USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 721 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 365 SER OG : rot -44:sc= 0.692 USER MOD Single : A 368 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 369 ASN :FLIP amide:sc= -2.84 F(o=-3.7,f=-2.8) USER MOD Single : A 371 LYS NZ :NH3+ -167:sc= -2.37! (180deg=-3.38!) USER MOD Single : A 373 GLN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot 180:sc= 0 USER MOD Single : A 380 TYR OH : rot 149:sc= -2.62! USER MOD Single : A 382 SER OG : rot -28:sc= 0.0841 USER MOD Single : A 386 HIS : no HE2:sc= -10.6! C(o=-11!,f=-11!) USER MOD Single : A 387 TYR OH : rot 155:sc= -4.28! USER MOD Single : A 389 THR OG1 : rot 160:sc= -1.78! USER MOD Single : A 391 LYS NZ :NH3+ -162:sc= -0.208 (180deg=-0.417) USER MOD Single : A 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 394 THR OG1 : rot -155:sc= -2.26! USER MOD Single : A 399 ASN : amide:sc= -0.967 K(o=-0.97,f=-4.9!) USER MOD Single : A 400 SER OG : rot -9:sc= -0.86! USER MOD Single : A 404 CYS SG : rot -97:sc= -3.43 USER MOD Single : A 410 THR OG1 : rot 180:sc= 0 USER MOD Single : A 414 THR OG1 : rot -13:sc= 0.896 USER MOD Single : A 419 ASN :FLIP amide:sc= -0.977 F(o=-3.2,f=-0.98) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -0.026 X(o=-0.026,f=-0.43) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 441 TYR OH : rot 121:sc= -1.99! USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.663 K(o=-0.66,f=-1.4!) USER MOD Single : A 451 SER OG : rot 180:sc= 0 USER MOD Single : A 453 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 364 -9.061 -10.721 12.187 1.00 0.00 N ATOM 2 CA GLY A 364 -8.023 -10.598 13.248 1.00 0.00 C ATOM 3 C GLY A 364 -6.989 -9.539 12.924 1.00 0.00 C ATOM 4 O GLY A 364 -7.028 -8.435 13.468 1.00 0.00 O ATOM 0 HA2 GLY A 364 -8.503 -10.355 14.196 1.00 0.00 H new ATOM 0 HA3 GLY A 364 -7.526 -11.559 13.379 1.00 0.00 H new ATOM 10 N SER A 365 -6.061 -9.875 12.034 1.00 0.00 N ATOM 11 CA SER A 365 -5.011 -8.946 11.634 1.00 0.00 C ATOM 12 C SER A 365 -5.072 -8.676 10.134 1.00 0.00 C ATOM 13 O SER A 365 -4.073 -8.303 9.518 1.00 0.00 O ATOM 14 CB SER A 365 -3.636 -9.503 12.009 1.00 0.00 C ATOM 15 OG SER A 365 -2.618 -8.541 11.791 1.00 0.00 O ATOM 0 H SER A 365 -6.015 -10.785 11.576 1.00 0.00 H new ATOM 0 HA SER A 365 -5.169 -8.006 12.163 1.00 0.00 H new ATOM 0 HB2 SER A 365 -3.636 -9.806 13.056 1.00 0.00 H new ATOM 0 HB3 SER A 365 -3.429 -10.396 11.419 1.00 0.00 H new ATOM 0 HG SER A 365 -2.764 -8.100 10.928 1.00 0.00 H new ATOM 21 N LEU A 366 -6.252 -8.869 9.554 1.00 0.00 N ATOM 22 CA LEU A 366 -6.448 -8.650 8.126 1.00 0.00 C ATOM 23 C LEU A 366 -7.757 -7.911 7.866 1.00 0.00 C ATOM 24 O LEU A 366 -8.784 -8.217 8.470 1.00 0.00 O ATOM 25 CB LEU A 366 -6.450 -9.987 7.381 1.00 0.00 C ATOM 26 CG LEU A 366 -5.323 -10.164 6.362 1.00 0.00 C ATOM 27 CD1 LEU A 366 -5.108 -8.880 5.576 1.00 0.00 C ATOM 28 CD2 LEU A 366 -4.039 -10.587 7.057 1.00 0.00 C ATOM 0 H LEU A 366 -7.087 -9.177 10.052 1.00 0.00 H new ATOM 0 HA LEU A 366 -5.624 -8.037 7.760 1.00 0.00 H new ATOM 0 HB2 LEU A 366 -6.387 -10.793 8.112 1.00 0.00 H new ATOM 0 HB3 LEU A 366 -7.405 -10.097 6.866 1.00 0.00 H new ATOM 0 HG LEU A 366 -5.610 -10.950 5.663 1.00 0.00 H new ATOM 0 HD11 LEU A 366 -4.303 -9.025 4.856 1.00 0.00 H new ATOM 0 HD12 LEU A 366 -6.025 -8.619 5.047 1.00 0.00 H new ATOM 0 HD13 LEU A 366 -4.842 -8.074 6.261 1.00 0.00 H new ATOM 0 HD21 LEU A 366 -3.248 -10.708 6.317 1.00 0.00 H new ATOM 0 HD22 LEU A 366 -3.747 -9.824 7.778 1.00 0.00 H new ATOM 0 HD23 LEU A 366 -4.200 -11.533 7.575 1.00 0.00 H new ATOM 40 N ASP A 367 -7.712 -6.939 6.960 1.00 0.00 N ATOM 41 CA ASP A 367 -8.897 -6.159 6.619 1.00 0.00 C ATOM 42 C ASP A 367 -9.558 -6.704 5.357 1.00 0.00 C ATOM 43 O ASP A 367 -9.193 -7.772 4.867 1.00 0.00 O ATOM 44 CB ASP A 367 -8.531 -4.687 6.428 1.00 0.00 C ATOM 45 CG ASP A 367 -8.325 -3.973 7.747 1.00 0.00 C ATOM 46 OD1 ASP A 367 -7.335 -4.283 8.443 1.00 0.00 O ATOM 47 OD2 ASP A 367 -9.155 -3.103 8.088 1.00 0.00 O ATOM 0 H ASP A 367 -6.870 -6.673 6.450 1.00 0.00 H new ATOM 0 HA ASP A 367 -9.606 -6.240 7.443 1.00 0.00 H new ATOM 0 HB2 ASP A 367 -7.621 -4.615 5.832 1.00 0.00 H new ATOM 0 HB3 ASP A 367 -9.321 -4.188 5.866 1.00 0.00 H new ATOM 52 N MET A 368 -10.538 -5.969 4.839 1.00 0.00 N ATOM 53 CA MET A 368 -11.248 -6.391 3.640 1.00 0.00 C ATOM 54 C MET A 368 -10.841 -5.566 2.425 1.00 0.00 C ATOM 55 O MET A 368 -10.588 -6.113 1.352 1.00 0.00 O ATOM 56 CB MET A 368 -12.760 -6.287 3.856 1.00 0.00 C ATOM 57 CG MET A 368 -13.288 -7.225 4.929 1.00 0.00 C ATOM 58 SD MET A 368 -14.520 -8.380 4.297 1.00 0.00 S ATOM 59 CE MET A 368 -15.959 -7.318 4.192 1.00 0.00 C ATOM 0 H MET A 368 -10.856 -5.082 5.230 1.00 0.00 H new ATOM 0 HA MET A 368 -10.979 -7.429 3.447 1.00 0.00 H new ATOM 0 HB2 MET A 368 -13.010 -5.261 4.127 1.00 0.00 H new ATOM 0 HB3 MET A 368 -13.268 -6.501 2.916 1.00 0.00 H new ATOM 0 HG2 MET A 368 -12.457 -7.785 5.358 1.00 0.00 H new ATOM 0 HG3 MET A 368 -13.726 -6.638 5.736 1.00 0.00 H new ATOM 0 HE1 MET A 368 -16.807 -7.890 3.816 1.00 0.00 H new ATOM 0 HE2 MET A 368 -16.196 -6.927 5.182 1.00 0.00 H new ATOM 0 HE3 MET A 368 -15.751 -6.490 3.515 1.00 0.00 H new ATOM 69 N ASN A 369 -10.792 -4.249 2.589 1.00 0.00 N ATOM 70 CA ASN A 369 -10.427 -3.365 1.489 1.00 0.00 C ATOM 71 C ASN A 369 -9.274 -2.440 1.863 1.00 0.00 C ATOM 72 O ASN A 369 -9.479 -1.263 2.158 1.00 0.00 O ATOM 73 CB ASN A 369 -11.636 -2.530 1.084 1.00 0.00 C ATOM 74 CG ASN A 369 -12.279 -3.020 -0.198 1.00 0.00 C ATOM 75 OD1 ASN A 369 -11.457 -3.294 -1.206 1.00 0.00 O flip ATOM 76 ND2 ASN A 369 -13.500 -3.152 -0.283 1.00 0.00 N flip ATOM 0 H ASN A 369 -10.999 -3.772 3.467 1.00 0.00 H new ATOM 0 HA ASN A 369 -10.101 -3.987 0.656 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -12.373 -2.551 1.887 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -11.330 -1.491 0.959 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -14.094 -2.930 0.516 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -13.918 -3.483 -1.152 1.00 0.00 H new ATOM 83 N ALA A 370 -8.065 -2.972 1.821 1.00 0.00 N ATOM 84 CA ALA A 370 -6.873 -2.185 2.125 1.00 0.00 C ATOM 85 C ALA A 370 -6.442 -1.379 0.913 1.00 0.00 C ATOM 86 O ALA A 370 -6.366 -0.160 0.961 1.00 0.00 O ATOM 87 CB ALA A 370 -5.735 -3.066 2.597 1.00 0.00 C ATOM 0 H ALA A 370 -7.878 -3.945 1.580 1.00 0.00 H new ATOM 0 HA ALA A 370 -7.128 -1.499 2.933 1.00 0.00 H new ATOM 0 HB1 ALA A 370 -4.863 -2.449 2.815 1.00 0.00 H new ATOM 0 HB2 ALA A 370 -6.037 -3.598 3.499 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -5.485 -3.786 1.818 1.00 0.00 H new ATOM 93 N LYS A 371 -6.174 -2.075 -0.183 1.00 0.00 N ATOM 94 CA LYS A 371 -5.770 -1.421 -1.419 1.00 0.00 C ATOM 95 C LYS A 371 -6.848 -0.429 -1.842 1.00 0.00 C ATOM 96 O LYS A 371 -6.581 0.567 -2.506 1.00 0.00 O ATOM 97 CB LYS A 371 -5.549 -2.462 -2.517 1.00 0.00 C ATOM 98 CG LYS A 371 -4.421 -3.434 -2.212 1.00 0.00 C ATOM 99 CD LYS A 371 -4.912 -4.617 -1.391 1.00 0.00 C ATOM 100 CE LYS A 371 -4.144 -5.889 -1.721 1.00 0.00 C ATOM 101 NZ LYS A 371 -3.772 -5.964 -3.162 1.00 0.00 N ATOM 0 H LYS A 371 -6.229 -3.092 -0.241 1.00 0.00 H new ATOM 0 HA LYS A 371 -4.834 -0.887 -1.256 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -6.471 -3.023 -2.666 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -5.333 -1.950 -3.454 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -3.986 -3.793 -3.145 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -3.630 -2.916 -1.670 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -4.805 -4.393 -0.330 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -5.974 -4.774 -1.578 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -3.241 -5.935 -1.112 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -4.750 -6.756 -1.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -3.452 -6.927 -3.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -4.599 -5.728 -3.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -3.005 -5.290 -3.358 1.00 0.00 H new ATOM 115 N ARG A 372 -8.065 -0.719 -1.409 1.00 0.00 N ATOM 116 CA ARG A 372 -9.207 0.139 -1.700 1.00 0.00 C ATOM 117 C ARG A 372 -9.232 1.319 -0.746 1.00 0.00 C ATOM 118 O ARG A 372 -9.198 2.474 -1.169 1.00 0.00 O ATOM 119 CB ARG A 372 -10.521 -0.636 -1.598 1.00 0.00 C ATOM 120 CG ARG A 372 -11.749 0.264 -1.561 1.00 0.00 C ATOM 121 CD ARG A 372 -12.502 0.228 -2.880 1.00 0.00 C ATOM 122 NE ARG A 372 -13.889 0.660 -2.731 1.00 0.00 N ATOM 123 CZ ARG A 372 -14.882 -0.155 -2.392 1.00 0.00 C ATOM 124 NH1 ARG A 372 -14.639 -1.439 -2.164 1.00 0.00 N ATOM 125 NH2 ARG A 372 -16.119 0.313 -2.281 1.00 0.00 N ATOM 0 H ARG A 372 -8.289 -1.544 -0.853 1.00 0.00 H new ATOM 0 HA ARG A 372 -9.101 0.502 -2.722 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -10.602 -1.314 -2.447 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -10.503 -1.252 -0.699 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -12.410 -0.053 -0.754 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -11.445 1.288 -1.341 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -11.998 0.870 -3.603 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -12.479 -0.785 -3.283 1.00 0.00 H new ATOM 0 HE ARG A 372 -14.108 1.642 -2.896 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -13.689 -1.801 -2.249 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -15.402 -2.064 -1.904 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -16.309 1.300 -2.456 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -16.880 -0.314 -2.021 1.00 0.00 H new ATOM 139 N GLN A 373 -9.291 1.020 0.544 1.00 0.00 N ATOM 140 CA GLN A 373 -9.318 2.056 1.564 1.00 0.00 C ATOM 141 C GLN A 373 -8.103 2.958 1.421 1.00 0.00 C ATOM 142 O GLN A 373 -8.215 4.179 1.398 1.00 0.00 O ATOM 143 CB GLN A 373 -9.358 1.411 2.945 1.00 0.00 C ATOM 144 CG GLN A 373 -9.596 2.400 4.067 1.00 0.00 C ATOM 145 CD GLN A 373 -10.882 2.130 4.824 1.00 0.00 C ATOM 146 OE1 GLN A 373 -11.961 2.068 4.235 1.00 0.00 O ATOM 147 NE2 GLN A 373 -10.772 1.967 6.136 1.00 0.00 N ATOM 0 H GLN A 373 -9.321 0.068 0.908 1.00 0.00 H new ATOM 0 HA GLN A 373 -10.212 2.668 1.440 1.00 0.00 H new ATOM 0 HB2 GLN A 373 -10.145 0.657 2.963 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -8.416 0.892 3.122 1.00 0.00 H new ATOM 0 HG2 GLN A 373 -8.756 2.364 4.761 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -9.627 3.409 3.656 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -9.857 2.027 6.582 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -11.603 1.782 6.698 1.00 0.00 H new ATOM 156 N LEU A 374 -6.953 2.329 1.287 1.00 0.00 N ATOM 157 CA LEU A 374 -5.702 3.038 1.104 1.00 0.00 C ATOM 158 C LEU A 374 -5.810 3.959 -0.106 1.00 0.00 C ATOM 159 O LEU A 374 -5.707 5.178 0.017 1.00 0.00 O ATOM 160 CB LEU A 374 -4.550 2.040 0.932 1.00 0.00 C ATOM 161 CG LEU A 374 -3.147 2.618 1.138 1.00 0.00 C ATOM 162 CD1 LEU A 374 -2.508 2.965 -0.196 1.00 0.00 C ATOM 163 CD2 LEU A 374 -3.205 3.840 2.043 1.00 0.00 C ATOM 0 H LEU A 374 -6.859 1.313 1.302 1.00 0.00 H new ATOM 0 HA LEU A 374 -5.495 3.644 1.986 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -4.694 1.220 1.635 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -4.606 1.615 -0.070 1.00 0.00 H new ATOM 0 HG LEU A 374 -2.529 1.861 1.622 1.00 0.00 H new ATOM 0 HD11 LEU A 374 -1.512 3.374 -0.027 1.00 0.00 H new ATOM 0 HD12 LEU A 374 -2.432 2.066 -0.808 1.00 0.00 H new ATOM 0 HD13 LEU A 374 -3.121 3.704 -0.712 1.00 0.00 H new ATOM 0 HD21 LEU A 374 -2.200 4.239 2.180 1.00 0.00 H new ATOM 0 HD22 LEU A 374 -3.839 4.601 1.587 1.00 0.00 H new ATOM 0 HD23 LEU A 374 -3.618 3.556 3.011 1.00 0.00 H new ATOM 175 N TYR A 375 -6.020 3.364 -1.276 1.00 0.00 N ATOM 176 CA TYR A 375 -6.147 4.140 -2.513 1.00 0.00 C ATOM 177 C TYR A 375 -7.056 5.326 -2.279 1.00 0.00 C ATOM 178 O TYR A 375 -6.849 6.414 -2.813 1.00 0.00 O ATOM 179 CB TYR A 375 -6.705 3.286 -3.643 1.00 0.00 C ATOM 180 CG TYR A 375 -6.293 3.753 -5.023 1.00 0.00 C ATOM 181 CD1 TYR A 375 -5.023 4.276 -5.253 1.00 0.00 C ATOM 182 CD2 TYR A 375 -7.174 3.675 -6.096 1.00 0.00 C ATOM 183 CE1 TYR A 375 -4.647 4.705 -6.514 1.00 0.00 C ATOM 184 CE2 TYR A 375 -6.804 4.102 -7.357 1.00 0.00 C ATOM 185 CZ TYR A 375 -5.540 4.617 -7.561 1.00 0.00 C ATOM 186 OH TYR A 375 -5.166 5.041 -8.815 1.00 0.00 O ATOM 0 H TYR A 375 -6.106 2.355 -1.398 1.00 0.00 H new ATOM 0 HA TYR A 375 -5.154 4.485 -2.802 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -6.375 2.256 -3.505 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -7.793 3.283 -3.580 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.321 4.348 -4.435 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -8.165 3.274 -5.941 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -3.658 5.107 -6.677 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.501 4.033 -8.179 1.00 0.00 H new ATOM 0 HH TYR A 375 -5.909 4.910 -9.440 1.00 0.00 H new ATOM 196 N SER A 376 -8.045 5.108 -1.437 1.00 0.00 N ATOM 197 CA SER A 376 -8.970 6.163 -1.078 1.00 0.00 C ATOM 198 C SER A 376 -8.226 7.167 -0.206 1.00 0.00 C ATOM 199 O SER A 376 -8.296 8.378 -0.416 1.00 0.00 O ATOM 200 CB SER A 376 -10.185 5.594 -0.336 1.00 0.00 C ATOM 201 OG SER A 376 -10.762 6.568 0.515 1.00 0.00 O ATOM 0 H SER A 376 -8.229 4.210 -0.989 1.00 0.00 H new ATOM 0 HA SER A 376 -9.342 6.653 -1.978 1.00 0.00 H new ATOM 0 HB2 SER A 376 -10.927 5.250 -1.056 1.00 0.00 H new ATOM 0 HB3 SER A 376 -9.884 4.726 0.251 1.00 0.00 H new ATOM 0 HG SER A 376 -11.536 6.182 0.976 1.00 0.00 H new ATOM 207 N LEU A 377 -7.511 6.629 0.777 1.00 0.00 N ATOM 208 CA LEU A 377 -6.738 7.434 1.707 1.00 0.00 C ATOM 209 C LEU A 377 -5.498 8.029 1.039 1.00 0.00 C ATOM 210 O LEU A 377 -5.402 9.243 0.862 1.00 0.00 O ATOM 211 CB LEU A 377 -6.314 6.556 2.887 1.00 0.00 C ATOM 212 CG LEU A 377 -7.348 6.421 4.006 1.00 0.00 C ATOM 213 CD1 LEU A 377 -8.505 5.548 3.553 1.00 0.00 C ATOM 214 CD2 LEU A 377 -6.709 5.843 5.258 1.00 0.00 C ATOM 0 H LEU A 377 -7.453 5.625 0.948 1.00 0.00 H new ATOM 0 HA LEU A 377 -7.360 8.261 2.050 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -6.077 5.561 2.511 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -5.396 6.963 3.310 1.00 0.00 H new ATOM 0 HG LEU A 377 -7.731 7.414 4.242 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -9.233 5.461 4.360 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -8.981 5.998 2.682 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -8.133 4.557 3.292 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -7.461 5.755 6.043 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -6.299 4.858 5.036 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -5.908 6.501 5.595 1.00 0.00 H new ATOM 226 N ILE A 378 -4.530 7.174 0.711 1.00 0.00 N ATOM 227 CA ILE A 378 -3.265 7.594 0.111 1.00 0.00 C ATOM 228 C ILE A 378 -3.204 7.276 -1.388 1.00 0.00 C ATOM 229 O ILE A 378 -2.133 7.116 -1.961 1.00 0.00 O ATOM 230 CB ILE A 378 -2.113 6.872 0.850 1.00 0.00 C ATOM 231 CG1 ILE A 378 -2.032 7.357 2.293 1.00 0.00 C ATOM 232 CG2 ILE A 378 -0.778 7.070 0.170 1.00 0.00 C ATOM 233 CD1 ILE A 378 -1.033 6.589 3.126 1.00 0.00 C ATOM 0 H ILE A 378 -4.602 6.167 0.855 1.00 0.00 H new ATOM 0 HA ILE A 378 -3.174 8.675 0.212 1.00 0.00 H new ATOM 0 HB ILE A 378 -2.337 5.805 0.828 1.00 0.00 H new ATOM 0 HG12 ILE A 378 -1.764 8.414 2.299 1.00 0.00 H new ATOM 0 HG13 ILE A 378 -3.017 7.275 2.752 1.00 0.00 H new ATOM 0 HG21 ILE A 378 -0.004 6.543 0.728 1.00 0.00 H new ATOM 0 HG22 ILE A 378 -0.825 6.676 -0.845 1.00 0.00 H new ATOM 0 HG23 ILE A 378 -0.541 8.133 0.136 1.00 0.00 H new ATOM 0 HD11 ILE A 378 -1.025 6.985 4.142 1.00 0.00 H new ATOM 0 HD12 ILE A 378 -1.312 5.536 3.149 1.00 0.00 H new ATOM 0 HD13 ILE A 378 -0.040 6.692 2.689 1.00 0.00 H new ATOM 245 N GLY A 379 -4.340 7.221 -2.051 1.00 0.00 N ATOM 246 CA GLY A 379 -4.298 6.951 -3.472 1.00 0.00 C ATOM 247 C GLY A 379 -4.569 8.187 -4.310 1.00 0.00 C ATOM 248 O GLY A 379 -5.629 8.802 -4.202 1.00 0.00 O ATOM 0 H GLY A 379 -5.268 7.354 -1.650 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -3.319 6.548 -3.732 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -5.034 6.184 -3.714 1.00 0.00 H new ATOM 252 N TYR A 380 -3.600 8.550 -5.147 1.00 0.00 N ATOM 253 CA TYR A 380 -3.726 9.720 -6.007 1.00 0.00 C ATOM 254 C TYR A 380 -3.009 9.496 -7.338 1.00 0.00 C ATOM 255 O TYR A 380 -2.713 8.360 -7.709 1.00 0.00 O ATOM 256 CB TYR A 380 -3.156 10.952 -5.304 1.00 0.00 C ATOM 257 CG TYR A 380 -3.639 11.112 -3.880 1.00 0.00 C ATOM 258 CD1 TYR A 380 -4.794 11.830 -3.596 1.00 0.00 C ATOM 259 CD2 TYR A 380 -2.942 10.545 -2.817 1.00 0.00 C ATOM 260 CE1 TYR A 380 -5.242 11.979 -2.296 1.00 0.00 C ATOM 261 CE2 TYR A 380 -3.383 10.690 -1.516 1.00 0.00 C ATOM 262 CZ TYR A 380 -4.534 11.408 -1.261 1.00 0.00 C ATOM 263 OH TYR A 380 -4.976 11.554 0.033 1.00 0.00 O ATOM 0 H TYR A 380 -2.718 8.048 -5.247 1.00 0.00 H new ATOM 0 HA TYR A 380 -4.784 9.883 -6.211 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -2.068 10.890 -5.305 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -3.425 11.842 -5.873 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -5.352 12.280 -4.404 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -2.041 9.982 -3.013 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -6.142 12.540 -2.093 1.00 0.00 H new ATOM 0 HE2 TYR A 380 -2.830 10.244 -0.703 1.00 0.00 H new ATOM 0 HH TYR A 380 -4.724 10.764 0.556 1.00 0.00 H new ATOM 273 N ALA A 381 -2.735 10.583 -8.054 1.00 0.00 N ATOM 274 CA ALA A 381 -2.055 10.497 -9.343 1.00 0.00 C ATOM 275 C ALA A 381 -0.544 10.383 -9.163 1.00 0.00 C ATOM 276 O ALA A 381 0.060 9.378 -9.540 1.00 0.00 O ATOM 277 CB ALA A 381 -2.389 11.698 -10.214 1.00 0.00 C ATOM 0 H ALA A 381 -2.973 11.532 -7.764 1.00 0.00 H new ATOM 0 HA ALA A 381 -2.410 9.595 -9.842 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -1.870 11.611 -11.169 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -3.465 11.734 -10.387 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -2.072 12.612 -9.711 1.00 0.00 H new ATOM 283 N SER A 382 0.061 11.412 -8.579 1.00 0.00 N ATOM 284 CA SER A 382 1.501 11.417 -8.344 1.00 0.00 C ATOM 285 C SER A 382 1.861 10.454 -7.218 1.00 0.00 C ATOM 286 O SER A 382 3.028 10.114 -7.023 1.00 0.00 O ATOM 287 CB SER A 382 1.979 12.828 -7.998 1.00 0.00 C ATOM 288 OG SER A 382 3.349 12.829 -7.635 1.00 0.00 O ATOM 0 H SER A 382 -0.422 12.252 -8.260 1.00 0.00 H new ATOM 0 HA SER A 382 1.999 11.090 -9.257 1.00 0.00 H new ATOM 0 HB2 SER A 382 1.826 13.487 -8.853 1.00 0.00 H new ATOM 0 HB3 SER A 382 1.382 13.226 -7.178 1.00 0.00 H new ATOM 0 HG SER A 382 3.585 11.961 -7.245 1.00 0.00 H new ATOM 294 N LEU A 383 0.844 10.018 -6.483 1.00 0.00 N ATOM 295 CA LEU A 383 1.030 9.092 -5.375 1.00 0.00 C ATOM 296 C LEU A 383 0.737 7.662 -5.815 1.00 0.00 C ATOM 297 O LEU A 383 0.110 6.891 -5.088 1.00 0.00 O ATOM 298 CB LEU A 383 0.112 9.479 -4.220 1.00 0.00 C ATOM 299 CG LEU A 383 0.814 9.764 -2.896 1.00 0.00 C ATOM 300 CD1 LEU A 383 1.023 8.472 -2.132 1.00 0.00 C ATOM 301 CD2 LEU A 383 2.141 10.469 -3.131 1.00 0.00 C ATOM 0 H LEU A 383 -0.125 10.295 -6.638 1.00 0.00 H new ATOM 0 HA LEU A 383 2.068 9.146 -5.046 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -0.455 10.364 -4.509 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -0.608 8.675 -4.065 1.00 0.00 H new ATOM 0 HG LEU A 383 0.183 10.425 -2.301 1.00 0.00 H new ATOM 0 HD11 LEU A 383 1.525 8.685 -1.188 1.00 0.00 H new ATOM 0 HD12 LEU A 383 0.058 8.007 -1.933 1.00 0.00 H new ATOM 0 HD13 LEU A 383 1.637 7.794 -2.725 1.00 0.00 H new ATOM 0 HD21 LEU A 383 2.625 10.663 -2.174 1.00 0.00 H new ATOM 0 HD22 LEU A 383 2.786 9.837 -3.742 1.00 0.00 H new ATOM 0 HD23 LEU A 383 1.965 11.413 -3.646 1.00 0.00 H new ATOM 313 N ARG A 384 1.180 7.327 -7.017 1.00 0.00 N ATOM 314 CA ARG A 384 0.959 6.003 -7.584 1.00 0.00 C ATOM 315 C ARG A 384 1.493 4.887 -6.690 1.00 0.00 C ATOM 316 O ARG A 384 2.554 4.324 -6.962 1.00 0.00 O ATOM 317 CB ARG A 384 1.622 5.910 -8.957 1.00 0.00 C ATOM 318 CG ARG A 384 0.686 5.428 -10.053 1.00 0.00 C ATOM 319 CD ARG A 384 0.702 3.912 -10.166 1.00 0.00 C ATOM 320 NE ARG A 384 0.172 3.450 -11.445 1.00 0.00 N ATOM 321 CZ ARG A 384 -1.125 3.392 -11.728 1.00 0.00 C ATOM 322 NH1 ARG A 384 -2.020 3.767 -10.824 1.00 0.00 N ATOM 323 NH2 ARG A 384 -1.529 2.959 -12.914 1.00 0.00 N ATOM 0 H ARG A 384 1.700 7.960 -7.625 1.00 0.00 H new ATOM 0 HA ARG A 384 -0.119 5.869 -7.672 1.00 0.00 H new ATOM 0 HB2 ARG A 384 2.013 6.890 -9.230 1.00 0.00 H new ATOM 0 HB3 ARG A 384 2.474 5.233 -8.895 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -0.328 5.769 -9.844 1.00 0.00 H new ATOM 0 HG3 ARG A 384 0.980 5.869 -11.005 1.00 0.00 H new ATOM 0 HD2 ARG A 384 1.723 3.551 -10.046 1.00 0.00 H new ATOM 0 HD3 ARG A 384 0.115 3.482 -9.354 1.00 0.00 H new ATOM 0 HE ARG A 384 0.835 3.155 -12.162 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -1.713 4.100 -9.910 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -3.015 3.722 -11.043 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -0.844 2.669 -13.612 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -2.525 2.915 -13.129 1.00 0.00 H new ATOM 337 N LEU A 385 0.745 4.539 -5.645 1.00 0.00 N ATOM 338 CA LEU A 385 1.152 3.458 -4.761 1.00 0.00 C ATOM 339 C LEU A 385 1.075 2.131 -5.508 1.00 0.00 C ATOM 340 O LEU A 385 0.248 1.962 -6.403 1.00 0.00 O ATOM 341 CB LEU A 385 0.288 3.419 -3.493 1.00 0.00 C ATOM 342 CG LEU A 385 -1.221 3.545 -3.700 1.00 0.00 C ATOM 343 CD1 LEU A 385 -1.646 4.996 -3.588 1.00 0.00 C ATOM 344 CD2 LEU A 385 -1.648 2.966 -5.038 1.00 0.00 C ATOM 0 H LEU A 385 -0.137 4.987 -5.394 1.00 0.00 H new ATOM 0 HA LEU A 385 2.181 3.634 -4.448 1.00 0.00 H new ATOM 0 HB2 LEU A 385 0.485 2.482 -2.973 1.00 0.00 H new ATOM 0 HB3 LEU A 385 0.612 4.224 -2.833 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.717 2.970 -2.918 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -2.723 5.072 -3.737 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.389 5.375 -2.599 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.132 5.585 -4.347 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -2.727 3.072 -5.153 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -1.143 3.500 -5.843 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -1.381 1.910 -5.079 1.00 0.00 H new ATOM 356 N HIS A 386 1.938 1.191 -5.148 1.00 0.00 N ATOM 357 CA HIS A 386 1.951 -0.112 -5.801 1.00 0.00 C ATOM 358 C HIS A 386 2.384 -1.197 -4.830 1.00 0.00 C ATOM 359 O HIS A 386 3.132 -0.938 -3.889 1.00 0.00 O ATOM 360 CB HIS A 386 2.881 -0.095 -7.018 1.00 0.00 C ATOM 361 CG HIS A 386 4.335 -0.240 -6.680 1.00 0.00 C ATOM 362 ND1 HIS A 386 4.896 -1.414 -6.210 1.00 0.00 N ATOM 363 CD2 HIS A 386 5.354 0.649 -6.764 1.00 0.00 C ATOM 364 CE1 HIS A 386 6.192 -1.236 -6.022 1.00 0.00 C ATOM 365 NE2 HIS A 386 6.493 0.005 -6.352 1.00 0.00 N ATOM 0 H HIS A 386 2.635 1.304 -4.412 1.00 0.00 H new ATOM 0 HA HIS A 386 0.937 -0.331 -6.137 1.00 0.00 H new ATOM 0 HB2 HIS A 386 2.594 -0.902 -7.693 1.00 0.00 H new ATOM 0 HB3 HIS A 386 2.736 0.840 -7.559 1.00 0.00 H new ATOM 0 HD1 HIS A 386 4.389 -2.282 -6.036 1.00 0.00 H new ATOM 0 HD2 HIS A 386 5.283 1.675 -7.094 1.00 0.00 H new ATOM 0 HE1 HIS A 386 6.886 -1.980 -5.660 1.00 0.00 H new ATOM 374 N TYR A 387 1.907 -2.411 -5.061 1.00 0.00 N ATOM 375 CA TYR A 387 2.243 -3.533 -4.205 1.00 0.00 C ATOM 376 C TYR A 387 3.311 -4.398 -4.858 1.00 0.00 C ATOM 377 O TYR A 387 3.139 -4.887 -5.974 1.00 0.00 O ATOM 378 CB TYR A 387 0.983 -4.341 -3.906 1.00 0.00 C ATOM 379 CG TYR A 387 -0.223 -3.456 -3.691 1.00 0.00 C ATOM 380 CD1 TYR A 387 -0.408 -2.787 -2.487 1.00 0.00 C ATOM 381 CD2 TYR A 387 -1.162 -3.264 -4.697 1.00 0.00 C ATOM 382 CE1 TYR A 387 -1.493 -1.957 -2.291 1.00 0.00 C ATOM 383 CE2 TYR A 387 -2.253 -2.437 -4.506 1.00 0.00 C ATOM 384 CZ TYR A 387 -2.412 -1.786 -3.301 1.00 0.00 C ATOM 385 OH TYR A 387 -3.494 -0.958 -3.107 1.00 0.00 O ATOM 0 H TYR A 387 1.285 -2.642 -5.836 1.00 0.00 H new ATOM 0 HA TYR A 387 2.649 -3.162 -3.264 1.00 0.00 H new ATOM 0 HB2 TYR A 387 0.787 -5.025 -4.732 1.00 0.00 H new ATOM 0 HB3 TYR A 387 1.147 -4.952 -3.018 1.00 0.00 H new ATOM 0 HD1 TYR A 387 0.310 -2.919 -1.691 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -1.037 -3.769 -5.643 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -1.620 -1.444 -1.349 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -2.977 -2.302 -5.296 1.00 0.00 H new ATOM 0 HH TYR A 387 -3.812 -0.627 -3.973 1.00 0.00 H new ATOM 395 N VAL A 388 4.418 -4.573 -4.151 1.00 0.00 N ATOM 396 CA VAL A 388 5.526 -5.368 -4.652 1.00 0.00 C ATOM 397 C VAL A 388 5.582 -6.721 -3.960 1.00 0.00 C ATOM 398 O VAL A 388 5.477 -6.806 -2.740 1.00 0.00 O ATOM 399 CB VAL A 388 6.871 -4.640 -4.456 1.00 0.00 C ATOM 400 CG1 VAL A 388 6.932 -3.980 -3.089 1.00 0.00 C ATOM 401 CG2 VAL A 388 8.029 -5.604 -4.639 1.00 0.00 C ATOM 0 H VAL A 388 4.571 -4.173 -3.225 1.00 0.00 H new ATOM 0 HA VAL A 388 5.357 -5.517 -5.719 1.00 0.00 H new ATOM 0 HB VAL A 388 6.951 -3.859 -5.213 1.00 0.00 H new ATOM 0 HG11 VAL A 388 7.890 -3.472 -2.972 1.00 0.00 H new ATOM 0 HG12 VAL A 388 6.123 -3.255 -2.999 1.00 0.00 H new ATOM 0 HG13 VAL A 388 6.827 -4.739 -2.314 1.00 0.00 H new ATOM 0 HG21 VAL A 388 8.970 -5.073 -4.497 1.00 0.00 H new ATOM 0 HG22 VAL A 388 7.952 -6.408 -3.907 1.00 0.00 H new ATOM 0 HG23 VAL A 388 7.997 -6.024 -5.644 1.00 0.00 H new ATOM 411 N THR A 389 5.752 -7.779 -4.745 1.00 0.00 N ATOM 412 CA THR A 389 5.825 -9.127 -4.199 1.00 0.00 C ATOM 413 C THR A 389 7.270 -9.539 -3.949 1.00 0.00 C ATOM 414 O THR A 389 8.023 -9.798 -4.888 1.00 0.00 O ATOM 415 CB THR A 389 5.168 -10.154 -5.139 1.00 0.00 C ATOM 416 OG1 THR A 389 3.880 -9.707 -5.582 1.00 0.00 O ATOM 417 CG2 THR A 389 5.002 -11.497 -4.441 1.00 0.00 C ATOM 0 H THR A 389 5.842 -7.728 -5.760 1.00 0.00 H new ATOM 0 HA THR A 389 5.282 -9.113 -3.254 1.00 0.00 H new ATOM 0 HB THR A 389 5.826 -10.264 -6.001 1.00 0.00 H new ATOM 0 HG1 THR A 389 3.629 -10.190 -6.397 1.00 0.00 H new ATOM 0 HG21 THR A 389 4.536 -12.207 -5.124 1.00 0.00 H new ATOM 0 HG22 THR A 389 5.979 -11.873 -4.138 1.00 0.00 H new ATOM 0 HG23 THR A 389 4.372 -11.374 -3.560 1.00 0.00 H new ATOM 425 N VAL A 390 7.646 -9.611 -2.678 1.00 0.00 N ATOM 426 CA VAL A 390 9.001 -10.010 -2.307 1.00 0.00 C ATOM 427 C VAL A 390 9.082 -11.524 -2.178 1.00 0.00 C ATOM 428 O VAL A 390 10.101 -12.135 -2.499 1.00 0.00 O ATOM 429 CB VAL A 390 9.466 -9.369 -0.981 1.00 0.00 C ATOM 430 CG1 VAL A 390 10.660 -8.460 -1.218 1.00 0.00 C ATOM 431 CG2 VAL A 390 8.334 -8.605 -0.313 1.00 0.00 C ATOM 0 H VAL A 390 7.036 -9.400 -1.889 1.00 0.00 H new ATOM 0 HA VAL A 390 9.661 -9.657 -3.100 1.00 0.00 H new ATOM 0 HB VAL A 390 9.770 -10.171 -0.308 1.00 0.00 H new ATOM 0 HG11 VAL A 390 10.974 -8.017 -0.273 1.00 0.00 H new ATOM 0 HG12 VAL A 390 11.482 -9.041 -1.637 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.382 -7.669 -1.915 1.00 0.00 H new ATOM 0 HG21 VAL A 390 8.692 -8.165 0.618 1.00 0.00 H new ATOM 0 HG22 VAL A 390 7.987 -7.814 -0.978 1.00 0.00 H new ATOM 0 HG23 VAL A 390 7.511 -9.287 -0.099 1.00 0.00 H new ATOM 441 N LYS A 391 7.990 -12.120 -1.715 1.00 0.00 N ATOM 442 CA LYS A 391 7.918 -13.564 -1.551 1.00 0.00 C ATOM 443 C LYS A 391 6.511 -14.067 -1.869 1.00 0.00 C ATOM 444 O LYS A 391 5.542 -13.312 -1.803 1.00 0.00 O ATOM 445 CB LYS A 391 8.348 -13.968 -0.129 1.00 0.00 C ATOM 446 CG LYS A 391 7.235 -14.531 0.746 1.00 0.00 C ATOM 447 CD LYS A 391 7.795 -15.331 1.910 1.00 0.00 C ATOM 448 CE LYS A 391 7.939 -16.803 1.557 1.00 0.00 C ATOM 449 NZ LYS A 391 8.365 -17.617 2.728 1.00 0.00 N ATOM 0 H LYS A 391 7.141 -11.623 -1.446 1.00 0.00 H new ATOM 0 HA LYS A 391 8.608 -14.031 -2.254 1.00 0.00 H new ATOM 0 HB2 LYS A 391 9.142 -14.711 -0.203 1.00 0.00 H new ATOM 0 HB3 LYS A 391 8.773 -13.096 0.367 1.00 0.00 H new ATOM 0 HG2 LYS A 391 6.621 -13.715 1.126 1.00 0.00 H new ATOM 0 HG3 LYS A 391 6.584 -15.167 0.145 1.00 0.00 H new ATOM 0 HD2 LYS A 391 8.766 -14.928 2.196 1.00 0.00 H new ATOM 0 HD3 LYS A 391 7.139 -15.226 2.774 1.00 0.00 H new ATOM 0 HE2 LYS A 391 6.989 -17.180 1.180 1.00 0.00 H new ATOM 0 HE3 LYS A 391 8.668 -16.914 0.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 8.742 -18.528 2.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 9.102 -17.107 3.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 7.548 -17.785 3.350 1.00 0.00 H new ATOM 463 N LYS A 392 6.412 -15.343 -2.212 1.00 0.00 N ATOM 464 CA LYS A 392 5.131 -15.953 -2.541 1.00 0.00 C ATOM 465 C LYS A 392 5.036 -17.352 -1.950 1.00 0.00 C ATOM 466 O LYS A 392 6.020 -17.889 -1.443 1.00 0.00 O ATOM 467 CB LYS A 392 4.943 -16.024 -4.058 1.00 0.00 C ATOM 468 CG LYS A 392 6.108 -15.449 -4.848 1.00 0.00 C ATOM 469 CD LYS A 392 7.250 -16.446 -4.959 1.00 0.00 C ATOM 470 CE LYS A 392 8.170 -16.113 -6.123 1.00 0.00 C ATOM 471 NZ LYS A 392 7.829 -16.898 -7.341 1.00 0.00 N ATOM 0 H LYS A 392 7.207 -15.979 -2.270 1.00 0.00 H new ATOM 0 HA LYS A 392 4.343 -15.333 -2.113 1.00 0.00 H new ATOM 0 HB2 LYS A 392 4.797 -17.064 -4.348 1.00 0.00 H new ATOM 0 HB3 LYS A 392 4.033 -15.488 -4.328 1.00 0.00 H new ATOM 0 HG2 LYS A 392 5.770 -15.169 -5.846 1.00 0.00 H new ATOM 0 HG3 LYS A 392 6.463 -14.539 -4.364 1.00 0.00 H new ATOM 0 HD2 LYS A 392 7.822 -16.450 -4.031 1.00 0.00 H new ATOM 0 HD3 LYS A 392 6.846 -17.450 -5.089 1.00 0.00 H new ATOM 0 HE2 LYS A 392 8.102 -15.048 -6.346 1.00 0.00 H new ATOM 0 HE3 LYS A 392 9.203 -16.314 -5.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 8.479 -16.642 -8.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 7.918 -17.914 -7.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 6.852 -16.687 -7.628 1.00 0.00 H new ATOM 485 N PRO A 393 3.847 -17.966 -2.014 1.00 0.00 N ATOM 486 CA PRO A 393 3.637 -19.314 -1.489 1.00 0.00 C ATOM 487 C PRO A 393 4.565 -20.324 -2.151 1.00 0.00 C ATOM 488 O PRO A 393 4.683 -20.362 -3.376 1.00 0.00 O ATOM 489 CB PRO A 393 2.176 -19.619 -1.839 1.00 0.00 C ATOM 490 CG PRO A 393 1.543 -18.288 -2.063 1.00 0.00 C ATOM 491 CD PRO A 393 2.626 -17.400 -2.607 1.00 0.00 C ATOM 0 HA PRO A 393 3.846 -19.377 -0.421 1.00 0.00 H new ATOM 0 HB2 PRO A 393 2.106 -20.243 -2.730 1.00 0.00 H new ATOM 0 HB3 PRO A 393 1.682 -20.159 -1.032 1.00 0.00 H new ATOM 0 HG2 PRO A 393 0.712 -18.364 -2.764 1.00 0.00 H new ATOM 0 HG3 PRO A 393 1.140 -17.887 -1.133 1.00 0.00 H new ATOM 0 HD2 PRO A 393 2.658 -17.424 -3.696 1.00 0.00 H new ATOM 0 HD3 PRO A 393 2.480 -16.360 -2.315 1.00 0.00 H new ATOM 499 N THR A 394 5.223 -21.138 -1.338 1.00 0.00 N ATOM 500 CA THR A 394 6.142 -22.144 -1.845 1.00 0.00 C ATOM 501 C THR A 394 6.101 -23.402 -0.985 1.00 0.00 C ATOM 502 O THR A 394 5.803 -23.340 0.208 1.00 0.00 O ATOM 503 CB THR A 394 7.583 -21.605 -1.896 1.00 0.00 C ATOM 504 OG1 THR A 394 8.215 -21.683 -0.613 1.00 0.00 O ATOM 505 CG2 THR A 394 7.601 -20.153 -2.353 1.00 0.00 C ATOM 0 H THR A 394 5.136 -21.120 -0.322 1.00 0.00 H new ATOM 0 HA THR A 394 5.823 -22.393 -2.857 1.00 0.00 H new ATOM 0 HB THR A 394 8.129 -22.226 -2.607 1.00 0.00 H new ATOM 0 HG1 THR A 394 8.927 -21.012 -0.558 1.00 0.00 H new ATOM 0 HG21 THR A 394 8.630 -19.793 -2.381 1.00 0.00 H new ATOM 0 HG22 THR A 394 7.163 -20.079 -3.348 1.00 0.00 H new ATOM 0 HG23 THR A 394 7.023 -19.545 -1.657 1.00 0.00 H new ATOM 513 N ALA A 395 6.395 -24.543 -1.596 1.00 0.00 N ATOM 514 CA ALA A 395 6.383 -25.815 -0.886 1.00 0.00 C ATOM 515 C ALA A 395 7.033 -25.687 0.487 1.00 0.00 C ATOM 516 O ALA A 395 6.474 -26.126 1.492 1.00 0.00 O ATOM 517 CB ALA A 395 7.078 -26.899 -1.697 1.00 0.00 C ATOM 0 H ALA A 395 6.645 -24.613 -2.582 1.00 0.00 H new ATOM 0 HA ALA A 395 5.341 -26.101 -0.746 1.00 0.00 H new ATOM 0 HB1 ALA A 395 7.055 -27.838 -1.144 1.00 0.00 H new ATOM 0 HB2 ALA A 395 6.564 -27.026 -2.650 1.00 0.00 H new ATOM 0 HB3 ALA A 395 8.113 -26.610 -1.879 1.00 0.00 H new ATOM 523 N VAL A 396 8.214 -25.087 0.520 1.00 0.00 N ATOM 524 CA VAL A 396 8.942 -24.904 1.766 1.00 0.00 C ATOM 525 C VAL A 396 8.193 -23.980 2.716 1.00 0.00 C ATOM 526 O VAL A 396 8.140 -24.221 3.922 1.00 0.00 O ATOM 527 CB VAL A 396 10.350 -24.335 1.507 1.00 0.00 C ATOM 528 CG1 VAL A 396 10.983 -25.014 0.303 1.00 0.00 C ATOM 529 CG2 VAL A 396 10.303 -22.825 1.310 1.00 0.00 C ATOM 0 H VAL A 396 8.689 -24.718 -0.304 1.00 0.00 H new ATOM 0 HA VAL A 396 9.033 -25.887 2.229 1.00 0.00 H new ATOM 0 HB VAL A 396 10.965 -24.539 2.384 1.00 0.00 H new ATOM 0 HG11 VAL A 396 11.977 -24.601 0.133 1.00 0.00 H new ATOM 0 HG12 VAL A 396 11.062 -26.085 0.489 1.00 0.00 H new ATOM 0 HG13 VAL A 396 10.364 -24.844 -0.578 1.00 0.00 H new ATOM 0 HG21 VAL A 396 11.310 -22.450 1.129 1.00 0.00 H new ATOM 0 HG22 VAL A 396 9.669 -22.589 0.455 1.00 0.00 H new ATOM 0 HG23 VAL A 396 9.896 -22.354 2.205 1.00 0.00 H new ATOM 539 N ASP A 397 7.620 -22.916 2.166 1.00 0.00 N ATOM 540 CA ASP A 397 6.882 -21.952 2.970 1.00 0.00 C ATOM 541 C ASP A 397 5.780 -21.278 2.158 1.00 0.00 C ATOM 542 O ASP A 397 6.039 -20.352 1.389 1.00 0.00 O ATOM 543 CB ASP A 397 7.833 -20.893 3.531 1.00 0.00 C ATOM 544 CG ASP A 397 8.237 -21.178 4.964 1.00 0.00 C ATOM 545 OD1 ASP A 397 8.874 -22.225 5.204 1.00 0.00 O ATOM 546 OD2 ASP A 397 7.916 -20.356 5.847 1.00 0.00 O ATOM 0 H ASP A 397 7.652 -22.700 1.170 1.00 0.00 H new ATOM 0 HA ASP A 397 6.416 -22.493 3.793 1.00 0.00 H new ATOM 0 HB2 ASP A 397 8.726 -20.844 2.908 1.00 0.00 H new ATOM 0 HB3 ASP A 397 7.354 -19.915 3.479 1.00 0.00 H new ATOM 551 N PRO A 398 4.528 -21.734 2.324 1.00 0.00 N ATOM 552 CA PRO A 398 3.369 -21.179 1.612 1.00 0.00 C ATOM 553 C PRO A 398 3.018 -19.767 2.079 1.00 0.00 C ATOM 554 O PRO A 398 1.863 -19.480 2.396 1.00 0.00 O ATOM 555 CB PRO A 398 2.228 -22.149 1.959 1.00 0.00 C ATOM 556 CG PRO A 398 2.885 -23.340 2.575 1.00 0.00 C ATOM 557 CD PRO A 398 4.141 -22.831 3.217 1.00 0.00 C ATOM 0 HA PRO A 398 3.562 -21.090 0.543 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.521 -21.691 2.650 1.00 0.00 H new ATOM 0 HB3 PRO A 398 1.667 -22.429 1.067 1.00 0.00 H new ATOM 0 HG2 PRO A 398 2.232 -23.809 3.311 1.00 0.00 H new ATOM 0 HG3 PRO A 398 3.110 -24.095 1.822 1.00 0.00 H new ATOM 0 HD2 PRO A 398 3.965 -22.483 4.235 1.00 0.00 H new ATOM 0 HD3 PRO A 398 4.910 -23.601 3.272 1.00 0.00 H new ATOM 565 N ASN A 399 4.016 -18.887 2.121 1.00 0.00 N ATOM 566 CA ASN A 399 3.800 -17.510 2.551 1.00 0.00 C ATOM 567 C ASN A 399 4.218 -16.519 1.469 1.00 0.00 C ATOM 568 O ASN A 399 4.995 -16.850 0.574 1.00 0.00 O ATOM 569 CB ASN A 399 4.577 -17.229 3.838 1.00 0.00 C ATOM 570 CG ASN A 399 4.424 -18.339 4.859 1.00 0.00 C ATOM 571 OD1 ASN A 399 4.681 -19.507 4.566 1.00 0.00 O ATOM 572 ND2 ASN A 399 4.003 -17.978 6.066 1.00 0.00 N ATOM 0 H ASN A 399 4.979 -19.103 1.863 1.00 0.00 H new ATOM 0 HA ASN A 399 2.734 -17.383 2.737 1.00 0.00 H new ATOM 0 HB2 ASN A 399 5.633 -17.100 3.601 1.00 0.00 H new ATOM 0 HB3 ASN A 399 4.231 -16.291 4.271 1.00 0.00 H new ATOM 0 HD21 ASN A 399 3.881 -18.681 6.795 1.00 0.00 H new ATOM 0 HD22 ASN A 399 3.802 -16.998 6.264 1.00 0.00 H new ATOM 579 N SER A 400 3.699 -15.300 1.568 1.00 0.00 N ATOM 580 CA SER A 400 4.015 -14.247 0.612 1.00 0.00 C ATOM 581 C SER A 400 4.370 -12.954 1.337 1.00 0.00 C ATOM 582 O SER A 400 3.892 -12.700 2.443 1.00 0.00 O ATOM 583 CB SER A 400 2.826 -13.997 -0.320 1.00 0.00 C ATOM 584 OG SER A 400 3.232 -13.309 -1.490 1.00 0.00 O ATOM 0 H SER A 400 3.054 -15.016 2.306 1.00 0.00 H new ATOM 0 HA SER A 400 4.872 -14.572 0.022 1.00 0.00 H new ATOM 0 HB2 SER A 400 2.368 -14.948 -0.594 1.00 0.00 H new ATOM 0 HB3 SER A 400 2.066 -13.416 0.202 1.00 0.00 H new ATOM 0 HG SER A 400 4.159 -13.007 -1.387 1.00 0.00 H new ATOM 590 N ILE A 401 5.198 -12.132 0.703 1.00 0.00 N ATOM 591 CA ILE A 401 5.597 -10.856 1.283 1.00 0.00 C ATOM 592 C ILE A 401 5.261 -9.721 0.327 1.00 0.00 C ATOM 593 O ILE A 401 5.328 -9.885 -0.890 1.00 0.00 O ATOM 594 CB ILE A 401 7.102 -10.812 1.617 1.00 0.00 C ATOM 595 CG1 ILE A 401 7.469 -11.956 2.577 1.00 0.00 C ATOM 596 CG2 ILE A 401 7.462 -9.454 2.208 1.00 0.00 C ATOM 597 CD1 ILE A 401 8.385 -11.551 3.716 1.00 0.00 C ATOM 0 H ILE A 401 5.606 -12.326 -0.212 1.00 0.00 H new ATOM 0 HA ILE A 401 5.043 -10.740 2.215 1.00 0.00 H new ATOM 0 HB ILE A 401 7.678 -10.948 0.702 1.00 0.00 H new ATOM 0 HG12 ILE A 401 6.552 -12.371 2.995 1.00 0.00 H new ATOM 0 HG13 ILE A 401 7.948 -12.752 2.007 1.00 0.00 H new ATOM 0 HG21 ILE A 401 8.526 -9.430 2.442 1.00 0.00 H new ATOM 0 HG22 ILE A 401 7.231 -8.670 1.487 1.00 0.00 H new ATOM 0 HG23 ILE A 401 6.887 -9.290 3.119 1.00 0.00 H new ATOM 0 HD11 ILE A 401 8.592 -12.419 4.343 1.00 0.00 H new ATOM 0 HD12 ILE A 401 9.320 -11.165 3.311 1.00 0.00 H new ATOM 0 HD13 ILE A 401 7.902 -10.778 4.314 1.00 0.00 H new ATOM 609 N VAL A 402 4.899 -8.571 0.880 1.00 0.00 N ATOM 610 CA VAL A 402 4.558 -7.428 0.048 1.00 0.00 C ATOM 611 C VAL A 402 4.968 -6.101 0.673 1.00 0.00 C ATOM 612 O VAL A 402 4.986 -5.947 1.894 1.00 0.00 O ATOM 613 CB VAL A 402 3.055 -7.395 -0.278 1.00 0.00 C ATOM 614 CG1 VAL A 402 2.692 -6.111 -1.008 1.00 0.00 C ATOM 615 CG2 VAL A 402 2.660 -8.614 -1.096 1.00 0.00 C ATOM 0 H VAL A 402 4.835 -8.407 1.885 1.00 0.00 H new ATOM 0 HA VAL A 402 5.125 -7.556 -0.874 1.00 0.00 H new ATOM 0 HB VAL A 402 2.499 -7.419 0.659 1.00 0.00 H new ATOM 0 HG11 VAL A 402 1.625 -6.108 -1.229 1.00 0.00 H new ATOM 0 HG12 VAL A 402 2.935 -5.254 -0.380 1.00 0.00 H new ATOM 0 HG13 VAL A 402 3.256 -6.050 -1.939 1.00 0.00 H new ATOM 0 HG21 VAL A 402 1.593 -8.574 -1.317 1.00 0.00 H new ATOM 0 HG22 VAL A 402 3.224 -8.625 -2.029 1.00 0.00 H new ATOM 0 HG23 VAL A 402 2.879 -9.519 -0.529 1.00 0.00 H new ATOM 625 N GLU A 403 5.282 -5.144 -0.192 1.00 0.00 N ATOM 626 CA GLU A 403 5.680 -3.805 0.232 1.00 0.00 C ATOM 627 C GLU A 403 4.950 -2.756 -0.601 1.00 0.00 C ATOM 628 O GLU A 403 5.165 -2.655 -1.808 1.00 0.00 O ATOM 629 CB GLU A 403 7.192 -3.626 0.097 1.00 0.00 C ATOM 630 CG GLU A 403 7.961 -4.937 0.087 1.00 0.00 C ATOM 631 CD GLU A 403 9.339 -4.798 -0.529 1.00 0.00 C ATOM 632 OE1 GLU A 403 10.222 -4.198 0.118 1.00 0.00 O ATOM 633 OE2 GLU A 403 9.536 -5.289 -1.661 1.00 0.00 O ATOM 0 H GLU A 403 5.268 -5.272 -1.204 1.00 0.00 H new ATOM 0 HA GLU A 403 5.410 -3.677 1.280 1.00 0.00 H new ATOM 0 HB2 GLU A 403 7.404 -3.083 -0.824 1.00 0.00 H new ATOM 0 HB3 GLU A 403 7.552 -3.010 0.921 1.00 0.00 H new ATOM 0 HG2 GLU A 403 8.059 -5.305 1.108 1.00 0.00 H new ATOM 0 HG3 GLU A 403 7.392 -5.684 -0.468 1.00 0.00 H new ATOM 640 N CYS A 404 4.071 -1.988 0.034 1.00 0.00 N ATOM 641 CA CYS A 404 3.306 -0.975 -0.677 1.00 0.00 C ATOM 642 C CYS A 404 4.134 0.274 -0.958 1.00 0.00 C ATOM 643 O CYS A 404 4.259 1.149 -0.102 1.00 0.00 O ATOM 644 CB CYS A 404 2.089 -0.584 0.157 1.00 0.00 C ATOM 645 SG CYS A 404 0.953 -1.946 0.507 1.00 0.00 S ATOM 0 H CYS A 404 3.873 -2.048 1.033 1.00 0.00 H new ATOM 0 HA CYS A 404 3.001 -1.401 -1.633 1.00 0.00 H new ATOM 0 HB2 CYS A 404 2.432 -0.161 1.101 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.544 0.202 -0.365 1.00 0.00 H new ATOM 0 HG CYS A 404 -0.026 -1.925 -0.348 1.00 0.00 H new ATOM 651 N ARG A 405 4.700 0.353 -2.158 1.00 0.00 N ATOM 652 CA ARG A 405 5.512 1.498 -2.544 1.00 0.00 C ATOM 653 C ARG A 405 4.661 2.577 -3.200 1.00 0.00 C ATOM 654 O ARG A 405 3.436 2.479 -3.238 1.00 0.00 O ATOM 655 CB ARG A 405 6.631 1.062 -3.489 1.00 0.00 C ATOM 656 CG ARG A 405 7.082 -0.372 -3.274 1.00 0.00 C ATOM 657 CD ARG A 405 8.427 -0.634 -3.928 1.00 0.00 C ATOM 658 NE ARG A 405 9.368 0.460 -3.703 1.00 0.00 N ATOM 659 CZ ARG A 405 10.389 0.731 -4.509 1.00 0.00 C ATOM 660 NH1 ARG A 405 10.596 -0.008 -5.590 1.00 0.00 N ATOM 661 NH2 ARG A 405 11.203 1.741 -4.235 1.00 0.00 N ATOM 0 H ARG A 405 4.610 -0.363 -2.879 1.00 0.00 H new ATOM 0 HA ARG A 405 5.955 1.917 -1.640 1.00 0.00 H new ATOM 0 HB2 ARG A 405 6.292 1.177 -4.518 1.00 0.00 H new ATOM 0 HB3 ARG A 405 7.485 1.726 -3.359 1.00 0.00 H new ATOM 0 HG2 ARG A 405 7.149 -0.578 -2.206 1.00 0.00 H new ATOM 0 HG3 ARG A 405 6.337 -1.054 -3.684 1.00 0.00 H new ATOM 0 HD2 ARG A 405 8.847 -1.560 -3.535 1.00 0.00 H new ATOM 0 HD3 ARG A 405 8.287 -0.777 -4.999 1.00 0.00 H new ATOM 0 HE ARG A 405 9.234 1.049 -2.881 1.00 0.00 H new ATOM 0 HH11 ARG A 405 9.971 -0.785 -5.804 1.00 0.00 H new ATOM 0 HH12 ARG A 405 11.380 0.201 -6.208 1.00 0.00 H new ATOM 0 HH21 ARG A 405 11.046 2.312 -3.404 1.00 0.00 H new ATOM 0 HH22 ARG A 405 11.986 1.947 -4.855 1.00 0.00 H new ATOM 675 N VAL A 406 5.321 3.612 -3.707 1.00 0.00 N ATOM 676 CA VAL A 406 4.620 4.716 -4.351 1.00 0.00 C ATOM 677 C VAL A 406 5.472 5.380 -5.424 1.00 0.00 C ATOM 678 O VAL A 406 6.694 5.248 -5.433 1.00 0.00 O ATOM 679 CB VAL A 406 4.179 5.775 -3.321 1.00 0.00 C ATOM 680 CG1 VAL A 406 2.675 5.722 -3.124 1.00 0.00 C ATOM 681 CG2 VAL A 406 4.896 5.571 -1.993 1.00 0.00 C ATOM 0 H VAL A 406 6.336 3.710 -3.685 1.00 0.00 H new ATOM 0 HA VAL A 406 3.737 4.288 -4.825 1.00 0.00 H new ATOM 0 HB VAL A 406 4.448 6.759 -3.705 1.00 0.00 H new ATOM 0 HG11 VAL A 406 2.377 6.475 -2.394 1.00 0.00 H new ATOM 0 HG12 VAL A 406 2.177 5.919 -4.073 1.00 0.00 H new ATOM 0 HG13 VAL A 406 2.390 4.734 -2.763 1.00 0.00 H new ATOM 0 HG21 VAL A 406 4.569 6.330 -1.282 1.00 0.00 H new ATOM 0 HG22 VAL A 406 4.661 4.581 -1.601 1.00 0.00 H new ATOM 0 HG23 VAL A 406 5.972 5.655 -2.144 1.00 0.00 H new ATOM 691 N GLY A 407 4.810 6.091 -6.335 1.00 0.00 N ATOM 692 CA GLY A 407 5.512 6.766 -7.409 1.00 0.00 C ATOM 693 C GLY A 407 6.796 7.434 -6.951 1.00 0.00 C ATOM 694 O GLY A 407 7.716 7.632 -7.745 1.00 0.00 O ATOM 0 H GLY A 407 3.797 6.210 -6.346 1.00 0.00 H new ATOM 0 HA2 GLY A 407 5.744 6.045 -8.193 1.00 0.00 H new ATOM 0 HA3 GLY A 407 4.856 7.517 -7.849 1.00 0.00 H new ATOM 698 N ASP A 408 6.859 7.786 -5.670 1.00 0.00 N ATOM 699 CA ASP A 408 8.040 8.441 -5.115 1.00 0.00 C ATOM 700 C ASP A 408 9.159 7.436 -4.852 1.00 0.00 C ATOM 701 O ASP A 408 10.214 7.795 -4.328 1.00 0.00 O ATOM 702 CB ASP A 408 7.679 9.165 -3.817 1.00 0.00 C ATOM 703 CG ASP A 408 7.832 10.669 -3.932 1.00 0.00 C ATOM 704 OD1 ASP A 408 7.928 11.170 -5.073 1.00 0.00 O ATOM 705 OD2 ASP A 408 7.855 11.345 -2.882 1.00 0.00 O ATOM 0 H ASP A 408 6.108 7.629 -4.998 1.00 0.00 H new ATOM 0 HA ASP A 408 8.397 9.165 -5.847 1.00 0.00 H new ATOM 0 HB2 ASP A 408 6.651 8.927 -3.545 1.00 0.00 H new ATOM 0 HB3 ASP A 408 8.315 8.798 -3.011 1.00 0.00 H new ATOM 710 N GLY A 409 8.924 6.180 -5.216 1.00 0.00 N ATOM 711 CA GLY A 409 9.924 5.148 -5.009 1.00 0.00 C ATOM 712 C GLY A 409 10.097 4.801 -3.543 1.00 0.00 C ATOM 713 O GLY A 409 10.994 4.040 -3.180 1.00 0.00 O ATOM 0 H GLY A 409 8.059 5.858 -5.651 1.00 0.00 H new ATOM 0 HA2 GLY A 409 9.639 4.252 -5.561 1.00 0.00 H new ATOM 0 HA3 GLY A 409 10.878 5.483 -5.416 1.00 0.00 H new ATOM 717 N THR A 410 9.240 5.368 -2.700 1.00 0.00 N ATOM 718 CA THR A 410 9.300 5.123 -1.265 1.00 0.00 C ATOM 719 C THR A 410 8.240 4.115 -0.830 1.00 0.00 C ATOM 720 O THR A 410 7.126 4.104 -1.350 1.00 0.00 O ATOM 721 CB THR A 410 9.106 6.426 -0.468 1.00 0.00 C ATOM 722 OG1 THR A 410 9.762 7.530 -1.104 1.00 0.00 O ATOM 723 CG2 THR A 410 9.658 6.285 0.944 1.00 0.00 C ATOM 0 H THR A 410 8.494 6.002 -2.988 1.00 0.00 H new ATOM 0 HA THR A 410 10.290 4.717 -1.056 1.00 0.00 H new ATOM 0 HB THR A 410 8.034 6.617 -0.429 1.00 0.00 H new ATOM 0 HG1 THR A 410 9.620 8.343 -0.576 1.00 0.00 H new ATOM 0 HG21 THR A 410 9.509 7.218 1.488 1.00 0.00 H new ATOM 0 HG22 THR A 410 9.137 5.478 1.459 1.00 0.00 H new ATOM 0 HG23 THR A 410 10.723 6.058 0.897 1.00 0.00 H new ATOM 731 N VAL A 411 8.597 3.274 0.130 1.00 0.00 N ATOM 732 CA VAL A 411 7.677 2.262 0.643 1.00 0.00 C ATOM 733 C VAL A 411 6.862 2.804 1.812 1.00 0.00 C ATOM 734 O VAL A 411 7.396 3.027 2.898 1.00 0.00 O ATOM 735 CB VAL A 411 8.432 1.000 1.098 1.00 0.00 C ATOM 736 CG1 VAL A 411 7.460 -0.143 1.351 1.00 0.00 C ATOM 737 CG2 VAL A 411 9.477 0.603 0.066 1.00 0.00 C ATOM 0 H VAL A 411 9.517 3.270 0.571 1.00 0.00 H new ATOM 0 HA VAL A 411 7.004 2.000 -0.174 1.00 0.00 H new ATOM 0 HB VAL A 411 8.945 1.223 2.034 1.00 0.00 H new ATOM 0 HG11 VAL A 411 8.012 -1.026 1.672 1.00 0.00 H new ATOM 0 HG12 VAL A 411 6.754 0.146 2.129 1.00 0.00 H new ATOM 0 HG13 VAL A 411 6.917 -0.368 0.433 1.00 0.00 H new ATOM 0 HG21 VAL A 411 10.001 -0.291 0.404 1.00 0.00 H new ATOM 0 HG22 VAL A 411 8.988 0.399 -0.887 1.00 0.00 H new ATOM 0 HG23 VAL A 411 10.191 1.417 -0.060 1.00 0.00 H new ATOM 747 N LEU A 412 5.565 3.014 1.589 1.00 0.00 N ATOM 748 CA LEU A 412 4.693 3.531 2.637 1.00 0.00 C ATOM 749 C LEU A 412 4.170 2.404 3.518 1.00 0.00 C ATOM 750 O LEU A 412 3.998 2.581 4.724 1.00 0.00 O ATOM 751 CB LEU A 412 3.519 4.331 2.051 1.00 0.00 C ATOM 752 CG LEU A 412 2.838 3.738 0.815 1.00 0.00 C ATOM 753 CD1 LEU A 412 2.004 2.526 1.193 1.00 0.00 C ATOM 754 CD2 LEU A 412 1.969 4.789 0.141 1.00 0.00 C ATOM 0 H LEU A 412 5.100 2.835 0.699 1.00 0.00 H new ATOM 0 HA LEU A 412 5.291 4.205 3.250 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.766 4.452 2.830 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.879 5.328 1.797 1.00 0.00 H new ATOM 0 HG LEU A 412 3.609 3.418 0.115 1.00 0.00 H new ATOM 0 HD11 LEU A 412 1.528 2.119 0.301 1.00 0.00 H new ATOM 0 HD12 LEU A 412 2.646 1.767 1.640 1.00 0.00 H new ATOM 0 HD13 LEU A 412 1.238 2.821 1.910 1.00 0.00 H new ATOM 0 HD21 LEU A 412 1.490 4.356 -0.737 1.00 0.00 H new ATOM 0 HD22 LEU A 412 1.206 5.132 0.839 1.00 0.00 H new ATOM 0 HD23 LEU A 412 2.588 5.633 -0.163 1.00 0.00 H new ATOM 766 N GLY A 413 3.903 1.250 2.917 1.00 0.00 N ATOM 767 CA GLY A 413 3.389 0.133 3.685 1.00 0.00 C ATOM 768 C GLY A 413 4.091 -1.178 3.394 1.00 0.00 C ATOM 769 O GLY A 413 4.894 -1.278 2.467 1.00 0.00 O ATOM 0 H GLY A 413 4.032 1.069 1.921 1.00 0.00 H new ATOM 0 HA2 GLY A 413 3.485 0.359 4.747 1.00 0.00 H new ATOM 0 HA3 GLY A 413 2.325 0.019 3.478 1.00 0.00 H new ATOM 773 N THR A 414 3.769 -2.183 4.198 1.00 0.00 N ATOM 774 CA THR A 414 4.341 -3.516 4.056 1.00 0.00 C ATOM 775 C THR A 414 3.474 -4.528 4.793 1.00 0.00 C ATOM 776 O THR A 414 2.884 -4.208 5.825 1.00 0.00 O ATOM 777 CB THR A 414 5.778 -3.580 4.606 1.00 0.00 C ATOM 778 OG1 THR A 414 6.638 -2.651 3.933 1.00 0.00 O ATOM 779 CG2 THR A 414 6.357 -4.976 4.444 1.00 0.00 C ATOM 0 H THR A 414 3.104 -2.097 4.967 1.00 0.00 H new ATOM 0 HA THR A 414 4.373 -3.752 2.992 1.00 0.00 H new ATOM 0 HB THR A 414 5.724 -3.321 5.663 1.00 0.00 H new ATOM 0 HG1 THR A 414 6.191 -2.316 3.128 1.00 0.00 H new ATOM 0 HG21 THR A 414 7.373 -4.997 4.839 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.741 -5.691 4.989 1.00 0.00 H new ATOM 0 HG23 THR A 414 6.374 -5.243 3.387 1.00 0.00 H new ATOM 787 N GLY A 415 3.389 -5.745 4.270 1.00 0.00 N ATOM 788 CA GLY A 415 2.576 -6.754 4.920 1.00 0.00 C ATOM 789 C GLY A 415 2.817 -8.146 4.378 1.00 0.00 C ATOM 790 O GLY A 415 3.144 -8.320 3.204 1.00 0.00 O ATOM 0 H GLY A 415 3.862 -6.049 3.419 1.00 0.00 H new ATOM 0 HA2 GLY A 415 2.783 -6.746 5.990 1.00 0.00 H new ATOM 0 HA3 GLY A 415 1.523 -6.499 4.797 1.00 0.00 H new ATOM 794 N VAL A 416 2.642 -9.142 5.238 1.00 0.00 N ATOM 795 CA VAL A 416 2.829 -10.529 4.853 1.00 0.00 C ATOM 796 C VAL A 416 1.506 -11.285 4.950 1.00 0.00 C ATOM 797 O VAL A 416 0.695 -11.024 5.838 1.00 0.00 O ATOM 798 CB VAL A 416 3.897 -11.215 5.739 1.00 0.00 C ATOM 799 CG1 VAL A 416 3.636 -12.709 5.870 1.00 0.00 C ATOM 800 CG2 VAL A 416 5.289 -10.964 5.180 1.00 0.00 C ATOM 0 H VAL A 416 2.369 -9.010 6.212 1.00 0.00 H new ATOM 0 HA VAL A 416 3.179 -10.549 3.821 1.00 0.00 H new ATOM 0 HB VAL A 416 3.834 -10.779 6.736 1.00 0.00 H new ATOM 0 HG11 VAL A 416 4.405 -13.159 6.498 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.657 -12.869 6.323 1.00 0.00 H new ATOM 0 HG13 VAL A 416 3.659 -13.170 4.883 1.00 0.00 H new ATOM 0 HG21 VAL A 416 6.029 -11.453 5.814 1.00 0.00 H new ATOM 0 HG22 VAL A 416 5.353 -11.367 4.169 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.483 -9.892 5.156 1.00 0.00 H new ATOM 810 N GLY A 417 1.296 -12.217 4.030 1.00 0.00 N ATOM 811 CA GLY A 417 0.073 -12.994 4.034 1.00 0.00 C ATOM 812 C GLY A 417 0.212 -14.288 3.259 1.00 0.00 C ATOM 813 O GLY A 417 1.169 -14.468 2.507 1.00 0.00 O ATOM 0 H GLY A 417 1.950 -12.448 3.282 1.00 0.00 H new ATOM 0 HA2 GLY A 417 -0.209 -13.218 5.063 1.00 0.00 H new ATOM 0 HA3 GLY A 417 -0.734 -12.400 3.604 1.00 0.00 H new ATOM 817 N ARG A 418 -0.744 -15.190 3.439 1.00 0.00 N ATOM 818 CA ARG A 418 -0.719 -16.469 2.745 1.00 0.00 C ATOM 819 C ARG A 418 -0.310 -16.274 1.292 1.00 0.00 C ATOM 820 O ARG A 418 0.481 -17.042 0.746 1.00 0.00 O ATOM 821 CB ARG A 418 -2.091 -17.133 2.817 1.00 0.00 C ATOM 822 CG ARG A 418 -3.230 -16.193 2.465 1.00 0.00 C ATOM 823 CD ARG A 418 -4.415 -16.381 3.397 1.00 0.00 C ATOM 824 NE ARG A 418 -5.028 -17.697 3.245 1.00 0.00 N ATOM 825 CZ ARG A 418 -5.815 -18.253 4.158 1.00 0.00 C ATOM 826 NH1 ARG A 418 -6.087 -17.607 5.284 1.00 0.00 N ATOM 827 NH2 ARG A 418 -6.334 -19.454 3.946 1.00 0.00 N ATOM 0 H ARG A 418 -1.544 -15.059 4.058 1.00 0.00 H new ATOM 0 HA ARG A 418 0.012 -17.115 3.231 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -2.110 -17.986 2.139 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -2.247 -17.521 3.823 1.00 0.00 H new ATOM 0 HG2 ARG A 418 -2.882 -15.161 2.520 1.00 0.00 H new ATOM 0 HG3 ARG A 418 -3.544 -16.369 1.436 1.00 0.00 H new ATOM 0 HD2 ARG A 418 -4.089 -16.250 4.429 1.00 0.00 H new ATOM 0 HD3 ARG A 418 -5.159 -15.610 3.198 1.00 0.00 H new ATOM 0 HE ARG A 418 -4.841 -18.219 2.389 1.00 0.00 H new ATOM 0 HH11 ARG A 418 -5.691 -16.682 5.449 1.00 0.00 H new ATOM 0 HH12 ARG A 418 -6.692 -18.036 5.985 1.00 0.00 H new ATOM 0 HH21 ARG A 418 -6.129 -19.953 3.080 1.00 0.00 H new ATOM 0 HH22 ARG A 418 -6.938 -19.880 4.649 1.00 0.00 H new ATOM 841 N ASN A 419 -0.856 -15.234 0.677 1.00 0.00 N ATOM 842 CA ASN A 419 -0.555 -14.916 -0.710 1.00 0.00 C ATOM 843 C ASN A 419 -0.228 -13.436 -0.856 1.00 0.00 C ATOM 844 O ASN A 419 -0.220 -12.694 0.126 1.00 0.00 O ATOM 845 CB ASN A 419 -1.740 -15.277 -1.606 1.00 0.00 C ATOM 846 CG ASN A 419 -1.515 -16.565 -2.374 1.00 0.00 C ATOM 847 OD1 ASN A 419 -1.222 -17.640 -1.653 1.00 0.00 O flip ATOM 848 ND2 ASN A 419 -1.604 -16.592 -3.601 1.00 0.00 N flip ATOM 0 H ASN A 419 -1.514 -14.593 1.121 1.00 0.00 H new ATOM 0 HA ASN A 419 0.312 -15.501 -1.017 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -2.637 -15.374 -0.995 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -1.920 -14.465 -2.310 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -1.832 -15.741 -4.115 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -1.450 -17.466 -4.104 1.00 0.00 H new ATOM 855 N ILE A 420 0.039 -13.011 -2.084 1.00 0.00 N ATOM 856 CA ILE A 420 0.363 -11.617 -2.352 1.00 0.00 C ATOM 857 C ILE A 420 -0.810 -10.707 -2.008 1.00 0.00 C ATOM 858 O ILE A 420 -0.657 -9.489 -1.926 1.00 0.00 O ATOM 859 CB ILE A 420 0.751 -11.407 -3.829 1.00 0.00 C ATOM 860 CG1 ILE A 420 2.171 -11.911 -4.079 1.00 0.00 C ATOM 861 CG2 ILE A 420 0.628 -9.938 -4.213 1.00 0.00 C ATOM 862 CD1 ILE A 420 2.220 -13.231 -4.816 1.00 0.00 C ATOM 0 H ILE A 420 0.038 -13.611 -2.909 1.00 0.00 H new ATOM 0 HA ILE A 420 1.214 -11.360 -1.722 1.00 0.00 H new ATOM 0 HB ILE A 420 0.064 -11.980 -4.453 1.00 0.00 H new ATOM 0 HG12 ILE A 420 2.718 -11.163 -4.653 1.00 0.00 H new ATOM 0 HG13 ILE A 420 2.684 -12.018 -3.123 1.00 0.00 H new ATOM 0 HG21 ILE A 420 0.906 -9.811 -5.259 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -0.401 -9.609 -4.069 1.00 0.00 H new ATOM 0 HG23 ILE A 420 1.291 -9.341 -3.586 1.00 0.00 H new ATOM 0 HD11 ILE A 420 3.259 -13.529 -4.960 1.00 0.00 H new ATOM 0 HD12 ILE A 420 1.701 -13.992 -4.234 1.00 0.00 H new ATOM 0 HD13 ILE A 420 1.736 -13.124 -5.787 1.00 0.00 H new ATOM 874 N LYS A 421 -1.977 -11.302 -1.813 1.00 0.00 N ATOM 875 CA LYS A 421 -3.162 -10.537 -1.484 1.00 0.00 C ATOM 876 C LYS A 421 -3.213 -10.222 0.001 1.00 0.00 C ATOM 877 O LYS A 421 -3.248 -9.060 0.395 1.00 0.00 O ATOM 878 CB LYS A 421 -4.407 -11.302 -1.902 1.00 0.00 C ATOM 879 CG LYS A 421 -5.679 -10.684 -1.382 1.00 0.00 C ATOM 880 CD LYS A 421 -5.635 -9.176 -1.517 1.00 0.00 C ATOM 881 CE LYS A 421 -5.638 -8.762 -2.975 1.00 0.00 C ATOM 882 NZ LYS A 421 -7.019 -8.568 -3.497 1.00 0.00 N ATOM 0 H LYS A 421 -2.125 -12.309 -1.877 1.00 0.00 H new ATOM 0 HA LYS A 421 -3.122 -9.593 -2.028 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.450 -11.348 -2.990 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.334 -12.328 -1.542 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.533 -11.079 -1.933 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -5.821 -10.957 -0.336 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.493 -8.736 -1.008 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -4.741 -8.789 -1.027 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -5.074 -7.837 -3.090 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -5.129 -9.522 -3.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -6.976 -8.286 -4.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -7.551 -9.458 -3.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -7.497 -7.825 -2.948 1.00 0.00 H new ATOM 896 N ILE A 422 -3.210 -11.255 0.825 1.00 0.00 N ATOM 897 CA ILE A 422 -3.253 -11.059 2.264 1.00 0.00 C ATOM 898 C ILE A 422 -2.116 -10.165 2.706 1.00 0.00 C ATOM 899 O ILE A 422 -2.273 -9.339 3.605 1.00 0.00 O ATOM 900 CB ILE A 422 -3.193 -12.390 3.017 1.00 0.00 C ATOM 901 CG1 ILE A 422 -4.395 -13.259 2.645 1.00 0.00 C ATOM 902 CG2 ILE A 422 -3.147 -12.152 4.519 1.00 0.00 C ATOM 903 CD1 ILE A 422 -5.603 -12.473 2.155 1.00 0.00 C ATOM 0 H ILE A 422 -3.179 -12.230 0.527 1.00 0.00 H new ATOM 0 HA ILE A 422 -4.203 -10.580 2.503 1.00 0.00 H new ATOM 0 HB ILE A 422 -2.282 -12.915 2.728 1.00 0.00 H new ATOM 0 HG12 ILE A 422 -4.094 -13.963 1.869 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -4.687 -13.848 3.514 1.00 0.00 H new ATOM 0 HG21 ILE A 422 -3.105 -13.110 5.038 1.00 0.00 H new ATOM 0 HG22 ILE A 422 -2.263 -11.565 4.767 1.00 0.00 H new ATOM 0 HG23 ILE A 422 -4.041 -11.610 4.829 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -6.412 -13.162 1.912 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -5.933 -11.788 2.936 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -5.331 -11.905 1.265 1.00 0.00 H new ATOM 915 N ALA A 423 -0.978 -10.303 2.043 1.00 0.00 N ATOM 916 CA ALA A 423 0.157 -9.464 2.352 1.00 0.00 C ATOM 917 C ALA A 423 -0.174 -8.052 1.902 1.00 0.00 C ATOM 918 O ALA A 423 -0.088 -7.094 2.671 1.00 0.00 O ATOM 919 CB ALA A 423 1.423 -9.967 1.676 1.00 0.00 C ATOM 0 H ALA A 423 -0.822 -10.981 1.297 1.00 0.00 H new ATOM 0 HA ALA A 423 0.349 -9.485 3.425 1.00 0.00 H new ATOM 0 HB1 ALA A 423 2.256 -9.312 1.931 1.00 0.00 H new ATOM 0 HB2 ALA A 423 1.640 -10.979 2.017 1.00 0.00 H new ATOM 0 HB3 ALA A 423 1.281 -9.971 0.595 1.00 0.00 H new ATOM 925 N GLY A 424 -0.587 -7.950 0.640 1.00 0.00 N ATOM 926 CA GLY A 424 -0.969 -6.671 0.077 1.00 0.00 C ATOM 927 C GLY A 424 -2.058 -6.007 0.894 1.00 0.00 C ATOM 928 O GLY A 424 -1.975 -4.816 1.195 1.00 0.00 O ATOM 0 H GLY A 424 -0.663 -8.738 -0.004 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -0.098 -6.018 0.031 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -1.316 -6.812 -0.947 1.00 0.00 H new ATOM 932 N ILE A 425 -3.078 -6.779 1.275 1.00 0.00 N ATOM 933 CA ILE A 425 -4.163 -6.244 2.084 1.00 0.00 C ATOM 934 C ILE A 425 -3.597 -5.654 3.370 1.00 0.00 C ATOM 935 O ILE A 425 -3.708 -4.456 3.634 1.00 0.00 O ATOM 936 CB ILE A 425 -5.190 -7.333 2.464 1.00 0.00 C ATOM 937 CG1 ILE A 425 -5.849 -7.916 1.220 1.00 0.00 C ATOM 938 CG2 ILE A 425 -6.241 -6.762 3.404 1.00 0.00 C ATOM 939 CD1 ILE A 425 -6.132 -9.394 1.333 1.00 0.00 C ATOM 0 H ILE A 425 -3.171 -7.766 1.037 1.00 0.00 H new ATOM 0 HA ILE A 425 -4.666 -5.481 1.490 1.00 0.00 H new ATOM 0 HB ILE A 425 -4.662 -8.137 2.976 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -6.783 -7.387 1.030 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -5.203 -7.741 0.359 1.00 0.00 H new ATOM 0 HG21 ILE A 425 -6.958 -7.540 3.664 1.00 0.00 H new ATOM 0 HG22 ILE A 425 -5.758 -6.396 4.310 1.00 0.00 H new ATOM 0 HG23 ILE A 425 -6.760 -5.939 2.912 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -6.601 -9.746 0.414 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -5.198 -9.932 1.493 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -6.802 -9.573 2.174 1.00 0.00 H new ATOM 951 N ARG A 426 -2.991 -6.525 4.166 1.00 0.00 N ATOM 952 CA ARG A 426 -2.397 -6.132 5.437 1.00 0.00 C ATOM 953 C ARG A 426 -1.451 -4.943 5.273 1.00 0.00 C ATOM 954 O ARG A 426 -1.385 -4.072 6.138 1.00 0.00 O ATOM 955 CB ARG A 426 -1.648 -7.316 6.040 1.00 0.00 C ATOM 956 CG ARG A 426 -2.063 -7.640 7.465 1.00 0.00 C ATOM 957 CD ARG A 426 -1.285 -8.825 8.016 1.00 0.00 C ATOM 958 NE ARG A 426 -0.553 -8.482 9.233 1.00 0.00 N ATOM 959 CZ ARG A 426 0.649 -7.916 9.232 1.00 0.00 C ATOM 960 NH1 ARG A 426 1.249 -7.631 8.085 1.00 0.00 N ATOM 961 NH2 ARG A 426 1.250 -7.633 10.380 1.00 0.00 N ATOM 0 H ARG A 426 -2.898 -7.518 3.951 1.00 0.00 H new ATOM 0 HA ARG A 426 -3.201 -5.825 6.106 1.00 0.00 H new ATOM 0 HB2 ARG A 426 -1.811 -8.194 5.415 1.00 0.00 H new ATOM 0 HB3 ARG A 426 -0.579 -7.106 6.021 1.00 0.00 H new ATOM 0 HG2 ARG A 426 -1.899 -6.769 8.100 1.00 0.00 H new ATOM 0 HG3 ARG A 426 -3.130 -7.859 7.493 1.00 0.00 H new ATOM 0 HD2 ARG A 426 -1.973 -9.644 8.226 1.00 0.00 H new ATOM 0 HD3 ARG A 426 -0.585 -9.182 7.260 1.00 0.00 H new ATOM 0 HE ARG A 426 -0.988 -8.688 10.132 1.00 0.00 H new ATOM 0 HH11 ARG A 426 0.788 -7.846 7.201 1.00 0.00 H new ATOM 0 HH12 ARG A 426 2.172 -7.196 8.086 1.00 0.00 H new ATOM 0 HH21 ARG A 426 0.789 -7.850 11.264 1.00 0.00 H new ATOM 0 HH22 ARG A 426 2.173 -7.198 10.379 1.00 0.00 H new ATOM 975 N ALA A 427 -0.715 -4.912 4.166 1.00 0.00 N ATOM 976 CA ALA A 427 0.230 -3.827 3.908 1.00 0.00 C ATOM 977 C ALA A 427 -0.496 -2.527 3.578 1.00 0.00 C ATOM 978 O ALA A 427 -0.377 -1.539 4.300 1.00 0.00 O ATOM 979 CB ALA A 427 1.181 -4.190 2.776 1.00 0.00 C ATOM 0 H ALA A 427 -0.753 -5.622 3.435 1.00 0.00 H new ATOM 0 HA ALA A 427 0.809 -3.678 4.819 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.874 -3.366 2.604 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.742 -5.085 3.045 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.610 -4.379 1.867 1.00 0.00 H new ATOM 985 N ALA A 428 -1.242 -2.537 2.481 1.00 0.00 N ATOM 986 CA ALA A 428 -1.977 -1.354 2.054 1.00 0.00 C ATOM 987 C ALA A 428 -2.635 -0.723 3.262 1.00 0.00 C ATOM 988 O ALA A 428 -2.504 0.474 3.518 1.00 0.00 O ATOM 989 CB ALA A 428 -3.020 -1.699 1.009 1.00 0.00 C ATOM 0 H ALA A 428 -1.354 -3.348 1.873 1.00 0.00 H new ATOM 0 HA ALA A 428 -1.279 -0.651 1.600 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -3.550 -0.794 0.712 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -2.532 -2.136 0.138 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -3.729 -2.415 1.425 1.00 0.00 H new ATOM 995 N GLU A 429 -3.318 -1.564 4.013 1.00 0.00 N ATOM 996 CA GLU A 429 -3.990 -1.152 5.223 1.00 0.00 C ATOM 997 C GLU A 429 -2.965 -0.652 6.241 1.00 0.00 C ATOM 998 O GLU A 429 -3.050 0.462 6.748 1.00 0.00 O ATOM 999 CB GLU A 429 -4.744 -2.349 5.784 1.00 0.00 C ATOM 1000 CG GLU A 429 -6.198 -2.056 6.118 1.00 0.00 C ATOM 1001 CD GLU A 429 -6.440 -1.912 7.607 1.00 0.00 C ATOM 1002 OE1 GLU A 429 -5.730 -2.577 8.391 1.00 0.00 O ATOM 1003 OE2 GLU A 429 -7.340 -1.134 7.990 1.00 0.00 O ATOM 0 H GLU A 429 -3.421 -2.556 3.798 1.00 0.00 H new ATOM 0 HA GLU A 429 -4.687 -0.342 5.009 1.00 0.00 H new ATOM 0 HB2 GLU A 429 -4.704 -3.163 5.061 1.00 0.00 H new ATOM 0 HB3 GLU A 429 -4.237 -2.697 6.684 1.00 0.00 H new ATOM 0 HG2 GLU A 429 -6.504 -1.139 5.614 1.00 0.00 H new ATOM 0 HG3 GLU A 429 -6.825 -2.858 5.728 1.00 0.00 H new ATOM 1010 N ASN A 430 -2.002 -1.511 6.522 1.00 0.00 N ATOM 1011 CA ASN A 430 -0.952 -1.201 7.480 1.00 0.00 C ATOM 1012 C ASN A 430 -0.445 0.211 7.247 1.00 0.00 C ATOM 1013 O ASN A 430 -0.449 1.042 8.156 1.00 0.00 O ATOM 1014 CB ASN A 430 0.195 -2.196 7.350 1.00 0.00 C ATOM 1015 CG ASN A 430 1.384 -1.831 8.218 1.00 0.00 C ATOM 1016 OD1 ASN A 430 2.211 -1.000 7.842 1.00 0.00 O ATOM 1017 ND2 ASN A 430 1.475 -2.454 9.388 1.00 0.00 N ATOM 0 H ASN A 430 -1.924 -2.435 6.098 1.00 0.00 H new ATOM 0 HA ASN A 430 -1.362 -1.273 8.488 1.00 0.00 H new ATOM 0 HB2 ASN A 430 -0.158 -3.190 7.624 1.00 0.00 H new ATOM 0 HB3 ASN A 430 0.512 -2.246 6.308 1.00 0.00 H new ATOM 0 HD21 ASN A 430 2.253 -2.250 10.015 1.00 0.00 H new ATOM 0 HD22 ASN A 430 0.767 -3.136 9.659 1.00 0.00 H new ATOM 1024 N ALA A 431 -0.046 0.487 6.018 1.00 0.00 N ATOM 1025 CA ALA A 431 0.421 1.813 5.655 1.00 0.00 C ATOM 1026 C ALA A 431 -0.729 2.792 5.769 1.00 0.00 C ATOM 1027 O ALA A 431 -0.561 3.943 6.171 1.00 0.00 O ATOM 1028 CB ALA A 431 0.964 1.821 4.240 1.00 0.00 C ATOM 0 H ALA A 431 -0.036 -0.189 5.255 1.00 0.00 H new ATOM 0 HA ALA A 431 1.225 2.104 6.331 1.00 0.00 H new ATOM 0 HB1 ALA A 431 1.309 2.824 3.988 1.00 0.00 H new ATOM 0 HB2 ALA A 431 1.797 1.122 4.166 1.00 0.00 H new ATOM 0 HB3 ALA A 431 0.177 1.523 3.547 1.00 0.00 H new ATOM 1034 N LEU A 432 -1.904 2.301 5.406 1.00 0.00 N ATOM 1035 CA LEU A 432 -3.126 3.083 5.448 1.00 0.00 C ATOM 1036 C LEU A 432 -3.456 3.508 6.877 1.00 0.00 C ATOM 1037 O LEU A 432 -3.941 4.615 7.109 1.00 0.00 O ATOM 1038 CB LEU A 432 -4.256 2.244 4.862 1.00 0.00 C ATOM 1039 CG LEU A 432 -5.649 2.846 4.936 1.00 0.00 C ATOM 1040 CD1 LEU A 432 -6.587 2.032 4.063 1.00 0.00 C ATOM 1041 CD2 LEU A 432 -6.141 2.877 6.375 1.00 0.00 C ATOM 0 H LEU A 432 -2.035 1.346 5.073 1.00 0.00 H new ATOM 0 HA LEU A 432 -2.997 3.993 4.862 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -4.025 2.042 3.816 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -4.271 1.283 5.376 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.621 3.873 4.573 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -7.589 2.458 4.111 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -6.233 2.051 3.032 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -6.613 1.002 4.419 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -7.140 3.311 6.409 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -6.173 1.862 6.770 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -5.463 3.480 6.979 1.00 0.00 H new ATOM 1053 N ARG A 433 -3.187 2.624 7.833 1.00 0.00 N ATOM 1054 CA ARG A 433 -3.454 2.918 9.238 1.00 0.00 C ATOM 1055 C ARG A 433 -2.707 4.172 9.676 1.00 0.00 C ATOM 1056 O ARG A 433 -3.114 4.858 10.612 1.00 0.00 O ATOM 1057 CB ARG A 433 -3.039 1.740 10.123 1.00 0.00 C ATOM 1058 CG ARG A 433 -3.165 0.388 9.446 1.00 0.00 C ATOM 1059 CD ARG A 433 -4.526 0.217 8.795 1.00 0.00 C ATOM 1060 NE ARG A 433 -5.617 0.350 9.755 1.00 0.00 N ATOM 1061 CZ ARG A 433 -5.875 -0.543 10.704 1.00 0.00 C ATOM 1062 NH1 ARG A 433 -5.120 -1.626 10.822 1.00 0.00 N ATOM 1063 NH2 ARG A 433 -6.890 -0.354 11.537 1.00 0.00 N ATOM 0 H ARG A 433 -2.786 1.702 7.662 1.00 0.00 H new ATOM 0 HA ARG A 433 -4.525 3.086 9.348 1.00 0.00 H new ATOM 0 HB2 ARG A 433 -2.006 1.882 10.439 1.00 0.00 H new ATOM 0 HB3 ARG A 433 -3.651 1.742 11.025 1.00 0.00 H new ATOM 0 HG2 ARG A 433 -2.384 0.283 8.693 1.00 0.00 H new ATOM 0 HG3 ARG A 433 -3.009 -0.403 10.179 1.00 0.00 H new ATOM 0 HD2 ARG A 433 -4.646 0.960 8.006 1.00 0.00 H new ATOM 0 HD3 ARG A 433 -4.579 -0.763 8.320 1.00 0.00 H new ATOM 0 HE ARG A 433 -6.215 1.174 9.694 1.00 0.00 H new ATOM 0 HH11 ARG A 433 -4.339 -1.775 10.183 1.00 0.00 H new ATOM 0 HH12 ARG A 433 -5.320 -2.310 11.552 1.00 0.00 H new ATOM 0 HH21 ARG A 433 -7.474 0.478 11.449 1.00 0.00 H new ATOM 0 HH22 ARG A 433 -7.087 -1.041 12.265 1.00 0.00 H new ATOM 1077 N ASP A 434 -1.603 4.455 8.995 1.00 0.00 N ATOM 1078 CA ASP A 434 -0.779 5.613 9.303 1.00 0.00 C ATOM 1079 C ASP A 434 -1.409 6.904 8.783 1.00 0.00 C ATOM 1080 O ASP A 434 -1.443 7.146 7.576 1.00 0.00 O ATOM 1081 CB ASP A 434 0.609 5.424 8.696 1.00 0.00 C ATOM 1082 CG ASP A 434 1.213 4.076 9.041 1.00 0.00 C ATOM 1083 OD1 ASP A 434 1.395 3.798 10.245 1.00 0.00 O ATOM 1084 OD2 ASP A 434 1.503 3.300 8.107 1.00 0.00 O ATOM 0 H ASP A 434 -1.257 3.891 8.219 1.00 0.00 H new ATOM 0 HA ASP A 434 -0.699 5.699 10.387 1.00 0.00 H new ATOM 0 HB2 ASP A 434 0.545 5.524 7.612 1.00 0.00 H new ATOM 0 HB3 ASP A 434 1.269 6.216 9.051 1.00 0.00 H new ATOM 1089 N LYS A 435 -1.902 7.732 9.702 1.00 0.00 N ATOM 1090 CA LYS A 435 -2.524 8.999 9.337 1.00 0.00 C ATOM 1091 C LYS A 435 -1.487 9.996 8.844 1.00 0.00 C ATOM 1092 O LYS A 435 -1.579 10.492 7.726 1.00 0.00 O ATOM 1093 CB LYS A 435 -3.284 9.582 10.529 1.00 0.00 C ATOM 1094 CG LYS A 435 -4.299 10.643 10.136 1.00 0.00 C ATOM 1095 CD LYS A 435 -5.723 10.158 10.354 1.00 0.00 C ATOM 1096 CE LYS A 435 -6.087 9.046 9.383 1.00 0.00 C ATOM 1097 NZ LYS A 435 -7.281 8.282 9.837 1.00 0.00 N ATOM 0 H LYS A 435 -1.882 7.546 10.705 1.00 0.00 H new ATOM 0 HA LYS A 435 -3.227 8.806 8.526 1.00 0.00 H new ATOM 0 HB2 LYS A 435 -3.797 8.776 11.053 1.00 0.00 H new ATOM 0 HB3 LYS A 435 -2.570 10.015 11.230 1.00 0.00 H new ATOM 0 HG2 LYS A 435 -4.128 11.547 10.721 1.00 0.00 H new ATOM 0 HG3 LYS A 435 -4.161 10.910 9.088 1.00 0.00 H new ATOM 0 HD2 LYS A 435 -5.834 9.800 11.377 1.00 0.00 H new ATOM 0 HD3 LYS A 435 -6.415 10.991 10.231 1.00 0.00 H new ATOM 0 HE2 LYS A 435 -6.281 9.472 8.399 1.00 0.00 H new ATOM 0 HE3 LYS A 435 -5.241 8.367 9.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 -7.497 7.533 9.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 -7.087 7.854 10.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 -8.095 8.925 9.916 1.00 0.00 H new ATOM 1111 N LYS A 436 -0.512 10.301 9.692 1.00 0.00 N ATOM 1112 CA LYS A 436 0.524 11.260 9.335 1.00 0.00 C ATOM 1113 C LYS A 436 0.896 11.100 7.870 1.00 0.00 C ATOM 1114 O LYS A 436 0.838 12.058 7.097 1.00 0.00 O ATOM 1115 CB LYS A 436 1.756 11.066 10.216 1.00 0.00 C ATOM 1116 CG LYS A 436 1.792 11.981 11.428 1.00 0.00 C ATOM 1117 CD LYS A 436 1.940 13.439 11.022 1.00 0.00 C ATOM 1118 CE LYS A 436 2.441 14.290 12.176 1.00 0.00 C ATOM 1119 NZ LYS A 436 2.521 15.732 11.813 1.00 0.00 N ATOM 0 H LYS A 436 -0.418 9.901 10.625 1.00 0.00 H new ATOM 0 HA LYS A 436 0.139 12.267 9.495 1.00 0.00 H new ATOM 0 HB2 LYS A 436 1.791 10.030 10.553 1.00 0.00 H new ATOM 0 HB3 LYS A 436 2.650 11.236 9.617 1.00 0.00 H new ATOM 0 HG2 LYS A 436 0.878 11.855 12.008 1.00 0.00 H new ATOM 0 HG3 LYS A 436 2.622 11.697 12.075 1.00 0.00 H new ATOM 0 HD2 LYS A 436 2.633 13.516 10.184 1.00 0.00 H new ATOM 0 HD3 LYS A 436 0.979 13.821 10.677 1.00 0.00 H new ATOM 0 HE2 LYS A 436 1.777 14.168 13.031 1.00 0.00 H new ATOM 0 HE3 LYS A 436 3.426 13.939 12.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 2.867 16.277 12.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 3.175 15.853 11.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 1.577 16.075 11.543 1.00 0.00 H new ATOM 1133 N MET A 437 1.247 9.883 7.479 1.00 0.00 N ATOM 1134 CA MET A 437 1.586 9.618 6.085 1.00 0.00 C ATOM 1135 C MET A 437 0.372 9.928 5.220 1.00 0.00 C ATOM 1136 O MET A 437 0.468 10.655 4.238 1.00 0.00 O ATOM 1137 CB MET A 437 2.044 8.169 5.858 1.00 0.00 C ATOM 1138 CG MET A 437 1.947 7.275 7.082 1.00 0.00 C ATOM 1139 SD MET A 437 3.234 7.622 8.297 1.00 0.00 S ATOM 1140 CE MET A 437 4.597 6.676 7.626 1.00 0.00 C ATOM 0 H MET A 437 1.305 9.073 8.096 1.00 0.00 H new ATOM 0 HA MET A 437 2.425 10.258 5.810 1.00 0.00 H new ATOM 0 HB2 MET A 437 1.445 7.734 5.058 1.00 0.00 H new ATOM 0 HB3 MET A 437 3.078 8.179 5.513 1.00 0.00 H new ATOM 0 HG2 MET A 437 0.969 7.405 7.546 1.00 0.00 H new ATOM 0 HG3 MET A 437 2.016 6.232 6.772 1.00 0.00 H new ATOM 0 HE1 MET A 437 5.470 6.790 8.269 1.00 0.00 H new ATOM 0 HE2 MET A 437 4.319 5.623 7.575 1.00 0.00 H new ATOM 0 HE3 MET A 437 4.833 7.038 6.625 1.00 0.00 H new ATOM 1150 N LEU A 438 -0.782 9.402 5.620 1.00 0.00 N ATOM 1151 CA LEU A 438 -2.022 9.663 4.903 1.00 0.00 C ATOM 1152 C LEU A 438 -2.085 11.140 4.547 1.00 0.00 C ATOM 1153 O LEU A 438 -2.103 11.525 3.378 1.00 0.00 O ATOM 1154 CB LEU A 438 -3.213 9.311 5.793 1.00 0.00 C ATOM 1155 CG LEU A 438 -4.178 8.272 5.232 1.00 0.00 C ATOM 1156 CD1 LEU A 438 -3.482 6.929 5.082 1.00 0.00 C ATOM 1157 CD2 LEU A 438 -5.394 8.152 6.136 1.00 0.00 C ATOM 0 H LEU A 438 -0.882 8.795 6.434 1.00 0.00 H new ATOM 0 HA LEU A 438 -2.055 9.058 3.997 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -2.834 8.948 6.748 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -3.771 10.224 5.998 1.00 0.00 H new ATOM 0 HG LEU A 438 -4.510 8.593 4.245 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -4.184 6.198 4.681 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -2.636 7.031 4.402 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -3.126 6.593 6.056 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -6.078 7.408 5.728 1.00 0.00 H new ATOM 0 HD22 LEU A 438 -5.077 7.846 7.133 1.00 0.00 H new ATOM 0 HD23 LEU A 438 -5.900 9.116 6.196 1.00 0.00 H new ATOM 1169 N ASP A 439 -2.103 11.957 5.595 1.00 0.00 N ATOM 1170 CA ASP A 439 -2.146 13.409 5.466 1.00 0.00 C ATOM 1171 C ASP A 439 -0.933 13.929 4.706 1.00 0.00 C ATOM 1172 O ASP A 439 -0.949 15.033 4.179 1.00 0.00 O ATOM 1173 CB ASP A 439 -2.192 14.045 6.856 1.00 0.00 C ATOM 1174 CG ASP A 439 -3.234 15.143 6.958 1.00 0.00 C ATOM 1175 OD1 ASP A 439 -3.687 15.633 5.901 1.00 0.00 O ATOM 1176 OD2 ASP A 439 -3.597 15.512 8.094 1.00 0.00 O ATOM 0 H ASP A 439 -2.088 11.630 6.561 1.00 0.00 H new ATOM 0 HA ASP A 439 -3.041 13.677 4.905 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -2.406 13.275 7.597 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -1.211 14.456 7.097 1.00 0.00 H new ATOM 1181 N PHE A 440 0.110 13.116 4.647 1.00 0.00 N ATOM 1182 CA PHE A 440 1.324 13.497 3.941 1.00 0.00 C ATOM 1183 C PHE A 440 1.129 13.308 2.444 1.00 0.00 C ATOM 1184 O PHE A 440 1.282 14.245 1.660 1.00 0.00 O ATOM 1185 CB PHE A 440 2.515 12.670 4.434 1.00 0.00 C ATOM 1186 CG PHE A 440 3.811 13.029 3.769 1.00 0.00 C ATOM 1187 CD1 PHE A 440 4.563 14.101 4.221 1.00 0.00 C ATOM 1188 CD2 PHE A 440 4.278 12.292 2.693 1.00 0.00 C ATOM 1189 CE1 PHE A 440 5.758 14.432 3.612 1.00 0.00 C ATOM 1190 CE2 PHE A 440 5.472 12.619 2.079 1.00 0.00 C ATOM 1191 CZ PHE A 440 6.213 13.690 2.539 1.00 0.00 C ATOM 0 H PHE A 440 0.141 12.192 5.077 1.00 0.00 H new ATOM 0 HA PHE A 440 1.534 14.548 4.142 1.00 0.00 H new ATOM 0 HB2 PHE A 440 2.619 12.804 5.511 1.00 0.00 H new ATOM 0 HB3 PHE A 440 2.309 11.613 4.263 1.00 0.00 H new ATOM 0 HD1 PHE A 440 4.211 14.685 5.059 1.00 0.00 H new ATOM 0 HD2 PHE A 440 3.703 11.453 2.330 1.00 0.00 H new ATOM 0 HE1 PHE A 440 6.336 15.270 3.974 1.00 0.00 H new ATOM 0 HE2 PHE A 440 5.825 12.038 1.240 1.00 0.00 H new ATOM 0 HZ PHE A 440 7.147 13.947 2.061 1.00 0.00 H new ATOM 1201 N TYR A 441 0.771 12.091 2.058 1.00 0.00 N ATOM 1202 CA TYR A 441 0.532 11.774 0.666 1.00 0.00 C ATOM 1203 C TYR A 441 -0.604 12.624 0.129 1.00 0.00 C ATOM 1204 O TYR A 441 -0.499 13.203 -0.952 1.00 0.00 O ATOM 1205 CB TYR A 441 0.230 10.289 0.514 1.00 0.00 C ATOM 1206 CG TYR A 441 1.452 9.433 0.724 1.00 0.00 C ATOM 1207 CD1 TYR A 441 2.673 9.794 0.170 1.00 0.00 C ATOM 1208 CD2 TYR A 441 1.387 8.269 1.472 1.00 0.00 C ATOM 1209 CE1 TYR A 441 3.798 9.018 0.356 1.00 0.00 C ATOM 1210 CE2 TYR A 441 2.507 7.486 1.661 1.00 0.00 C ATOM 1211 CZ TYR A 441 3.711 7.864 1.103 1.00 0.00 C ATOM 1212 OH TYR A 441 4.831 7.087 1.290 1.00 0.00 O ATOM 0 H TYR A 441 0.640 11.307 2.697 1.00 0.00 H new ATOM 0 HA TYR A 441 1.427 11.998 0.085 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -0.540 10.002 1.230 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -0.175 10.103 -0.481 1.00 0.00 H new ATOM 0 HD1 TYR A 441 2.743 10.698 -0.417 1.00 0.00 H new ATOM 0 HD2 TYR A 441 0.447 7.971 1.913 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.741 9.313 -0.081 1.00 0.00 H new ATOM 0 HE2 TYR A 441 2.442 6.579 2.244 1.00 0.00 H new ATOM 0 HH TYR A 441 5.018 7.008 2.249 1.00 0.00 H new ATOM 1222 N ALA A 442 -1.679 12.733 0.902 1.00 0.00 N ATOM 1223 CA ALA A 442 -2.799 13.560 0.489 1.00 0.00 C ATOM 1224 C ALA A 442 -2.296 14.984 0.313 1.00 0.00 C ATOM 1225 O ALA A 442 -2.310 15.534 -0.787 1.00 0.00 O ATOM 1226 CB ALA A 442 -3.929 13.511 1.509 1.00 0.00 C ATOM 0 H ALA A 442 -1.795 12.267 1.802 1.00 0.00 H new ATOM 0 HA ALA A 442 -3.203 13.184 -0.451 1.00 0.00 H new ATOM 0 HB1 ALA A 442 -4.752 14.140 1.171 1.00 0.00 H new ATOM 0 HB2 ALA A 442 -4.278 12.484 1.616 1.00 0.00 H new ATOM 0 HB3 ALA A 442 -3.567 13.874 2.471 1.00 0.00 H new ATOM 1232 N LYS A 443 -1.840 15.569 1.418 1.00 0.00 N ATOM 1233 CA LYS A 443 -1.317 16.924 1.405 1.00 0.00 C ATOM 1234 C LYS A 443 -0.416 17.101 0.198 1.00 0.00 C ATOM 1235 O LYS A 443 -0.346 18.177 -0.391 1.00 0.00 O ATOM 1236 CB LYS A 443 -0.510 17.191 2.670 1.00 0.00 C ATOM 1237 CG LYS A 443 -1.352 17.505 3.888 1.00 0.00 C ATOM 1238 CD LYS A 443 -1.632 18.993 4.000 1.00 0.00 C ATOM 1239 CE LYS A 443 -2.302 19.535 2.746 1.00 0.00 C ATOM 1240 NZ LYS A 443 -2.878 20.890 2.968 1.00 0.00 N ATOM 0 H LYS A 443 -1.824 15.121 2.334 1.00 0.00 H new ATOM 0 HA LYS A 443 -2.151 17.624 1.358 1.00 0.00 H new ATOM 0 HB2 LYS A 443 0.108 16.319 2.884 1.00 0.00 H new ATOM 0 HB3 LYS A 443 0.168 18.025 2.486 1.00 0.00 H new ATOM 0 HG2 LYS A 443 -2.294 16.959 3.831 1.00 0.00 H new ATOM 0 HG3 LYS A 443 -0.838 17.161 4.786 1.00 0.00 H new ATOM 0 HD2 LYS A 443 -2.271 19.179 4.863 1.00 0.00 H new ATOM 0 HD3 LYS A 443 -0.698 19.527 4.173 1.00 0.00 H new ATOM 0 HE2 LYS A 443 -1.575 19.578 1.935 1.00 0.00 H new ATOM 0 HE3 LYS A 443 -3.091 18.852 2.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 -3.325 21.225 2.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 -3.590 20.845 3.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 -2.121 21.548 3.244 1.00 0.00 H new ATOM 1254 N GLN A 444 0.242 16.016 -0.176 1.00 0.00 N ATOM 1255 CA GLN A 444 1.111 16.025 -1.340 1.00 0.00 C ATOM 1256 C GLN A 444 0.260 16.231 -2.588 1.00 0.00 C ATOM 1257 O GLN A 444 0.476 17.158 -3.367 1.00 0.00 O ATOM 1258 CB GLN A 444 1.885 14.708 -1.436 1.00 0.00 C ATOM 1259 CG GLN A 444 3.270 14.859 -2.045 1.00 0.00 C ATOM 1260 CD GLN A 444 4.355 14.985 -0.996 1.00 0.00 C ATOM 1261 OE1 GLN A 444 4.246 14.430 0.097 1.00 0.00 O ATOM 1262 NE2 GLN A 444 5.412 15.719 -1.325 1.00 0.00 N ATOM 0 H GLN A 444 0.191 15.120 0.309 1.00 0.00 H new ATOM 0 HA GLN A 444 1.833 16.837 -1.251 1.00 0.00 H new ATOM 0 HB2 GLN A 444 1.981 14.279 -0.439 1.00 0.00 H new ATOM 0 HB3 GLN A 444 1.310 14.001 -2.033 1.00 0.00 H new ATOM 0 HG2 GLN A 444 3.480 13.998 -2.679 1.00 0.00 H new ATOM 0 HG3 GLN A 444 3.287 15.739 -2.688 1.00 0.00 H new ATOM 0 HE21 GLN A 444 5.460 16.161 -2.243 1.00 0.00 H new ATOM 0 HE22 GLN A 444 6.176 15.841 -0.660 1.00 0.00 H new ATOM 1271 N ARG A 445 -0.699 15.331 -2.768 1.00 0.00 N ATOM 1272 CA ARG A 445 -1.589 15.380 -3.920 1.00 0.00 C ATOM 1273 C ARG A 445 -1.952 16.828 -4.227 1.00 0.00 C ATOM 1274 O ARG A 445 -1.857 17.276 -5.370 1.00 0.00 O ATOM 1275 CB ARG A 445 -2.856 14.564 -3.652 1.00 0.00 C ATOM 1276 CG ARG A 445 -4.020 14.932 -4.557 1.00 0.00 C ATOM 1277 CD ARG A 445 -3.549 15.281 -5.960 1.00 0.00 C ATOM 1278 NE ARG A 445 -4.273 14.533 -6.983 1.00 0.00 N ATOM 1279 CZ ARG A 445 -5.471 14.882 -7.438 1.00 0.00 C ATOM 1280 NH1 ARG A 445 -6.076 15.962 -6.963 1.00 0.00 N ATOM 1281 NH2 ARG A 445 -6.066 14.151 -8.370 1.00 0.00 N ATOM 0 H ARG A 445 -0.880 14.557 -2.129 1.00 0.00 H new ATOM 0 HA ARG A 445 -1.077 14.949 -4.780 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -2.630 13.505 -3.778 1.00 0.00 H new ATOM 0 HB3 ARG A 445 -3.156 14.705 -2.613 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -4.722 14.099 -4.605 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -4.559 15.779 -4.132 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -3.681 16.349 -6.131 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -2.482 15.073 -6.046 1.00 0.00 H new ATOM 0 HE ARG A 445 -3.835 13.697 -7.370 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -5.621 16.527 -6.246 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -6.996 16.227 -7.315 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -5.604 13.320 -8.738 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -6.986 14.420 -8.719 1.00 0.00 H new ATOM 1295 N ALA A 446 -2.345 17.559 -3.192 1.00 0.00 N ATOM 1296 CA ALA A 446 -2.699 18.965 -3.330 1.00 0.00 C ATOM 1297 C ALA A 446 -1.435 19.811 -3.444 1.00 0.00 C ATOM 1298 O ALA A 446 -1.412 20.850 -4.102 1.00 0.00 O ATOM 1299 CB ALA A 446 -3.529 19.413 -2.141 1.00 0.00 C ATOM 0 H ALA A 446 -2.427 17.198 -2.242 1.00 0.00 H new ATOM 0 HA ALA A 446 -3.291 19.095 -4.236 1.00 0.00 H new ATOM 0 HB1 ALA A 446 -3.788 20.466 -2.254 1.00 0.00 H new ATOM 0 HB2 ALA A 446 -4.441 18.818 -2.089 1.00 0.00 H new ATOM 0 HB3 ALA A 446 -2.955 19.277 -1.225 1.00 0.00 H new ATOM 1305 N ALA A 447 -0.388 19.335 -2.784 1.00 0.00 N ATOM 1306 CA ALA A 447 0.915 19.994 -2.768 1.00 0.00 C ATOM 1307 C ALA A 447 1.777 19.536 -3.944 1.00 0.00 C ATOM 1308 O ALA A 447 3.000 19.452 -3.835 1.00 0.00 O ATOM 1309 CB ALA A 447 1.635 19.736 -1.454 1.00 0.00 C ATOM 0 H ALA A 447 -0.417 18.473 -2.239 1.00 0.00 H new ATOM 0 HA ALA A 447 0.746 21.066 -2.866 1.00 0.00 H new ATOM 0 HB1 ALA A 447 2.603 20.237 -1.465 1.00 0.00 H new ATOM 0 HB2 ALA A 447 1.036 20.122 -0.629 1.00 0.00 H new ATOM 0 HB3 ALA A 447 1.782 18.664 -1.324 1.00 0.00 H new ATOM 1315 N ILE A 448 1.133 19.251 -5.071 1.00 0.00 N ATOM 1316 CA ILE A 448 1.844 18.811 -6.267 1.00 0.00 C ATOM 1317 C ILE A 448 2.493 19.995 -6.981 1.00 0.00 C ATOM 1318 O ILE A 448 1.860 21.029 -7.192 1.00 0.00 O ATOM 1319 CB ILE A 448 0.895 18.079 -7.242 1.00 0.00 C ATOM 1320 CG1 ILE A 448 0.588 16.675 -6.723 1.00 0.00 C ATOM 1321 CG2 ILE A 448 1.497 18.008 -8.640 1.00 0.00 C ATOM 1322 CD1 ILE A 448 -0.446 15.937 -7.546 1.00 0.00 C ATOM 0 H ILE A 448 0.121 19.317 -5.182 1.00 0.00 H new ATOM 0 HA ILE A 448 2.622 18.118 -5.946 1.00 0.00 H new ATOM 0 HB ILE A 448 -0.035 18.644 -7.303 1.00 0.00 H new ATOM 0 HG12 ILE A 448 1.510 16.093 -6.707 1.00 0.00 H new ATOM 0 HG13 ILE A 448 0.237 16.746 -5.693 1.00 0.00 H new ATOM 0 HG21 ILE A 448 0.809 17.488 -9.306 1.00 0.00 H new ATOM 0 HG22 ILE A 448 1.670 19.017 -9.013 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.443 17.468 -8.602 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -0.613 14.948 -7.119 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -1.381 16.497 -7.542 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -0.089 15.834 -8.571 1.00 0.00 H new ATOM 1334 N PRO A 449 3.773 19.854 -7.360 1.00 0.00 N ATOM 1335 CA PRO A 449 4.514 20.913 -8.051 1.00 0.00 C ATOM 1336 C PRO A 449 4.121 21.042 -9.519 1.00 0.00 C ATOM 1337 O PRO A 449 4.979 21.089 -10.400 1.00 0.00 O ATOM 1338 CB PRO A 449 5.966 20.453 -7.928 1.00 0.00 C ATOM 1339 CG PRO A 449 5.881 18.967 -7.866 1.00 0.00 C ATOM 1340 CD PRO A 449 4.598 18.652 -7.143 1.00 0.00 C ATOM 0 HA PRO A 449 4.318 21.896 -7.621 1.00 0.00 H new ATOM 0 HB2 PRO A 449 6.560 20.782 -8.781 1.00 0.00 H new ATOM 0 HB3 PRO A 449 6.438 20.861 -7.034 1.00 0.00 H new ATOM 0 HG2 PRO A 449 5.881 18.535 -8.867 1.00 0.00 H new ATOM 0 HG3 PRO A 449 6.738 18.549 -7.338 1.00 0.00 H new ATOM 0 HD2 PRO A 449 4.120 17.759 -7.546 1.00 0.00 H new ATOM 0 HD3 PRO A 449 4.770 18.470 -6.082 1.00 0.00 H new ATOM 1348 N ARG A 450 2.818 21.098 -9.777 1.00 0.00 N ATOM 1349 CA ARG A 450 2.312 21.222 -11.139 1.00 0.00 C ATOM 1350 C ARG A 450 2.613 19.965 -11.949 1.00 0.00 C ATOM 1351 O ARG A 450 3.730 19.446 -11.918 1.00 0.00 O ATOM 1352 CB ARG A 450 2.925 22.444 -11.825 1.00 0.00 C ATOM 1353 CG ARG A 450 2.422 23.768 -11.275 1.00 0.00 C ATOM 1354 CD ARG A 450 3.225 24.939 -11.820 1.00 0.00 C ATOM 1355 NE ARG A 450 3.042 25.106 -13.259 1.00 0.00 N ATOM 1356 CZ ARG A 450 1.933 25.590 -13.810 1.00 0.00 C ATOM 1357 NH1 ARG A 450 0.914 25.952 -13.043 1.00 0.00 N ATOM 1358 NH2 ARG A 450 1.844 25.714 -15.127 1.00 0.00 N ATOM 0 H ARG A 450 2.093 21.059 -9.060 1.00 0.00 H new ATOM 0 HA ARG A 450 1.231 21.348 -11.087 1.00 0.00 H new ATOM 0 HB2 ARG A 450 4.009 22.404 -11.718 1.00 0.00 H new ATOM 0 HB3 ARG A 450 2.708 22.398 -12.892 1.00 0.00 H new ATOM 0 HG2 ARG A 450 1.371 23.895 -11.533 1.00 0.00 H new ATOM 0 HG3 ARG A 450 2.484 23.758 -10.187 1.00 0.00 H new ATOM 0 HD2 ARG A 450 2.925 25.853 -11.308 1.00 0.00 H new ATOM 0 HD3 ARG A 450 4.282 24.785 -11.605 1.00 0.00 H new ATOM 0 HE ARG A 450 3.808 24.836 -13.876 1.00 0.00 H new ATOM 0 HH11 ARG A 450 0.980 25.859 -12.029 1.00 0.00 H new ATOM 0 HH12 ARG A 450 0.064 26.323 -13.467 1.00 0.00 H new ATOM 0 HH21 ARG A 450 2.627 25.438 -15.719 1.00 0.00 H new ATOM 0 HH22 ARG A 450 0.992 26.085 -15.548 1.00 0.00 H new ATOM 1372 N SER A 451 1.611 19.481 -12.677 1.00 0.00 N ATOM 1373 CA SER A 451 1.769 18.286 -13.497 1.00 0.00 C ATOM 1374 C SER A 451 0.773 18.286 -14.653 1.00 0.00 C ATOM 1375 O SER A 451 -0.399 18.614 -14.476 1.00 0.00 O ATOM 1376 CB SER A 451 1.580 17.028 -12.647 1.00 0.00 C ATOM 1377 OG SER A 451 2.438 15.986 -13.079 1.00 0.00 O ATOM 0 H SER A 451 0.681 19.899 -12.715 1.00 0.00 H new ATOM 0 HA SER A 451 2.778 18.289 -13.908 1.00 0.00 H new ATOM 0 HB2 SER A 451 1.781 17.259 -11.601 1.00 0.00 H new ATOM 0 HB3 SER A 451 0.543 16.698 -12.707 1.00 0.00 H new ATOM 0 HG SER A 451 2.299 15.194 -12.519 1.00 0.00 H new ATOM 1383 N GLU A 452 1.249 17.917 -15.838 1.00 0.00 N ATOM 1384 CA GLU A 452 0.401 17.875 -17.023 1.00 0.00 C ATOM 1385 C GLU A 452 -0.673 16.801 -16.885 1.00 0.00 C ATOM 1386 O GLU A 452 -1.670 16.808 -17.609 1.00 0.00 O ATOM 1387 CB GLU A 452 1.244 17.611 -18.272 1.00 0.00 C ATOM 1388 CG GLU A 452 2.020 18.828 -18.749 1.00 0.00 C ATOM 1389 CD GLU A 452 1.212 20.107 -18.657 1.00 0.00 C ATOM 1390 OE1 GLU A 452 1.037 20.620 -17.532 1.00 0.00 O ATOM 1391 OE2 GLU A 452 0.752 20.596 -19.711 1.00 0.00 O ATOM 0 H GLU A 452 2.218 17.643 -16.003 1.00 0.00 H new ATOM 0 HA GLU A 452 -0.089 18.844 -17.122 1.00 0.00 H new ATOM 0 HB2 GLU A 452 1.944 16.802 -18.063 1.00 0.00 H new ATOM 0 HB3 GLU A 452 0.592 17.268 -19.075 1.00 0.00 H new ATOM 0 HG2 GLU A 452 2.927 18.932 -18.154 1.00 0.00 H new ATOM 0 HG3 GLU A 452 2.332 18.673 -19.782 1.00 0.00 H new ATOM 1398 N SER A 453 -0.465 15.879 -15.950 1.00 0.00 N ATOM 1399 CA SER A 453 -1.416 14.799 -15.717 1.00 0.00 C ATOM 1400 C SER A 453 -2.812 15.351 -15.447 1.00 0.00 C ATOM 1401 O SER A 453 -3.769 14.550 -15.417 1.00 0.00 O ATOM 1402 CB SER A 453 -0.960 13.936 -14.540 1.00 0.00 C ATOM 1403 OG SER A 453 -1.415 12.601 -14.679 1.00 0.00 O ATOM 1404 OXT SER A 453 -2.936 16.582 -15.266 1.00 0.00 O ATOM 0 H SER A 453 0.354 15.859 -15.342 1.00 0.00 H new ATOM 0 HA SER A 453 -1.456 14.184 -16.616 1.00 0.00 H new ATOM 0 HB2 SER A 453 0.128 13.948 -14.477 1.00 0.00 H new ATOM 0 HB3 SER A 453 -1.338 14.357 -13.608 1.00 0.00 H new ATOM 0 HG SER A 453 -1.109 12.070 -13.915 1.00 0.00 H new TER 1410 SER A 453