0 HG3 ARG B 340 -11.833 4.505 8.349 1.00 0.00 H new ATOM 0 HD2 ARG B 340 -11.010 2.668 9.843 1.00 0.00 H new ATOM 0 HD3 ARG B 340 -9.430 2.790 9.094 1.00 0.00 H new ATOM 0 HE ARG B 340 -10.039 5.391 9.957 1.00 0.00 H new ATOM 0 HH11 ARG B 340 -9.665 2.185 11.396 1.00 0.00 H new ATOM 0 HH12 ARG B 340 -9.113 2.822 12.949 1.00 0.00 H new ATOM 0 HH21 ARG B 340 -9.328 6.197 11.950 1.00 0.00 H new ATOM 0 HH22 ARG B 340 -8.923 5.084 13.261 1.00 0.00 H new ATOM 1142 N ASN B 341 -12.916 5.382 6.713 1.00 0.00 N ATOM 1143 CA ASN B 341 -13.906 6.387 7.081 1.00 0.00 C ATOM 1144 C ASN B 341 -14.834 6.689 5.909 1.00 0.00 C ATOM 1145 O ASN B 341 -16.057 6.646 6.047 1.00 0.00 O ATOM 1146 CB ASN B 341 -13.210 7.672 7.539 1.00 0.00 C ATOM 1147 CG ASN B 341 -14.178 8.683 8.126 1.00 0.00 C ATOM 1148 OD1 ASN B 341 -15.349 8.735 7.748 1.00 0.00 O ATOM 1149 ND2 ASN B 341 -13.691 9.495 9.055 1.00 0.00 N ATOM 0 H ASN B 341 -11.950 5.677 6.853 1.00 0.00 H new ATOM 0 HA ASN B 341 -14.503 5.991 7.902 1.00 0.00 H new ATOM 0 HB2 ASN B 341 -12.453 7.425 8.283 1.00 0.00 H new ATOM 0 HB3 ASN B 341 -12.691 8.121 6.692 1.00 0.00 H new ATOM 0 HD21 ASN B 341 -14.293 10.197 9.486 1.00 0.00 H new ATOM 0 HD22 ASN B 341 -12.714 9.418 9.339 1.00 0.00 H new ATOM 1156 N ALA B 342 -14.245 6.998 4.757 1.00 0.00 N ATOM 1157 CA ALA B 342 -15.021 7.305 3.562 1.00 0.00 C ATOM 1158 C ALA B 342 -15.926 6.138 3.183 1.00 0.00 C ATOM 1159 O ALA B 342 -17.022 6.333 2.656 1.00 0.00 O ATOM 1160 CB ALA B 342 -14.096 7.655 2.407 1.00 0.00 C ATOM 0 H ALA B 342 -13.234 7.042 4.627 1.00 0.00 H new ATOM 0 HA ALA B 342 -15.653 8.166 3.779 1.00 0.00 H new ATOM 0 HB1 ALA B 342 -14.690 7.882 1.521 1.00 0.00 H new ATOM 0 HB2 ALA B 342 -13.494 8.524 2.673 1.00 0.00 H new ATOM 0 HB3 ALA B 342 -13.440 6.810 2.197 1.00 0.00 H new ATOM 1166 N LYS B 343 -15.459 4.923 3.455 1.00 0.00 N ATOM 1167 CA LYS B 343 -16.223 3.721 3.147 1.00 0.00 C ATOM 1168 C LYS B 343 -17.431 3.591 4.070 1.00 0.00 C ATOM 1169 O LYS B 343 -18.508 3.170 3.645 1.00 0.00 O ATOM 1170 CB LYS B 343 -15.334 2.483 3.276 1.00 0.00 C ATOM 1171 CG LYS B 343 -16.027 1.193 2.873 1.00 0.00 C ATOM 1172 CD LYS B 343 -15.140 -0.016 3.119 1.00 0.00 C ATOM 1173 CE LYS B 343 -15.790 -1.295 2.616 1.00 0.00 C ATOM 1174 NZ LYS B 343 -17.110 -1.539 3.260 1.00 0.00 N ATOM 0 H LYS B 343 -14.553 4.746 3.889 1.00 0.00 H new ATOM 0 HA LYS B 343 -16.581 3.800 2.120 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -14.446 2.617 2.658 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -14.994 2.396 4.308 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -16.954 1.086 3.436 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -16.298 1.238 1.818 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -14.182 0.127 2.620 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -14.934 -0.106 4.185 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -15.919 -1.236 1.535 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -15.129 -2.139 2.812 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -17.449 -2.489 3.008 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -17.010 -1.470 4.293 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -17.794 -0.829 2.930 1.00 0.00 H new ATOM 1188 N GLU B 344 -17.244 3.954 5.334 1.00 0.00 N ATOM 1189 CA GLU B 344 -18.310 3.879 6.321 1.00 0.00 C ATOM 1190 C GLU B 344 -19.277 5.051 6.174 1.00 0.00 C ATOM 1191 O GLU B 344 -20.430 4.973 6.600 1.00 0.00 O ATOM 1192 CB GLU B 344 -17.714 3.867 7.728 1.00 0.00 C ATOM 1193 CG GLU B 344 -16.893 2.624 8.033 1.00 0.00 C ATOM 1194 CD GLU B 344 -17.719 1.353 7.983 1.00 0.00 C ATOM 1195 OE1 GLU B 344 -18.352 1.016 9.006 1.00 0.00 O ATOM 1196 OE2 GLU B 344 -17.734 0.696 6.921 1.00 0.00 O ATOM 0 H GLU B 344 -16.358 4.305 5.699 1.00 0.00 H new ATOM 0 HA GLU B 344 -18.866 2.956 6.155 1.00 0.00 H new ATOM 0 HB2 GLU B 344 -17.084 4.748 7.854 1.00 0.00 H new ATOM 0 HB3 GLU B 344 -18.522 3.946 8.456 1.00 0.00 H new ATOM 0 HG2 GLU B 344 -16.074 2.549 7.317 1.00 0.00 H new ATOM 0 HG3 GLU B 344 -16.444 2.723 9.021 1.00 0.00 H new ATOM 1203 N ALA B 345 -18.798 6.135 5.571 1.00 0.00 N ATOM 1204 CA ALA B 345 -19.620 7.323 5.369 1.00 0.00 C ATOM 1205 C ALA B 345 -20.598 7.124 4.217 1.00 0.00 C ATOM 1206 O ALA B 345 -21.759 7.525 4.300 1.00 0.00 O ATOM 1207 CB ALA B 345 -18.738 8.536 5.111 1.00 0.00 C ATOM 0 H ALA B 345 -17.846 6.215 5.214 1.00 0.00 H new ATOM 0 HA ALA B 345 -20.199 7.494 6.277 1.00 0.00 H new ATOM 0 HB1 ALA B 345 -19.364 9.416 4.962 1.00 0.00 H new ATOM 0 HB2 ALA B 345 -18.082 8.698 5.967 1.00 0.00 H new ATOM 0 HB3 ALA B 345 -18.135 8.364 4.219 1.00 0.00 H new ATOM 1276 N PRO B 351 -12.611 12.257 0.973 1.00 0.00 N ATOM 1277 CA PRO B 351 -11.315 11.653 1.306 1.00 0.00 C ATOM 1278 C PRO B 351 -10.152 12.620 1.110 1.00 0.00 C ATOM 1279 O PRO B 351 -10.066 13.302 0.089 1.00 0.00 O ATOM 1280 CB PRO B 351 -11.201 10.483 0.326 1.00 0.00 C ATOM 1281 CG PRO B 351 -12.606 10.148 -0.031 1.00 0.00 C ATOM 1282 CD PRO B 351 -13.355 11.450 -0.014 1.00 0.00 C ATOM 0 HA PRO B 351 -11.267 11.357 2.354 1.00 0.00 H new ATOM 0 HB2 PRO B 351 -10.624 10.761 -0.556 1.00 0.00 H new ATOM 0 HB3 PRO B 351 -10.695 9.632 0.783 1.00 0.00 H new ATOM 0 HG2 PRO B 351 -12.659 9.680 -1.014 1.00 0.00 H new ATOM 0 HG3 PRO B 351 -13.033 9.442 0.682 1.00 0.00 H new ATOM 0 HD2 PRO B 351 -13.363 11.923 -0.996 1.00 0.00 H new ATOM 0 HD3 PRO B 351 -14.395 11.312 0.281 1.00 0.00 H new ATOM 1290 N ALA B 352 -9.261 12.672 2.095 1.00 0.00 N ATOM 1291 CA ALA B 352 -8.100 13.552 2.032 1.00 0.00 C ATOM 1292 C ALA B 352 -7.120 13.081 0.964 1.00 0.00 C ATOM 1293 O ALA B 352 -6.741 13.843 0.074 1.00 0.00 O ATOM 1294 CB ALA B 352 -7.413 13.619 3.388 1.00 0.00 C ATOM 0 H ALA B 352 -9.321 12.114 2.947 1.00 0.00 H new ATOM 0 HA ALA B 352 -8.443 14.551 1.763 1.00 0.00 H new ATOM 0 HB1 ALA B 352 -6.548 14.280 3.325 1.00 0.00 H new ATOM 0 HB2 ALA B 352 -8.111 14.005 4.131 1.00 0.00 H new ATOM 0 HB3 ALA B 352 -7.087 12.621 3.680 1.00 0.00 H new ATOM 1300 N LEU B 353 -6.715 11.818 1.061 1.00 0.00 N ATOM 1301 CA LEU B 353 -5.779 11.237 0.106 1.00 0.00 C ATOM 1302 C LEU B 353 -6.483 10.255 -0.823 1.00 0.00 C ATOM 1303 O LEU B 353 -7.224 9.381 -0.375 1.00 0.00 O ATOM 1304 CB LEU B 353 -4.639 10.525 0.837 1.00 0.00 C ATOM 1305 CG LEU B 353 -3.599 11.443 1.476 1.00 0.00 C ATOM 1306 CD1 LEU B 353 -4.156 12.100 2.728 1.00 0.00 C ATOM 1307 CD2 LEU B 353 -2.336 10.661 1.790 1.00 0.00 C ATOM 0 H LEU B 353 -7.021 11.177 1.793 1.00 0.00 H new ATOM 0 HA LEU B 353 -5.369 12.050 -0.492 1.00 0.00 H new ATOM 0 HB2 LEU B 353 -5.067 9.892 1.614 1.00 0.00 H new ATOM 0 HB3 LEU B 353 -4.133 9.866 0.132 1.00 0.00 H new ATOM 0 HG LEU B 353 -3.350 12.234 0.768 1.00 0.00 H new ATOM 0 HD11 LEU B 353 -3.398 12.749 3.166 1.00 0.00 H new ATOM 0 HD12 LEU B 353 -5.034 12.691 2.469 1.00 0.00 H new ATOM 0 HD13 LEU B 353 -4.436 11.331 3.448 1.00 0.00 H new ATOM 0 HD21 LEU B 353 -1.601 11.325 2.245 1.00 0.00 H new ATOM 0 HD22 LEU B 353 -2.572 9.852 2.481 1.00 0.00 H new ATOM 0 HD23 LEU B 353 -1.928 10.244 0.869 1.00 0.00 H new ATOM 1319 N THR B 354 -6.242 10.408 -2.120 1.00 0.00 N ATOM 1320 CA THR B 354 -6.841 9.535 -3.119 1.00 0.00 C ATOM 1321 C THR B 354 -5.773 8.694 -3.807 1.00 0.00 C ATOM 1322 O THR B 354 -4.594 8.768 -3.458 1.00 0.00 O ATOM 1323 CB THR B 354 -7.610 10.342 -4.181 1.00 0.00 C ATOM 1324 OG1 THR B 354 -6.726 11.260 -4.836 1.00 0.00 O ATOM 1325 CG2 THR B 354 -8.764 11.105 -3.548 1.00 0.00 C ATOM 0 H THR B 354 -5.634 11.131 -2.504 1.00 0.00 H new ATOM 0 HA THR B 354 -7.541 8.882 -2.599 1.00 0.00 H new ATOM 0 HB THR B 354 -8.014 9.644 -4.914 1.00 0.00 H new ATOM 0 HG1 THR B 354 -7.223 11.768 -5.511 1.00 0.00 H new ATOM 0 HG21 THR B 354 -9.293 11.668 -4.317 1.00 0.00 H new ATOM 0 HG22 THR B 354 -9.450 10.401 -3.076 1.00 0.00 H new ATOM 0 HG23 THR B 354 -8.377 11.793 -2.797 1.00 0.00 H new ATOM 1333 N GLU B 355 -6.190 7.892 -4.781 1.00 0.00 N ATOM 1334 CA GLU B 355 -5.263 7.041 -5.517 1.00 0.00 C ATOM 1335 C GLU B 355 -4.151 7.875 -6.148 1.00 0.00 C ATOM 1336 O GLU B 355 -2.998 7.444 -6.220 1.00 0.00 O ATOM 1337 CB GLU B 355 -6.010 6.256 -6.597 1.00 0.00 C ATOM 1338 CG GLU B 355 -7.097 5.346 -6.045 1.00 0.00 C ATOM 1339 CD GLU B 355 -7.804 4.557 -7.129 1.00 0.00 C ATOM 1340 OE1 GLU B 355 -8.718 5.117 -7.771 1.00 0.00 O ATOM 1341 OE2 GLU B 355 -7.445 3.379 -7.336 1.00 0.00 O ATOM 0 H GLU B 355 -7.162 7.814 -5.079 1.00 0.00 H new ATOM 0 HA GLU B 355 -4.812 6.338 -4.817 1.00 0.00 H new ATOM 0 HB2 GLU B 355 -6.458 6.958 -7.301 1.00 0.00 H new ATOM 0 HB3 GLU B 355 -5.295 5.655 -7.158 1.00 0.00 H new ATOM 0 HG2 GLU B 355 -6.657 4.655 -5.327 1.00 0.00 H new ATOM 0 HG3 GLU B 355 -7.828 5.946 -5.503 1.00 0.00 H new ATOM 1348 N GLN B 356 -4.509 9.076 -6.593 1.00 0.00 N ATOM 1349 CA GLN B 356 -3.552 9.979 -7.220 1.00 0.00 C ATOM 1350 C GLN B 356 -2.619 10.600 -6.185 1.00 0.00 C ATOM 1351 O GLN B 356 -1.447 10.848 -6.468 1.00 0.00 O ATOM 1352 CB GLN B 356 -4.286 11.081 -7.987 1.00 0.00 C ATOM 1353 CG GLN B 356 -5.087 10.568 -9.174 1.00 0.00 C ATOM 1354 CD GLN B 356 -4.219 9.889 -10.218 1.00 0.00 C ATOM 1355 OE1 GLN B 356 -2.976 10.341 -10.344 1.00 0.00 O flip ATOM 1356 NE2 GLN B 356 -4.663 8.971 -10.906 1.00 0.00 N flip ATOM 0 H GLN B 356 -5.457 9.446 -6.530 1.00 0.00 H new ATOM 0 HA GLN B 356 -2.950 9.396 -7.917 1.00 0.00 H new ATOM 0 HB2 GLN B 356 -4.957 11.602 -7.304 1.00 0.00 H new ATOM 0 HB3 GLN B 356 -3.559 11.813 -8.339 1.00 0.00 H new ATOM 0 HG2 GLN B 356 -5.841 9.864 -8.821 1.00 0.00 H new ATOM 0 HG3 GLN B 356 -5.619 11.400 -9.635 1.00 0.00 H new ATOM 0 HE21 GLN B 356 -5.624 8.655 -10.776 1.00 0.00 H new ATOM 0 HE22 GLN B 356 -4.070 8.526 -11.606 1.00 0.00 H new ATOM 1365 N GLU B 357 -3.142 10.852 -4.988 1.00 0.00 N ATOM 1366 CA GLU B 357 -2.344 11.446 -3.919 1.00 0.00 C ATOM 1367 C GLU B 357 -1.209 10.511 -3.517 1.00 0.00 C ATOM 1368 O GLU B 357 -0.056 10.929 -3.404 1.00 0.00 O ATOM 1369 CB GLU B 357 -3.217 11.755 -2.700 1.00 0.00 C ATOM 1370 CG GLU B 357 -2.666 12.870 -1.825 1.00 0.00 C ATOM 1371 CD GLU B 357 -2.557 14.191 -2.562 1.00 0.00 C ATOM 1372 OE1 GLU B 357 -3.563 14.930 -2.605 1.00 0.00 O ATOM 1373 OE2 GLU B 357 -1.468 14.484 -3.098 1.00 0.00 O ATOM 0 H GLU B 357 -4.110 10.655 -4.734 1.00 0.00 H new ATOM 0 HA GLU B 357 -1.920 12.378 -4.293 1.00 0.00 H new ATOM 0 HB2 GLU B 357 -4.216 12.030 -3.039 1.00 0.00 H new ATOM 0 HB3 GLU B 357 -3.322 10.851 -2.100 1.00 0.00 H new ATOM 0 HG2 GLU B 357 -3.310 12.996 -0.955 1.00 0.00 H new ATOM 0 HG3 GLU B 357 -1.682 12.583 -1.454 1.00 0.00 H new ATOM 1380 N VAL B 358 -1.544 9.242 -3.308 1.00 0.00 N ATOM 1381 CA VAL B 358 -0.554 8.248 -2.918 1.00 0.00 C ATOM 1382 C VAL B 358 0.438 7.982 -4.044 1.00 0.00 C ATOM 1383 O VAL B 358 1.644 8.114 -3.853 1.00 0.00 O ATOM 1384 CB VAL B 358 -1.216 6.919 -2.502 1.00 0.00 C ATOM 1385 CG1 VAL B 358 -0.165 5.880 -2.143 1.00 0.00 C ATOM 1386 CG2 VAL B 358 -2.163 7.136 -1.335 1.00 0.00 C ATOM 0 H VAL B 358 -2.493 8.879 -3.402 1.00 0.00 H new ATOM 0 HA VAL B 358 -0.021 8.660 -2.061 1.00 0.00 H new ATOM 0 HB VAL B 358 -1.790 6.547 -3.351 1.00 0.00 H new ATOM 0 HG11 VAL B 358 -0.656 4.951 -1.853 1.00 0.00 H new ATOM 0 HG12 VAL B 358 0.476 5.698 -3.006 1.00 0.00 H new ATOM 0 HG13 VAL B 358 0.439 6.246 -1.313 1.00 0.00 H new ATOM 0 HG21 VAL B 358 -2.620 6.187 -1.056 1.00 0.00 H new ATOM 0 HG22 VAL B 358 -1.608 7.535 -0.486 1.00 0.00 H new ATOM 0 HG23 VAL B 358 -2.941 7.842 -1.624 1.00 0.00 H new ATOM 1396 N TYR B 359 -0.069 7.617 -5.219 1.00 0.00 N ATOM 1397 CA TYR B 359 0.798 7.325 -6.358 1.00 0.00 C ATOM 1398 C TYR B 359 1.761 8.480 -6.633 1.00 0.00 C ATOM 1399 O TYR B 359 2.920 8.259 -6.981 1.00 0.00 O ATOM 1400 CB TYR B 359 -0.031 7.025 -7.611 1.00 0.00 C ATOM 1401 CG TYR B 359 0.625 6.025 -8.542 1.00 0.00 C ATOM 1402 CD1 TYR B 359 1.886 6.263 -9.076 1.00 0.00 C ATOM 1403 CD2 TYR B 359 -0.016 4.839 -8.880 1.00 0.00 C ATOM 1404 CE1 TYR B 359 2.489 5.349 -9.921 1.00 0.00 C ATOM 1405 CE2 TYR B 359 0.580 3.920 -9.724 1.00 0.00 C ATOM 1406 CZ TYR B 359 1.832 4.179 -10.241 1.00 0.00 C ATOM 1407 OH TYR B 359 2.428 3.267 -11.081 1.00 0.00 O ATOM 0 H TYR B 359 -1.067 7.517 -5.407 1.00 0.00 H new ATOM 0 HA TYR B 359 1.385 6.442 -6.104 1.00 0.00 H new ATOM 0 HB2 TYR B 359 -1.007 6.644 -7.309 1.00 0.00 H new ATOM 0 HB3 TYR B 359 -0.206 7.954 -8.153 1.00 0.00 H new ATOM 0 HD1 TYR B 359 2.404 7.177 -8.827 1.00 0.00 H new ATOM 0 HD2 TYR B 359 -0.996 4.632 -8.477 1.00 0.00 H new ATOM 0 HE1 TYR B 359 3.469 5.550 -10.328 1.00 0.00 H new ATOM 0 HE2 TYR B 359 0.067 3.004 -9.977 1.00 0.00 H new ATOM 0 HH TYR B 359 2.910 2.599 -10.550 1.00 0.00 H new ATOM 1417 N ALA B 360 1.279 9.709 -6.469 1.00 0.00 N ATOM 1418 CA ALA B 360 2.105 10.891 -6.707 1.00 0.00 C ATOM 1419 C ALA B 360 3.230 11.000 -5.681 1.00 0.00 C ATOM 1420 O ALA B 360 4.409 10.987 -6.038 1.00 0.00 O ATOM 1421 CB ALA B 360 1.247 12.146 -6.687 1.00 0.00 C ATOM 0 H ALA B 360 0.324 9.913 -6.173 1.00 0.00 H new ATOM 0 HA ALA B 360 2.561 10.789 -7.692 1.00 0.00 H new ATOM 0 HB1 ALA B 360 1.875 13.019 -6.866 1.00 0.00 H new ATOM 0 HB2 ALA B 360 0.487 12.080 -7.466 1.00 0.00 H new ATOM 0 HB3 ALA B 360 0.763 12.240 -5.715 1.00 0.00 H new ATOM 1427 N GLN B 361 2.859 11.112 -4.407 1.00 0.00 N ATOM 1428 CA GLN B 361 3.840 11.222 -3.330 1.00 0.00 C ATOM 1429 C GLN B 361 4.854 10.084 -3.402 1.00 0.00 C ATOM 1430 O GLN B 361 6.058 10.305 -3.273 1.00 0.00 O ATOM 1431 CB GLN B 361 3.140 11.215 -1.970 1.00 0.00 C ATOM 1432 CG GLN B 361 2.247 12.425 -1.740 1.00 0.00 C ATOM 1433 CD GLN B 361 1.582 12.409 -0.377 1.00 0.00 C ATOM 1434 OE1 GLN B 361 1.307 11.347 0.180 1.00 0.00 O ATOM 1435 NE2 GLN B 361 1.319 13.592 0.166 1.00 0.00 N ATOM 0 H GLN B 361 1.888 11.129 -4.096 1.00 0.00 H new ATOM 0 HA GLN B 361 4.371 12.166 -3.450 1.00 0.00 H new ATOM 0 HB2 GLN B 361 2.540 10.309 -1.884 1.00 0.00 H new ATOM 0 HB3 GLN B 361 3.893 11.174 -1.183 1.00 0.00 H new ATOM 0 HG2 GLN B 361 2.840 13.334 -1.840 1.00 0.00 H new ATOM 0 HG3 GLN B 361 1.480 12.458 -2.514 1.00 0.00 H new ATOM 0 HE21 GLN B 361 1.565 14.448 -0.332 1.00 0.00 H new ATOM 0 HE22 GLN B 361 0.871 13.645 1.081 1.00 0.00 H new ATOM 1444 N VAL B 362 4.358 8.867 -3.604 1.00 0.00 N ATOM 1445 CA VAL B 362 5.221 7.697 -3.706 1.00 0.00 C ATOM 1446 C VAL B 362 6.160 7.832 -4.900 1.00 0.00 C ATOM 1447 O VAL B 362 7.330 7.455 -4.829 1.00 0.00 O ATOM 1448 CB VAL B 362 4.399 6.399 -3.846 1.00 0.00 C ATOM 1449 CG1 VAL B 362 5.310 5.198 -4.039 1.00 0.00 C ATOM 1450 CG2 VAL B 362 3.512 6.195 -2.630 1.00 0.00 C ATOM 0 H VAL B 362 3.363 8.666 -3.700 1.00 0.00 H new ATOM 0 HA VAL B 362 5.804 7.640 -2.787 1.00 0.00 H new ATOM 0 HB VAL B 362 3.766 6.495 -4.728 1.00 0.00 H new ATOM 0 HG11 VAL B 362 4.707 4.295 -4.135 1.00 0.00 H new ATOM 0 HG12 VAL B 362 5.905 5.334 -4.942 1.00 0.00 H new ATOM 0 HG13 VAL B 362 5.972 5.102 -3.179 1.00 0.00 H new ATOM 0 HG21 VAL B 362 2.940 5.275 -2.747 1.00 0.00 H new ATOM 0 HG22 VAL B 362 4.131 6.126 -1.736 1.00 0.00 H new ATOM 0 HG23 VAL B 362 2.827 7.038 -2.533 1.00 0.00 H new ATOM 1460 N ALA B 363 5.637 8.377 -5.995 1.00 0.00 N ATOM 1461 CA ALA B 363 6.429 8.574 -7.203 1.00 0.00 C ATOM 1462 C ALA B 363 7.530 9.597 -6.958 1.00 0.00 C ATOM 1463 O ALA B 363 8.582 9.559 -7.596 1.00 0.00 O ATOM 1464 CB ALA B 363 5.539 9.016 -8.355 1.00 0.00 C ATOM 0 H ALA B 363 4.669 8.689 -6.070 1.00 0.00 H new ATOM 0 HA ALA B 363 6.894 7.625 -7.470 1.00 0.00 H new ATOM 0 HB1 ALA B 363 6.146 9.159 -9.249 1.00 0.00 H new ATOM 0 HB2 ALA B 363 4.785 8.252 -8.546 1.00 0.00 H new ATOM 0 HB3 ALA B 363 5.048 9.954 -8.096 1.00 0.00 H new ATOM 1470 N ARG B 364 7.276 10.512 -6.028 1.00 0.00 N ATOM 1471 CA ARG B 364 8.245 11.544 -5.684 1.00 0.00 C ATOM 1472 C ARG B 364 9.243 11.020 -4.656 1.00 0.00 C ATOM 1473 O ARG B 364 10.381 11.486 -4.586 1.00 0.00 O ATOM 1474 CB ARG B 364 7.531 12.782 -5.137 1.00 0.00 C ATOM 1475 CG ARG B 364 8.462 13.946 -4.845 1.00 0.00 C ATOM 1476 CD ARG B 364 7.694 15.164 -4.359 1.00 0.00 C ATOM 1477 NE ARG B 364 7.014 14.913 -3.091 1.00 0.00 N ATOM 1478 CZ ARG B 364 6.215 15.794 -2.494 1.00 0.00 C ATOM 1479 NH1 ARG B 364 5.991 16.977 -3.051 1.00 0.00 N ATOM 1480 NH2 ARG B 364 5.639 15.491 -1.338 1.00 0.00 N ATOM 0 H ARG B 364 6.405 10.559 -5.499 1.00 0.00 H new ATOM 0 HA ARG B 364 8.788 11.820 -6.588 1.00 0.00 H new ATOM 0 HB2 ARG B 364 6.777 13.103 -5.856 1.00 0.00 H new ATOM 0 HB3 ARG B 364 7.004 12.512 -4.222 1.00 0.00 H new ATOM 0 HG2 ARG B 364 9.191 13.650 -4.091 1.00 0.00 H new ATOM 0 HG3 ARG B 364 9.020 14.202 -5.746 1.00 0.00 H new ATOM 0 HD2 ARG B 364 8.381 16.002 -4.242 1.00 0.00 H new ATOM 0 HD3 ARG B 364 6.961 15.455 -5.112 1.00 0.00 H new ATOM 0 HE ARG B 364 7.160 14.011 -2.637 1.00 0.00 H new ATOM 0 HH11 ARG B 364 6.432 17.214 -3.940 1.00 0.00 H new ATOM 0 HH12 ARG B 364 5.378 17.650 -2.590 1.00 0.00 H new ATOM 0 HH21 ARG B 364 5.808 14.582 -0.906 1.00 0.00 H new ATOM 0 HH22 ARG B 364 5.027 16.167 -0.881 1.00 0.00 H new ATOM 1494 N LEU B 365 8.806 10.047 -3.862 1.00 0.00 N ATOM 1495 CA LEU B 365 9.657 9.450 -2.838 1.00 0.00 C ATOM 1496 C LEU B 365 10.871 8.779 -3.471 1.00 0.00 C ATOM 1497 O LEU B 365 11.975 8.826 -2.926 1.00 0.00 O ATOM 1498 CB LEU B 365 8.870 8.420 -2.022 1.00 0.00 C ATOM 1499 CG LEU B 365 8.613 8.796 -0.560 1.00 0.00 C ATOM 1500 CD1 LEU B 365 7.582 9.909 -0.463 1.00 0.00 C ATOM 1501 CD2 LEU B 365 8.156 7.578 0.228 1.00 0.00 C ATOM 0 H LEU B 365 7.866 9.655 -3.908 1.00 0.00 H new ATOM 0 HA LEU B 365 9.998 10.247 -2.176 1.00 0.00 H new ATOM 0 HB2 LEU B 365 7.910 8.252 -2.510 1.00 0.00 H new ATOM 0 HB3 LEU B 365 9.410 7.473 -2.046 1.00 0.00 H new ATOM 0 HG LEU B 365 9.547 9.158 -0.130 1.00 0.00 H new ATOM 0 HD11 LEU B 365 7.415 10.160 0.584 1.00 0.00 H new ATOM 0 HD12 LEU B 365 7.946 10.789 -0.993 1.00 0.00 H new ATOM 0 HD13 LEU B 365 6.645 9.577 -0.910 1.00 0.00 H new ATOM 0 HD21 LEU B 365 7.977 7.862 1.265 1.00 0.00 H new ATOM 0 HD22 LEU B 365 7.235 7.189 -0.205 1.00 0.00 H new ATOM 0 HD23 LEU B 365 8.928 6.809 0.190 1.00 0.00 H new ATOM 1513 N PHE B 366 10.658 8.158 -4.627 1.00 0.00 N ATOM 1514 CA PHE B 366 11.729 7.468 -5.337 1.00 0.00 C ATOM 1515 C PHE B 366 11.986 8.113 -6.695 1.00 0.00 C ATOM 1516 O PHE B 366 11.112 8.775 -7.254 1.00 0.00 O ATOM 1517 CB PHE B 366 11.369 5.993 -5.520 1.00 0.00 C ATOM 1518 CG PHE B 366 10.804 5.360 -4.281 1.00 0.00 C ATOM 1519 CD1 PHE B 366 11.632 4.999 -3.230 1.00 0.00 C ATOM 1520 CD2 PHE B 366 9.442 5.131 -4.164 1.00 0.00 C ATOM 1521 CE1 PHE B 366 11.113 4.422 -2.087 1.00 0.00 C ATOM 1522 CE2 PHE B 366 8.917 4.554 -3.023 1.00 0.00 C ATOM 1523 CZ PHE B 366 9.754 4.199 -1.983 1.00 0.00 C ATOM 0 H PHE B 366 9.751 8.119 -5.093 1.00 0.00 H new ATOM 0 HA PHE B 366 12.639 7.546 -4.743 1.00 0.00 H new ATOM 0 HB2 PHE B 366 10.644 5.901 -6.329 1.00 0.00 H new ATOM 0 HB3 PHE B 366 12.260 5.444 -5.826 1.00 0.00 H new ATOM 0 HD1 PHE B 366 12.696 5.171 -3.305 1.00 0.00 H new ATOM 0 HD2 PHE B 366 8.783 5.407 -4.974 1.00 0.00 H new ATOM 0 HE1 PHE B 366 11.770 4.146 -1.275 1.00 0.00 H new ATOM 0 HE2 PHE B 366 7.854 4.381 -2.945 1.00 0.00 H new ATOM 0 HZ PHE B 366 9.346 3.748 -1.090 1.00 0.00 H new ATOM 1533 N LYS B 367 13.190 7.915 -7.221 1.00 0.00 N ATOM 1534 CA LYS B 367 13.561 8.476 -8.516 1.00 0.00 C ATOM 1535 C LYS B 367 14.012 7.377 -9.471 1.00 0.00 C ATOM 1536 O LYS B 367 13.289 7.011 -10.397 1.00 0.00 O ATOM 1537 CB LYS B 367 14.673 9.512 -8.347 1.00 0.00 C ATOM 1538 CG LYS B 367 15.061 10.208 -9.641 1.00 0.00 C ATOM 1539 CD LYS B 367 16.144 11.248 -9.409 1.00 0.00 C ATOM 1540 CE LYS B 367 16.527 11.957 -10.699 1.00 0.00 C ATOM 1541 NZ LYS B 367 15.372 12.676 -11.304 1.00 0.00 N ATOM 0 H LYS B 367 13.926 7.370 -6.771 1.00 0.00 H new ATOM 0 HA LYS B 367 12.684 8.964 -8.940 1.00 0.00 H new ATOM 0 HB2 LYS B 367 14.352 10.262 -7.624 1.00 0.00 H new ATOM 0 HB3 LYS B 367 15.553 9.023 -7.930 1.00 0.00 H new ATOM 0 HG2 LYS B 367 15.412 9.470 -10.362 1.00 0.00 H new ATOM 0 HG3 LYS B 367 14.183 10.686 -10.076 1.00 0.00 H new ATOM 0 HD2 LYS B 367 15.796 11.980 -8.681 1.00 0.00 H new ATOM 0 HD3 LYS B 367 17.025 10.768 -8.982 1.00 0.00 H new ATOM 0 HE2 LYS B 367 17.331 12.666 -10.498 1.00 0.00 H new ATOM 0 HE3 LYS B 367 16.915 11.229 -11.412 1.00 0.00 H new ATOM 0 HZ1 LYS B 367 15.714 13.318 -12.047 1.00 0.00 H new ATOM 0 HZ2 LYS B 367 14.713 11.987 -11.718 1.00 0.00 H new ATOM 0 HZ3 LYS B 367 14.882 13.226 -10.570 1.00 0.00 H new ATOM 1555 N ASN B 368 15.212 6.853 -9.238 1.00 0.00 N ATOM 1556 CA ASN B 368 15.758 5.792 -10.075 1.00 0.00 C ATOM 1557 C ASN B 368 15.040 4.474 -9.805 1.00 0.00 C ATOM 1558 O ASN B 368 15.101 3.544 -10.611 1.00 0.00 O ATOM 1559 CB ASN B 368 17.259 5.634 -9.824 1.00 0.00 C ATOM 1560 CG ASN B 368 17.878 4.542 -10.676 1.00 0.00 C ATOM 1561 OD1 ASN B 368 17.947 3.383 -10.267 1.00 0.00 O ATOM 1562 ND2 ASN B 368 18.331 4.909 -11.869 1.00 0.00 N ATOM 0 H ASN B 368 15.824 7.146 -8.476 1.00 0.00 H new ATOM 0 HA ASN B 368 15.603 6.065 -11.119 1.00 0.00 H new ATOM 0 HB2 ASN B 368 17.760 6.580 -10.030 1.00 0.00 H new ATOM 0 HB3 ASN B 368 17.426 5.408 -8.771 1.00 0.00 H new ATOM 0 HD21 ASN B 368 18.757 4.219 -12.487 1.00 0.00 H new ATOM 0 HD22 ASN B 368 18.253 5.881 -12.167 1.00 0.00 H new ATOM 1569 N GLN B 369 14.357 4.403 -8.666 1.00 0.00 N ATOM 1570 CA GLN B 369 13.624 3.200 -8.287 1.00 0.00 C ATOM 1571 C GLN B 369 12.161 3.300 -8.709 1.00 0.00 C ATOM 1572 O GLN B 369 11.309 3.738 -7.936 1.00 0.00 O ATOM 1573 CB GLN B 369 13.714 2.966 -6.776 1.00 0.00 C ATOM 1574 CG GLN B 369 15.134 2.768 -6.268 1.00 0.00 C ATOM 1575 CD GLN B 369 15.959 4.039 -6.322 1.00 0.00 C ATOM 1576 OE1 GLN B 369 15.430 5.143 -6.189 1.00 0.00 O ATOM 1577 NE2 GLN B 369 17.263 3.890 -6.520 1.00 0.00 N ATOM 0 H GLN B 369 14.296 5.164 -7.990 1.00 0.00 H new ATOM 0 HA GLN B 369 14.080 2.355 -8.803 1.00 0.00 H new ATOM 0 HB2 GLN B 369 13.269 3.816 -6.259 1.00 0.00 H new ATOM 0 HB3 GLN B 369 13.120 2.089 -6.518 1.00 0.00 H new ATOM 0 HG2 GLN B 369 15.100 2.405 -5.241 1.00 0.00 H new ATOM 0 HG3 GLN B 369 15.624 1.997 -6.863 1.00 0.00 H new ATOM 0 HE21 GLN B 369 17.659 2.956 -6.625 1.00 0.00 H new ATOM 0 HE22 GLN B 369 17.869 4.709 -6.567 1.00 0.00 H new ATOM 1586 N GLU B 370 11.880 2.900 -9.946 1.00 0.00 N ATOM 1587 CA GLU B 370 10.521 2.941 -10.474 1.00 0.00 C ATOM 1588 C GLU B 370 9.824 1.598 -10.269 1.00 0.00 C ATOM 1589 O GLU B 370 8.602 1.493 -10.393 1.00 0.00 O ATOM 1590 CB GLU B 370 10.545 3.302 -11.960 1.00 0.00 C ATOM 1591 CG GLU B 370 9.164 3.506 -12.561 1.00 0.00 C ATOM 1592 CD GLU B 370 9.218 3.857 -14.035 1.00 0.00 C ATOM 1593 OE1 GLU B 370 9.314 2.927 -14.863 1.00 0.00 O ATOM 1594 OE2 GLU B 370 9.169 5.061 -14.361 1.00 0.00 O ATOM 0 H GLU B 370 12.576 2.544 -10.601 1.00 0.00 H new ATOM 0 HA GLU B 370 9.962 3.705 -9.933 1.00 0.00 H new ATOM 0 HB2 GLU B 370 11.128 4.213 -12.094 1.00 0.00 H new ATOM 0 HB3 GLU B 370 11.057 2.512 -12.509 1.00 0.00 H new ATOM 0 HG2 GLU B 370 8.576 2.598 -12.428 1.00 0.00 H new ATOM 0 HG3 GLU B 370 8.650 4.301 -12.020 1.00 0.00 H new ATOM 1601 N ASP B 371 10.614 0.575 -9.956 1.00 0.00 N ATOM 1602 CA ASP B 371 10.084 -0.763 -9.730 1.00 0.00 C ATOM 1603 C ASP B 371 9.009 -0.746 -8.647 1.00 0.00 C ATOM 1604 O ASP B 371 8.010 -1.458 -8.741 1.00 0.00 O ATOM 1605 CB ASP B 371 11.212 -1.717 -9.334 1.00 0.00 C ATOM 1606 CG ASP B 371 10.717 -3.128 -9.082 1.00 0.00 C ATOM 1607 OD1 ASP B 371 10.649 -3.914 -10.050 1.00 0.00 O ATOM 1608 OD2 ASP B 371 10.399 -3.446 -7.916 1.00 0.00 O ATOM 0 H ASP B 371 11.626 0.649 -9.853 1.00 0.00 H new ATOM 0 HA ASP B 371 9.631 -1.112 -10.658 1.00 0.00 H new ATOM 0 HB2 ASP B 371 11.963 -1.734 -10.124 1.00 0.00 H new ATOM 0 HB3 ASP B 371 11.703 -1.342 -8.436 1.00 0.00 H new ATOM 1613 N LEU B 372 9.219 0.075 -7.623 1.00 0.00 N ATOM 1614 CA LEU B 372 8.265 0.184 -6.526 1.00 0.00 C ATOM 1615 C LEU B 372 6.955 0.806 -6.997 1.00 0.00 C ATOM 1616 O LEU B 372 5.876 0.398 -6.569 1.00 0.00 O ATOM 1617 CB LEU B 372 8.849 1.017 -5.385 1.00 0.00 C ATOM 1618 CG LEU B 372 10.010 0.367 -4.631 1.00 0.00 C ATOM 1619 CD1 LEU B 372 11.315 0.540 -5.392 1.00 0.00 C ATOM 1620 CD2 LEU B 372 10.123 0.950 -3.231 1.00 0.00 C ATOM 0 H LEU B 372 10.040 0.673 -7.530 1.00 0.00 H new ATOM 0 HA LEU B 372 8.062 -0.824 -6.164 1.00 0.00 H new ATOM 0 HB2 LEU B 372 9.188 1.971 -5.790 1.00 0.00 H new ATOM 0 HB3 LEU B 372 8.053 1.238 -4.674 1.00 0.00 H new ATOM 0 HG LEU B 372 9.809 -0.701 -4.547 1.00 0.00 H new ATOM 0 HD11 LEU B 372 12.126 0.069 -4.836 1.00 0.00 H new ATOM 0 HD12 LEU B 372 11.229 0.073 -6.373 1.00 0.00 H new ATOM 0 HD13 LEU B 372 11.527 1.602 -5.514 1.00 0.00 H new ATOM 0 HD21 LEU B 372 10.954 0.478 -2.706 1.00 0.00 H new ATOM 0 HD22 LEU B 372 10.299 2.024 -3.297 1.00 0.00 H new ATOM 0 HD23 LEU B 372 9.198 0.767 -2.685 1.00 0.00 H new ATOM 1632 N LEU B 373 7.054 1.796 -7.880 1.00 0.00 N ATOM 1633 CA LEU B 373 5.873 2.474 -8.402 1.00 0.00 C ATOM 1634 C LEU B 373 5.007 1.514 -9.212 1.00 0.00 C ATOM 1635 O LEU B 373 3.785 1.500 -9.071 1.00 0.00 O ATOM 1636 CB LEU B 373 6.279 3.672 -9.264 1.00 0.00 C ATOM 1637 CG LEU B 373 7.292 4.625 -8.621 1.00 0.00 C ATOM 1638 CD1 LEU B 373 7.506 5.847 -9.499 1.00 0.00 C ATOM 1639 CD2 LEU B 373 6.840 5.044 -7.227 1.00 0.00 C ATOM 0 H LEU B 373 7.939 2.146 -8.248 1.00 0.00 H new ATOM 0 HA LEU B 373 5.289 2.833 -7.555 1.00 0.00 H new ATOM 0 HB2 LEU B 373 6.697 3.301 -10.200 1.00 0.00 H new ATOM 0 HB3 LEU B 373 5.382 4.238 -9.517 1.00 0.00 H new ATOM 0 HG LEU B 373 8.240 4.095 -8.525 1.00 0.00 H new ATOM 0 HD11 LEU B 373 8.228 6.513 -9.026 1.00 0.00 H new ATOM 0 HD12 LEU B 373 7.884 5.534 -10.472 1.00 0.00 H new ATOM 0 HD13 LEU B 373 6.560 6.372 -9.629 1.00 0.00 H new ATOM 0 HD21 LEU B 373 7.577 5.720 -6.793 1.00 0.00 H new ATOM 0 HD22 LEU B 373 5.877 5.551 -7.294 1.00 0.00 H new ATOM 0 HD23 LEU B 373 6.742 4.161 -6.596 1.00 0.00 H new ATOM 1651 N SER B 374 5.647 0.715 -10.060 1.00 0.00 N ATOM 1652 CA SER B 374 4.929 -0.252 -10.885 1.00 0.00 C ATOM 1653 C SER B 374 4.286 -1.325 -10.013 1.00 0.00 C ATOM 1654 O SER B 374 3.075 -1.560 -10.085 1.00 0.00 O ATOM 1655 CB SER B 374 5.877 -0.897 -11.899 1.00 0.00 C ATOM 1656 OG SER B 374 6.434 0.075 -12.767 1.00 0.00 O ATOM 0 H SER B 374 6.658 0.717 -10.194 1.00 0.00 H new ATOM 0 HA SER B 374 4.143 0.275 -11.426 1.00 0.00 H new ATOM 0 HB2 SER B 374 6.676 -1.420 -11.373 1.00 0.00 H new ATOM 0 HB3 SER B 374 5.338 -1.643 -12.482 1.00 0.00 H new ATOM 0 HG SER B 374 7.037 -0.362 -13.404 1.00 0.00 H new ATOM 1662 N GLU B 375 5.104 -1.974 -9.189 1.00 0.00 N ATOM 1663 CA GLU B 375 4.614 -3.013 -8.294 1.00 0.00 C ATOM 1664 C GLU B 375 3.447 -2.486 -7.471 1.00 0.00 C ATOM 1665 O GLU B 375 2.477 -3.202 -7.223 1.00 0.00 O ATOM 1666 CB GLU B 375 5.733 -3.499 -7.370 1.00 0.00 C ATOM 1667 CG GLU B 375 6.842 -4.244 -8.097 1.00 0.00 C ATOM 1668 CD GLU B 375 6.351 -5.509 -8.773 1.00 0.00 C ATOM 1669 OE1 GLU B 375 6.300 -6.560 -8.101 1.00 0.00 O ATOM 1670 OE2 GLU B 375 6.016 -5.448 -9.975 1.00 0.00 O ATOM 0 H GLU B 375 6.107 -1.798 -9.124 1.00 0.00 H new ATOM 0 HA GLU B 375 4.272 -3.855 -8.895 1.00 0.00 H new ATOM 0 HB2 GLU B 375 6.162 -2.642 -6.851 1.00 0.00 H new ATOM 0 HB3 GLU B 375 5.306 -4.152 -6.609 1.00 0.00 H new ATOM 0 HG2 GLU B 375 7.287 -3.587 -8.844 1.00 0.00 H new ATOM 0 HG3 GLU B 375 7.629 -4.498 -7.387 1.00 0.00 H new ATOM 1677 N PHE B 376 3.546 -1.225 -7.055 1.00 0.00 N ATOM 1678 CA PHE B 376 2.490 -0.597 -6.273 1.00 0.00 C ATOM 1679 C PHE B 376 1.234 -0.447 -7.119 1.00 0.00 C ATOM 1680 O PHE B 376 0.122 -0.678 -6.644 1.00 0.00 O ATOM 1681 CB PHE B 376 2.936 0.771 -5.755 1.00 0.00 C ATOM 1682 CG PHE B 376 1.854 1.506 -5.016 1.00 0.00 C ATOM 1683 CD1 PHE B 376 1.544 1.174 -3.708 1.00 0.00 C ATOM 1684 CD2 PHE B 376 1.144 2.523 -5.633 1.00 0.00 C ATOM 1685 CE1 PHE B 376 0.544 1.843 -3.028 1.00 0.00 C ATOM 1686 CE2 PHE B 376 0.144 3.196 -4.958 1.00 0.00 C ATOM 1687 CZ PHE B 376 -0.156 2.855 -3.653 1.00 0.00 C ATOM 0 H PHE B 376 4.346 -0.622 -7.247 1.00 0.00 H new ATOM 0 HA PHE B 376 2.273 -1.235 -5.416 1.00 0.00 H new ATOM 0 HB2 PHE B 376 3.793 0.640 -5.095 1.00 0.00 H new ATOM 0 HB3 PHE B 376 3.270 1.379 -6.596 1.00 0.00 H new ATOM 0 HD1 PHE B 376 2.090 0.384 -3.214 1.00 0.00 H new ATOM 0 HD2 PHE B 376 1.375 2.793 -6.653 1.00 0.00 H new ATOM 0 HE1 PHE B 376 0.311 1.574 -2.008 1.00 0.00 H new ATOM 0 HE2 PHE B 376 -0.402 3.987 -5.450 1.00 0.00 H new ATOM 0 HZ PHE B 376 -0.937 3.380 -3.123 1.00 0.00 H new ATOM 1697 N GLY B 377 1.422 -0.051 -8.376 1.00 0.00 N ATOM 1698 CA GLY B 377 0.298 0.106 -9.276 1.00 0.00 C ATOM 1699 C GLY B 377 -0.512 -1.167 -9.369 1.00 0.00 C ATOM 1700 O GLY B 377 -1.737 -1.129 -9.489 1.00 0.00 O ATOM 0 H GLY B 377 2.332 0.163 -8.784 1.00 0.00 H new ATOM 0 HA2 GLY B 377 -0.338 0.920 -8.928 1.00 0.00 H new ATOM 0 HA3 GLY B 377 0.658 0.384 -10.267 1.00 0.00 H new ATOM 1704 N GLN B 378 0.183 -2.301 -9.316 1.00 0.00 N ATOM 1705 CA GLN B 378 -0.473 -3.603 -9.373 1.00 0.00 C ATOM 1706 C GLN B 378 -1.502 -3.730 -8.254 1.00 0.00 C ATOM 1707 O GLN B 378 -2.549 -4.355 -8.425 1.00 0.00 O ATOM 1708 CB GLN B 378 0.560 -4.726 -9.259 1.00 0.00 C ATOM 1709 CG GLN B 378 1.587 -4.731 -10.381 1.00 0.00 C ATOM 1710 CD GLN B 378 1.010 -5.197 -11.705 1.00 0.00 C ATOM 1711 OE1 GLN B 378 -0.169 -4.991 -11.991 1.00 0.00 O ATOM 1712 NE2 GLN B 378 1.843 -5.835 -12.520 1.00 0.00 N ATOM 0 H GLN B 378 1.199 -2.344 -9.234 1.00 0.00 H new ATOM 0 HA GLN B 378 -0.983 -3.688 -10.333 1.00 0.00 H new ATOM 0 HB2 GLN B 378 1.079 -4.635 -8.305 1.00 0.00 H new ATOM 0 HB3 GLN B 378 0.041 -5.685 -9.249 1.00 0.00 H new ATOM 0 HG2 GLN B 378 1.993 -3.726 -10.500 1.00 0.00 H new ATOM 0 HG3 GLN B 378 2.418 -5.380 -10.104 1.00 0.00 H new ATOM 0 HE21 GLN B 378 2.813 -5.984 -12.243 1.00 0.00 H new ATOM 0 HE22 GLN B 378 1.512 -6.175 -13.423 1.00 0.00 H new ATOM 1721 N PHE B 379 -1.192 -3.134 -7.105 1.00 0.00 N ATOM 1722 CA PHE B 379 -2.089 -3.168 -5.955 1.00 0.00 C ATOM 1723 C PHE B 379 -3.275 -2.236 -6.169 1.00 0.00 C ATOM 1724 O PHE B 379 -4.402 -2.554 -5.792 1.00 0.00 O ATOM 1725 CB PHE B 379 -1.348 -2.755 -4.682 1.00 0.00 C ATOM 1726 CG PHE B 379 -0.327 -3.753 -4.217 1.00 0.00 C ATOM 1727 CD1 PHE B 379 -0.684 -4.773 -3.350 1.00 0.00 C ATOM 1728 CD2 PHE B 379 0.989 -3.667 -4.638 1.00 0.00 C ATOM 1729 CE1 PHE B 379 0.253 -5.688 -2.912 1.00 0.00 C ATOM 1730 CE2 PHE B 379 1.932 -4.579 -4.204 1.00 0.00 C ATOM 1731 CZ PHE B 379 1.563 -5.591 -3.339 1.00 0.00 C ATOM 0 H PHE B 379 -0.325 -2.621 -6.947 1.00 0.00 H new ATOM 0 HA PHE B 379 -2.451 -4.190 -5.846 1.00 0.00 H new ATOM 0 HB2 PHE B 379 -0.854 -1.799 -4.856 1.00 0.00 H new ATOM 0 HB3 PHE B 379 -2.075 -2.597 -3.886 1.00 0.00 H new ATOM 0 HD1 PHE B 379 -1.707 -4.853 -3.013 1.00 0.00 H new ATOM 0 HD2 PHE B 379 1.282 -2.877 -5.314 1.00 0.00 H new ATOM 0 HE1 PHE B 379 -0.038 -6.479 -2.236 1.00 0.00 H new ATOM 0 HE2 PHE B 379 2.955 -4.501 -4.540 1.00 0.00 H new ATOM 0 HZ PHE B 379 2.298 -6.305 -2.997 1.00 0.00 H new ATOM 1741 N LEU B 380 -3.005 -1.083 -6.776 1.00 0.00 N ATOM 1742 CA LEU B 380 -4.036 -0.086 -7.039 1.00 0.00 C ATOM 1743 C LEU B 380 -5.296 -0.737 -7.611 1.00 0.00 C ATOM 1744 O LEU B 380 -5.265 -1.288 -8.712 1.00 0.00 O ATOM 1745 CB LEU B 380 -3.508 0.968 -8.014 1.00 0.00 C ATOM 1746 CG LEU B 380 -4.163 2.344 -7.898 1.00 0.00 C ATOM 1747 CD1 LEU B 380 -3.802 2.995 -6.570 1.00 0.00 C ATOM 1748 CD2 LEU B 380 -3.743 3.229 -9.061 1.00 0.00 C ATOM 0 H LEU B 380 -2.074 -0.816 -7.096 1.00 0.00 H new ATOM 0 HA LEU B 380 -4.295 0.392 -6.094 1.00 0.00 H new ATOM 0 HB2 LEU B 380 -2.435 1.079 -7.858 1.00 0.00 H new ATOM 0 HB3 LEU B 380 -3.646 0.601 -9.031 1.00 0.00 H new ATOM 0 HG LEU B 380 -5.245 2.218 -7.934 1.00 0.00 H new ATOM 0 HD11 LEU B 380 -4.277 3.974 -6.504 1.00 0.00 H new ATOM 0 HD12 LEU B 380 -4.150 2.367 -5.750 1.00 0.00 H new ATOM 0 HD13 LEU B 380 -2.720 3.111 -6.504 1.00 0.00 H new ATOM 0 HD21 LEU B 380 -4.217 4.206 -8.965 1.00 0.00 H new ATOM 0 HD22 LEU B 380 -2.660 3.349 -9.054 1.00 0.00 H new ATOM 0 HD23 LEU B 380 -4.050 2.767 -9.999 1.00 0.00 H new ATOM 1760 N PRO B 381 -6.423 -0.687 -6.869 1.00 0.00 N ATOM 1761 CA PRO B 381 -7.690 -1.280 -7.311 1.00 0.00 C ATOM 1762 C PRO B 381 -8.012 -0.959 -8.769 1.00 0.00 C ATOM 1763 O PRO B 381 -8.057 0.207 -9.162 1.00 0.00 O ATOM 1764 CB PRO B 381 -8.714 -0.633 -6.382 1.00 0.00 C ATOM 1765 CG PRO B 381 -7.962 -0.389 -5.123 1.00 0.00 C ATOM 1766 CD PRO B 381 -6.555 -0.050 -5.541 1.00 0.00 C ATOM 0 HA PRO B 381 -7.671 -2.369 -7.264 1.00 0.00 H new ATOM 0 HB2 PRO B 381 -9.101 0.296 -6.801 1.00 0.00 H new ATOM 0 HB3 PRO B 381 -9.569 -1.288 -6.214 1.00 0.00 H new ATOM 0 HG2 PRO B 381 -8.408 0.427 -4.554 1.00 0.00 H new ATOM 0 HG3 PRO B 381 -7.977 -1.270 -4.482 1.00 0.00 H new ATOM 0 HD2 PRO B 381 -6.402 1.028 -5.596 1.00 0.00 H new ATOM 0 HD3 PRO B 381 -5.822 -0.440 -4.835 1.00 0.00 H new