USER MOD reduce.3.24.130724 H: found=0, std=0, add=714, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 715 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 Single : A 368 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 369 THR OG1 : rot 47:sc= 0.0166 USER MOD Single : A 372 SER OG : rot 180:sc= 0 USER MOD Single : A 373 SER OG : rot 180:sc= 0 USER MOD Single : A 376 TYR OH : rot -144:sc= 1.23 USER MOD Single : A 377 GLN : amide:sc= -0.245 X(o=-0.25,f=0) USER MOD Single : A 384 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 389 SER OG : rot 180:sc= 0 USER MOD Single : A 390 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 399 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 401 THR OG1 : rot 180:sc= -0.0454 USER MOD Single : A 402 GLN : amide:sc= -0.143 X(o=-0.14,f=0) USER MOD Single : A 406 SER OG : rot -10:sc= 1.05 USER MOD Single : A 411 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 416 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 417 THR OG1 : rot 180:sc= 0 USER MOD Single : A 419 SER OG : rot 180:sc= 0 USER MOD Single : A 420 GLN : amide:sc= -0.724 K(o=-0.72,f=-5.2!) USER MOD Single : A 421 SER OG : rot 180:sc= 0 USER MOD Single : A 425 ASN : amide:sc= 0.859 K(o=0.86,f=-1.5) USER MOD Single : A 429 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 430 GLN : amide:sc= -1.92! K(o=-1.9!,f=0.64) USER MOD Single : A 431 ASN : amide:sc= -0.0835 X(o=-0.083,f=0) USER MOD Single : A 434 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 444 TYR OH : rot -26:sc= 0.327 USER MOD Single : A 445 GLN : amide:sc= -0.0595 K(o=-0.059,f=1) USER MOD Single : A 451 SER OG : rot 180:sc= 0 USER MOD Single : A 453 ASN : amide:sc= 0 X(o=0,f=0.013) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 368 -8.077 15.191 -10.657 1.00 0.00 N ATOM 2 CA ASN A 368 -8.363 15.794 -9.329 1.00 0.00 C ATOM 3 C ASN A 368 -8.612 14.716 -8.278 1.00 0.00 C ATOM 4 O ASN A 368 -7.853 14.582 -7.318 1.00 0.00 O ATOM 5 CB ASN A 368 -9.589 16.700 -9.459 1.00 0.00 C ATOM 6 CG ASN A 368 -9.330 18.101 -8.940 1.00 0.00 C ATOM 7 OD1 ASN A 368 -8.524 18.843 -9.498 1.00 0.00 O ATOM 8 ND2 ASN A 368 -10.017 18.469 -7.863 1.00 0.00 N ATOM 0 HA ASN A 368 -7.500 16.375 -9.005 1.00 0.00 H new ATOM 0 HB2 ASN A 368 -9.889 16.753 -10.506 1.00 0.00 H new ATOM 0 HB3 ASN A 368 -10.422 16.260 -8.910 1.00 0.00 H new ATOM 0 HD21 ASN A 368 -9.885 19.400 -7.468 1.00 0.00 H new ATOM 0 HD22 ASN A 368 -10.676 17.820 -7.432 1.00 0.00 H new ATOM 15 N THR A 369 -9.682 13.950 -8.466 1.00 0.00 N ATOM 16 CA THR A 369 -10.031 12.884 -7.535 1.00 0.00 C ATOM 17 C THR A 369 -10.295 11.576 -8.272 1.00 0.00 C ATOM 18 O THR A 369 -11.330 11.413 -8.920 1.00 0.00 O ATOM 19 CB THR A 369 -11.274 13.250 -6.704 1.00 0.00 C ATOM 20 OG1 THR A 369 -12.232 13.928 -7.526 1.00 0.00 O ATOM 21 CG2 THR A 369 -10.896 14.136 -5.526 1.00 0.00 C ATOM 0 H THR A 369 -10.322 14.048 -9.254 1.00 0.00 H new ATOM 0 HA THR A 369 -9.180 12.757 -6.866 1.00 0.00 H new ATOM 0 HB THR A 369 -11.711 12.328 -6.321 1.00 0.00 H new ATOM 0 HG1 THR A 369 -12.348 13.437 -8.366 1.00 0.00 H new ATOM 0 HG21 THR A 369 -11.791 14.382 -4.954 1.00 0.00 H new ATOM 0 HG22 THR A 369 -10.189 13.608 -4.886 1.00 0.00 H new ATOM 0 HG23 THR A 369 -10.437 15.054 -5.894 1.00 0.00 H new ATOM 29 N GLU A 370 -9.353 10.644 -8.170 1.00 0.00 N ATOM 30 CA GLU A 370 -9.483 9.349 -8.828 1.00 0.00 C ATOM 31 C GLU A 370 -9.236 8.209 -7.843 1.00 0.00 C ATOM 32 O GLU A 370 -8.597 7.213 -8.178 1.00 0.00 O ATOM 33 CB GLU A 370 -8.505 9.249 -10.001 1.00 0.00 C ATOM 34 CG GLU A 370 -9.144 8.743 -11.285 1.00 0.00 C ATOM 35 CD GLU A 370 -8.868 9.646 -12.470 1.00 0.00 C ATOM 36 OE1 GLU A 370 -9.487 10.728 -12.552 1.00 0.00 O ATOM 37 OE2 GLU A 370 -8.030 9.270 -13.320 1.00 0.00 O ATOM 0 H GLU A 370 -8.491 10.762 -7.638 1.00 0.00 H new ATOM 0 HA GLU A 370 -10.502 9.262 -9.206 1.00 0.00 H new ATOM 0 HB2 GLU A 370 -8.069 10.231 -10.184 1.00 0.00 H new ATOM 0 HB3 GLU A 370 -7.687 8.584 -9.725 1.00 0.00 H new ATOM 0 HG2 GLU A 370 -8.771 7.742 -11.502 1.00 0.00 H new ATOM 0 HG3 GLU A 370 -10.221 8.658 -11.141 1.00 0.00 H new ATOM 44 N VAL A 371 -9.748 8.364 -6.626 1.00 0.00 N ATOM 45 CA VAL A 371 -9.583 7.351 -5.592 1.00 0.00 C ATOM 46 C VAL A 371 -10.932 6.900 -5.043 1.00 0.00 C ATOM 47 O VAL A 371 -11.627 7.661 -4.370 1.00 0.00 O ATOM 48 CB VAL A 371 -8.717 7.869 -4.429 1.00 0.00 C ATOM 49 CG1 VAL A 371 -8.391 6.742 -3.461 1.00 0.00 C ATOM 50 CG2 VAL A 371 -7.444 8.512 -4.958 1.00 0.00 C ATOM 0 H VAL A 371 -10.281 9.183 -6.333 1.00 0.00 H new ATOM 0 HA VAL A 371 -9.081 6.504 -6.059 1.00 0.00 H new ATOM 0 HB VAL A 371 -9.283 8.627 -3.888 1.00 0.00 H new ATOM 0 HG11 VAL A 371 -7.778 7.128 -2.646 1.00 0.00 H new ATOM 0 HG12 VAL A 371 -9.316 6.331 -3.056 1.00 0.00 H new ATOM 0 HG13 VAL A 371 -7.845 5.958 -3.986 1.00 0.00 H new ATOM 0 HG21 VAL A 371 -6.844 8.872 -4.122 1.00 0.00 H new ATOM 0 HG22 VAL A 371 -6.873 7.776 -5.524 1.00 0.00 H new ATOM 0 HG23 VAL A 371 -7.702 9.349 -5.607 1.00 0.00 H new ATOM 60 N SER A 372 -11.297 5.655 -5.335 1.00 0.00 N ATOM 61 CA SER A 372 -12.564 5.101 -4.871 1.00 0.00 C ATOM 62 C SER A 372 -12.353 4.222 -3.642 1.00 0.00 C ATOM 63 O SER A 372 -11.219 3.962 -3.241 1.00 0.00 O ATOM 64 CB SER A 372 -13.230 4.291 -5.985 1.00 0.00 C ATOM 65 OG SER A 372 -13.727 5.140 -7.005 1.00 0.00 O ATOM 0 H SER A 372 -10.733 5.011 -5.890 1.00 0.00 H new ATOM 0 HA SER A 372 -13.217 5.930 -4.596 1.00 0.00 H new ATOM 0 HB2 SER A 372 -12.511 3.590 -6.409 1.00 0.00 H new ATOM 0 HB3 SER A 372 -14.046 3.699 -5.571 1.00 0.00 H new ATOM 0 HG SER A 372 -14.146 4.598 -7.706 1.00 0.00 H new ATOM 71 N SER A 373 -13.453 3.767 -3.051 1.00 0.00 N ATOM 72 CA SER A 373 -13.390 2.916 -1.867 1.00 0.00 C ATOM 73 C SER A 373 -12.599 1.641 -2.150 1.00 0.00 C ATOM 74 O SER A 373 -12.038 1.034 -1.237 1.00 0.00 O ATOM 75 CB SER A 373 -14.801 2.561 -1.395 1.00 0.00 C ATOM 76 OG SER A 373 -14.766 1.557 -0.395 1.00 0.00 O ATOM 0 H SER A 373 -14.399 3.973 -3.372 1.00 0.00 H new ATOM 0 HA SER A 373 -12.878 3.470 -1.080 1.00 0.00 H new ATOM 0 HB2 SER A 373 -15.292 3.452 -1.003 1.00 0.00 H new ATOM 0 HB3 SER A 373 -15.395 2.216 -2.241 1.00 0.00 H new ATOM 0 HG SER A 373 -15.680 1.349 -0.109 1.00 0.00 H new ATOM 82 N GLU A 374 -12.559 1.240 -3.418 1.00 0.00 N ATOM 83 CA GLU A 374 -11.837 0.036 -3.818 1.00 0.00 C ATOM 84 C GLU A 374 -10.378 0.097 -3.376 1.00 0.00 C ATOM 85 O GLU A 374 -9.730 -0.937 -3.201 1.00 0.00 O ATOM 86 CB GLU A 374 -11.915 -0.147 -5.334 1.00 0.00 C ATOM 87 CG GLU A 374 -13.332 -0.318 -5.855 1.00 0.00 C ATOM 88 CD GLU A 374 -13.743 -1.775 -5.958 1.00 0.00 C ATOM 89 OE1 GLU A 374 -13.189 -2.602 -5.205 1.00 0.00 O ATOM 90 OE2 GLU A 374 -14.619 -2.086 -6.793 1.00 0.00 O ATOM 0 H GLU A 374 -13.018 1.731 -4.185 1.00 0.00 H new ATOM 0 HA GLU A 374 -12.307 -0.817 -3.328 1.00 0.00 H new ATOM 0 HB2 GLU A 374 -11.460 0.717 -5.819 1.00 0.00 H new ATOM 0 HB3 GLU A 374 -11.325 -1.019 -5.617 1.00 0.00 H new ATOM 0 HG2 GLU A 374 -14.024 0.205 -5.195 1.00 0.00 H new ATOM 0 HG3 GLU A 374 -13.413 0.149 -6.836 1.00 0.00 H new ATOM 97 N ILE A 375 -9.862 1.310 -3.197 1.00 0.00 N ATOM 98 CA ILE A 375 -8.478 1.498 -2.778 1.00 0.00 C ATOM 99 C ILE A 375 -8.202 0.786 -1.455 1.00 0.00 C ATOM 100 O ILE A 375 -7.161 0.151 -1.288 1.00 0.00 O ATOM 101 CB ILE A 375 -8.131 2.993 -2.632 1.00 0.00 C ATOM 102 CG1 ILE A 375 -6.641 3.170 -2.333 1.00 0.00 C ATOM 103 CG2 ILE A 375 -8.977 3.635 -1.541 1.00 0.00 C ATOM 104 CD1 ILE A 375 -5.756 3.009 -3.549 1.00 0.00 C ATOM 0 H ILE A 375 -10.382 2.176 -3.336 1.00 0.00 H new ATOM 0 HA ILE A 375 -7.850 1.065 -3.556 1.00 0.00 H new ATOM 0 HB ILE A 375 -8.354 3.492 -3.575 1.00 0.00 H new ATOM 0 HG12 ILE A 375 -6.480 4.160 -1.905 1.00 0.00 H new ATOM 0 HG13 ILE A 375 -6.342 2.444 -1.577 1.00 0.00 H new ATOM 0 HG21 ILE A 375 -8.718 4.690 -1.453 1.00 0.00 H new ATOM 0 HG22 ILE A 375 -10.032 3.541 -1.796 1.00 0.00 H new ATOM 0 HG23 ILE A 375 -8.787 3.134 -0.592 1.00 0.00 H new ATOM 0 HD11 ILE A 375 -4.714 3.148 -3.261 1.00 0.00 H new ATOM 0 HD12 ILE A 375 -5.888 2.010 -3.965 1.00 0.00 H new ATOM 0 HD13 ILE A 375 -6.028 3.753 -4.298 1.00 0.00 H new ATOM 116 N TYR A 376 -9.139 0.897 -0.520 1.00 0.00 N ATOM 117 CA TYR A 376 -8.994 0.264 0.786 1.00 0.00 C ATOM 118 C TYR A 376 -9.177 -1.246 0.682 1.00 0.00 C ATOM 119 O TYR A 376 -8.380 -2.017 1.215 1.00 0.00 O ATOM 120 CB TYR A 376 -10.007 0.845 1.774 1.00 0.00 C ATOM 121 CG TYR A 376 -9.716 2.276 2.172 1.00 0.00 C ATOM 122 CD1 TYR A 376 -8.856 2.562 3.226 1.00 0.00 C ATOM 123 CD2 TYR A 376 -10.296 3.337 1.493 1.00 0.00 C ATOM 124 CE1 TYR A 376 -8.588 3.866 3.593 1.00 0.00 C ATOM 125 CE2 TYR A 376 -10.032 4.645 1.852 1.00 0.00 C ATOM 126 CZ TYR A 376 -9.178 4.905 2.903 1.00 0.00 C ATOM 127 OH TYR A 376 -8.913 6.205 3.264 1.00 0.00 O ATOM 0 H TYR A 376 -10.007 1.419 -0.642 1.00 0.00 H new ATOM 0 HA TYR A 376 -7.986 0.466 1.149 1.00 0.00 H new ATOM 0 HB2 TYR A 376 -11.002 0.795 1.332 1.00 0.00 H new ATOM 0 HB3 TYR A 376 -10.025 0.224 2.670 1.00 0.00 H new ATOM 0 HD1 TYR A 376 -8.390 1.751 3.767 1.00 0.00 H new ATOM 0 HD2 TYR A 376 -10.966 3.138 0.669 1.00 0.00 H new ATOM 0 HE1 TYR A 376 -7.920 4.072 4.416 1.00 0.00 H new ATOM 0 HE2 TYR A 376 -10.492 5.459 1.312 1.00 0.00 H new ATOM 0 HH TYR A 376 -9.720 6.749 3.145 1.00 0.00 H new ATOM 137 N GLN A 377 -10.234 -1.662 -0.011 1.00 0.00 N ATOM 138 CA GLN A 377 -10.522 -3.079 -0.187 1.00 0.00 C ATOM 139 C GLN A 377 -9.363 -3.792 -0.877 1.00 0.00 C ATOM 140 O GLN A 377 -9.143 -4.986 -0.668 1.00 0.00 O ATOM 141 CB GLN A 377 -11.804 -3.262 -1.000 1.00 0.00 C ATOM 142 CG GLN A 377 -12.311 -4.696 -1.023 1.00 0.00 C ATOM 143 CD GLN A 377 -13.062 -5.070 0.240 1.00 0.00 C ATOM 144 OE1 GLN A 377 -14.292 -5.028 0.279 1.00 0.00 O ATOM 145 NE2 GLN A 377 -12.324 -5.436 1.280 1.00 0.00 N ATOM 0 H GLN A 377 -10.904 -1.037 -0.459 1.00 0.00 H new ATOM 0 HA GLN A 377 -10.658 -3.520 0.800 1.00 0.00 H new ATOM 0 HB2 GLN A 377 -12.581 -2.617 -0.588 1.00 0.00 H new ATOM 0 HB3 GLN A 377 -11.626 -2.932 -2.023 1.00 0.00 H new ATOM 0 HG2 GLN A 377 -12.965 -4.832 -1.884 1.00 0.00 H new ATOM 0 HG3 GLN A 377 -11.467 -5.374 -1.154 1.00 0.00 H new ATOM 0 HE21 GLN A 377 -11.307 -5.456 1.202 1.00 0.00 H new ATOM 0 HE22 GLN A 377 -12.773 -5.697 2.158 1.00 0.00 H new ATOM 154 N TRP A 378 -8.623 -3.054 -1.697 1.00 0.00 N ATOM 155 CA TRP A 378 -7.487 -3.617 -2.418 1.00 0.00 C ATOM 156 C TRP A 378 -6.358 -3.980 -1.458 1.00 0.00 C ATOM 157 O TRP A 378 -5.908 -5.126 -1.419 1.00 0.00 O ATOM 158 CB TRP A 378 -6.979 -2.626 -3.467 1.00 0.00 C ATOM 159 CG TRP A 378 -7.898 -2.479 -4.642 1.00 0.00 C ATOM 160 CD1 TRP A 378 -8.856 -3.361 -5.051 1.00 0.00 C ATOM 161 CD2 TRP A 378 -7.944 -1.381 -5.561 1.00 0.00 C ATOM 162 NE1 TRP A 378 -9.496 -2.879 -6.168 1.00 0.00 N ATOM 163 CE2 TRP A 378 -8.954 -1.664 -6.501 1.00 0.00 C ATOM 164 CE3 TRP A 378 -7.231 -0.185 -5.680 1.00 0.00 C ATOM 165 CZ2 TRP A 378 -9.267 -0.797 -7.544 1.00 0.00 C ATOM 166 CZ3 TRP A 378 -7.543 0.676 -6.716 1.00 0.00 C ATOM 167 CH2 TRP A 378 -8.553 0.367 -7.635 1.00 0.00 C ATOM 0 H TRP A 378 -8.789 -2.064 -1.879 1.00 0.00 H new ATOM 0 HA TRP A 378 -7.822 -4.526 -2.918 1.00 0.00 H new ATOM 0 HB2 TRP A 378 -6.841 -1.651 -2.999 1.00 0.00 H new ATOM 0 HB3 TRP A 378 -6.000 -2.951 -3.819 1.00 0.00 H new ATOM 0 HD1 TRP A 378 -9.079 -4.301 -4.567 1.00 0.00 H new ATOM 0 HE1 TRP A 378 -10.251 -3.349 -6.668 1.00 0.00 H new ATOM 0 HE3 TRP A 378 -6.451 0.062 -4.976 1.00 0.00 H new ATOM 0 HZ2 TRP A 378 -10.045 -1.034 -8.255 1.00 0.00 H new ATOM 0 HZ3 TRP A 378 -6.998 1.603 -6.818 1.00 0.00 H new ATOM 0 HH2 TRP A 378 -8.773 1.062 -8.432 1.00 0.00 H new ATOM 178 N VAL A 379 -5.905 -2.998 -0.685 1.00 0.00 N ATOM 179 CA VAL A 379 -4.828 -3.215 0.274 1.00 0.00 C ATOM 180 C VAL A 379 -5.195 -4.299 1.282 1.00 0.00 C ATOM 181 O VAL A 379 -4.402 -5.199 1.557 1.00 0.00 O ATOM 182 CB VAL A 379 -4.482 -1.921 1.033 1.00 0.00 C ATOM 183 CG1 VAL A 379 -3.243 -2.117 1.892 1.00 0.00 C ATOM 184 CG2 VAL A 379 -4.286 -0.768 0.059 1.00 0.00 C ATOM 0 H VAL A 379 -6.267 -2.045 -0.704 1.00 0.00 H new ATOM 0 HA VAL A 379 -3.958 -3.536 -0.298 1.00 0.00 H new ATOM 0 HB VAL A 379 -5.315 -1.675 1.691 1.00 0.00 H new ATOM 0 HG11 VAL A 379 -3.016 -1.191 2.420 1.00 0.00 H new ATOM 0 HG12 VAL A 379 -3.424 -2.912 2.616 1.00 0.00 H new ATOM 0 HG13 VAL A 379 -2.400 -2.389 1.257 1.00 0.00 H new ATOM 0 HG21 VAL A 379 -4.042 0.139 0.613 1.00 0.00 H new ATOM 0 HG22 VAL A 379 -3.472 -1.005 -0.626 1.00 0.00 H new ATOM 0 HG23 VAL A 379 -5.203 -0.611 -0.508 1.00 0.00 H new ATOM 194 N ARG A 380 -6.400 -4.204 1.833 1.00 0.00 N ATOM 195 CA ARG A 380 -6.873 -5.177 2.813 1.00 0.00 C ATOM 196 C ARG A 380 -6.865 -6.586 2.229 1.00 0.00 C ATOM 197 O ARG A 380 -6.531 -7.551 2.916 1.00 0.00 O ATOM 198 CB ARG A 380 -8.281 -4.814 3.284 1.00 0.00 C ATOM 199 CG ARG A 380 -8.346 -3.507 4.057 1.00 0.00 C ATOM 200 CD ARG A 380 -9.627 -3.400 4.867 1.00 0.00 C ATOM 201 NE ARG A 380 -10.675 -2.684 4.144 1.00 0.00 N ATOM 202 CZ ARG A 380 -11.738 -2.137 4.727 1.00 0.00 C ATOM 203 NH1 ARG A 380 -11.899 -2.220 6.042 1.00 0.00 N ATOM 204 NH2 ARG A 380 -12.644 -1.504 3.995 1.00 0.00 N ATOM 0 H ARG A 380 -7.068 -3.463 1.618 1.00 0.00 H new ATOM 0 HA ARG A 380 -6.196 -5.154 3.667 1.00 0.00 H new ATOM 0 HB2 ARG A 380 -8.939 -4.747 2.418 1.00 0.00 H new ATOM 0 HB3 ARG A 380 -8.663 -5.618 3.913 1.00 0.00 H new ATOM 0 HG2 ARG A 380 -7.486 -3.434 4.723 1.00 0.00 H new ATOM 0 HG3 ARG A 380 -8.283 -2.669 3.363 1.00 0.00 H new ATOM 0 HD2 ARG A 380 -9.980 -4.400 5.120 1.00 0.00 H new ATOM 0 HD3 ARG A 380 -9.420 -2.887 5.806 1.00 0.00 H new ATOM 0 HE ARG A 380 -10.586 -2.598 3.131 1.00 0.00 H new ATOM 0 HH11 ARG A 380 -11.205 -2.705 6.611 1.00 0.00 H new ATOM 0 HH12 ARG A 380 -12.716 -1.798 6.483 1.00 0.00 H new ATOM 0 HH21 ARG A 380 -12.526 -1.436 2.984 1.00 0.00 H new ATOM 0 HH22 ARG A 380 -13.459 -1.085 4.443 1.00 0.00 H new ATOM 218 N ASP A 381 -7.236 -6.698 0.958 1.00 0.00 N ATOM 219 CA ASP A 381 -7.273 -7.990 0.284 1.00 0.00 C ATOM 220 C ASP A 381 -5.871 -8.425 -0.135 1.00 0.00 C ATOM 221 O ASP A 381 -5.507 -9.594 0.001 1.00 0.00 O ATOM 222 CB ASP A 381 -8.185 -7.923 -0.943 1.00 0.00 C ATOM 223 CG ASP A 381 -9.611 -8.324 -0.624 1.00 0.00 C ATOM 224 OD1 ASP A 381 -9.814 -9.068 0.356 1.00 0.00 O ATOM 225 OD2 ASP A 381 -10.527 -7.895 -1.359 1.00 0.00 O ATOM 0 H ASP A 381 -7.515 -5.910 0.374 1.00 0.00 H new ATOM 0 HA ASP A 381 -7.670 -8.726 0.984 1.00 0.00 H new ATOM 0 HB2 ASP A 381 -8.176 -6.910 -1.344 1.00 0.00 H new ATOM 0 HB3 ASP A 381 -7.792 -8.577 -1.721 1.00 0.00 H new ATOM 230 N GLU A 382 -5.089 -7.477 -0.641 1.00 0.00 N ATOM 231 CA GLU A 382 -3.728 -7.764 -1.079 1.00 0.00 C ATOM 232 C GLU A 382 -2.869 -8.236 0.089 1.00 0.00 C ATOM 233 O GLU A 382 -2.060 -9.153 -0.053 1.00 0.00 O ATOM 234 CB GLU A 382 -3.104 -6.520 -1.715 1.00 0.00 C ATOM 235 CG GLU A 382 -2.198 -6.832 -2.897 1.00 0.00 C ATOM 236 CD GLU A 382 -2.975 -7.186 -4.148 1.00 0.00 C ATOM 237 OE1 GLU A 382 -3.685 -8.213 -4.136 1.00 0.00 O ATOM 238 OE2 GLU A 382 -2.872 -6.437 -5.143 1.00 0.00 O ATOM 0 H GLU A 382 -5.374 -6.505 -0.758 1.00 0.00 H new ATOM 0 HA GLU A 382 -3.771 -8.562 -1.820 1.00 0.00 H new ATOM 0 HB2 GLU A 382 -3.900 -5.852 -2.044 1.00 0.00 H new ATOM 0 HB3 GLU A 382 -2.530 -5.984 -0.959 1.00 0.00 H new ATOM 0 HG2 GLU A 382 -1.562 -5.970 -3.100 1.00 0.00 H new ATOM 0 HG3 GLU A 382 -1.539 -7.660 -2.636 1.00 0.00 H new ATOM 245 N LEU A 383 -3.051 -7.605 1.246 1.00 0.00 N ATOM 246 CA LEU A 383 -2.292 -7.962 2.439 1.00 0.00 C ATOM 247 C LEU A 383 -2.561 -9.408 2.841 1.00 0.00 C ATOM 248 O LEU A 383 -1.637 -10.215 2.950 1.00 0.00 O ATOM 249 CB LEU A 383 -2.648 -7.023 3.594 1.00 0.00 C ATOM 250 CG LEU A 383 -1.831 -5.732 3.653 1.00 0.00 C ATOM 251 CD1 LEU A 383 -2.382 -4.800 4.722 1.00 0.00 C ATOM 252 CD2 LEU A 383 -0.365 -6.042 3.918 1.00 0.00 C ATOM 0 H LEU A 383 -3.717 -6.845 1.382 1.00 0.00 H new ATOM 0 HA LEU A 383 -1.231 -7.859 2.210 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -3.704 -6.764 3.519 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.518 -7.561 4.533 1.00 0.00 H new ATOM 0 HG LEU A 383 -1.908 -5.231 2.688 1.00 0.00 H new ATOM 0 HD11 LEU A 383 -1.788 -3.886 4.750 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -3.418 -4.552 4.490 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -2.335 -5.292 5.693 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.202 -5.112 3.957 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -0.270 -6.565 4.870 1.00 0.00 H new ATOM 0 HD23 LEU A 383 0.024 -6.671 3.118 1.00 0.00 H new ATOM 264 N LYS A 384 -3.831 -9.729 3.061 1.00 0.00 N ATOM 265 CA LYS A 384 -4.223 -11.078 3.452 1.00 0.00 C ATOM 266 C LYS A 384 -3.877 -12.084 2.358 1.00 0.00 C ATOM 267 O LYS A 384 -3.470 -13.210 2.641 1.00 0.00 O ATOM 268 CB LYS A 384 -5.721 -11.131 3.754 1.00 0.00 C ATOM 269 CG LYS A 384 -6.593 -10.695 2.588 1.00 0.00 C ATOM 270 CD LYS A 384 -8.050 -10.551 3.002 1.00 0.00 C ATOM 271 CE LYS A 384 -8.901 -11.682 2.449 1.00 0.00 C ATOM 272 NZ LYS A 384 -8.672 -12.960 3.179 1.00 0.00 N ATOM 0 H LYS A 384 -4.607 -9.073 2.975 1.00 0.00 H new ATOM 0 HA LYS A 384 -3.669 -11.342 4.353 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -5.990 -12.149 4.037 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -5.933 -10.494 4.613 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -6.230 -9.745 2.196 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -6.514 -11.423 1.781 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -8.121 -10.539 4.090 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -8.437 -9.596 2.647 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -9.954 -11.410 2.516 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -8.675 -11.823 1.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -9.271 -13.705 2.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -7.672 -13.234 3.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -8.912 -12.834 4.183 1.00 0.00 H new ATOM 286 N ARG A 385 -4.043 -11.668 1.107 1.00 0.00 N ATOM 287 CA ARG A 385 -3.750 -12.531 -0.031 1.00 0.00 C ATOM 288 C ARG A 385 -2.249 -12.770 -0.163 1.00 0.00 C ATOM 289 O ARG A 385 -1.816 -13.842 -0.585 1.00 0.00 O ATOM 290 CB ARG A 385 -4.294 -11.912 -1.321 1.00 0.00 C ATOM 291 CG ARG A 385 -5.775 -12.170 -1.542 1.00 0.00 C ATOM 292 CD ARG A 385 -6.126 -12.178 -3.021 1.00 0.00 C ATOM 293 NE ARG A 385 -7.565 -12.298 -3.243 1.00 0.00 N ATOM 294 CZ ARG A 385 -8.108 -12.677 -4.398 1.00 0.00 C ATOM 295 NH1 ARG A 385 -7.337 -12.974 -5.436 1.00 0.00 N ATOM 296 NH2 ARG A 385 -9.426 -12.761 -4.513 1.00 0.00 N ATOM 0 H ARG A 385 -4.379 -10.738 0.856 1.00 0.00 H new ATOM 0 HA ARG A 385 -4.239 -13.490 0.139 1.00 0.00 H new ATOM 0 HB2 ARG A 385 -4.120 -10.836 -1.299 1.00 0.00 H new ATOM 0 HB3 ARG A 385 -3.734 -12.308 -2.168 1.00 0.00 H new ATOM 0 HG2 ARG A 385 -6.049 -13.127 -1.097 1.00 0.00 H new ATOM 0 HG3 ARG A 385 -6.359 -11.403 -1.033 1.00 0.00 H new ATOM 0 HD2 ARG A 385 -5.763 -11.260 -3.484 1.00 0.00 H new ATOM 0 HD3 ARG A 385 -5.614 -13.006 -3.510 1.00 0.00 H new ATOM 0 HE ARG A 385 -8.190 -12.079 -2.468 1.00 0.00 H new ATOM 0 HH11 ARG A 385 -6.322 -12.913 -5.352 1.00 0.00 H new ATOM 0 HH12 ARG A 385 -7.759 -13.264 -6.318 1.00 0.00 H new ATOM 0 HH21 ARG A 385 -10.023 -12.535 -3.717 1.00 0.00 H new ATOM 0 HH22 ARG A 385 -9.843 -13.051 -5.397 1.00 0.00 H new ATOM 310 N ALA A 386 -1.461 -11.765 0.206 1.00 0.00 N ATOM 311 CA ALA A 386 -0.009 -11.866 0.130 1.00 0.00 C ATOM 312 C ALA A 386 0.565 -12.497 1.394 1.00 0.00 C ATOM 313 O ALA A 386 1.596 -13.169 1.351 1.00 0.00 O ATOM 314 CB ALA A 386 0.604 -10.493 -0.102 1.00 0.00 C ATOM 0 H ALA A 386 -1.804 -10.872 0.560 1.00 0.00 H new ATOM 0 HA ALA A 386 0.242 -12.511 -0.712 1.00 0.00 H new ATOM 0 HB1 ALA A 386 1.689 -10.583 -0.157 1.00 0.00 H new ATOM 0 HB2 ALA A 386 0.227 -10.079 -1.037 1.00 0.00 H new ATOM 0 HB3 ALA A 386 0.336 -9.831 0.722 1.00 0.00 H new ATOM 320 N GLY A 387 -0.109 -12.276 2.518 1.00 0.00 N ATOM 321 CA GLY A 387 0.351 -12.829 3.778 1.00 0.00 C ATOM 322 C GLY A 387 1.615 -12.160 4.280 1.00 0.00 C ATOM 323 O GLY A 387 2.414 -12.777 4.986 1.00 0.00 O ATOM 0 H GLY A 387 -0.965 -11.724 2.579 1.00 0.00 H new ATOM 0 HA2 GLY A 387 -0.434 -12.722 4.526 1.00 0.00 H new ATOM 0 HA3 GLY A 387 0.533 -13.897 3.657 1.00 0.00 H new ATOM 327 N ILE A 388 1.798 -10.895 3.916 1.00 0.00 N ATOM 328 CA ILE A 388 2.974 -10.142 4.333 1.00 0.00 C ATOM 329 C ILE A 388 2.616 -9.112 5.399 1.00 0.00 C ATOM 330 O ILE A 388 1.443 -8.792 5.599 1.00 0.00 O ATOM 331 CB ILE A 388 3.633 -9.422 3.142 1.00 0.00 C ATOM 332 CG1 ILE A 388 2.617 -8.525 2.432 1.00 0.00 C ATOM 333 CG2 ILE A 388 4.223 -10.434 2.171 1.00 0.00 C ATOM 334 CD1 ILE A 388 3.222 -7.671 1.341 1.00 0.00 C ATOM 0 H ILE A 388 1.146 -10.370 3.333 1.00 0.00 H new ATOM 0 HA ILE A 388 3.680 -10.862 4.747 1.00 0.00 H new ATOM 0 HB ILE A 388 4.441 -8.795 3.519 1.00 0.00 H new ATOM 0 HG12 ILE A 388 1.833 -9.148 2.001 1.00 0.00 H new ATOM 0 HG13 ILE A 388 2.141 -7.877 3.167 1.00 0.00 H new ATOM 0 HG21 ILE A 388 4.685 -9.909 1.335 1.00 0.00 H new ATOM 0 HG22 ILE A 388 4.975 -11.034 2.683 1.00 0.00 H new ATOM 0 HG23 ILE A 388 3.432 -11.085 1.798 1.00 0.00 H new ATOM 0 HD11 ILE A 388 2.443 -7.062 0.882 1.00 0.00 H new ATOM 0 HD12 ILE A 388 3.986 -7.022 1.769 1.00 0.00 H new ATOM 0 HD13 ILE A 388 3.673 -8.313 0.585 1.00 0.00 H new ATOM 346 N SER A 389 3.632 -8.596 6.083 1.00 0.00 N ATOM 347 CA SER A 389 3.424 -7.602 7.128 1.00 0.00 C ATOM 348 C SER A 389 3.138 -6.229 6.527 1.00 0.00 C ATOM 349 O SER A 389 3.582 -5.919 5.422 1.00 0.00 O ATOM 350 CB SER A 389 4.651 -7.527 8.040 1.00 0.00 C ATOM 351 OG SER A 389 4.269 -7.379 9.398 1.00 0.00 O ATOM 0 H SER A 389 4.608 -8.850 5.932 1.00 0.00 H new ATOM 0 HA SER A 389 2.559 -7.907 7.717 1.00 0.00 H new ATOM 0 HB2 SER A 389 5.250 -8.430 7.924 1.00 0.00 H new ATOM 0 HB3 SER A 389 5.279 -6.687 7.742 1.00 0.00 H new ATOM 0 HG SER A 389 5.070 -7.335 9.960 1.00 0.00 H new ATOM 357 N GLN A 390 2.392 -5.412 7.264 1.00 0.00 N ATOM 358 CA GLN A 390 2.046 -4.071 6.804 1.00 0.00 C ATOM 359 C GLN A 390 3.299 -3.230 6.585 1.00 0.00 C ATOM 360 O GLN A 390 3.326 -2.352 5.722 1.00 0.00 O ATOM 361 CB GLN A 390 1.128 -3.384 7.817 1.00 0.00 C ATOM 362 CG GLN A 390 -0.222 -4.066 7.975 1.00 0.00 C ATOM 363 CD GLN A 390 -0.667 -4.153 9.421 1.00 0.00 C ATOM 364 OE1 GLN A 390 -0.037 -4.823 10.237 1.00 0.00 O ATOM 365 NE2 GLN A 390 -1.761 -3.473 9.747 1.00 0.00 N ATOM 0 H GLN A 390 2.016 -5.654 8.181 1.00 0.00 H new ATOM 0 HA GLN A 390 1.522 -4.164 5.853 1.00 0.00 H new ATOM 0 HB2 GLN A 390 1.627 -3.355 8.786 1.00 0.00 H new ATOM 0 HB3 GLN A 390 0.970 -2.350 7.509 1.00 0.00 H new ATOM 0 HG2 GLN A 390 -0.970 -3.519 7.401 1.00 0.00 H new ATOM 0 HG3 GLN A 390 -0.169 -5.070 7.554 1.00 0.00 H new ATOM 0 HE21 GLN A 390 -2.254 -2.929 9.038 1.00 0.00 H new ATOM 0 HE22 GLN A 390 -2.108 -3.495 10.706 1.00 0.00 H new ATOM 374 N ALA A 391 4.335 -3.502 7.372 1.00 0.00 N ATOM 375 CA ALA A 391 5.590 -2.769 7.263 1.00 0.00 C ATOM 376 C ALA A 391 6.222 -2.964 5.889 1.00 0.00 C ATOM 377 O ALA A 391 6.760 -2.024 5.304 1.00 0.00 O ATOM 378 CB ALA A 391 6.553 -3.208 8.356 1.00 0.00 C ATOM 0 H ALA A 391 4.330 -4.225 8.092 1.00 0.00 H new ATOM 0 HA ALA A 391 5.375 -1.708 7.388 1.00 0.00 H new ATOM 0 HB1 ALA A 391 7.486 -2.653 8.263 1.00 0.00 H new ATOM 0 HB2 ALA A 391 6.110 -3.011 9.332 1.00 0.00 H new ATOM 0 HB3 ALA A 391 6.754 -4.275 8.257 1.00 0.00 H new ATOM 384 N VAL A 392 6.153 -4.189 5.378 1.00 0.00 N ATOM 385 CA VAL A 392 6.721 -4.505 4.073 1.00 0.00 C ATOM 386 C VAL A 392 5.866 -3.929 2.948 1.00 0.00 C ATOM 387 O VAL A 392 6.382 -3.554 1.895 1.00 0.00 O ATOM 388 CB VAL A 392 6.854 -6.027 3.872 1.00 0.00 C ATOM 389 CG1 VAL A 392 7.592 -6.334 2.577 1.00 0.00 C ATOM 390 CG2 VAL A 392 7.561 -6.663 5.059 1.00 0.00 C ATOM 0 H VAL A 392 5.710 -4.978 5.848 1.00 0.00 H new ATOM 0 HA VAL A 392 7.712 -4.053 4.042 1.00 0.00 H new ATOM 0 HB VAL A 392 5.853 -6.453 3.803 1.00 0.00 H new ATOM 0 HG11 VAL A 392 7.676 -7.414 2.453 1.00 0.00 H new ATOM 0 HG12 VAL A 392 7.041 -5.914 1.736 1.00 0.00 H new ATOM 0 HG13 VAL A 392 8.589 -5.895 2.613 1.00 0.00 H new ATOM 0 HG21 VAL A 392 7.646 -7.738 4.899 1.00 0.00 H new ATOM 0 HG22 VAL A 392 8.557 -6.232 5.163 1.00 0.00 H new ATOM 0 HG23 VAL A 392 6.988 -6.475 5.967 1.00 0.00 H new ATOM 400 N PHE A 393 4.560 -3.860 3.179 1.00 0.00 N ATOM 401 CA PHE A 393 3.635 -3.330 2.185 1.00 0.00 C ATOM 402 C PHE A 393 3.715 -1.807 2.123 1.00 0.00 C ATOM 403 O PHE A 393 3.872 -1.227 1.048 1.00 0.00 O ATOM 404 CB PHE A 393 2.202 -3.763 2.507 1.00 0.00 C ATOM 405 CG PHE A 393 1.209 -3.386 1.445 1.00 0.00 C ATOM 406 CD1 PHE A 393 0.798 -2.071 1.299 1.00 0.00 C ATOM 407 CD2 PHE A 393 0.688 -4.347 0.593 1.00 0.00 C ATOM 408 CE1 PHE A 393 -0.116 -1.721 0.323 1.00 0.00 C ATOM 409 CE2 PHE A 393 -0.226 -4.002 -0.385 1.00 0.00 C ATOM 410 CZ PHE A 393 -0.629 -2.688 -0.520 1.00 0.00 C ATOM 0 H PHE A 393 4.118 -4.165 4.046 1.00 0.00 H new ATOM 0 HA PHE A 393 3.919 -3.731 1.212 1.00 0.00 H new ATOM 0 HB2 PHE A 393 2.180 -4.844 2.646 1.00 0.00 H new ATOM 0 HB3 PHE A 393 1.899 -3.314 3.453 1.00 0.00 H new ATOM 0 HD1 PHE A 393 1.196 -1.311 1.955 1.00 0.00 H new ATOM 0 HD2 PHE A 393 0.999 -5.376 0.694 1.00 0.00 H new ATOM 0 HE1 PHE A 393 -0.429 -0.693 0.219 1.00 0.00 H new ATOM 0 HE2 PHE A 393 -0.625 -4.760 -1.043 1.00 0.00 H new ATOM 0 HZ PHE A 393 -1.344 -2.417 -1.283 1.00 0.00 H new ATOM 420 N ALA A 394 3.605 -1.167 3.281 1.00 0.00 N ATOM 421 CA ALA A 394 3.664 0.288 3.358 1.00 0.00 C ATOM 422 C ALA A 394 4.991 0.814 2.821 1.00 0.00 C ATOM 423 O ALA A 394 5.060 1.914 2.273 1.00 0.00 O ATOM 424 CB ALA A 394 3.451 0.748 4.794 1.00 0.00 C ATOM 0 H ALA A 394 3.475 -1.632 4.179 1.00 0.00 H new ATOM 0 HA ALA A 394 2.866 0.694 2.736 1.00 0.00 H new ATOM 0 HB1 ALA A 394 3.497 1.836 4.838 1.00 0.00 H new ATOM 0 HB2 ALA A 394 2.474 0.412 5.143 1.00 0.00 H new ATOM 0 HB3 ALA A 394 4.229 0.326 5.430 1.00 0.00 H new ATOM 430 N ARG A 395 6.045 0.020 2.983 1.00 0.00 N ATOM 431 CA ARG A 395 7.371 0.407 2.514 1.00 0.00 C ATOM 432 C ARG A 395 7.435 0.395 0.990 1.00 0.00 C ATOM 433 O ARG A 395 7.993 1.304 0.375 1.00 0.00 O ATOM 434 CB ARG A 395 8.431 -0.536 3.088 1.00 0.00 C ATOM 435 CG ARG A 395 9.857 -0.102 2.785 1.00 0.00 C ATOM 436 CD ARG A 395 10.825 -0.595 3.849 1.00 0.00 C ATOM 437 NE ARG A 395 11.475 -1.844 3.462 1.00 0.00 N ATOM 438 CZ ARG A 395 12.427 -1.930 2.537 1.00 0.00 C ATOM 439 NH1 ARG A 395 12.843 -0.842 1.899 1.00 0.00 N ATOM 440 NH2 ARG A 395 12.966 -3.107 2.247 1.00 0.00 N ATOM 0 H ARG A 395 6.007 -0.894 3.435 1.00 0.00 H new ATOM 0 HA ARG A 395 7.570 1.422 2.859 1.00 0.00 H new ATOM 0 HB2 ARG A 395 8.301 -0.601 4.168 1.00 0.00 H new ATOM 0 HB3 ARG A 395 8.271 -1.537 2.687 1.00 0.00 H new ATOM 0 HG2 ARG A 395 10.157 -0.488 1.811 1.00 0.00 H new ATOM 0 HG3 ARG A 395 9.903 0.985 2.725 1.00 0.00 H new ATOM 0 HD2 ARG A 395 11.583 0.167 4.030 1.00 0.00 H new ATOM 0 HD3 ARG A 395 10.289 -0.741 4.787 1.00 0.00 H new ATOM 0 HE ARG A 395 11.181 -2.702 3.929 1.00 0.00 H new ATOM 0 HH11 ARG A 395 12.432 0.066 2.117 1.00 0.00 H new ATOM 0 HH12 ARG A 395 13.573 -0.914 1.191 1.00 0.00 H new ATOM 0 HH21 ARG A 395 12.650 -3.946 2.733 1.00 0.00 H new ATOM 0 HH22 ARG A 395 13.696 -3.173 1.538 1.00 0.00 H new ATOM 454 N VAL A 396 6.860 -0.639 0.386 1.00 0.00 N ATOM 455 CA VAL A 396 6.853 -0.768 -1.065 1.00 0.00 C ATOM 456 C VAL A 396 5.750 0.082 -1.689 1.00 0.00 C ATOM 457 O VAL A 396 5.899 0.593 -2.798 1.00 0.00 O ATOM 458 CB VAL A 396 6.661 -2.235 -1.500 1.00 0.00 C ATOM 459 CG1 VAL A 396 7.819 -3.091 -1.010 1.00 0.00 C ATOM 460 CG2 VAL A 396 5.334 -2.777 -0.991 1.00 0.00 C ATOM 0 H VAL A 396 6.393 -1.400 0.879 1.00 0.00 H new ATOM 0 HA VAL A 396 7.823 -0.416 -1.416 1.00 0.00 H new ATOM 0 HB VAL A 396 6.645 -2.272 -2.589 1.00 0.00 H new ATOM 0 HG11 VAL A 396 7.667 -4.123 -1.326 1.00 0.00 H new ATOM 0 HG12 VAL A 396 8.752 -2.716 -1.431 1.00 0.00 H new ATOM 0 HG13 VAL A 396 7.868 -3.048 0.078 1.00 0.00 H new ATOM 0 HG21 VAL A 396 5.218 -3.813 -1.309 1.00 0.00 H new ATOM 0 HG22 VAL A 396 5.314 -2.727 0.098 1.00 0.00 H new ATOM 0 HG23 VAL A 396 4.517 -2.180 -1.397 1.00 0.00 H new ATOM 470 N ALA A 397 4.644 0.229 -0.966 1.00 0.00 N ATOM 471 CA ALA A 397 3.517 1.017 -1.447 1.00 0.00 C ATOM 472 C ALA A 397 3.825 2.510 -1.393 1.00 0.00 C ATOM 473 O ALA A 397 3.916 3.173 -2.427 1.00 0.00 O ATOM 474 CB ALA A 397 2.270 0.705 -0.632 1.00 0.00 C ATOM 0 H ALA A 397 4.505 -0.188 -0.045 1.00 0.00 H new ATOM 0 HA ALA A 397 3.337 0.748 -2.488 1.00 0.00 H new ATOM 0 HB1 ALA A 397 1.435 1.301 -1.002 1.00 0.00 H new ATOM 0 HB2 ALA A 397 2.030 -0.354 -0.726 1.00 0.00 H new ATOM 0 HB3 ALA A 397 2.451 0.945 0.416 1.00 0.00 H new ATOM 480 N PHE A 398 3.988 3.032 -0.182 1.00 0.00 N ATOM 481 CA PHE A 398 4.287 4.447 0.005 1.00 0.00 C ATOM 482 C PHE A 398 5.390 4.637 1.042 1.00 0.00 C ATOM 483 O PHE A 398 5.165 4.465 2.241 1.00 0.00 O ATOM 484 CB PHE A 398 3.030 5.202 0.438 1.00 0.00 C ATOM 485 CG PHE A 398 2.377 4.632 1.664 1.00 0.00 C ATOM 486 CD1 PHE A 398 1.609 3.481 1.585 1.00 0.00 C ATOM 487 CD2 PHE A 398 2.530 5.248 2.896 1.00 0.00 C ATOM 488 CE1 PHE A 398 1.007 2.954 2.711 1.00 0.00 C ATOM 489 CE2 PHE A 398 1.931 4.725 4.026 1.00 0.00 C ATOM 490 CZ PHE A 398 1.168 3.577 3.934 1.00 0.00 C ATOM 0 H PHE A 398 3.918 2.497 0.684 1.00 0.00 H new ATOM 0 HA PHE A 398 4.634 4.849 -0.947 1.00 0.00 H new ATOM 0 HB2 PHE A 398 3.289 6.244 0.626 1.00 0.00 H new ATOM 0 HB3 PHE A 398 2.312 5.195 -0.382 1.00 0.00 H new ATOM 0 HD1 PHE A 398 1.480 2.990 0.632 1.00 0.00 H new ATOM 0 HD2 PHE A 398 3.124 6.147 2.974 1.00 0.00 H new ATOM 0 HE1 PHE A 398 0.411 2.056 2.636 1.00 0.00 H new ATOM 0 HE2 PHE A 398 2.059 5.213 4.981 1.00 0.00 H new ATOM 0 HZ PHE A 398 0.698 3.167 4.816 1.00 0.00 H new ATOM 500 N ASN A 399 6.581 4.991 0.572 1.00 0.00 N ATOM 501 CA ASN A 399 7.720 5.204 1.458 1.00 0.00 C ATOM 502 C ASN A 399 7.533 6.469 2.289 1.00 0.00 C ATOM 503 O ASN A 399 7.852 7.572 1.842 1.00 0.00 O ATOM 504 CB ASN A 399 9.013 5.300 0.646 1.00 0.00 C ATOM 505 CG ASN A 399 9.649 3.944 0.410 1.00 0.00 C ATOM 506 OD1 ASN A 399 9.994 3.233 1.354 1.00 0.00 O ATOM 507 ND2 ASN A 399 9.809 3.578 -0.856 1.00 0.00 N ATOM 0 H ASN A 399 6.783 5.137 -0.417 1.00 0.00 H new ATOM 0 HA ASN A 399 7.787 4.352 2.135 1.00 0.00 H new ATOM 0 HB2 ASN A 399 8.802 5.771 -0.314 1.00 0.00 H new ATOM 0 HB3 ASN A 399 9.720 5.944 1.169 1.00 0.00 H new ATOM 0 HD21 ASN A 399 10.232 2.677 -1.077 1.00 0.00 H new ATOM 0 HD22 ASN A 399 9.509 4.198 -1.608 1.00 0.00 H new ATOM 514 N ARG A 400 7.016 6.303 3.502 1.00 0.00 N ATOM 515 CA ARG A 400 6.786 7.432 4.397 1.00 0.00 C ATOM 516 C ARG A 400 7.245 7.104 5.815 1.00 0.00 C ATOM 517 O ARG A 400 8.249 7.633 6.290 1.00 0.00 O ATOM 518 CB ARG A 400 5.304 7.814 4.399 1.00 0.00 C ATOM 519 CG ARG A 400 5.059 9.306 4.244 1.00 0.00 C ATOM 520 CD ARG A 400 3.574 9.631 4.263 1.00 0.00 C ATOM 521 NE ARG A 400 3.246 10.738 3.369 1.00 0.00 N ATOM 522 CZ ARG A 400 3.443 12.020 3.670 1.00 0.00 C ATOM 523 NH1 ARG A 400 3.967 12.360 4.840 1.00 0.00 N ATOM 524 NH2 ARG A 400 3.116 12.963 2.797 1.00 0.00 N ATOM 0 H ARG A 400 6.748 5.398 3.888 1.00 0.00 H new ATOM 0 HA ARG A 400 7.370 8.278 4.034 1.00 0.00 H new ATOM 0 HB2 ARG A 400 4.800 7.286 3.589 1.00 0.00 H new ATOM 0 HB3 ARG A 400 4.851 7.475 5.331 1.00 0.00 H new ATOM 0 HG2 ARG A 400 5.561 9.844 5.049 1.00 0.00 H new ATOM 0 HG3 ARG A 400 5.497 9.652 3.308 1.00 0.00 H new ATOM 0 HD2 ARG A 400 3.006 8.748 3.971 1.00 0.00 H new ATOM 0 HD3 ARG A 400 3.271 9.883 5.279 1.00 0.00 H new ATOM 0 HE ARG A 400 2.842 10.516 2.459 1.00 0.00 H new ATOM 0 HH11 ARG A 400 4.221 11.638 5.514 1.00 0.00 H new ATOM 0 HH12 ARG A 400 4.116 13.344 5.066 1.00 0.00 H new ATOM 0 HH21 ARG A 400 2.714 12.706 1.896 1.00 0.00 H new ATOM 0 HH22 ARG A 400 3.267 13.945 3.027 1.00 0.00 H new ATOM 538 N THR A 401 6.501 6.231 6.486 1.00 0.00 N ATOM 539 CA THR A 401 6.830 5.833 7.848 1.00 0.00 C ATOM 540 C THR A 401 6.026 4.608 8.273 1.00 0.00 C ATOM 541 O THR A 401 4.807 4.566 8.105 1.00 0.00 O ATOM 542 CB THR A 401 6.570 6.979 8.848 1.00 0.00 C ATOM 543 OG1 THR A 401 5.740 7.978 8.244 1.00 0.00 O ATOM 544 CG2 THR A 401 7.880 7.610 9.301 1.00 0.00 C ATOM 0 H THR A 401 5.665 5.786 6.107 1.00 0.00 H new ATOM 0 HA THR A 401 7.892 5.587 7.858 1.00 0.00 H new ATOM 0 HB THR A 401 6.063 6.563 9.719 1.00 0.00 H new ATOM 0 HG1 THR A 401 5.579 8.701 8.886 1.00 0.00 H new ATOM 0 HG21 THR A 401 7.672 8.415 10.005 1.00 0.00 H new ATOM 0 HG22 THR A 401 8.499 6.855 9.786 1.00 0.00 H new ATOM 0 HG23 THR A 401 8.408 8.012 8.436 1.00 0.00 H new ATOM 552 N GLN A 402 6.714 3.614 8.823 1.00 0.00 N ATOM 553 CA GLN A 402 6.064 2.389 9.271 1.00 0.00 C ATOM 554 C GLN A 402 5.064 2.679 10.385 1.00 0.00 C ATOM 555 O GLN A 402 5.407 3.288 11.399 1.00 0.00 O ATOM 556 CB GLN A 402 7.108 1.381 9.758 1.00 0.00 C ATOM 557 CG GLN A 402 8.020 0.869 8.654 1.00 0.00 C ATOM 558 CD GLN A 402 9.400 1.492 8.704 1.00 0.00 C ATOM 559 OE1 GLN A 402 9.854 2.104 7.736 1.00 0.00 O ATOM 560 NE2 GLN A 402 10.079 1.338 9.835 1.00 0.00 N ATOM 0 H GLN A 402 7.723 3.633 8.969 1.00 0.00 H new ATOM 0 HA GLN A 402 5.525 1.964 8.424 1.00 0.00 H new ATOM 0 HB2 GLN A 402 7.716 1.846 10.534 1.00 0.00 H new ATOM 0 HB3 GLN A 402 6.597 0.535 10.218 1.00 0.00 H new ATOM 0 HG2 GLN A 402 8.111 -0.214 8.736 1.00 0.00 H new ATOM 0 HG3 GLN A 402 7.565 1.078 7.686 1.00 0.00 H new ATOM 0 HE21 GLN A 402 9.665 0.824 10.612 1.00 0.00 H new ATOM 0 HE22 GLN A 402 11.014 1.734 9.926 1.00 0.00 H new ATOM 569 N GLY A 403 3.825 2.238 10.191 1.00 0.00 N ATOM 570 CA GLY A 403 2.793 2.459 11.188 1.00 0.00 C ATOM 571 C GLY A 403 1.632 3.273 10.651 1.00 0.00 C ATOM 572 O GLY A 403 0.502 3.141 11.124 1.00 0.00 O ATOM 0 H GLY A 403 3.517 1.731 9.361 1.00 0.00 H new ATOM 0 HA2 GLY A 403 2.424 1.497 11.544 1.00 0.00 H new ATOM 0 HA3 GLY A 403 3.226 2.972 12.047 1.00 0.00 H new ATOM 576 N LEU A 404 1.909 4.116 9.663 1.00 0.00 N ATOM 577 CA LEU A 404 0.880 4.954 9.061 1.00 0.00 C ATOM 578 C LEU A 404 -0.191 4.105 8.385 1.00 0.00 C ATOM 579 O LEU A 404 -1.367 4.473 8.360 1.00 0.00 O ATOM 580 CB LEU A 404 1.503 5.911 8.043 1.00 0.00 C ATOM 581 CG LEU A 404 0.679 7.164 7.741 1.00 0.00 C ATOM 582 CD1 LEU A 404 0.962 8.250 8.767 1.00 0.00 C ATOM 583 CD2 LEU A 404 0.971 7.665 6.334 1.00 0.00 C ATOM 0 H LEU A 404 2.839 4.237 9.262 1.00 0.00 H new ATOM 0 HA LEU A 404 0.410 5.533 9.856 1.00 0.00 H new ATOM 0 HB2 LEU A 404 2.482 6.219 8.409 1.00 0.00 H new ATOM 0 HB3 LEU A 404 1.667 5.369 7.111 1.00 0.00 H new ATOM 0 HG LEU A 404 -0.378 6.905 7.801 1.00 0.00 H new ATOM 0 HD11 LEU A 404 0.367 9.133 8.535 1.00 0.00 H new ATOM 0 HD12 LEU A 404 0.702 7.888 9.762 1.00 0.00 H new ATOM 0 HD13 LEU A 404 2.021 8.509 8.740 1.00 0.00 H new ATOM 0 HD21 LEU A 404 0.377 8.557 6.135 1.00 0.00 H new ATOM 0 HD22 LEU A 404 2.030 7.907 6.247 1.00 0.00 H new ATOM 0 HD23 LEU A 404 0.715 6.890 5.611 1.00 0.00 H new ATOM 595 N LEU A 405 0.221 2.965 7.839 1.00 0.00 N ATOM 596 CA LEU A 405 -0.703 2.062 7.161 1.00 0.00 C ATOM 597 C LEU A 405 -1.816 1.612 8.104 1.00 0.00 C ATOM 598 O LEU A 405 -2.986 1.570 7.722 1.00 0.00 O ATOM 599 CB LEU A 405 0.047 0.842 6.622 1.00 0.00 C ATOM 600 CG LEU A 405 -0.653 0.103 5.480 1.00 0.00 C ATOM 601 CD1 LEU A 405 0.368 -0.470 4.509 1.00 0.00 C ATOM 602 CD2 LEU A 405 -1.546 -1.001 6.031 1.00 0.00 C ATOM 0 H LEU A 405 1.189 2.644 7.853 1.00 0.00 H new ATOM 0 HA LEU A 405 -1.153 2.602 6.328 1.00 0.00 H new ATOM 0 HB2 LEU A 405 1.031 1.162 6.278 1.00 0.00 H new ATOM 0 HB3 LEU A 405 0.208 0.142 7.442 1.00 0.00 H new ATOM 0 HG LEU A 405 -1.277 0.815 4.939 1.00 0.00 H new ATOM 0 HD11 LEU A 405 -0.149 -0.992 3.704 1.00 0.00 H new ATOM 0 HD12 LEU A 405 0.967 0.339 4.091 1.00 0.00 H new ATOM 0 HD13 LEU A 405 1.019 -1.169 5.035 1.00 0.00 H new ATOM 0 HD21 LEU A 405 -2.037 -1.517 5.206 1.00 0.00 H new ATOM 0 HD22 LEU A 405 -0.941 -1.711 6.595 1.00 0.00 H new ATOM 0 HD23 LEU A 405 -2.300 -0.566 6.687 1.00 0.00 H new ATOM 614 N SER A 406 -1.443 1.277 9.335 1.00 0.00 N ATOM 615 CA SER A 406 -2.410 0.830 10.331 1.00 0.00 C ATOM 616 C SER A 406 -3.350 1.964 10.728 1.00 0.00 C ATOM 617 O SER A 406 -4.501 1.730 11.093 1.00 0.00 O ATOM 618 CB SER A 406 -1.687 0.293 11.567 1.00 0.00 C ATOM 619 OG SER A 406 -0.804 1.263 12.103 1.00 0.00 O ATOM 0 H SER A 406 -0.479 1.307 9.666 1.00 0.00 H new ATOM 0 HA SER A 406 -3.005 0.030 9.890 1.00 0.00 H new ATOM 0 HB2 SER A 406 -2.418 0.005 12.323 1.00 0.00 H new ATOM 0 HB3 SER A 406 -1.129 -0.606 11.304 1.00 0.00 H new ATOM 0 HG SER A 406 -0.720 2.011 11.475 1.00 0.00 H new ATOM 625 N GLU A 407 -2.849 3.194 10.657 1.00 0.00 N ATOM 626 CA GLU A 407 -3.644 4.364 11.012 1.00 0.00 C ATOM 627 C GLU A 407 -4.641 4.703 9.908 1.00 0.00 C ATOM 628 O GLU A 407 -5.806 4.993 10.180 1.00 0.00 O ATOM 629 CB GLU A 407 -2.731 5.563 11.277 1.00 0.00 C ATOM 630 CG GLU A 407 -3.221 6.464 12.399 1.00 0.00 C ATOM 631 CD GLU A 407 -2.122 6.828 13.378 1.00 0.00 C ATOM 632 OE1 GLU A 407 -0.941 6.824 12.971 1.00 0.00 O ATOM 633 OE2 GLU A 407 -2.441 7.117 14.550 1.00 0.00 O ATOM 0 H GLU A 407 -1.897 3.406 10.357 1.00 0.00 H new ATOM 0 HA GLU A 407 -4.202 4.131 11.919 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -1.732 5.202 11.522 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -2.642 6.150 10.363 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -3.638 7.376 11.972 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -4.028 5.965 12.934 1.00 0.00 H new ATOM 640 N ILE A 408 -4.176 4.666 8.663 1.00 0.00 N ATOM 641 CA ILE A 408 -5.027 4.971 7.521 1.00 0.00 C ATOM 642 C ILE A 408 -6.098 3.901 7.331 1.00 0.00 C ATOM 643 O ILE A 408 -7.214 4.195 6.903 1.00 0.00 O ATOM 644 CB ILE A 408 -4.205 5.095 6.222 1.00 0.00 C ATOM 645 CG1 ILE A 408 -3.041 6.069 6.420 1.00 0.00 C ATOM 646 CG2 ILE A 408 -5.091 5.551 5.071 1.00 0.00 C ATOM 647 CD1 ILE A 408 -1.853 5.781 5.528 1.00 0.00 C ATOM 0 H ILE A 408 -3.214 4.428 8.421 1.00 0.00 H new ATOM 0 HA ILE A 408 -5.505 5.927 7.732 1.00 0.00 H new ATOM 0 HB ILE A 408 -3.799 4.114 5.975 1.00 0.00 H new ATOM 0 HG12 ILE A 408 -3.391 7.084 6.229 1.00 0.00 H new ATOM 0 HG13 ILE A 408 -2.721 6.033 7.461 1.00 0.00 H new ATOM 0 HG21 ILE A 408 -4.494 5.633 4.163 1.00 0.00 H new ATOM 0 HG22 ILE A 408 -5.889 4.825 4.916 1.00 0.00 H new ATOM 0 HG23 ILE A 408 -5.525 6.522 5.309 1.00 0.00 H new ATOM 0 HD11 ILE A 408 -1.067 6.510 5.723 1.00 0.00 H new ATOM 0 HD12 ILE A 408 -1.478 4.779 5.734 1.00 0.00 H new ATOM 0 HD13 ILE A 408 -2.158 5.846 4.484 1.00 0.00 H new ATOM 659 N LEU A 409 -5.751 2.659 7.652 1.00 0.00 N ATOM 660 CA LEU A 409 -6.685 1.547 7.517 1.00 0.00 C ATOM 661 C LEU A 409 -7.700 1.546 8.656 1.00 0.00 C ATOM 662 O LEU A 409 -8.839 1.112 8.485 1.00 0.00 O ATOM 663 CB LEU A 409 -5.928 0.218 7.488 1.00 0.00 C ATOM 664 CG LEU A 409 -5.605 -0.314 6.090 1.00 0.00 C ATOM 665 CD1 LEU A 409 -6.880 -0.492 5.280 1.00 0.00 C ATOM 666 CD2 LEU A 409 -4.644 0.623 5.374 1.00 0.00 C ATOM 0 H LEU A 409 -4.831 2.397 8.007 1.00 0.00 H new ATOM 0 HA LEU A 409 -7.223 1.670 6.577 1.00 0.00 H new ATOM 0 HB2 LEU A 409 -4.995 0.337 8.039 1.00 0.00 H new ATOM 0 HB3 LEU A 409 -6.518 -0.530 8.017 1.00 0.00 H new ATOM 0 HG LEU A 409 -5.125 -1.287 6.193 1.00 0.00 H new ATOM 0 HD11 LEU A 409 -6.631 -0.871 4.289 1.00 0.00 H new ATOM 0 HD12 LEU A 409 -7.536 -1.201 5.785 1.00 0.00 H new ATOM 0 HD13 LEU A 409 -7.387 0.468 5.185 1.00 0.00 H new ATOM 0 HD21 LEU A 409 -4.425 0.230 4.381 1.00 0.00 H new ATOM 0 HD22 LEU A 409 -5.099 1.609 5.282 1.00 0.00 H new ATOM 0 HD23 LEU A 409 -3.719 0.702 5.946 1.00 0.00 H new ATOM 678 N ARG A 410 -7.279 2.034 9.818 1.00 0.00 N ATOM 679 CA ARG A 410 -8.152 2.089 10.984 1.00 0.00 C ATOM 680 C ARG A 410 -9.283 3.090 10.771 1.00 0.00 C ATOM 681 O ARG A 410 -10.415 2.863 11.199 1.00 0.00 O ATOM 682 CB ARG A 410 -7.350 2.468 12.231 1.00 0.00 C ATOM 683 CG ARG A 410 -8.080 2.187 13.533 1.00 0.00 C ATOM 684 CD ARG A 410 -7.121 2.128 14.711 1.00 0.00 C ATOM 685 NE ARG A 410 -6.853 0.755 15.131 1.00 0.00 N ATOM 686 CZ ARG A 410 -7.680 0.036 15.885 1.00 0.00 C ATOM 687 NH1 ARG A 410 -8.828 0.553 16.302 1.00 0.00 N ATOM 688 NH2 ARG A 410 -7.359 -1.206 16.223 1.00 0.00 N ATOM 0 H ARG A 410 -6.339 2.397 9.977 1.00 0.00 H new ATOM 0 HA ARG A 410 -8.588 1.100 11.126 1.00 0.00 H new ATOM 0 HB2 ARG A 410 -6.408 1.920 12.227 1.00 0.00 H new ATOM 0 HB3 ARG A 410 -7.102 3.528 12.185 1.00 0.00 H new ATOM 0 HG2 ARG A 410 -8.825 2.963 13.708 1.00 0.00 H new ATOM 0 HG3 ARG A 410 -8.617 1.242 13.453 1.00 0.00 H new ATOM 0 HD2 ARG A 410 -6.184 2.614 14.440 1.00 0.00 H new ATOM 0 HD3 ARG A 410 -7.540 2.688 15.547 1.00 0.00 H new ATOM 0 HE ARG A 410 -5.980 0.322 14.828 1.00 0.00 H new ATOM 0 HH11 ARG A 410 -9.081 1.507 16.045 1.00 0.00 H new ATOM 0 HH12 ARG A 410 -9.458 -0.003 16.880 1.00 0.00 H new ATOM 0 HH21 ARG A 410 -6.478 -1.610 15.905 1.00 0.00 H new ATOM 0 HH22 ARG A 410 -7.993 -1.757 16.801 1.00 0.00 H new ATOM 702 N LYS A 411 -8.970 4.197 10.106 1.00 0.00 N ATOM 703 CA LYS A 411 -9.962 5.232 9.836 1.00 0.00 C ATOM 704 C LYS A 411 -11.008 4.739 8.842 1.00 0.00 C ATOM 705 O LYS A 411 -12.209 4.846 9.085 1.00 0.00 O ATOM 706 CB LYS A 411 -9.279 6.490 9.295 1.00 0.00 C ATOM 707 CG LYS A 411 -8.544 7.289 10.359 1.00 0.00 C ATOM 708 CD LYS A 411 -7.616 8.321 9.737 1.00 0.00 C ATOM 709 CE LYS A 411 -7.592 9.609 10.543 1.00 0.00 C ATOM 710 NZ LYS A 411 -8.274 10.724 9.830 1.00 0.00 N ATOM 0 H LYS A 411 -8.038 4.401 9.744 1.00 0.00 H new ATOM 0 HA LYS A 411 -10.465 5.473 10.773 1.00 0.00 H new ATOM 0 HB2 LYS A 411 -8.573 6.203 8.516 1.00 0.00 H new ATOM 0 HB3 LYS A 411 -10.029 7.128 8.827 1.00 0.00 H new ATOM 0 HG2 LYS A 411 -9.266 7.789 11.004 1.00 0.00 H new ATOM 0 HG3 LYS A 411 -7.967 6.613 10.990 1.00 0.00 H new ATOM 0 HD2 LYS A 411 -6.608 7.912 9.673 1.00 0.00 H new ATOM 0 HD3 LYS A 411 -7.939 8.535 8.718 1.00 0.00 H new ATOM 0 HE2 LYS A 411 -8.076 9.444 11.505 1.00 0.00 H new ATOM 0 HE3 LYS A 411 -6.559 9.889 10.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 411 -8.236 11.584 10.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 411 -7.797 10.899 8.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 411 -9.267 10.468 9.655 1.00 0.00 H new ATOM 724 N GLU A 412 -10.540 4.198 7.720 1.00 0.00 N ATOM 725 CA GLU A 412 -11.437 3.687 6.688 1.00 0.00 C ATOM 726 C GLU A 412 -12.323 4.798 6.138 1.00 0.00 C ATOM 727 O GLU A 412 -13.464 4.557 5.740 1.00 0.00 O ATOM 728 CB GLU A 412 -12.303 2.557 7.249 1.00 0.00 C ATOM 729 CG GLU A 412 -11.511 1.489 7.983 1.00 0.00 C ATOM 730 CD GLU A 412 -12.402 0.462 8.656 1.00 0.00 C ATOM 731 OE1 GLU A 412 -13.221 -0.165 7.951 1.00 0.00 O ATOM 732 OE2 GLU A 412 -12.280 0.284 9.885 1.00 0.00 O ATOM 0 H GLU A 412 -9.548 4.102 7.503 1.00 0.00 H new ATOM 0 HA GLU A 412 -10.827 3.297 5.873 1.00 0.00 H new ATOM 0 HB2 GLU A 412 -13.042 2.981 7.929 1.00 0.00 H new ATOM 0 HB3 GLU A 412 -12.853 2.092 6.431 1.00 0.00 H new ATOM 0 HG2 GLU A 412 -10.849 0.985 7.279 1.00 0.00 H new ATOM 0 HG3 GLU A 412 -10.878 1.963 8.733 1.00 0.00 H new ATOM 739 N GLU A 413 -11.793 6.017 6.119 1.00 0.00 N ATOM 740 CA GLU A 413 -12.538 7.167 5.616 1.00 0.00 C ATOM 741 C GLU A 413 -12.197 7.437 4.154 1.00 0.00 C ATOM 742 O GLU A 413 -11.026 7.517 3.784 1.00 0.00 O ATOM 743 CB GLU A 413 -12.238 8.405 6.463 1.00 0.00 C ATOM 744 CG GLU A 413 -13.313 8.713 7.493 1.00 0.00 C ATOM 745 CD GLU A 413 -12.829 9.654 8.578 1.00 0.00 C ATOM 746 OE1 GLU A 413 -12.033 10.564 8.263 1.00 0.00 O ATOM 747 OE2 GLU A 413 -13.247 9.483 9.743 1.00 0.00 O ATOM 0 H GLU A 413 -10.851 6.234 6.446 1.00 0.00 H new ATOM 0 HA GLU A 413 -13.602 6.940 5.685 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -11.286 8.263 6.975 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -12.120 9.266 5.805 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -14.175 9.155 6.992 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -13.651 7.782 7.949 1.00 0.00 H new ATOM 754 N ASP A 414 -13.228 7.580 3.329 1.00 0.00 N ATOM 755 CA ASP A 414 -13.038 7.842 1.907 1.00 0.00 C ATOM 756 C ASP A 414 -12.332 9.179 1.689 1.00 0.00 C ATOM 757 O ASP A 414 -12.234 9.996 2.605 1.00 0.00 O ATOM 758 CB ASP A 414 -14.385 7.839 1.181 1.00 0.00 C ATOM 759 CG ASP A 414 -14.677 6.511 0.510 1.00 0.00 C ATOM 760 OD1 ASP A 414 -14.454 5.462 1.149 1.00 0.00 O ATOM 761 OD2 ASP A 414 -15.128 6.522 -0.655 1.00 0.00 O ATOM 0 H ASP A 414 -14.204 7.519 3.620 1.00 0.00 H new ATOM 0 HA ASP A 414 -12.411 7.049 1.498 1.00 0.00 H new ATOM 0 HB2 ASP A 414 -15.179 8.066 1.893 1.00 0.00 H new ATOM 0 HB3 ASP A 414 -14.393 8.631 0.432 1.00 0.00 H new ATOM 766 N PRO A 415 -11.826 9.419 0.467 1.00 0.00 N ATOM 767 CA PRO A 415 -11.127 10.665 0.131 1.00 0.00 C ATOM 768 C PRO A 415 -12.068 11.866 0.062 1.00 0.00 C ATOM 769 O PRO A 415 -11.620 13.009 -0.048 1.00 0.00 O ATOM 770 CB PRO A 415 -10.531 10.375 -1.247 1.00 0.00 C ATOM 771 CG PRO A 415 -11.424 9.340 -1.836 1.00 0.00 C ATOM 772 CD PRO A 415 -11.900 8.499 -0.684 1.00 0.00 C ATOM 0 HA PRO A 415 -10.387 10.931 0.886 1.00 0.00 H new ATOM 0 HB2 PRO A 415 -10.505 11.273 -1.864 1.00 0.00 H new ATOM 0 HB3 PRO A 415 -9.506 10.014 -1.167 1.00 0.00 H new ATOM 0 HG2 PRO A 415 -12.264 9.800 -2.357 1.00 0.00 H new ATOM 0 HG3 PRO A 415 -10.889 8.734 -2.567 1.00 0.00 H new ATOM 0 HD2 PRO A 415 -12.916 8.137 -0.844 1.00 0.00 H new ATOM 0 HD3 PRO A 415 -11.268 7.623 -0.539 1.00 0.00 H new ATOM 780 N LYS A 416 -13.372 11.606 0.124 1.00 0.00 N ATOM 781 CA LYS A 416 -14.369 12.669 0.067 1.00 0.00 C ATOM 782 C LYS A 416 -14.131 13.702 1.164 1.00 0.00 C ATOM 783 O LYS A 416 -14.265 14.905 0.937 1.00 0.00 O ATOM 784 CB LYS A 416 -15.775 12.084 0.197 1.00 0.00 C ATOM 785 CG LYS A 416 -16.159 11.159 -0.947 1.00 0.00 C ATOM 786 CD LYS A 416 -16.636 11.943 -2.158 1.00 0.00 C ATOM 787 CE LYS A 416 -17.445 11.070 -3.104 1.00 0.00 C ATOM 788 NZ LYS A 416 -18.425 11.865 -3.894 1.00 0.00 N ATOM 0 H LYS A 416 -13.762 10.668 0.214 1.00 0.00 H new ATOM 0 HA LYS A 416 -14.277 13.166 -0.899 1.00 0.00 H new ATOM 0 HB2 LYS A 416 -15.845 11.535 1.136 1.00 0.00 H new ATOM 0 HB3 LYS A 416 -16.495 12.900 0.250 1.00 0.00 H new ATOM 0 HG2 LYS A 416 -15.302 10.545 -1.224 1.00 0.00 H new ATOM 0 HG3 LYS A 416 -16.945 10.479 -0.619 1.00 0.00 H new ATOM 0 HD2 LYS A 416 -17.244 12.786 -1.830 1.00 0.00 H new ATOM 0 HD3 LYS A 416 -15.777 12.356 -2.687 1.00 0.00 H new ATOM 0 HE2 LYS A 416 -16.770 10.548 -3.783 1.00 0.00 H new ATOM 0 HE3 LYS A 416 -17.974 10.308 -2.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 416 -18.956 11.232 -4.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 416 -19.085 12.343 -3.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 416 -17.919 12.576 -4.460 1.00 0.00 H new ATOM 802 N THR A 417 -13.781 13.226 2.354 1.00 0.00 N ATOM 803 CA THR A 417 -13.527 14.109 3.487 1.00 0.00 C ATOM 804 C THR A 417 -12.048 14.122 3.861 1.00 0.00 C ATOM 805 O THR A 417 -11.570 15.060 4.499 1.00 0.00 O ATOM 806 CB THR A 417 -14.353 13.695 4.719 1.00 0.00 C ATOM 807 OG1 THR A 417 -14.063 14.565 5.819 1.00 0.00 O ATOM 808 CG2 THR A 417 -14.054 12.257 5.113 1.00 0.00 C ATOM 0 H THR A 417 -13.667 12.233 2.559 1.00 0.00 H new ATOM 0 HA THR A 417 -13.826 15.110 3.177 1.00 0.00 H new ATOM 0 HB THR A 417 -15.409 13.773 4.462 1.00 0.00 H new ATOM 0 HG1 THR A 417 -14.594 14.296 6.598 1.00 0.00 H new ATOM 0 HG21 THR A 417 -14.649 11.988 5.986 1.00 0.00 H new ATOM 0 HG22 THR A 417 -14.303 11.594 4.285 1.00 0.00 H new ATOM 0 HG23 THR A 417 -12.995 12.158 5.351 1.00 0.00 H new ATOM 816 N ALA A 418 -11.326 13.077 3.465 1.00 0.00 N ATOM 817 CA ALA A 418 -9.902 12.975 3.764 1.00 0.00 C ATOM 818 C ALA A 418 -9.136 14.164 3.198 1.00 0.00 C ATOM 819 O ALA A 418 -9.501 14.715 2.160 1.00 0.00 O ATOM 820 CB ALA A 418 -9.341 11.673 3.216 1.00 0.00 C ATOM 0 H ALA A 418 -11.704 12.290 2.937 1.00 0.00 H new ATOM 0 HA ALA A 418 -9.781 12.982 4.847 1.00 0.00 H new ATOM 0 HB1 ALA A 418 -8.277 11.610 3.446 1.00 0.00 H new ATOM 0 HB2 ALA A 418 -9.862 10.832 3.673 1.00 0.00 H new ATOM 0 HB3 ALA A 418 -9.481 11.643 2.135 1.00 0.00 H new ATOM 826 N SER A 419 -8.068 14.556 3.888 1.00 0.00 N ATOM 827 CA SER A 419 -7.249 15.680 3.453 1.00 0.00 C ATOM 828 C SER A 419 -6.341 15.277 2.296 1.00 0.00 C ATOM 829 O SER A 419 -6.387 14.139 1.825 1.00 0.00 O ATOM 830 CB SER A 419 -6.405 16.204 4.619 1.00 0.00 C ATOM 831 OG SER A 419 -7.206 16.905 5.553 1.00 0.00 O ATOM 0 H SER A 419 -7.751 14.111 4.750 1.00 0.00 H new ATOM 0 HA SER A 419 -7.916 16.471 3.110 1.00 0.00 H new ATOM 0 HB2 SER A 419 -5.907 15.371 5.115 1.00 0.00 H new ATOM 0 HB3 SER A 419 -5.623 16.862 4.239 1.00 0.00 H new ATOM 0 HG SER A 419 -6.644 17.228 6.288 1.00 0.00 H new ATOM 837 N GLN A 420 -5.517 16.214 1.841 1.00 0.00 N ATOM 838 CA GLN A 420 -4.600 15.956 0.739 1.00 0.00 C ATOM 839 C GLN A 420 -3.580 14.887 1.118 1.00 0.00 C ATOM 840 O GLN A 420 -3.104 14.138 0.266 1.00 0.00 O ATOM 841 CB GLN A 420 -3.879 17.244 0.333 1.00 0.00 C ATOM 842 CG GLN A 420 -3.619 17.351 -1.161 1.00 0.00 C ATOM 843 CD GLN A 420 -2.421 16.534 -1.603 1.00 0.00 C ATOM 844 OE1 GLN A 420 -1.516 16.262 -0.815 1.00 0.00 O ATOM 845 NE2 GLN A 420 -2.410 16.141 -2.872 1.00 0.00 N ATOM 0 H GLN A 420 -5.466 17.160 2.219 1.00 0.00 H new ATOM 0 HA GLN A 420 -5.183 15.593 -0.107 1.00 0.00 H new ATOM 0 HB2 GLN A 420 -4.474 18.100 0.652 1.00 0.00 H new ATOM 0 HB3 GLN A 420 -2.929 17.301 0.864 1.00 0.00 H new ATOM 0 HG2 GLN A 420 -4.503 17.017 -1.705 1.00 0.00 H new ATOM 0 HG3 GLN A 420 -3.459 18.396 -1.424 1.00 0.00 H new ATOM 0 HE21 GLN A 420 -3.183 16.390 -3.490 1.00 0.00 H new ATOM 0 HE22 GLN A 420 -1.629 15.590 -3.229 1.00 0.00 H new ATOM 854 N SER A 421 -3.246 14.824 2.405 1.00 0.00 N ATOM 855 CA SER A 421 -2.282 13.848 2.897 1.00 0.00 C ATOM 856 C SER A 421 -2.723 12.427 2.563 1.00 0.00 C ATOM 857 O SER A 421 -1.953 11.641 2.009 1.00 0.00 O ATOM 858 CB SER A 421 -2.103 13.997 4.409 1.00 0.00 C ATOM 859 OG SER A 421 -1.852 15.345 4.765 1.00 0.00 O ATOM 0 H SER A 421 -3.629 15.438 3.124 1.00 0.00 H new ATOM 0 HA SER A 421 -1.329 14.036 2.403 1.00 0.00 H new ATOM 0 HB2 SER A 421 -2.998 13.644 4.920 1.00 0.00 H new ATOM 0 HB3 SER A 421 -1.277 13.370 4.744 1.00 0.00 H new ATOM 0 HG SER A 421 -1.743 15.412 5.737 1.00 0.00 H new ATOM 865 N LEU A 422 -3.967 12.102 2.903 1.00 0.00 N ATOM 866 CA LEU A 422 -4.509 10.774 2.636 1.00 0.00 C ATOM 867 C LEU A 422 -4.591 10.513 1.136 1.00 0.00 C ATOM 868 O LEU A 422 -4.297 9.412 0.672 1.00 0.00 O ATOM 869 CB LEU A 422 -5.893 10.627 3.272 1.00 0.00 C ATOM 870 CG LEU A 422 -6.169 9.264 3.909 1.00 0.00 C ATOM 871 CD1 LEU A 422 -7.572 9.223 4.498 1.00 0.00 C ATOM 872 CD2 LEU A 422 -5.987 8.152 2.886 1.00 0.00 C ATOM 0 H LEU A 422 -4.617 12.739 3.363 1.00 0.00 H new ATOM 0 HA LEU A 422 -3.837 10.038 3.077 1.00 0.00 H new ATOM 0 HB2 LEU A 422 -6.010 11.398 4.034 1.00 0.00 H new ATOM 0 HB3 LEU A 422 -6.649 10.815 2.509 1.00 0.00 H new ATOM 0 HG LEU A 422 -5.453 9.110 4.717 1.00 0.00 H new ATOM 0 HD11 LEU A 422 -7.750 8.246 4.947 1.00 0.00 H new ATOM 0 HD12 LEU A 422 -7.669 9.995 5.261 1.00 0.00 H new ATOM 0 HD13 LEU A 422 -8.303 9.399 3.709 1.00 0.00 H new ATOM 0 HD21 LEU A 422 -6.187 7.189 3.356 1.00 0.00 H new ATOM 0 HD22 LEU A 422 -6.679 8.303 2.058 1.00 0.00 H new ATOM 0 HD23 LEU A 422 -4.964 8.167 2.511 1.00 0.00 H new ATOM 884 N LEU A 423 -4.991 11.534 0.383 1.00 0.00 N ATOM 885 CA LEU A 423 -5.109 11.413 -1.066 1.00 0.00 C ATOM 886 C LEU A 423 -3.773 11.016 -1.687 1.00 0.00 C ATOM 887 O LEU A 423 -3.732 10.320 -2.702 1.00 0.00 O ATOM 888 CB LEU A 423 -5.594 12.732 -1.670 1.00 0.00 C ATOM 889 CG LEU A 423 -6.994 13.169 -1.232 1.00 0.00 C ATOM 890 CD1 LEU A 423 -7.351 14.512 -1.852 1.00 0.00 C ATOM 891 CD2 LEU A 423 -8.021 12.114 -1.610 1.00 0.00 C ATOM 0 H LEU A 423 -5.238 12.452 0.752 1.00 0.00 H new ATOM 0 HA LEU A 423 -5.838 10.632 -1.284 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -4.886 13.517 -1.406 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -5.581 12.643 -2.756 1.00 0.00 H new ATOM 0 HG LEU A 423 -6.999 13.281 -0.148 1.00 0.00 H new ATOM 0 HD11 LEU A 423 -8.350 14.807 -1.530 1.00 0.00 H new ATOM 0 HD12 LEU A 423 -6.629 15.264 -1.532 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -7.330 14.428 -2.939 1.00 0.00 H new ATOM 0 HD21 LEU A 423 -9.011 12.440 -1.292 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -8.016 11.972 -2.691 1.00 0.00 H new ATOM 0 HD23 LEU A 423 -7.773 11.173 -1.119 1.00 0.00 H new ATOM 903 N VAL A 424 -2.685 11.463 -1.071 1.00 0.00 N ATOM 904 CA VAL A 424 -1.347 11.152 -1.560 1.00 0.00 C ATOM 905 C VAL A 424 -0.979 9.704 -1.259 1.00 0.00 C ATOM 906 O VAL A 424 -0.253 9.066 -2.022 1.00 0.00 O ATOM 907 CB VAL A 424 -0.290 12.082 -0.932 1.00 0.00 C ATOM 908 CG1 VAL A 424 1.074 11.843 -1.559 1.00 0.00 C ATOM 909 CG2 VAL A 424 -0.706 13.540 -1.077 1.00 0.00 C ATOM 0 H VAL A 424 -2.703 12.042 -0.232 1.00 0.00 H new ATOM 0 HA VAL A 424 -1.358 11.305 -2.639 1.00 0.00 H new ATOM 0 HB VAL A 424 -0.219 11.853 0.131 1.00 0.00 H new ATOM 0 HG11 VAL A 424 1.806 12.509 -1.102 1.00 0.00 H new ATOM 0 HG12 VAL A 424 1.373 10.808 -1.395 1.00 0.00 H new ATOM 0 HG13 VAL A 424 1.022 12.041 -2.630 1.00 0.00 H new ATOM 0 HG21 VAL A 424 0.052 14.181 -0.628 1.00 0.00 H new ATOM 0 HG22 VAL A 424 -0.809 13.786 -2.134 1.00 0.00 H new ATOM 0 HG23 VAL A 424 -1.660 13.698 -0.573 1.00 0.00 H new ATOM 919 N ASN A 425 -1.487 9.190 -0.145 1.00 0.00 N ATOM 920 CA ASN A 425 -1.214 7.815 0.257 1.00 0.00 C ATOM 921 C ASN A 425 -2.007 6.832 -0.599 1.00 0.00 C ATOM 922 O ASN A 425 -1.492 5.787 -1.000 1.00 0.00 O ATOM 923 CB ASN A 425 -1.557 7.614 1.734 1.00 0.00 C ATOM 924 CG ASN A 425 -0.477 8.144 2.656 1.00 0.00 C ATOM 925 OD1 ASN A 425 0.270 7.376 3.263 1.00 0.00 O ATOM 926 ND2 ASN A 425 -0.387 9.465 2.766 1.00 0.00 N ATOM 0 H ASN A 425 -2.090 9.705 0.496 1.00 0.00 H new ATOM 0 HA ASN A 425 -0.151 7.624 0.110 1.00 0.00 H new ATOM 0 HB2 ASN A 425 -2.499 8.115 1.957 1.00 0.00 H new ATOM 0 HB3 ASN A 425 -1.707 6.552 1.928 1.00 0.00 H new ATOM 0 HD21 ASN A 425 0.322 9.879 3.372 1.00 0.00 H new ATOM 0 HD22 ASN A 425 -1.026 10.065 2.245 1.00 0.00 H new ATOM 933 N LEU A 426 -3.261 7.174 -0.875 1.00 0.00 N ATOM 934 CA LEU A 426 -4.123 6.322 -1.685 1.00 0.00 C ATOM 935 C LEU A 426 -3.606 6.227 -3.118 1.00 0.00 C ATOM 936 O LEU A 426 -3.621 5.158 -3.724 1.00 0.00 O ATOM 937 CB LEU A 426 -5.556 6.861 -1.683 1.00 0.00 C ATOM 938 CG LEU A 426 -6.121 7.193 -0.302 1.00 0.00 C ATOM 939 CD1 LEU A 426 -7.059 8.390 -0.380 1.00 0.00 C ATOM 940 CD2 LEU A 426 -6.841 5.985 0.281 1.00 0.00 C ATOM 0 H LEU A 426 -3.702 8.034 -0.550 1.00 0.00 H new ATOM 0 HA LEU A 426 -4.116 5.323 -1.249 1.00 0.00 H new ATOM 0 HB2 LEU A 426 -5.591 7.760 -2.298 1.00 0.00 H new ATOM 0 HB3 LEU A 426 -6.205 6.125 -2.157 1.00 0.00 H new ATOM 0 HG LEU A 426 -5.292 7.452 0.357 1.00 0.00 H new ATOM 0 HD11 LEU A 426 -7.451 8.611 0.613 1.00 0.00 H new ATOM 0 HD12 LEU A 426 -6.514 9.256 -0.755 1.00 0.00 H new ATOM 0 HD13 LEU A 426 -7.885 8.162 -1.053 1.00 0.00 H new ATOM 0 HD21 LEU A 426 -7.238 6.237 1.264 1.00 0.00 H new ATOM 0 HD22 LEU A 426 -7.660 5.697 -0.378 1.00 0.00 H new ATOM 0 HD23 LEU A 426 -6.141 5.154 0.374 1.00 0.00 H new ATOM 952 N ARG A 427 -3.147 7.356 -3.650 1.00 0.00 N ATOM 953 CA ARG A 427 -2.623 7.400 -5.010 1.00 0.00 C ATOM 954 C ARG A 427 -1.430 6.461 -5.162 1.00 0.00 C ATOM 955 O ARG A 427 -1.297 5.769 -6.172 1.00 0.00 O ATOM 956 CB ARG A 427 -2.213 8.827 -5.375 1.00 0.00 C ATOM 957 CG ARG A 427 -3.382 9.705 -5.799 1.00 0.00 C ATOM 958 CD ARG A 427 -2.999 10.629 -6.945 1.00 0.00 C ATOM 959 NE ARG A 427 -4.098 10.812 -7.890 1.00 0.00 N ATOM 960 CZ ARG A 427 -5.125 11.633 -7.683 1.00 0.00 C ATOM 961 NH1 ARG A 427 -5.197 12.349 -6.567 1.00 0.00 N ATOM 962 NH2 ARG A 427 -6.081 11.740 -8.595 1.00 0.00 N ATOM 0 H ARG A 427 -3.128 8.251 -3.161 1.00 0.00 H new ATOM 0 HA ARG A 427 -3.411 7.072 -5.688 1.00 0.00 H new ATOM 0 HB2 ARG A 427 -1.717 9.284 -4.519 1.00 0.00 H new ATOM 0 HB3 ARG A 427 -1.484 8.791 -6.184 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -4.219 9.076 -6.102 1.00 0.00 H new ATOM 0 HG3 ARG A 427 -3.720 10.298 -4.949 1.00 0.00 H new ATOM 0 HD2 ARG A 427 -2.699 11.598 -6.545 1.00 0.00 H new ATOM 0 HD3 ARG A 427 -2.135 10.219 -7.468 1.00 0.00 H new ATOM 0 HE ARG A 427 -4.077 10.279 -8.760 1.00 0.00 H new ATOM 0 HH11 ARG A 427 -4.463 12.271 -5.863 1.00 0.00 H new ATOM 0 HH12 ARG A 427 -5.986 12.977 -6.414 1.00 0.00 H new ATOM 0 HH21 ARG A 427 -6.029 11.193 -9.455 1.00 0.00 H new ATOM 0 HH22 ARG A 427 -6.868 12.369 -8.437 1.00 0.00 H new ATOM 976 N ALA A 428 -0.565 6.443 -4.154 1.00 0.00 N ATOM 977 CA ALA A 428 0.615 5.588 -4.175 1.00 0.00 C ATOM 978 C ALA A 428 0.223 4.114 -4.173 1.00 0.00 C ATOM 979 O ALA A 428 0.833 3.299 -4.864 1.00 0.00 O ATOM 980 CB ALA A 428 1.514 5.900 -2.988 1.00 0.00 C ATOM 0 H ALA A 428 -0.659 7.011 -3.312 1.00 0.00 H new ATOM 0 HA ALA A 428 1.165 5.790 -5.094 1.00 0.00 H new ATOM 0 HB1 ALA A 428 2.391 5.254 -3.016 1.00 0.00 H new ATOM 0 HB2 ALA A 428 1.829 6.942 -3.034 1.00 0.00 H new ATOM 0 HB3 ALA A 428 0.966 5.727 -2.062 1.00 0.00 H new ATOM 986 N MET A 429 -0.799 3.781 -3.393 1.00 0.00 N ATOM 987 CA MET A 429 -1.274 2.406 -3.302 1.00 0.00 C ATOM 988 C MET A 429 -1.969 1.985 -4.593 1.00 0.00 C ATOM 989 O MET A 429 -1.821 0.851 -5.049 1.00 0.00 O ATOM 990 CB MET A 429 -2.234 2.251 -2.119 1.00 0.00 C ATOM 991 CG MET A 429 -1.547 1.829 -0.830 1.00 0.00 C ATOM 992 SD MET A 429 -1.369 3.188 0.343 1.00 0.00 S ATOM 993 CE MET A 429 -2.458 2.645 1.657 1.00 0.00 C ATOM 0 H MET A 429 -1.314 4.445 -2.815 1.00 0.00 H new ATOM 0 HA MET A 429 -0.410 1.760 -3.146 1.00 0.00 H new ATOM 0 HB2 MET A 429 -2.749 3.197 -1.954 1.00 0.00 H new ATOM 0 HB3 MET A 429 -2.995 1.514 -2.374 1.00 0.00 H new ATOM 0 HG2 MET A 429 -2.119 1.026 -0.365 1.00 0.00 H new ATOM 0 HG3 MET A 429 -0.562 1.425 -1.064 1.00 0.00 H new ATOM 0 HE1 MET A 429 -2.456 3.383 2.459 1.00 0.00 H new ATOM 0 HE2 MET A 429 -3.470 2.534 1.268 1.00 0.00 H new ATOM 0 HE3 MET A 429 -2.111 1.687 2.044 1.00 0.00 H new ATOM 1003 N GLN A 430 -2.726 2.908 -5.178 1.00 0.00 N ATOM 1004 CA GLN A 430 -3.442 2.635 -6.417 1.00 0.00 C ATOM 1005 C GLN A 430 -2.471 2.280 -7.539 1.00 0.00 C ATOM 1006 O GLN A 430 -2.689 1.327 -8.285 1.00 0.00 O ATOM 1007 CB GLN A 430 -4.286 3.845 -6.821 1.00 0.00 C ATOM 1008 CG GLN A 430 -5.290 3.547 -7.922 1.00 0.00 C ATOM 1009 CD GLN A 430 -6.614 4.256 -7.713 1.00 0.00 C ATOM 1010 OE1 GLN A 430 -7.110 4.945 -8.605 1.00 0.00 O ATOM 1011 NE2 GLN A 430 -7.192 4.093 -6.528 1.00 0.00 N ATOM 0 H GLN A 430 -2.859 3.851 -4.813 1.00 0.00 H new ATOM 0 HA GLN A 430 -4.100 1.783 -6.247 1.00 0.00 H new ATOM 0 HB2 GLN A 430 -4.819 4.214 -5.945 1.00 0.00 H new ATOM 0 HB3 GLN A 430 -3.624 4.645 -7.152 1.00 0.00 H new ATOM 0 HG2 GLN A 430 -4.870 3.846 -8.882 1.00 0.00 H new ATOM 0 HG3 GLN A 430 -5.462 2.472 -7.970 1.00 0.00 H new ATOM 0 HE21 GLN A 430 -6.745 3.513 -5.818 1.00 0.00 H new ATOM 0 HE22 GLN A 430 -8.083 4.548 -6.328 1.00 0.00 H new ATOM 1020 N ASN A 431 -1.397 3.056 -7.651 1.00 0.00 N ATOM 1021 CA ASN A 431 -0.391 2.824 -8.680 1.00 0.00 C ATOM 1022 C ASN A 431 0.376 1.535 -8.409 1.00 0.00 C ATOM 1023 O ASN A 431 0.689 0.781 -9.330 1.00 0.00 O ATOM 1024 CB ASN A 431 0.578 4.006 -8.751 1.00 0.00 C ATOM 1025 CG ASN A 431 0.163 5.035 -9.782 1.00 0.00 C ATOM 1026 OD1 ASN A 431 -0.100 6.192 -9.453 1.00 0.00 O ATOM 1027 ND2 ASN A 431 0.102 4.618 -11.043 1.00 0.00 N ATOM 0 H ASN A 431 -1.202 3.850 -7.042 1.00 0.00 H new ATOM 0 HA ASN A 431 -0.902 2.726 -9.638 1.00 0.00 H new ATOM 0 HB2 ASN A 431 0.639 4.481 -7.772 1.00 0.00 H new ATOM 0 HB3 ASN A 431 1.576 3.639 -8.990 1.00 0.00 H new ATOM 0 HD21 ASN A 431 -0.171 5.266 -11.782 1.00 0.00 H new ATOM 0 HD22 ASN A 431 0.328 3.650 -11.272 1.00 0.00 H new ATOM 1034 N PHE A 432 0.677 1.288 -7.138 1.00 0.00 N ATOM 1035 CA PHE A 432 1.407 0.089 -6.745 1.00 0.00 C ATOM 1036 C PHE A 432 0.538 -1.153 -6.909 1.00 0.00 C ATOM 1037 O PHE A 432 1.028 -2.223 -7.273 1.00 0.00 O ATOM 1038 CB PHE A 432 1.881 0.207 -5.295 1.00 0.00 C ATOM 1039 CG PHE A 432 2.685 -0.973 -4.827 1.00 0.00 C ATOM 1040 CD1 PHE A 432 3.998 -1.141 -5.238 1.00 0.00 C ATOM 1041 CD2 PHE A 432 2.127 -1.914 -3.976 1.00 0.00 C ATOM 1042 CE1 PHE A 432 4.740 -2.224 -4.809 1.00 0.00 C ATOM 1043 CE2 PHE A 432 2.864 -3.001 -3.543 1.00 0.00 C ATOM 1044 CZ PHE A 432 4.172 -3.155 -3.961 1.00 0.00 C ATOM 0 H PHE A 432 0.427 1.902 -6.363 1.00 0.00 H new ATOM 0 HA PHE A 432 2.276 -0.008 -7.396 1.00 0.00 H new ATOM 0 HB2 PHE A 432 2.482 1.110 -5.190 1.00 0.00 H new ATOM 0 HB3 PHE A 432 1.013 0.325 -4.646 1.00 0.00 H new ATOM 0 HD1 PHE A 432 4.446 -0.416 -5.902 1.00 0.00 H new ATOM 0 HD2 PHE A 432 1.105 -1.797 -3.647 1.00 0.00 H new ATOM 0 HE1 PHE A 432 5.762 -2.343 -5.136 1.00 0.00 H new ATOM 0 HE2 PHE A 432 2.418 -3.728 -2.880 1.00 0.00 H new ATOM 0 HZ PHE A 432 4.750 -4.003 -3.625 1.00 0.00 H new ATOM 1054 N LEU A 433 -0.754 -1.005 -6.638 1.00 0.00 N ATOM 1055 CA LEU A 433 -1.693 -2.114 -6.756 1.00 0.00 C ATOM 1056 C LEU A 433 -2.125 -2.310 -8.206 1.00 0.00 C ATOM 1057 O LEU A 433 -2.415 -3.427 -8.632 1.00 0.00 O ATOM 1058 CB LEU A 433 -2.921 -1.868 -5.875 1.00 0.00 C ATOM 1059 CG LEU A 433 -2.712 -2.136 -4.384 1.00 0.00 C ATOM 1060 CD1 LEU A 433 -3.566 -1.193 -3.549 1.00 0.00 C ATOM 1061 CD2 LEU A 433 -3.036 -3.584 -4.054 1.00 0.00 C ATOM 0 H LEU A 433 -1.175 -0.127 -6.335 1.00 0.00 H new ATOM 0 HA LEU A 433 -1.189 -3.020 -6.420 1.00 0.00 H new ATOM 0 HB2 LEU A 433 -3.239 -0.833 -6.002 1.00 0.00 H new ATOM 0 HB3 LEU A 433 -3.737 -2.497 -6.231 1.00 0.00 H new ATOM 0 HG LEU A 433 -1.664 -1.955 -4.143 1.00 0.00 H new ATOM 0 HD11 LEU A 433 -3.405 -1.397 -2.490 1.00 0.00 H new ATOM 0 HD12 LEU A 433 -3.288 -0.162 -3.766 1.00 0.00 H new ATOM 0 HD13 LEU A 433 -4.618 -1.344 -3.792 1.00 0.00 H new ATOM 0 HD21 LEU A 433 -2.882 -3.758 -2.989 1.00 0.00 H new ATOM 0 HD22 LEU A 433 -4.075 -3.792 -4.309 1.00 0.00 H new ATOM 0 HD23 LEU A 433 -2.383 -4.243 -4.627 1.00 0.00 H new ATOM 1073 N GLN A 434 -2.164 -1.216 -8.959 1.00 0.00 N ATOM 1074 CA GLN A 434 -2.561 -1.266 -10.361 1.00 0.00 C ATOM 1075 C GLN A 434 -1.498 -1.964 -11.203 1.00 0.00 C ATOM 1076 O GLN A 434 -1.807 -2.575 -12.227 1.00 0.00 O ATOM 1077 CB GLN A 434 -2.803 0.147 -10.895 1.00 0.00 C ATOM 1078 CG GLN A 434 -4.163 0.715 -10.520 1.00 0.00 C ATOM 1079 CD GLN A 434 -5.236 0.372 -11.535 1.00 0.00 C ATOM 1080 OE1 GLN A 434 -5.249 0.903 -12.644 1.00 0.00 O ATOM 1081 NE2 GLN A 434 -6.146 -0.520 -11.157 1.00 0.00 N ATOM 0 H GLN A 434 -1.925 -0.283 -8.622 1.00 0.00 H new ATOM 0 HA GLN A 434 -3.487 -1.837 -10.430 1.00 0.00 H new ATOM 0 HB2 GLN A 434 -2.025 0.808 -10.514 1.00 0.00 H new ATOM 0 HB3 GLN A 434 -2.710 0.137 -11.981 1.00 0.00 H new ATOM 0 HG2 GLN A 434 -4.456 0.332 -9.543 1.00 0.00 H new ATOM 0 HG3 GLN A 434 -4.088 1.798 -10.428 1.00 0.00 H new ATOM 0 HE21 GLN A 434 -6.097 -0.936 -10.227 1.00 0.00 H new ATOM 0 HE22 GLN A 434 -6.893 -0.789 -11.797 1.00 0.00 H new ATOM 1090 N LEU A 435 -0.245 -1.869 -10.770 1.00 0.00 N ATOM 1091 CA LEU A 435 0.863 -2.491 -11.485 1.00 0.00 C ATOM 1092 C LEU A 435 0.649 -3.998 -11.618 1.00 0.00 C ATOM 1093 O LEU A 435 -0.020 -4.612 -10.787 1.00 0.00 O ATOM 1094 CB LEU A 435 2.184 -2.213 -10.765 1.00 0.00 C ATOM 1095 CG LEU A 435 2.750 -0.807 -10.967 1.00 0.00 C ATOM 1096 CD1 LEU A 435 3.679 -0.435 -9.822 1.00 0.00 C ATOM 1097 CD2 LEU A 435 3.478 -0.714 -12.299 1.00 0.00 C ATOM 0 H LEU A 435 0.028 -1.366 -9.926 1.00 0.00 H new ATOM 0 HA LEU A 435 0.905 -2.059 -12.485 1.00 0.00 H new ATOM 0 HB2 LEU A 435 2.040 -2.380 -9.698 1.00 0.00 H new ATOM 0 HB3 LEU A 435 2.924 -2.938 -11.104 1.00 0.00 H new ATOM 0 HG LEU A 435 1.921 -0.100 -10.978 1.00 0.00 H new ATOM 0 HD11 LEU A 435 4.072 0.569 -9.984 1.00 0.00 H new ATOM 0 HD12 LEU A 435 3.127 -0.462 -8.882 1.00 0.00 H new ATOM 0 HD13 LEU A 435 4.505 -1.145 -9.778 1.00 0.00 H new ATOM 0 HD21 LEU A 435 3.875 0.293 -12.427 1.00 0.00 H new ATOM 0 HD22 LEU A 435 4.298 -1.432 -12.316 1.00 0.00 H new ATOM 0 HD23 LEU A 435 2.784 -0.936 -13.109 1.00 0.00 H new ATOM 1109 N PRO A 436 1.217 -4.613 -12.669 1.00 0.00 N ATOM 1110 CA PRO A 436 1.085 -6.055 -12.905 1.00 0.00 C ATOM 1111 C PRO A 436 1.465 -6.880 -11.679 1.00 0.00 C ATOM 1112 O PRO A 436 2.327 -6.483 -10.896 1.00 0.00 O ATOM 1113 CB PRO A 436 2.063 -6.318 -14.053 1.00 0.00 C ATOM 1114 CG PRO A 436 2.175 -5.015 -14.764 1.00 0.00 C ATOM 1115 CD PRO A 436 2.031 -3.955 -13.707 1.00 0.00 C ATOM 0 HA PRO A 436 0.057 -6.339 -13.130 1.00 0.00 H new ATOM 0 HB2 PRO A 436 3.032 -6.649 -13.679 1.00 0.00 H new ATOM 0 HB3 PRO A 436 1.693 -7.100 -14.716 1.00 0.00 H new ATOM 0 HG2 PRO A 436 3.134 -4.930 -15.274 1.00 0.00 H new ATOM 0 HG3 PRO A 436 1.400 -4.917 -15.524 1.00 0.00 H new ATOM 0 HD2 PRO A 436 3.000 -3.641 -13.318 1.00 0.00 H new ATOM 0 HD3 PRO A 436 1.540 -3.063 -14.097 1.00 0.00 H new ATOM 1123 N GLU A 437 0.817 -8.029 -11.523 1.00 0.00 N ATOM 1124 CA GLU A 437 1.086 -8.910 -10.393 1.00 0.00 C ATOM 1125 C GLU A 437 2.537 -9.378 -10.402 1.00 0.00 C ATOM 1126 O GLU A 437 3.139 -9.589 -9.350 1.00 0.00 O ATOM 1127 CB GLU A 437 0.149 -10.118 -10.426 1.00 0.00 C ATOM 1128 CG GLU A 437 0.173 -10.943 -9.148 1.00 0.00 C ATOM 1129 CD GLU A 437 -1.063 -11.806 -8.988 1.00 0.00 C ATOM 1130 OE1 GLU A 437 -2.182 -11.278 -9.163 1.00 0.00 O ATOM 1131 OE2 GLU A 437 -0.914 -13.008 -8.688 1.00 0.00 O ATOM 0 H GLU A 437 0.102 -8.372 -12.165 1.00 0.00 H new ATOM 0 HA GLU A 437 0.910 -8.347 -9.476 1.00 0.00 H new ATOM 0 HB2 GLU A 437 -0.869 -9.773 -10.606 1.00 0.00 H new ATOM 0 HB3 GLU A 437 0.423 -10.757 -11.266 1.00 0.00 H new ATOM 0 HG2 GLU A 437 1.058 -11.579 -9.147 1.00 0.00 H new ATOM 0 HG3 GLU A 437 0.259 -10.276 -8.291 1.00 0.00 H new ATOM 1138 N ALA A 438 3.094 -9.539 -11.598 1.00 0.00 N ATOM 1139 CA ALA A 438 4.475 -9.982 -11.746 1.00 0.00 C ATOM 1140 C ALA A 438 5.440 -8.994 -11.097 1.00 0.00 C ATOM 1141 O ALA A 438 6.437 -9.390 -10.494 1.00 0.00 O ATOM 1142 CB ALA A 438 4.815 -10.167 -13.216 1.00 0.00 C ATOM 0 H ALA A 438 2.609 -9.369 -12.479 1.00 0.00 H new ATOM 0 HA ALA A 438 4.580 -10.940 -11.237 1.00 0.00 H new ATOM 0 HB1 ALA A 438 5.849 -10.498 -13.311 1.00 0.00 H new ATOM 0 HB2 ALA A 438 4.153 -10.916 -13.651 1.00 0.00 H new ATOM 0 HB3 ALA A 438 4.687 -9.220 -13.741 1.00 0.00 H new ATOM 1148 N GLU A 439 5.136 -7.706 -11.227 1.00 0.00 N ATOM 1149 CA GLU A 439 5.976 -6.662 -10.653 1.00 0.00 C ATOM 1150 C GLU A 439 5.885 -6.665 -9.131 1.00 0.00 C ATOM 1151 O GLU A 439 6.886 -6.482 -8.439 1.00 0.00 O ATOM 1152 CB GLU A 439 5.566 -5.293 -11.198 1.00 0.00 C ATOM 1153 CG GLU A 439 5.941 -5.081 -12.656 1.00 0.00 C ATOM 1154 CD GLU A 439 6.322 -3.644 -12.957 1.00 0.00 C ATOM 1155 OE1 GLU A 439 5.862 -2.743 -12.226 1.00 0.00 O ATOM 1156 OE2 GLU A 439 7.082 -3.420 -13.922 1.00 0.00 O ATOM 0 H GLU A 439 4.315 -7.361 -11.724 1.00 0.00 H new ATOM 0 HA GLU A 439 7.009 -6.864 -10.937 1.00 0.00 H new ATOM 0 HB2 GLU A 439 4.488 -5.176 -11.088 1.00 0.00 H new ATOM 0 HB3 GLU A 439 6.035 -4.516 -10.594 1.00 0.00 H new ATOM 0 HG2 GLU A 439 6.774 -5.735 -12.912 1.00 0.00 H new ATOM 0 HG3 GLU A 439 5.102 -5.371 -13.289 1.00 0.00 H new ATOM 1163 N ARG A 440 4.677 -6.872 -8.616 1.00 0.00 N ATOM 1164 CA ARG A 440 4.456 -6.897 -7.174 1.00 0.00 C ATOM 1165 C ARG A 440 5.277 -8.001 -6.517 1.00 0.00 C ATOM 1166 O ARG A 440 5.842 -7.809 -5.439 1.00 0.00 O ATOM 1167 CB ARG A 440 2.970 -7.101 -6.871 1.00 0.00 C ATOM 1168 CG ARG A 440 2.193 -5.801 -6.733 1.00 0.00 C ATOM 1169 CD ARG A 440 0.745 -5.970 -7.164 1.00 0.00 C ATOM 1170 NE ARG A 440 0.085 -7.064 -6.455 1.00 0.00 N ATOM 1171 CZ ARG A 440 -1.038 -7.645 -6.870 1.00 0.00 C ATOM 1172 NH1 ARG A 440 -1.630 -7.242 -7.986 1.00 0.00 N ATOM 1173 NH2 ARG A 440 -1.570 -8.634 -6.165 1.00 0.00 N ATOM 0 H ARG A 440 3.837 -7.025 -9.175 1.00 0.00 H new ATOM 0 HA ARG A 440 4.776 -5.939 -6.764 1.00 0.00 H new ATOM 0 HB2 ARG A 440 2.524 -7.698 -7.666 1.00 0.00 H new ATOM 0 HB3 ARG A 440 2.871 -7.673 -5.949 1.00 0.00 H new ATOM 0 HG2 ARG A 440 2.229 -5.463 -5.697 1.00 0.00 H new ATOM 0 HG3 ARG A 440 2.666 -5.027 -7.338 1.00 0.00 H new ATOM 0 HD2 ARG A 440 0.203 -5.042 -6.983 1.00 0.00 H new ATOM 0 HD3 ARG A 440 0.706 -6.158 -8.237 1.00 0.00 H new ATOM 0 HE ARG A 440 0.510 -7.402 -5.592 1.00 0.00 H new ATOM 0 HH11 ARG A 440 -1.225 -6.482 -8.532 1.00 0.00 H new ATOM 0 HH12 ARG A 440 -2.491 -7.692 -8.298 1.00 0.00 H new ATOM 0 HH21 ARG A 440 -1.119 -8.948 -5.306 1.00 0.00 H new ATOM 0 HH22 ARG A 440 -2.431 -9.080 -6.482 1.00 0.00 H new ATOM 1187 N ASP A 441 5.341 -9.155 -7.172 1.00 0.00 N ATOM 1188 CA ASP A 441 6.095 -10.289 -6.650 1.00 0.00 C ATOM 1189 C ASP A 441 7.583 -9.962 -6.569 1.00 0.00 C ATOM 1190 O ASP A 441 8.269 -10.374 -5.633 1.00 0.00 O ATOM 1191 CB ASP A 441 5.880 -11.522 -7.530 1.00 0.00 C ATOM 1192 CG ASP A 441 4.735 -12.388 -7.042 1.00 0.00 C ATOM 1193 OD1 ASP A 441 4.747 -12.770 -5.852 1.00 0.00 O ATOM 1194 OD2 ASP A 441 3.828 -12.682 -7.848 1.00 0.00 O ATOM 0 H ASP A 441 4.880 -9.330 -8.065 1.00 0.00 H new ATOM 0 HA ASP A 441 5.732 -10.502 -5.644 1.00 0.00 H new ATOM 0 HB2 ASP A 441 5.681 -11.204 -8.553 1.00 0.00 H new ATOM 0 HB3 ASP A 441 6.795 -12.113 -7.552 1.00 0.00 H new ATOM 1199 N ARG A 442 8.075 -9.217 -7.553 1.00 0.00 N ATOM 1200 CA ARG A 442 9.481 -8.833 -7.592 1.00 0.00 C ATOM 1201 C ARG A 442 9.806 -7.843 -6.479 1.00 0.00 C ATOM 1202 O ARG A 442 10.852 -7.936 -5.836 1.00 0.00 O ATOM 1203 CB ARG A 442 9.827 -8.222 -8.952 1.00 0.00 C ATOM 1204 CG ARG A 442 11.206 -8.616 -9.462 1.00 0.00 C ATOM 1205 CD ARG A 442 11.115 -9.463 -10.722 1.00 0.00 C ATOM 1206 NE ARG A 442 12.434 -9.791 -11.257 1.00 0.00 N ATOM 1207 CZ ARG A 442 12.648 -10.199 -12.506 1.00 0.00 C ATOM 1208 NH1 ARG A 442 11.633 -10.330 -13.351 1.00 0.00 N ATOM 1209 NH2 ARG A 442 13.879 -10.476 -12.910 1.00 0.00 N ATOM 0 H ARG A 442 7.521 -8.867 -8.334 1.00 0.00 H new ATOM 0 HA ARG A 442 10.081 -9.730 -7.441 1.00 0.00 H new ATOM 0 HB2 ARG A 442 9.077 -8.530 -9.681 1.00 0.00 H new ATOM 0 HB3 ARG A 442 9.772 -7.136 -8.878 1.00 0.00 H new ATOM 0 HG2 ARG A 442 11.789 -7.718 -9.668 1.00 0.00 H new ATOM 0 HG3 ARG A 442 11.736 -9.170 -8.688 1.00 0.00 H new ATOM 0 HD2 ARG A 442 10.574 -10.383 -10.502 1.00 0.00 H new ATOM 0 HD3 ARG A 442 10.540 -8.928 -11.478 1.00 0.00 H new ATOM 0 HE ARG A 442 13.239 -9.702 -10.637 1.00 0.00 H new ATOM 0 HH11 ARG A 442 10.684 -10.118 -13.045 1.00 0.00 H new ATOM 0 HH12 ARG A 442 11.802 -10.643 -14.307 1.00 0.00 H new ATOM 0 HH21 ARG A 442 14.662 -10.377 -12.264 1.00 0.00 H new ATOM 0 HH22 ARG A 442 14.043 -10.789 -13.867 1.00 0.00 H new ATOM 1223 N ILE A 443 8.902 -6.894 -6.255 1.00 0.00 N ATOM 1224 CA ILE A 443 9.092 -5.887 -5.219 1.00 0.00 C ATOM 1225 C ILE A 443 8.991 -6.505 -3.828 1.00 0.00 C ATOM 1226 O ILE A 443 9.733 -6.136 -2.918 1.00 0.00 O ATOM 1227 CB ILE A 443 8.058 -4.749 -5.340 1.00 0.00 C ATOM 1228 CG1 ILE A 443 8.035 -4.199 -6.767 1.00 0.00 C ATOM 1229 CG2 ILE A 443 8.366 -3.641 -4.346 1.00 0.00 C ATOM 1230 CD1 ILE A 443 6.707 -3.589 -7.158 1.00 0.00 C ATOM 0 H ILE A 443 8.031 -6.802 -6.778 1.00 0.00 H new ATOM 0 HA ILE A 443 10.091 -5.474 -5.360 1.00 0.00 H new ATOM 0 HB ILE A 443 7.072 -5.152 -5.109 1.00 0.00 H new ATOM 0 HG12 ILE A 443 8.816 -3.446 -6.870 1.00 0.00 H new ATOM 0 HG13 ILE A 443 8.275 -5.004 -7.462 1.00 0.00 H new ATOM 0 HG21 ILE A 443 7.626 -2.847 -4.446 1.00 0.00 H new ATOM 0 HG22 ILE A 443 8.334 -4.042 -3.333 1.00 0.00 H new ATOM 0 HG23 ILE A 443 9.359 -3.239 -4.546 1.00 0.00 H new ATOM 0 HD11 ILE A 443 6.764 -3.220 -8.182 1.00 0.00 H new ATOM 0 HD12 ILE A 443 5.925 -4.345 -7.088 1.00 0.00 H new ATOM 0 HD13 ILE A 443 6.475 -2.762 -6.487 1.00 0.00 H new ATOM 1242 N TYR A 444 8.067 -7.449 -3.671 1.00 0.00 N ATOM 1243 CA TYR A 444 7.869 -8.119 -2.391 1.00 0.00 C ATOM 1244 C TYR A 444 9.077 -8.978 -2.033 1.00 0.00 C ATOM 1245 O TYR A 444 9.424 -9.121 -0.861 1.00 0.00 O ATOM 1246 CB TYR A 444 6.608 -8.984 -2.435 1.00 0.00 C ATOM 1247 CG TYR A 444 5.324 -8.192 -2.355 1.00 0.00 C ATOM 1248 CD1 TYR A 444 5.180 -7.152 -1.445 1.00 0.00 C ATOM 1249 CD2 TYR A 444 4.252 -8.483 -3.191 1.00 0.00 C ATOM 1250 CE1 TYR A 444 4.007 -6.426 -1.369 1.00 0.00 C ATOM 1251 CE2 TYR A 444 3.076 -7.761 -3.124 1.00 0.00 C ATOM 1252 CZ TYR A 444 2.959 -6.734 -2.211 1.00 0.00 C ATOM 1253 OH TYR A 444 1.790 -6.013 -2.138 1.00 0.00 O ATOM 0 H TYR A 444 7.445 -7.766 -4.414 1.00 0.00 H new ATOM 0 HA TYR A 444 7.751 -7.354 -1.623 1.00 0.00 H new ATOM 0 HB2 TYR A 444 6.609 -9.565 -3.357 1.00 0.00 H new ATOM 0 HB3 TYR A 444 6.637 -9.696 -1.610 1.00 0.00 H new ATOM 0 HD1 TYR A 444 5.999 -6.907 -0.786 1.00 0.00 H new ATOM 0 HD2 TYR A 444 4.340 -9.288 -3.906 1.00 0.00 H new ATOM 0 HE1 TYR A 444 3.911 -5.622 -0.654 1.00 0.00 H new ATOM 0 HE2 TYR A 444 2.254 -7.999 -3.782 1.00 0.00 H new ATOM 0 HH TYR A 444 1.694 -5.635 -1.239 1.00 0.00 H new ATOM 1263 N GLN A 445 9.714 -9.547 -3.052 1.00 0.00 N ATOM 1264 CA GLN A 445 10.884 -10.393 -2.845 1.00 0.00 C ATOM 1265 C GLN A 445 12.174 -9.577 -2.912 1.00 0.00 C ATOM 1266 O GLN A 445 13.219 -10.013 -2.429 1.00 0.00 O ATOM 1267 CB GLN A 445 10.919 -11.512 -3.888 1.00 0.00 C ATOM 1268 CG GLN A 445 11.300 -12.866 -3.311 1.00 0.00 C ATOM 1269 CD GLN A 445 12.737 -13.244 -3.607 1.00 0.00 C ATOM 1270 OE1 GLN A 445 13.670 -12.613 -3.111 1.00 0.00 O ATOM 1271 NE2 GLN A 445 12.924 -14.276 -4.421 1.00 0.00 N ATOM 0 H GLN A 445 9.440 -9.438 -4.028 1.00 0.00 H new ATOM 0 HA GLN A 445 10.809 -10.832 -1.850 1.00 0.00 H new ATOM 0 HB2 GLN A 445 9.939 -11.589 -4.360 1.00 0.00 H new ATOM 0 HB3 GLN A 445 11.629 -11.246 -4.671 1.00 0.00 H new ATOM 0 HG2 GLN A 445 11.147 -12.853 -2.232 1.00 0.00 H new ATOM 0 HG3 GLN A 445 10.637 -13.629 -3.718 1.00 0.00 H new ATOM 0 HE21 GLN A 445 12.121 -14.771 -4.810 1.00 0.00 H new ATOM 0 HE22 GLN A 445 13.870 -14.574 -4.658 1.00 0.00 H new ATOM 1280 N ASP A 446 12.097 -8.392 -3.516 1.00 0.00 N ATOM 1281 CA ASP A 446 13.261 -7.521 -3.645 1.00 0.00 C ATOM 1282 C ASP A 446 13.925 -7.285 -2.291 1.00 0.00 C ATOM 1283 O ASP A 446 13.334 -6.679 -1.397 1.00 0.00 O ATOM 1284 CB ASP A 446 12.855 -6.184 -4.269 1.00 0.00 C ATOM 1285 CG ASP A 446 13.837 -5.716 -5.325 1.00 0.00 C ATOM 1286 OD1 ASP A 446 15.040 -5.606 -5.010 1.00 0.00 O ATOM 1287 OD2 ASP A 446 13.402 -5.460 -6.468 1.00 0.00 O ATOM 0 H ASP A 446 11.241 -8.015 -3.923 1.00 0.00 H new ATOM 0 HA ASP A 446 13.981 -8.016 -4.296 1.00 0.00 H new ATOM 0 HB2 ASP A 446 11.865 -6.280 -4.715 1.00 0.00 H new ATOM 0 HB3 ASP A 446 12.780 -5.429 -3.486 1.00 0.00 H new ATOM 1292 N GLU A 447 15.156 -7.766 -2.150 1.00 0.00 N ATOM 1293 CA GLU A 447 15.902 -7.607 -0.906 1.00 0.00 C ATOM 1294 C GLU A 447 17.144 -6.749 -1.124 1.00 0.00 C ATOM 1295 O GLU A 447 17.382 -5.786 -0.394 1.00 0.00 O ATOM 1296 CB GLU A 447 16.303 -8.974 -0.351 1.00 0.00 C ATOM 1297 CG GLU A 447 15.217 -9.635 0.481 1.00 0.00 C ATOM 1298 CD GLU A 447 15.355 -9.342 1.962 1.00 0.00 C ATOM 1299 OE1 GLU A 447 16.018 -8.342 2.310 1.00 0.00 O ATOM 1300 OE2 GLU A 447 14.801 -10.112 2.775 1.00 0.00 O ATOM 0 H GLU A 447 15.658 -8.269 -2.881 1.00 0.00 H new ATOM 0 HA GLU A 447 15.257 -7.105 -0.185 1.00 0.00 H new ATOM 0 HB2 GLU A 447 16.564 -9.631 -1.180 1.00 0.00 H new ATOM 0 HB3 GLU A 447 17.199 -8.860 0.260 1.00 0.00 H new ATOM 0 HG2 GLU A 447 14.241 -9.292 0.136 1.00 0.00 H new ATOM 0 HG3 GLU A 447 15.250 -10.713 0.323 1.00 0.00 H new ATOM 1307 N ARG A 448 17.931 -7.104 -2.133 1.00 0.00 N ATOM 1308 CA ARG A 448 19.149 -6.369 -2.450 1.00 0.00 C ATOM 1309 C ARG A 448 18.827 -5.094 -3.221 1.00 0.00 C ATOM 1310 O ARG A 448 18.137 -5.129 -4.239 1.00 0.00 O ATOM 1311 CB ARG A 448 20.104 -7.245 -3.262 1.00 0.00 C ATOM 1312 CG ARG A 448 19.486 -7.801 -4.535 1.00 0.00 C ATOM 1313 CD ARG A 448 19.742 -9.294 -4.676 1.00 0.00 C ATOM 1314 NE ARG A 448 19.569 -9.754 -6.051 1.00 0.00 N ATOM 1315 CZ ARG A 448 20.050 -10.904 -6.514 1.00 0.00 C ATOM 1316 NH1 ARG A 448 20.735 -11.715 -5.716 1.00 0.00 N ATOM 1317 NH2 ARG A 448 19.847 -11.247 -7.779 1.00 0.00 N ATOM 0 H ARG A 448 17.747 -7.898 -2.746 1.00 0.00 H new ATOM 0 HA ARG A 448 19.632 -6.094 -1.513 1.00 0.00 H new ATOM 0 HB2 ARG A 448 20.987 -6.661 -3.522 1.00 0.00 H new ATOM 0 HB3 ARG A 448 20.441 -8.074 -2.640 1.00 0.00 H new ATOM 0 HG2 ARG A 448 18.412 -7.614 -4.530 1.00 0.00 H new ATOM 0 HG3 ARG A 448 19.897 -7.278 -5.398 1.00 0.00 H new ATOM 0 HD2 ARG A 448 20.755 -9.521 -4.343 1.00 0.00 H new ATOM 0 HD3 ARG A 448 19.062 -9.841 -4.023 1.00 0.00 H new ATOM 0 HE ARG A 448 19.048 -9.158 -6.694 1.00 0.00 H new ATOM 0 HH11 ARG A 448 20.895 -11.457 -4.742 1.00 0.00 H new ATOM 0 HH12 ARG A 448 21.101 -12.596 -6.077 1.00 0.00 H new ATOM 0 HH21 ARG A 448 19.322 -10.629 -8.397 1.00 0.00 H new ATOM 0 HH22 ARG A 448 20.216 -12.129 -8.134 1.00 0.00 H new ATOM 1331 N GLU A 449 19.333 -3.968 -2.728 1.00 0.00 N ATOM 1332 CA GLU A 449 19.101 -2.679 -3.369 1.00 0.00 C ATOM 1333 C GLU A 449 20.141 -2.399 -4.455 1.00 0.00 C ATOM 1334 O GLU A 449 20.174 -1.308 -5.025 1.00 0.00 O ATOM 1335 CB GLU A 449 19.125 -1.559 -2.327 1.00 0.00 C ATOM 1336 CG GLU A 449 18.112 -0.457 -2.594 1.00 0.00 C ATOM 1337 CD GLU A 449 18.165 0.645 -1.556 1.00 0.00 C ATOM 1338 OE1 GLU A 449 19.145 1.420 -1.562 1.00 0.00 O ATOM 1339 OE2 GLU A 449 17.227 0.736 -0.738 1.00 0.00 O ATOM 0 H GLU A 449 19.907 -3.922 -1.886 1.00 0.00 H new ATOM 0 HA GLU A 449 18.119 -2.715 -3.841 1.00 0.00 H new ATOM 0 HB2 GLU A 449 18.934 -1.986 -1.343 1.00 0.00 H new ATOM 0 HB3 GLU A 449 20.124 -1.123 -2.297 1.00 0.00 H new ATOM 0 HG2 GLU A 449 18.295 -0.031 -3.581 1.00 0.00 H new ATOM 0 HG3 GLU A 449 17.110 -0.886 -2.613 1.00 0.00 H new ATOM 1346 N ARG A 450 20.987 -3.386 -4.740 1.00 0.00 N ATOM 1347 CA ARG A 450 22.022 -3.235 -5.758 1.00 0.00 C ATOM 1348 C ARG A 450 21.461 -3.488 -7.157 1.00 0.00 C ATOM 1349 O ARG A 450 22.070 -3.107 -8.156 1.00 0.00 O ATOM 1350 CB ARG A 450 23.183 -4.191 -5.480 1.00 0.00 C ATOM 1351 CG ARG A 450 23.921 -3.891 -4.187 1.00 0.00 C ATOM 1352 CD ARG A 450 24.984 -4.938 -3.896 1.00 0.00 C ATOM 1353 NE ARG A 450 26.042 -4.941 -4.904 1.00 0.00 N ATOM 1354 CZ ARG A 450 27.246 -5.477 -4.712 1.00 0.00 C ATOM 1355 NH1 ARG A 450 27.549 -6.051 -3.555 1.00 0.00 N ATOM 1356 NH2 ARG A 450 28.148 -5.436 -5.683 1.00 0.00 N ATOM 0 H ARG A 450 20.976 -4.297 -4.281 1.00 0.00 H new ATOM 0 HA ARG A 450 22.386 -2.208 -5.717 1.00 0.00 H new ATOM 0 HB2 ARG A 450 22.802 -5.211 -5.443 1.00 0.00 H new ATOM 0 HB3 ARG A 450 23.888 -4.144 -6.310 1.00 0.00 H new ATOM 0 HG2 ARG A 450 24.386 -2.907 -4.252 1.00 0.00 H new ATOM 0 HG3 ARG A 450 23.210 -3.854 -3.361 1.00 0.00 H new ATOM 0 HD2 ARG A 450 25.419 -4.749 -2.915 1.00 0.00 H new ATOM 0 HD3 ARG A 450 24.520 -5.923 -3.855 1.00 0.00 H new ATOM 0 HE ARG A 450 25.847 -4.508 -5.807 1.00 0.00 H new ATOM 0 HH11 ARG A 450 26.858 -6.084 -2.806 1.00 0.00 H new ATOM 0 HH12 ARG A 450 28.473 -6.460 -3.415 1.00 0.00 H new ATOM 0 HH21 ARG A 450 27.919 -4.995 -6.574 1.00 0.00 H new ATOM 0 HH22 ARG A 450 29.071 -5.846 -5.539 1.00 0.00 H new ATOM 1370 N SER A 451 20.299 -4.133 -7.223 1.00 0.00 N ATOM 1371 CA SER A 451 19.662 -4.435 -8.501 1.00 0.00 C ATOM 1372 C SER A 451 19.486 -3.171 -9.338 1.00 0.00 C ATOM 1373 O SER A 451 20.172 -2.980 -10.343 1.00 0.00 O ATOM 1374 CB SER A 451 18.304 -5.101 -8.273 1.00 0.00 C ATOM 1375 OG SER A 451 18.455 -6.376 -7.673 1.00 0.00 O ATOM 0 H SER A 451 19.780 -4.456 -6.407 1.00 0.00 H new ATOM 0 HA SER A 451 20.310 -5.121 -9.046 1.00 0.00 H new ATOM 0 HB2 SER A 451 17.687 -4.467 -7.636 1.00 0.00 H new ATOM 0 HB3 SER A 451 17.781 -5.203 -9.224 1.00 0.00 H new ATOM 0 HG SER A 451 17.573 -6.780 -7.536 1.00 0.00 H new ATOM 1381 N LEU A 452 18.564 -2.312 -8.918 1.00 0.00 N ATOM 1382 CA LEU A 452 18.301 -1.066 -9.630 1.00 0.00 C ATOM 1383 C LEU A 452 17.576 -0.068 -8.731 1.00 0.00 C ATOM 1384 O LEU A 452 16.346 -0.040 -8.683 1.00 0.00 O ATOM 1385 CB LEU A 452 17.469 -1.338 -10.884 1.00 0.00 C ATOM 1386 CG LEU A 452 17.811 -0.463 -12.090 1.00 0.00 C ATOM 1387 CD1 LEU A 452 19.179 -0.828 -12.643 1.00 0.00 C ATOM 1388 CD2 LEU A 452 16.745 -0.600 -13.167 1.00 0.00 C ATOM 0 H LEU A 452 17.987 -2.455 -8.089 1.00 0.00 H new ATOM 0 HA LEU A 452 19.258 -0.635 -9.923 1.00 0.00 H new ATOM 0 HB2 LEU A 452 17.595 -2.383 -11.165 1.00 0.00 H new ATOM 0 HB3 LEU A 452 16.416 -1.198 -10.640 1.00 0.00 H new ATOM 0 HG LEU A 452 17.839 0.577 -11.764 1.00 0.00 H new ATOM 0 HD11 LEU A 452 19.405 -0.195 -13.501 1.00 0.00 H new ATOM 0 HD12 LEU A 452 19.935 -0.678 -11.872 1.00 0.00 H new ATOM 0 HD13 LEU A 452 19.179 -1.873 -12.953 1.00 0.00 H new ATOM 0 HD21 LEU A 452 17.005 0.030 -14.018 1.00 0.00 H new ATOM 0 HD22 LEU A 452 16.685 -1.639 -13.490 1.00 0.00 H new ATOM 0 HD23 LEU A 452 15.781 -0.288 -12.766 1.00 0.00 H new ATOM 1400 N ASN A 453 18.348 0.748 -8.022 1.00 0.00 N ATOM 1401 CA ASN A 453 17.780 1.749 -7.125 1.00 0.00 C ATOM 1402 C ASN A 453 18.829 2.784 -6.731 1.00 0.00 C ATOM 1403 O ASN A 453 19.873 2.444 -6.176 1.00 0.00 O ATOM 1404 CB ASN A 453 17.212 1.076 -5.873 1.00 0.00 C ATOM 1405 CG ASN A 453 15.854 1.630 -5.485 1.00 0.00 C ATOM 1406 OD1 ASN A 453 14.865 1.425 -6.188 1.00 0.00 O ATOM 1407 ND2 ASN A 453 15.802 2.336 -4.363 1.00 0.00 N ATOM 0 H ASN A 453 19.368 0.737 -8.050 1.00 0.00 H new ATOM 0 HA ASN A 453 16.974 2.260 -7.652 1.00 0.00 H new ATOM 0 HB2 ASN A 453 17.128 0.003 -6.047 1.00 0.00 H new ATOM 0 HB3 ASN A 453 17.907 1.211 -5.044 1.00 0.00 H new ATOM 0 HD21 ASN A 453 14.916 2.734 -4.052 1.00 0.00 H new ATOM 0 HD22 ASN A 453 16.648 2.480 -3.812 1.00 0.00 H new ATOM 1414 N ALA A 454 18.544 4.049 -7.023 1.00 0.00 N ATOM 1415 CA ALA A 454 19.462 5.134 -6.699 1.00 0.00 C ATOM 1416 C ALA A 454 19.628 5.281 -5.191 1.00 0.00 C ATOM 1417 O ALA A 454 18.689 5.057 -4.428 1.00 0.00 O ATOM 1418 CB ALA A 454 18.972 6.439 -7.308 1.00 0.00 C ATOM 0 H ALA A 454 17.684 4.348 -7.484 1.00 0.00 H new ATOM 0 HA ALA A 454 20.436 4.891 -7.123 1.00 0.00 H new ATOM 0 HB1 ALA A 454 19.667 7.241 -7.058 1.00 0.00 H new ATOM 0 HB2 ALA A 454 18.912 6.335 -8.391 1.00 0.00 H new ATOM 0 HB3 ALA A 454 17.985 6.678 -6.911 1.00 0.00 H new ATOM 1424 N ALA A 455 20.830 5.659 -4.767 1.00 0.00 N ATOM 1425 CA ALA A 455 21.119 5.837 -3.349 1.00 0.00 C ATOM 1426 C ALA A 455 21.718 7.213 -3.080 1.00 0.00 C ATOM 1427 O ALA A 455 21.728 7.634 -1.903 1.00 0.00 O ATOM 1428 CB ALA A 455 22.060 4.745 -2.861 1.00 0.00 C ATOM 0 H ALA A 455 21.619 5.848 -5.385 1.00 0.00 H new ATOM 0 HA ALA A 455 20.180 5.764 -2.800 1.00 0.00 H new ATOM 0 HB1 ALA A 455 22.267 4.890 -1.801 1.00 0.00 H new ATOM 0 HB2 ALA A 455 21.595 3.771 -3.010 1.00 0.00 H new ATOM 0 HB3 ALA A 455 22.993 4.791 -3.423 1.00 0.00 H new TER 1434 ALA A 455