USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=18 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 Set 1.1: A 371 LYS NZ :NH3+ 160:sc= -0.623 (180deg=-1.31!) USER MOD Set 1.2: A 421 LYS NZ :NH3+ -107:sc= -0.192 (180deg=-1.7!) USER MOD Single : A 365 SER OG : rot 180:sc= 0.0629 USER MOD Single : A 368 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 369 ASN : amide:sc= -1.23 K(o=-1.2,f=-2.7!) USER MOD Single : A 373 GLN : amide:sc= 0 X(o=0,f=0) 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 180:sc= 0 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= -7.16! C(o=-7.2!,f=-6.8!) USER MOD Single : A 387 TYR OH : rot 165:sc= -2.85 USER MOD Single : A 389 THR OG1 : rot 135:sc= -3.38! USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= -0.0629 (180deg=-0.0629) USER MOD Single : A 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 394 THR OG1 : rot -140:sc= -1.49! USER MOD Single : A 399 ASN :FLIP amide:sc= -0.0174 F(o=-0.54,f=-0.017) USER MOD Single : A 400 SER OG : rot 50:sc= -6.21! USER MOD Single : A 404 CYS SG : rot -78:sc= -2.93 USER MOD Single : A 410 THR OG1 : rot 180:sc= 0 USER MOD Single : A 414 THR OG1 : rot -17:sc= 0.785 USER MOD Single : A 419 ASN : amide:sc= -0.0793 K(o=-0.079,f=-1.1) USER MOD Single : A 430 ASN : amide:sc= -7.14! C(o=-7.1!,f=-7.7!) 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 113:sc= -3.95! USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -2.76! C(o=-2.8!,f=-5.7!) 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 -8.909 -7.303 12.966 1.00 0.00 N ATOM 2 CA GLY A 364 -7.619 -7.796 13.521 1.00 0.00 C ATOM 3 C GLY A 364 -6.418 -7.227 12.793 1.00 0.00 C ATOM 4 O GLY A 364 -6.285 -6.011 12.655 1.00 0.00 O ATOM 0 HA2 GLY A 364 -7.558 -7.533 14.577 1.00 0.00 H new ATOM 0 HA3 GLY A 364 -7.594 -8.884 13.461 1.00 0.00 H new ATOM 10 N SER A 365 -5.540 -8.109 12.327 1.00 0.00 N ATOM 11 CA SER A 365 -4.343 -7.690 11.608 1.00 0.00 C ATOM 12 C SER A 365 -4.619 -7.569 10.112 1.00 0.00 C ATOM 13 O SER A 365 -3.789 -7.064 9.357 1.00 0.00 O ATOM 14 CB SER A 365 -3.206 -8.684 11.848 1.00 0.00 C ATOM 15 OG SER A 365 -3.615 -9.725 12.718 1.00 0.00 O ATOM 0 H SER A 365 -5.635 -9.119 12.435 1.00 0.00 H new ATOM 0 HA SER A 365 -4.048 -6.711 11.985 1.00 0.00 H new ATOM 0 HB2 SER A 365 -2.881 -9.107 10.897 1.00 0.00 H new ATOM 0 HB3 SER A 365 -2.348 -8.164 12.275 1.00 0.00 H new ATOM 0 HG SER A 365 -2.871 -10.348 12.854 1.00 0.00 H new ATOM 21 N LEU A 366 -5.789 -8.038 9.692 1.00 0.00 N ATOM 22 CA LEU A 366 -6.174 -7.986 8.286 1.00 0.00 C ATOM 23 C LEU A 366 -7.535 -7.319 8.118 1.00 0.00 C ATOM 24 O LEU A 366 -8.394 -7.409 8.995 1.00 0.00 O ATOM 25 CB LEU A 366 -6.211 -9.397 7.696 1.00 0.00 C ATOM 26 CG LEU A 366 -5.011 -9.768 6.823 1.00 0.00 C ATOM 27 CD1 LEU A 366 -4.844 -8.766 5.692 1.00 0.00 C ATOM 28 CD2 LEU A 366 -3.745 -9.848 7.662 1.00 0.00 C ATOM 0 H LEU A 366 -6.487 -8.459 10.305 1.00 0.00 H new ATOM 0 HA LEU A 366 -5.431 -7.393 7.753 1.00 0.00 H new ATOM 0 HB2 LEU A 366 -6.281 -10.114 8.514 1.00 0.00 H new ATOM 0 HB3 LEU A 366 -7.119 -9.502 7.102 1.00 0.00 H new ATOM 0 HG LEU A 366 -5.193 -10.750 6.386 1.00 0.00 H new ATOM 0 HD11 LEU A 366 -3.986 -9.046 5.082 1.00 0.00 H new ATOM 0 HD12 LEU A 366 -5.742 -8.761 5.075 1.00 0.00 H new ATOM 0 HD13 LEU A 366 -4.684 -7.771 6.108 1.00 0.00 H new ATOM 0 HD21 LEU A 366 -2.902 -10.113 7.024 1.00 0.00 H new ATOM 0 HD22 LEU A 366 -3.557 -8.882 8.129 1.00 0.00 H new ATOM 0 HD23 LEU A 366 -3.868 -10.607 8.435 1.00 0.00 H new ATOM 40 N ASP A 367 -7.727 -6.651 6.985 1.00 0.00 N ATOM 41 CA ASP A 367 -8.988 -5.972 6.703 1.00 0.00 C ATOM 42 C ASP A 367 -9.651 -6.559 5.464 1.00 0.00 C ATOM 43 O ASP A 367 -9.222 -7.590 4.948 1.00 0.00 O ATOM 44 CB ASP A 367 -8.756 -4.473 6.510 1.00 0.00 C ATOM 45 CG ASP A 367 -8.880 -3.696 7.805 1.00 0.00 C ATOM 46 OD1 ASP A 367 -8.746 -4.313 8.883 1.00 0.00 O ATOM 47 OD2 ASP A 367 -9.109 -2.470 7.743 1.00 0.00 O ATOM 0 H ASP A 367 -7.027 -6.565 6.248 1.00 0.00 H new ATOM 0 HA ASP A 367 -9.651 -6.120 7.556 1.00 0.00 H new ATOM 0 HB2 ASP A 367 -7.764 -4.313 6.088 1.00 0.00 H new ATOM 0 HB3 ASP A 367 -9.476 -4.087 5.788 1.00 0.00 H new ATOM 52 N MET A 368 -10.702 -5.898 4.989 1.00 0.00 N ATOM 53 CA MET A 368 -11.420 -6.362 3.812 1.00 0.00 C ATOM 54 C MET A 368 -11.014 -5.576 2.569 1.00 0.00 C ATOM 55 O MET A 368 -10.787 -6.154 1.506 1.00 0.00 O ATOM 56 CB MET A 368 -12.932 -6.252 4.032 1.00 0.00 C ATOM 57 CG MET A 368 -13.313 -5.404 5.237 1.00 0.00 C ATOM 58 SD MET A 368 -15.083 -5.443 5.584 1.00 0.00 S ATOM 59 CE MET A 368 -15.422 -3.696 5.800 1.00 0.00 C ATOM 0 H MET A 368 -11.073 -5.042 5.401 1.00 0.00 H new ATOM 0 HA MET A 368 -11.158 -7.408 3.653 1.00 0.00 H new ATOM 0 HB2 MET A 368 -13.390 -5.826 3.139 1.00 0.00 H new ATOM 0 HB3 MET A 368 -13.346 -7.252 4.157 1.00 0.00 H new ATOM 0 HG2 MET A 368 -12.767 -5.757 6.112 1.00 0.00 H new ATOM 0 HG3 MET A 368 -13.004 -4.373 5.063 1.00 0.00 H new ATOM 0 HE1 MET A 368 -16.480 -3.555 6.021 1.00 0.00 H new ATOM 0 HE2 MET A 368 -14.824 -3.309 6.625 1.00 0.00 H new ATOM 0 HE3 MET A 368 -15.168 -3.160 4.885 1.00 0.00 H new ATOM 69 N ASN A 369 -10.929 -4.257 2.705 1.00 0.00 N ATOM 70 CA ASN A 369 -10.557 -3.403 1.582 1.00 0.00 C ATOM 71 C ASN A 369 -9.377 -2.501 1.927 1.00 0.00 C ATOM 72 O ASN A 369 -9.547 -1.318 2.217 1.00 0.00 O ATOM 73 CB ASN A 369 -11.754 -2.555 1.165 1.00 0.00 C ATOM 74 CG ASN A 369 -12.383 -3.041 -0.125 1.00 0.00 C ATOM 75 OD1 ASN A 369 -11.709 -3.621 -0.976 1.00 0.00 O ATOM 76 ND2 ASN A 369 -13.681 -2.808 -0.276 1.00 0.00 N ATOM 0 H ASN A 369 -11.111 -3.758 3.576 1.00 0.00 H new ATOM 0 HA ASN A 369 -10.253 -4.046 0.756 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -12.501 -2.570 1.959 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -11.438 -1.519 1.044 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -14.159 -3.114 -1.124 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -14.201 -2.323 0.456 1.00 0.00 H new ATOM 83 N ALA A 370 -8.181 -3.067 1.872 1.00 0.00 N ATOM 84 CA ALA A 370 -6.964 -2.314 2.151 1.00 0.00 C ATOM 85 C ALA A 370 -6.534 -1.530 0.926 1.00 0.00 C ATOM 86 O ALA A 370 -6.441 -0.307 0.960 1.00 0.00 O ATOM 87 CB ALA A 370 -5.844 -3.231 2.605 1.00 0.00 C ATOM 0 H ALA A 370 -8.025 -4.047 1.636 1.00 0.00 H new ATOM 0 HA ALA A 370 -7.180 -1.616 2.960 1.00 0.00 H new ATOM 0 HB1 ALA A 370 -4.950 -2.641 2.806 1.00 0.00 H new ATOM 0 HB2 ALA A 370 -6.146 -3.752 3.513 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -5.630 -3.959 1.823 1.00 0.00 H new ATOM 93 N LYS A 371 -6.292 -2.247 -0.164 1.00 0.00 N ATOM 94 CA LYS A 371 -5.895 -1.610 -1.413 1.00 0.00 C ATOM 95 C LYS A 371 -6.969 -0.619 -1.835 1.00 0.00 C ATOM 96 O LYS A 371 -6.710 0.332 -2.563 1.00 0.00 O ATOM 97 CB LYS A 371 -5.685 -2.657 -2.510 1.00 0.00 C ATOM 98 CG LYS A 371 -6.941 -3.444 -2.844 1.00 0.00 C ATOM 99 CD LYS A 371 -6.979 -4.772 -2.105 1.00 0.00 C ATOM 100 CE LYS A 371 -7.939 -5.751 -2.763 1.00 0.00 C ATOM 101 NZ LYS A 371 -7.886 -5.664 -4.247 1.00 0.00 N ATOM 0 H LYS A 371 -6.363 -3.264 -0.209 1.00 0.00 H new ATOM 0 HA LYS A 371 -4.953 -1.084 -1.260 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -5.326 -2.160 -3.412 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.904 -3.350 -2.196 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -7.821 -2.856 -2.583 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -6.985 -3.623 -3.918 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -5.979 -5.204 -2.080 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -7.280 -4.605 -1.071 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -7.695 -6.766 -2.449 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -8.955 -5.548 -2.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -8.272 -6.537 -4.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -8.450 -4.851 -4.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -6.899 -5.543 -4.553 1.00 0.00 H new ATOM 115 N ARG A 372 -8.171 -0.851 -1.336 1.00 0.00 N ATOM 116 CA ARG A 372 -9.298 0.021 -1.625 1.00 0.00 C ATOM 117 C ARG A 372 -9.291 1.214 -0.683 1.00 0.00 C ATOM 118 O ARG A 372 -9.242 2.365 -1.123 1.00 0.00 O ATOM 119 CB ARG A 372 -10.620 -0.735 -1.506 1.00 0.00 C ATOM 120 CG ARG A 372 -11.839 0.175 -1.440 1.00 0.00 C ATOM 121 CD ARG A 372 -12.611 0.170 -2.749 1.00 0.00 C ATOM 122 NE ARG A 372 -13.512 1.315 -2.861 1.00 0.00 N ATOM 123 CZ ARG A 372 -14.717 1.362 -2.302 1.00 0.00 C ATOM 124 NH1 ARG A 372 -15.157 0.334 -1.589 1.00 0.00 N ATOM 125 NH2 ARG A 372 -15.481 2.437 -2.453 1.00 0.00 N ATOM 0 H ARG A 372 -8.393 -1.638 -0.727 1.00 0.00 H new ATOM 0 HA ARG A 372 -9.200 0.376 -2.651 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -10.723 -1.406 -2.359 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -10.593 -1.358 -0.612 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -12.493 -0.149 -0.630 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -11.523 1.192 -1.207 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -11.909 0.179 -3.583 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -13.187 -0.752 -2.826 1.00 0.00 H new ATOM 0 HE ARG A 372 -13.199 2.123 -3.398 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -14.571 -0.492 -1.470 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -16.082 0.370 -1.160 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -15.144 3.230 -2.999 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -16.405 2.470 -2.023 1.00 0.00 H new ATOM 139 N GLN A 373 -9.339 0.938 0.615 1.00 0.00 N ATOM 140 CA GLN A 373 -9.340 2.001 1.610 1.00 0.00 C ATOM 141 C GLN A 373 -8.111 2.891 1.437 1.00 0.00 C ATOM 142 O GLN A 373 -8.179 4.108 1.611 1.00 0.00 O ATOM 143 CB GLN A 373 -9.387 1.406 3.016 1.00 0.00 C ATOM 144 CG GLN A 373 -9.322 2.449 4.118 1.00 0.00 C ATOM 145 CD GLN A 373 -10.370 2.232 5.191 1.00 0.00 C ATOM 146 OE1 GLN A 373 -11.159 3.128 5.494 1.00 0.00 O ATOM 147 NE2 GLN A 373 -10.384 1.039 5.775 1.00 0.00 N ATOM 0 H GLN A 373 -9.377 -0.006 1.000 1.00 0.00 H new ATOM 0 HA GLN A 373 -10.228 2.617 1.468 1.00 0.00 H new ATOM 0 HB2 GLN A 373 -10.305 0.828 3.127 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -8.556 0.710 3.136 1.00 0.00 H new ATOM 0 HG2 GLN A 373 -8.332 2.429 4.574 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -9.453 3.440 3.683 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -9.712 0.325 5.493 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -11.067 0.837 6.505 1.00 0.00 H new ATOM 156 N LEU A 374 -6.993 2.270 1.080 1.00 0.00 N ATOM 157 CA LEU A 374 -5.742 2.977 0.863 1.00 0.00 C ATOM 158 C LEU A 374 -5.803 3.792 -0.430 1.00 0.00 C ATOM 159 O LEU A 374 -5.699 5.020 -0.400 1.00 0.00 O ATOM 160 CB LEU A 374 -4.590 1.967 0.814 1.00 0.00 C ATOM 161 CG LEU A 374 -3.188 2.571 0.773 1.00 0.00 C ATOM 162 CD1 LEU A 374 -2.806 2.937 -0.646 1.00 0.00 C ATOM 163 CD2 LEU A 374 -3.105 3.783 1.685 1.00 0.00 C ATOM 0 H LEU A 374 -6.931 1.262 0.934 1.00 0.00 H new ATOM 0 HA LEU A 374 -5.573 3.670 1.687 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -4.662 1.318 1.687 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -4.721 1.335 -0.065 1.00 0.00 H new ATOM 0 HG LEU A 374 -2.480 1.824 1.132 1.00 0.00 H new ATOM 0 HD11 LEU A 374 -1.804 3.366 -0.654 1.00 0.00 H new ATOM 0 HD12 LEU A 374 -2.823 2.043 -1.270 1.00 0.00 H new ATOM 0 HD13 LEU A 374 -3.516 3.666 -1.037 1.00 0.00 H new ATOM 0 HD21 LEU A 374 -2.099 4.201 1.644 1.00 0.00 H new ATOM 0 HD22 LEU A 374 -3.824 4.534 1.358 1.00 0.00 H new ATOM 0 HD23 LEU A 374 -3.332 3.484 2.708 1.00 0.00 H new ATOM 175 N TYR A 375 -5.987 3.110 -1.562 1.00 0.00 N ATOM 176 CA TYR A 375 -6.076 3.792 -2.853 1.00 0.00 C ATOM 177 C TYR A 375 -6.961 5.012 -2.727 1.00 0.00 C ATOM 178 O TYR A 375 -6.745 6.039 -3.367 1.00 0.00 O ATOM 179 CB TYR A 375 -6.646 2.867 -3.921 1.00 0.00 C ATOM 180 CG TYR A 375 -6.310 3.294 -5.331 1.00 0.00 C ATOM 181 CD1 TYR A 375 -5.087 3.886 -5.627 1.00 0.00 C ATOM 182 CD2 TYR A 375 -7.218 3.112 -6.367 1.00 0.00 C ATOM 183 CE1 TYR A 375 -4.780 4.282 -6.912 1.00 0.00 C ATOM 184 CE2 TYR A 375 -6.916 3.505 -7.657 1.00 0.00 C ATOM 185 CZ TYR A 375 -5.696 4.090 -7.924 1.00 0.00 C ATOM 186 OH TYR A 375 -5.395 4.487 -9.206 1.00 0.00 O ATOM 0 H TYR A 375 -6.077 2.095 -1.611 1.00 0.00 H new ATOM 0 HA TYR A 375 -5.070 4.091 -3.149 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -6.268 1.858 -3.756 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -7.730 2.823 -3.812 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.366 4.038 -4.838 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -8.175 2.656 -6.161 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -3.826 4.741 -7.124 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.632 3.355 -8.452 1.00 0.00 H new ATOM 0 HH TYR A 375 -6.148 4.279 -9.798 1.00 0.00 H new ATOM 196 N SER A 376 -7.952 4.881 -1.872 1.00 0.00 N ATOM 197 CA SER A 376 -8.882 5.965 -1.609 1.00 0.00 C ATOM 198 C SER A 376 -8.233 6.980 -0.676 1.00 0.00 C ATOM 199 O SER A 376 -8.254 8.186 -0.926 1.00 0.00 O ATOM 200 CB SER A 376 -10.164 5.423 -0.979 1.00 0.00 C ATOM 201 OG SER A 376 -10.896 6.462 -0.354 1.00 0.00 O ATOM 0 H SER A 376 -8.138 4.029 -1.342 1.00 0.00 H new ATOM 0 HA SER A 376 -9.136 6.451 -2.551 1.00 0.00 H new ATOM 0 HB2 SER A 376 -10.778 4.949 -1.744 1.00 0.00 H new ATOM 0 HB3 SER A 376 -9.918 4.654 -0.247 1.00 0.00 H new ATOM 0 HG SER A 376 -11.714 6.094 0.042 1.00 0.00 H new ATOM 207 N LEU A 377 -7.667 6.466 0.408 1.00 0.00 N ATOM 208 CA LEU A 377 -7.011 7.286 1.409 1.00 0.00 C ATOM 209 C LEU A 377 -5.812 8.026 0.824 1.00 0.00 C ATOM 210 O LEU A 377 -5.778 9.257 0.816 1.00 0.00 O ATOM 211 CB LEU A 377 -6.577 6.405 2.579 1.00 0.00 C ATOM 212 CG LEU A 377 -7.711 5.994 3.517 1.00 0.00 C ATOM 213 CD1 LEU A 377 -7.356 4.718 4.260 1.00 0.00 C ATOM 214 CD2 LEU A 377 -8.022 7.116 4.493 1.00 0.00 C ATOM 0 H LEU A 377 -7.652 5.467 0.615 1.00 0.00 H new ATOM 0 HA LEU A 377 -7.718 8.037 1.761 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -6.105 5.505 2.184 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -5.820 6.936 3.156 1.00 0.00 H new ATOM 0 HG LEU A 377 -8.602 5.801 2.919 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -8.176 4.443 4.923 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -7.183 3.915 3.543 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -6.453 4.879 4.849 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -8.832 6.809 5.155 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -7.135 7.340 5.085 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -8.323 8.006 3.940 1.00 0.00 H new ATOM 226 N ILE A 378 -4.828 7.274 0.341 1.00 0.00 N ATOM 227 CA ILE A 378 -3.629 7.874 -0.236 1.00 0.00 C ATOM 228 C ILE A 378 -3.656 7.820 -1.764 1.00 0.00 C ATOM 229 O ILE A 378 -3.345 8.808 -2.429 1.00 0.00 O ATOM 230 CB ILE A 378 -2.381 7.130 0.272 1.00 0.00 C ATOM 231 CG1 ILE A 378 -2.186 7.376 1.766 1.00 0.00 C ATOM 232 CG2 ILE A 378 -1.155 7.544 -0.508 1.00 0.00 C ATOM 233 CD1 ILE A 378 -1.129 6.493 2.396 1.00 0.00 C ATOM 0 H ILE A 378 -4.836 6.254 0.337 1.00 0.00 H new ATOM 0 HA ILE A 378 -3.597 8.919 0.072 1.00 0.00 H new ATOM 0 HB ILE A 378 -2.530 6.061 0.118 1.00 0.00 H new ATOM 0 HG12 ILE A 378 -1.914 8.420 1.921 1.00 0.00 H new ATOM 0 HG13 ILE A 378 -3.134 7.214 2.279 1.00 0.00 H new ATOM 0 HG21 ILE A 378 -0.285 7.005 -0.132 1.00 0.00 H new ATOM 0 HG22 ILE A 378 -1.298 7.310 -1.563 1.00 0.00 H new ATOM 0 HG23 ILE A 378 -0.996 8.616 -0.393 1.00 0.00 H new ATOM 0 HD11 ILE A 378 -1.047 6.725 3.458 1.00 0.00 H new ATOM 0 HD12 ILE A 378 -1.409 5.447 2.274 1.00 0.00 H new ATOM 0 HD13 ILE A 378 -0.170 6.671 1.910 1.00 0.00 H new ATOM 245 N GLY A 379 -4.010 6.658 -2.309 1.00 0.00 N ATOM 246 CA GLY A 379 -4.052 6.487 -3.754 1.00 0.00 C ATOM 247 C GLY A 379 -4.382 7.766 -4.500 1.00 0.00 C ATOM 248 O GLY A 379 -5.365 8.440 -4.190 1.00 0.00 O ATOM 0 H GLY A 379 -4.269 5.829 -1.774 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -3.087 6.113 -4.097 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -4.794 5.728 -4.002 1.00 0.00 H new ATOM 252 N TYR A 380 -3.556 8.096 -5.490 1.00 0.00 N ATOM 253 CA TYR A 380 -3.754 9.299 -6.292 1.00 0.00 C ATOM 254 C TYR A 380 -3.202 9.108 -7.702 1.00 0.00 C ATOM 255 O TYR A 380 -2.804 8.006 -8.079 1.00 0.00 O ATOM 256 CB TYR A 380 -3.082 10.501 -5.627 1.00 0.00 C ATOM 257 CG TYR A 380 -3.862 11.053 -4.455 1.00 0.00 C ATOM 258 CD1 TYR A 380 -5.214 11.345 -4.575 1.00 0.00 C ATOM 259 CD2 TYR A 380 -3.248 11.277 -3.230 1.00 0.00 C ATOM 260 CE1 TYR A 380 -5.932 11.846 -3.508 1.00 0.00 C ATOM 261 CE2 TYR A 380 -3.961 11.776 -2.156 1.00 0.00 C ATOM 262 CZ TYR A 380 -5.302 12.059 -2.301 1.00 0.00 C ATOM 263 OH TYR A 380 -6.015 12.553 -1.233 1.00 0.00 O ATOM 0 H TYR A 380 -2.740 7.544 -5.756 1.00 0.00 H new ATOM 0 HA TYR A 380 -4.826 9.486 -6.361 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -2.088 10.210 -5.288 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.948 11.289 -6.368 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -5.712 11.177 -5.519 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -2.197 11.058 -3.114 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -6.983 12.070 -3.619 1.00 0.00 H new ATOM 0 HE2 TYR A 380 -3.470 11.943 -1.209 1.00 0.00 H new ATOM 0 HH TYR A 380 -5.422 12.643 -0.458 1.00 0.00 H new ATOM 273 N ALA A 381 -3.183 10.188 -8.479 1.00 0.00 N ATOM 274 CA ALA A 381 -2.682 10.135 -9.847 1.00 0.00 C ATOM 275 C ALA A 381 -1.156 10.156 -9.879 1.00 0.00 C ATOM 276 O ALA A 381 -0.524 9.209 -10.348 1.00 0.00 O ATOM 277 CB ALA A 381 -3.242 11.283 -10.675 1.00 0.00 C ATOM 0 H ALA A 381 -3.509 11.109 -8.184 1.00 0.00 H new ATOM 0 HA ALA A 381 -3.019 9.195 -10.284 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -2.854 11.222 -11.692 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -4.330 11.218 -10.698 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -2.944 12.232 -10.229 1.00 0.00 H new ATOM 283 N SER A 382 -0.569 11.240 -9.379 1.00 0.00 N ATOM 284 CA SER A 382 0.884 11.382 -9.354 1.00 0.00 C ATOM 285 C SER A 382 1.494 10.511 -8.259 1.00 0.00 C ATOM 286 O SER A 382 2.692 10.228 -8.270 1.00 0.00 O ATOM 287 CB SER A 382 1.271 12.846 -9.134 1.00 0.00 C ATOM 288 OG SER A 382 0.897 13.286 -7.839 1.00 0.00 O ATOM 0 H SER A 382 -1.077 12.033 -8.986 1.00 0.00 H new ATOM 0 HA SER A 382 1.275 11.053 -10.317 1.00 0.00 H new ATOM 0 HB2 SER A 382 2.347 12.964 -9.265 1.00 0.00 H new ATOM 0 HB3 SER A 382 0.788 13.470 -9.886 1.00 0.00 H new ATOM 0 HG SER A 382 1.157 14.224 -7.724 1.00 0.00 H new ATOM 294 N LEU A 383 0.659 10.092 -7.315 1.00 0.00 N ATOM 295 CA LEU A 383 1.104 9.256 -6.208 1.00 0.00 C ATOM 296 C LEU A 383 0.993 7.778 -6.567 1.00 0.00 C ATOM 297 O LEU A 383 0.578 6.958 -5.749 1.00 0.00 O ATOM 298 CB LEU A 383 0.266 9.555 -4.965 1.00 0.00 C ATOM 299 CG LEU A 383 1.010 9.510 -3.628 1.00 0.00 C ATOM 300 CD1 LEU A 383 0.198 8.733 -2.611 1.00 0.00 C ATOM 301 CD2 LEU A 383 2.395 8.896 -3.779 1.00 0.00 C ATOM 0 H LEU A 383 -0.335 10.320 -7.295 1.00 0.00 H new ATOM 0 HA LEU A 383 2.150 9.482 -6.002 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -0.177 10.545 -5.079 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -0.556 8.841 -4.925 1.00 0.00 H new ATOM 0 HG LEU A 383 1.140 10.535 -3.279 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.734 8.705 -1.662 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.767 9.219 -2.469 1.00 0.00 H new ATOM 0 HD13 LEU A 383 0.043 7.716 -2.970 1.00 0.00 H new ATOM 0 HD21 LEU A 383 2.894 8.880 -2.810 1.00 0.00 H new ATOM 0 HD22 LEU A 383 2.302 7.877 -4.156 1.00 0.00 H new ATOM 0 HD23 LEU A 383 2.982 9.490 -4.480 1.00 0.00 H new ATOM 313 N ARG A 384 1.355 7.456 -7.801 1.00 0.00 N ATOM 314 CA ARG A 384 1.293 6.088 -8.307 1.00 0.00 C ATOM 315 C ARG A 384 1.737 5.056 -7.273 1.00 0.00 C ATOM 316 O ARG A 384 2.882 4.606 -7.294 1.00 0.00 O ATOM 317 CB ARG A 384 2.169 5.954 -9.553 1.00 0.00 C ATOM 318 CG ARG A 384 1.548 5.099 -10.645 1.00 0.00 C ATOM 319 CD ARG A 384 1.583 3.623 -10.280 1.00 0.00 C ATOM 320 NE ARG A 384 0.770 2.813 -11.183 1.00 0.00 N ATOM 321 CZ ARG A 384 -0.539 2.642 -11.042 1.00 0.00 C ATOM 322 NH1 ARG A 384 -1.184 3.232 -10.044 1.00 0.00 N ATOM 323 NH2 ARG A 384 -1.208 1.883 -11.899 1.00 0.00 N ATOM 0 H ARG A 384 1.700 8.134 -8.481 1.00 0.00 H new ATOM 0 HA ARG A 384 0.249 5.888 -8.548 1.00 0.00 H new ATOM 0 HB2 ARG A 384 2.372 6.948 -9.953 1.00 0.00 H new ATOM 0 HB3 ARG A 384 3.129 5.523 -9.267 1.00 0.00 H new ATOM 0 HG2 ARG A 384 0.517 5.410 -10.811 1.00 0.00 H new ATOM 0 HG3 ARG A 384 2.083 5.257 -11.581 1.00 0.00 H new ATOM 0 HD2 ARG A 384 2.613 3.269 -10.305 1.00 0.00 H new ATOM 0 HD3 ARG A 384 1.226 3.494 -9.258 1.00 0.00 H new ATOM 0 HE ARG A 384 1.234 2.353 -11.966 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -0.674 3.818 -9.383 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -2.190 3.099 -9.938 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -0.717 1.429 -12.669 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -2.214 1.753 -11.788 1.00 0.00 H new ATOM 337 N LEU A 385 0.823 4.651 -6.397 1.00 0.00 N ATOM 338 CA LEU A 385 1.133 3.638 -5.400 1.00 0.00 C ATOM 339 C LEU A 385 1.073 2.264 -6.058 1.00 0.00 C ATOM 340 O LEU A 385 0.398 2.095 -7.074 1.00 0.00 O ATOM 341 CB LEU A 385 0.169 3.732 -4.216 1.00 0.00 C ATOM 342 CG LEU A 385 -1.273 4.081 -4.574 1.00 0.00 C ATOM 343 CD1 LEU A 385 -1.749 3.261 -5.761 1.00 0.00 C ATOM 344 CD2 LEU A 385 -2.168 3.846 -3.377 1.00 0.00 C ATOM 0 H LEU A 385 -0.132 5.007 -6.359 1.00 0.00 H new ATOM 0 HA LEU A 385 2.138 3.801 -5.010 1.00 0.00 H new ATOM 0 HB2 LEU A 385 0.174 2.778 -3.688 1.00 0.00 H new ATOM 0 HB3 LEU A 385 0.545 4.483 -3.521 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.319 5.134 -4.853 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -2.779 3.527 -5.997 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.114 3.466 -6.623 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.696 2.200 -5.515 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.196 4.096 -3.637 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.113 2.798 -3.082 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -1.840 4.474 -2.549 1.00 0.00 H new ATOM 356 N HIS A 386 1.780 1.282 -5.511 1.00 0.00 N ATOM 357 CA HIS A 386 1.780 -0.051 -6.099 1.00 0.00 C ATOM 358 C HIS A 386 2.089 -1.112 -5.049 1.00 0.00 C ATOM 359 O HIS A 386 2.484 -0.792 -3.931 1.00 0.00 O ATOM 360 CB HIS A 386 2.798 -0.119 -7.242 1.00 0.00 C ATOM 361 CG HIS A 386 3.282 -1.505 -7.547 1.00 0.00 C ATOM 362 ND1 HIS A 386 4.394 -2.064 -6.952 1.00 0.00 N ATOM 363 CD2 HIS A 386 2.798 -2.445 -8.393 1.00 0.00 C ATOM 364 CE1 HIS A 386 4.573 -3.286 -7.421 1.00 0.00 C ATOM 365 NE2 HIS A 386 3.618 -3.542 -8.296 1.00 0.00 N ATOM 0 H HIS A 386 2.353 1.381 -4.673 1.00 0.00 H new ATOM 0 HA HIS A 386 0.785 -0.251 -6.496 1.00 0.00 H new ATOM 0 HB2 HIS A 386 2.348 0.304 -8.141 1.00 0.00 H new ATOM 0 HB3 HIS A 386 3.654 0.506 -6.990 1.00 0.00 H new ATOM 0 HD2 HIS A 386 1.928 -2.350 -9.026 1.00 0.00 H new ATOM 0 HE1 HIS A 386 5.366 -3.961 -7.137 1.00 0.00 H new ATOM 0 HE2 HIS A 386 3.507 -4.413 -8.815 1.00 0.00 H new ATOM 374 N TYR A 387 1.909 -2.375 -5.422 1.00 0.00 N ATOM 375 CA TYR A 387 2.171 -3.485 -4.513 1.00 0.00 C ATOM 376 C TYR A 387 3.269 -4.391 -5.059 1.00 0.00 C ATOM 377 O TYR A 387 3.129 -4.986 -6.128 1.00 0.00 O ATOM 378 CB TYR A 387 0.888 -4.283 -4.276 1.00 0.00 C ATOM 379 CG TYR A 387 -0.300 -3.410 -3.939 1.00 0.00 C ATOM 380 CD1 TYR A 387 -0.506 -2.951 -2.643 1.00 0.00 C ATOM 381 CD2 TYR A 387 -1.207 -3.030 -4.920 1.00 0.00 C ATOM 382 CE1 TYR A 387 -1.579 -2.141 -2.336 1.00 0.00 C ATOM 383 CE2 TYR A 387 -2.287 -2.222 -4.619 1.00 0.00 C ATOM 384 CZ TYR A 387 -2.468 -1.780 -3.326 1.00 0.00 C ATOM 385 OH TYR A 387 -3.539 -0.971 -3.023 1.00 0.00 O ATOM 0 H TYR A 387 1.583 -2.655 -6.347 1.00 0.00 H new ATOM 0 HA TYR A 387 2.514 -3.077 -3.562 1.00 0.00 H new ATOM 0 HB2 TYR A 387 0.661 -4.867 -5.168 1.00 0.00 H new ATOM 0 HB3 TYR A 387 1.053 -4.991 -3.464 1.00 0.00 H new ATOM 0 HD1 TYR A 387 0.186 -3.234 -1.863 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -1.066 -3.372 -5.935 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -1.722 -1.791 -1.324 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -2.985 -1.938 -5.393 1.00 0.00 H new ATOM 0 HH TYR A 387 -3.926 -0.616 -3.851 1.00 0.00 H new ATOM 395 N VAL A 388 4.364 -4.479 -4.314 1.00 0.00 N ATOM 396 CA VAL A 388 5.504 -5.298 -4.702 1.00 0.00 C ATOM 397 C VAL A 388 5.564 -6.573 -3.867 1.00 0.00 C ATOM 398 O VAL A 388 5.492 -6.521 -2.644 1.00 0.00 O ATOM 399 CB VAL A 388 6.818 -4.519 -4.525 1.00 0.00 C ATOM 400 CG1 VAL A 388 6.870 -3.871 -3.148 1.00 0.00 C ATOM 401 CG2 VAL A 388 8.013 -5.429 -4.744 1.00 0.00 C ATOM 0 H VAL A 388 4.486 -3.987 -3.429 1.00 0.00 H new ATOM 0 HA VAL A 388 5.378 -5.561 -5.752 1.00 0.00 H new ATOM 0 HB VAL A 388 6.856 -3.728 -5.274 1.00 0.00 H new ATOM 0 HG11 VAL A 388 7.806 -3.324 -3.039 1.00 0.00 H new ATOM 0 HG12 VAL A 388 6.032 -3.183 -3.038 1.00 0.00 H new ATOM 0 HG13 VAL A 388 6.809 -4.642 -2.380 1.00 0.00 H new ATOM 0 HG21 VAL A 388 8.933 -4.859 -4.614 1.00 0.00 H new ATOM 0 HG22 VAL A 388 7.987 -6.245 -4.021 1.00 0.00 H new ATOM 0 HG23 VAL A 388 7.979 -5.838 -5.754 1.00 0.00 H new ATOM 411 N THR A 389 5.687 -7.718 -4.533 1.00 0.00 N ATOM 412 CA THR A 389 5.742 -8.999 -3.836 1.00 0.00 C ATOM 413 C THR A 389 7.178 -9.469 -3.621 1.00 0.00 C ATOM 414 O THR A 389 7.929 -9.664 -4.575 1.00 0.00 O ATOM 415 CB THR A 389 4.969 -10.090 -4.601 1.00 0.00 C ATOM 416 OG1 THR A 389 3.569 -9.790 -4.665 1.00 0.00 O ATOM 417 CG2 THR A 389 5.140 -11.445 -3.933 1.00 0.00 C ATOM 0 H THR A 389 5.750 -7.785 -5.549 1.00 0.00 H new ATOM 0 HA THR A 389 5.274 -8.838 -2.865 1.00 0.00 H new ATOM 0 HB THR A 389 5.380 -10.120 -5.610 1.00 0.00 H new ATOM 0 HG1 THR A 389 3.242 -9.946 -5.576 1.00 0.00 H new ATOM 0 HG21 THR A 389 4.585 -12.199 -4.492 1.00 0.00 H new ATOM 0 HG22 THR A 389 6.197 -11.711 -3.916 1.00 0.00 H new ATOM 0 HG23 THR A 389 4.761 -11.398 -2.912 1.00 0.00 H new ATOM 425 N VAL A 390 7.543 -9.657 -2.356 1.00 0.00 N ATOM 426 CA VAL A 390 8.882 -10.117 -2.000 1.00 0.00 C ATOM 427 C VAL A 390 8.910 -11.633 -1.857 1.00 0.00 C ATOM 428 O VAL A 390 9.879 -12.285 -2.246 1.00 0.00 O ATOM 429 CB VAL A 390 9.385 -9.485 -0.683 1.00 0.00 C ATOM 430 CG1 VAL A 390 10.642 -8.670 -0.930 1.00 0.00 C ATOM 431 CG2 VAL A 390 8.309 -8.625 -0.038 1.00 0.00 C ATOM 0 H VAL A 390 6.928 -9.497 -1.558 1.00 0.00 H new ATOM 0 HA VAL A 390 9.542 -9.805 -2.809 1.00 0.00 H new ATOM 0 HB VAL A 390 9.624 -10.294 0.007 1.00 0.00 H new ATOM 0 HG11 VAL A 390 10.982 -8.232 0.009 1.00 0.00 H new ATOM 0 HG12 VAL A 390 11.422 -9.317 -1.332 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.426 -7.875 -1.644 1.00 0.00 H new ATOM 0 HG21 VAL A 390 8.693 -8.194 0.887 1.00 0.00 H new ATOM 0 HG22 VAL A 390 8.025 -7.824 -0.721 1.00 0.00 H new ATOM 0 HG23 VAL A 390 7.436 -9.239 0.183 1.00 0.00 H new ATOM 441 N LYS A 391 7.839 -12.190 -1.301 1.00 0.00 N ATOM 442 CA LYS A 391 7.741 -13.632 -1.114 1.00 0.00 C ATOM 443 C LYS A 391 6.291 -14.100 -1.193 1.00 0.00 C ATOM 444 O LYS A 391 5.360 -13.320 -0.990 1.00 0.00 O ATOM 445 CB LYS A 391 8.383 -14.049 0.222 1.00 0.00 C ATOM 446 CG LYS A 391 7.399 -14.395 1.336 1.00 0.00 C ATOM 447 CD LYS A 391 8.037 -15.314 2.365 1.00 0.00 C ATOM 448 CE LYS A 391 8.288 -16.700 1.788 1.00 0.00 C ATOM 449 NZ LYS A 391 9.461 -17.364 2.422 1.00 0.00 N ATOM 0 H LYS A 391 7.028 -11.665 -0.973 1.00 0.00 H new ATOM 0 HA LYS A 391 8.289 -14.116 -1.922 1.00 0.00 H new ATOM 0 HB2 LYS A 391 9.024 -14.912 0.045 1.00 0.00 H new ATOM 0 HB3 LYS A 391 9.026 -13.239 0.566 1.00 0.00 H new ATOM 0 HG2 LYS A 391 7.059 -13.480 1.822 1.00 0.00 H new ATOM 0 HG3 LYS A 391 6.518 -14.876 0.911 1.00 0.00 H new ATOM 0 HD2 LYS A 391 8.979 -14.884 2.706 1.00 0.00 H new ATOM 0 HD3 LYS A 391 7.388 -15.393 3.237 1.00 0.00 H new ATOM 0 HE2 LYS A 391 7.401 -17.318 1.930 1.00 0.00 H new ATOM 0 HE3 LYS A 391 8.453 -16.621 0.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 9.597 -18.305 2.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 10.313 -16.788 2.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 9.293 -17.463 3.444 1.00 0.00 H new ATOM 463 N LYS A 392 6.116 -15.384 -1.478 1.00 0.00 N ATOM 464 CA LYS A 392 4.791 -15.981 -1.577 1.00 0.00 C ATOM 465 C LYS A 392 4.783 -17.355 -0.922 1.00 0.00 C ATOM 466 O LYS A 392 5.833 -17.889 -0.565 1.00 0.00 O ATOM 467 CB LYS A 392 4.359 -16.101 -3.041 1.00 0.00 C ATOM 468 CG LYS A 392 5.369 -15.544 -4.031 1.00 0.00 C ATOM 469 CD LYS A 392 6.526 -16.505 -4.248 1.00 0.00 C ATOM 470 CE LYS A 392 7.262 -16.208 -5.546 1.00 0.00 C ATOM 471 NZ LYS A 392 6.575 -16.805 -6.725 1.00 0.00 N ATOM 0 H LYS A 392 6.882 -16.036 -1.646 1.00 0.00 H new ATOM 0 HA LYS A 392 4.085 -15.333 -1.058 1.00 0.00 H new ATOM 0 HB2 LYS A 392 4.181 -17.151 -3.272 1.00 0.00 H new ATOM 0 HB3 LYS A 392 3.411 -15.580 -3.173 1.00 0.00 H new ATOM 0 HG2 LYS A 392 4.876 -15.346 -4.983 1.00 0.00 H new ATOM 0 HG3 LYS A 392 5.750 -14.591 -3.665 1.00 0.00 H new ATOM 0 HD2 LYS A 392 7.220 -16.435 -3.411 1.00 0.00 H new ATOM 0 HD3 LYS A 392 6.152 -17.528 -4.267 1.00 0.00 H new ATOM 0 HE2 LYS A 392 7.340 -15.129 -5.680 1.00 0.00 H new ATOM 0 HE3 LYS A 392 8.279 -16.596 -5.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 7.109 -16.579 -7.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 6.522 -17.837 -6.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 5.614 -16.416 -6.800 1.00 0.00 H new ATOM 485 N PRO A 393 3.594 -17.951 -0.758 1.00 0.00 N ATOM 486 CA PRO A 393 3.457 -19.275 -0.147 1.00 0.00 C ATOM 487 C PRO A 393 4.187 -20.347 -0.945 1.00 0.00 C ATOM 488 O PRO A 393 4.053 -20.425 -2.167 1.00 0.00 O ATOM 489 CB PRO A 393 1.945 -19.528 -0.160 1.00 0.00 C ATOM 490 CG PRO A 393 1.402 -18.591 -1.185 1.00 0.00 C ATOM 491 CD PRO A 393 2.298 -17.387 -1.160 1.00 0.00 C ATOM 0 HA PRO A 393 3.892 -19.312 0.852 1.00 0.00 H new ATOM 0 HB2 PRO A 393 1.721 -20.564 -0.415 1.00 0.00 H new ATOM 0 HB3 PRO A 393 1.505 -19.339 0.819 1.00 0.00 H new ATOM 0 HG2 PRO A 393 1.397 -19.053 -2.172 1.00 0.00 H new ATOM 0 HG3 PRO A 393 0.372 -18.316 -0.956 1.00 0.00 H new ATOM 0 HD2 PRO A 393 2.353 -16.904 -2.135 1.00 0.00 H new ATOM 0 HD3 PRO A 393 1.947 -16.637 -0.452 1.00 0.00 H new ATOM 499 N THR A 394 4.965 -21.168 -0.250 1.00 0.00 N ATOM 500 CA THR A 394 5.721 -22.231 -0.897 1.00 0.00 C ATOM 501 C THR A 394 5.816 -23.462 -0.001 1.00 0.00 C ATOM 502 O THR A 394 5.722 -23.360 1.222 1.00 0.00 O ATOM 503 CB THR A 394 7.140 -21.759 -1.260 1.00 0.00 C ATOM 504 OG1 THR A 394 8.036 -21.906 -0.153 1.00 0.00 O ATOM 505 CG2 THR A 394 7.131 -20.295 -1.679 1.00 0.00 C ATOM 0 H THR A 394 5.088 -21.117 0.761 1.00 0.00 H new ATOM 0 HA THR A 394 5.187 -22.495 -1.810 1.00 0.00 H new ATOM 0 HB THR A 394 7.481 -22.381 -2.087 1.00 0.00 H new ATOM 0 HG1 THR A 394 8.634 -21.131 -0.111 1.00 0.00 H new ATOM 0 HG21 THR A 394 8.144 -19.982 -1.931 1.00 0.00 H new ATOM 0 HG22 THR A 394 6.486 -20.169 -2.548 1.00 0.00 H new ATOM 0 HG23 THR A 394 6.757 -19.684 -0.858 1.00 0.00 H new ATOM 513 N ALA A 395 6.003 -24.626 -0.616 1.00 0.00 N ATOM 514 CA ALA A 395 6.110 -25.873 0.131 1.00 0.00 C ATOM 515 C ALA A 395 7.073 -25.724 1.302 1.00 0.00 C ATOM 516 O ALA A 395 6.802 -26.193 2.407 1.00 0.00 O ATOM 517 CB ALA A 395 6.553 -27.017 -0.771 1.00 0.00 C ATOM 0 H ALA A 395 6.083 -24.731 -1.627 1.00 0.00 H new ATOM 0 HA ALA A 395 5.120 -26.108 0.523 1.00 0.00 H new ATOM 0 HB1 ALA A 395 6.624 -27.934 -0.187 1.00 0.00 H new ATOM 0 HB2 ALA A 395 5.825 -27.152 -1.571 1.00 0.00 H new ATOM 0 HB3 ALA A 395 7.527 -26.785 -1.202 1.00 0.00 H new ATOM 523 N VAL A 396 8.198 -25.065 1.052 1.00 0.00 N ATOM 524 CA VAL A 396 9.202 -24.850 2.079 1.00 0.00 C ATOM 525 C VAL A 396 8.764 -23.766 3.058 1.00 0.00 C ATOM 526 O VAL A 396 9.022 -23.856 4.259 1.00 0.00 O ATOM 527 CB VAL A 396 10.554 -24.459 1.453 1.00 0.00 C ATOM 528 CG1 VAL A 396 10.811 -25.269 0.192 1.00 0.00 C ATOM 529 CG2 VAL A 396 10.605 -22.967 1.152 1.00 0.00 C ATOM 0 H VAL A 396 8.436 -24.670 0.142 1.00 0.00 H new ATOM 0 HA VAL A 396 9.318 -25.789 2.621 1.00 0.00 H new ATOM 0 HB VAL A 396 11.339 -24.684 2.175 1.00 0.00 H new ATOM 0 HG11 VAL A 396 11.770 -24.980 -0.237 1.00 0.00 H new ATOM 0 HG12 VAL A 396 10.829 -26.331 0.439 1.00 0.00 H new ATOM 0 HG13 VAL A 396 10.018 -25.078 -0.531 1.00 0.00 H new ATOM 0 HG21 VAL A 396 11.570 -22.718 0.711 1.00 0.00 H new ATOM 0 HG22 VAL A 396 9.809 -22.709 0.453 1.00 0.00 H new ATOM 0 HG23 VAL A 396 10.472 -22.405 2.076 1.00 0.00 H new ATOM 539 N ASP A 397 8.104 -22.739 2.534 1.00 0.00 N ATOM 540 CA ASP A 397 7.635 -21.634 3.360 1.00 0.00 C ATOM 541 C ASP A 397 6.322 -21.068 2.829 1.00 0.00 C ATOM 542 O ASP A 397 6.301 -20.360 1.822 1.00 0.00 O ATOM 543 CB ASP A 397 8.692 -20.529 3.420 1.00 0.00 C ATOM 544 CG ASP A 397 9.355 -20.438 4.780 1.00 0.00 C ATOM 545 OD1 ASP A 397 9.282 -21.424 5.543 1.00 0.00 O ATOM 546 OD2 ASP A 397 9.948 -19.381 5.082 1.00 0.00 O ATOM 0 H ASP A 397 7.882 -22.649 1.542 1.00 0.00 H new ATOM 0 HA ASP A 397 7.461 -22.018 4.365 1.00 0.00 H new ATOM 0 HB2 ASP A 397 9.451 -20.714 2.660 1.00 0.00 H new ATOM 0 HB3 ASP A 397 8.228 -19.572 3.180 1.00 0.00 H new ATOM 551 N PRO A 398 5.205 -21.377 3.505 1.00 0.00 N ATOM 552 CA PRO A 398 3.879 -20.904 3.108 1.00 0.00 C ATOM 553 C PRO A 398 3.616 -19.468 3.554 1.00 0.00 C ATOM 554 O PRO A 398 2.536 -19.155 4.057 1.00 0.00 O ATOM 555 CB PRO A 398 2.947 -21.870 3.834 1.00 0.00 C ATOM 556 CG PRO A 398 3.686 -22.233 5.076 1.00 0.00 C ATOM 557 CD PRO A 398 5.151 -22.220 4.715 1.00 0.00 C ATOM 0 HA PRO A 398 3.750 -20.888 2.026 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.990 -21.402 4.063 1.00 0.00 H new ATOM 0 HB3 PRO A 398 2.734 -22.750 3.226 1.00 0.00 H new ATOM 0 HG2 PRO A 398 3.476 -21.522 5.875 1.00 0.00 H new ATOM 0 HG3 PRO A 398 3.383 -23.216 5.436 1.00 0.00 H new ATOM 0 HD2 PRO A 398 5.758 -21.805 5.520 1.00 0.00 H new ATOM 0 HD3 PRO A 398 5.524 -23.225 4.520 1.00 0.00 H new ATOM 565 N ASN A 399 4.606 -18.599 3.370 1.00 0.00 N ATOM 566 CA ASN A 399 4.470 -17.199 3.758 1.00 0.00 C ATOM 567 C ASN A 399 4.669 -16.266 2.569 1.00 0.00 C ATOM 568 O ASN A 399 5.478 -16.532 1.680 1.00 0.00 O ATOM 569 CB ASN A 399 5.469 -16.844 4.860 1.00 0.00 C ATOM 570 CG ASN A 399 5.883 -18.050 5.680 1.00 0.00 C ATOM 571 OD1 ASN A 399 7.133 -18.470 5.525 1.00 0.00 O flip ATOM 572 ND2 ASN A 399 5.088 -18.597 6.446 1.00 0.00 N flip ATOM 0 H ASN A 399 5.507 -18.838 2.957 1.00 0.00 H new ATOM 0 HA ASN A 399 3.456 -17.066 4.134 1.00 0.00 H new ATOM 0 HB2 ASN A 399 6.354 -16.393 4.412 1.00 0.00 H new ATOM 0 HB3 ASN A 399 5.028 -16.095 5.518 1.00 0.00 H new ATOM 0 HD21 ASN A 399 4.136 -18.240 6.534 1.00 0.00 H new ATOM 0 HD22 ASN A 399 5.381 -19.407 6.993 1.00 0.00 H new ATOM 579 N SER A 400 3.920 -15.172 2.570 1.00 0.00 N ATOM 580 CA SER A 400 3.985 -14.176 1.514 1.00 0.00 C ATOM 581 C SER A 400 4.357 -12.812 2.095 1.00 0.00 C ATOM 582 O SER A 400 4.036 -12.511 3.246 1.00 0.00 O ATOM 583 CB SER A 400 2.627 -14.104 0.825 1.00 0.00 C ATOM 584 OG SER A 400 1.715 -14.952 1.470 1.00 0.00 O ATOM 0 H SER A 400 3.249 -14.951 3.306 1.00 0.00 H new ATOM 0 HA SER A 400 4.750 -14.457 0.790 1.00 0.00 H new ATOM 0 HB2 SER A 400 2.256 -13.079 0.840 1.00 0.00 H new ATOM 0 HB3 SER A 400 2.726 -14.392 -0.222 1.00 0.00 H new ATOM 0 HG SER A 400 1.732 -14.778 2.434 1.00 0.00 H new ATOM 590 N ILE A 401 5.016 -11.983 1.292 1.00 0.00 N ATOM 591 CA ILE A 401 5.414 -10.644 1.722 1.00 0.00 C ATOM 592 C ILE A 401 5.216 -9.652 0.588 1.00 0.00 C ATOM 593 O ILE A 401 5.584 -9.937 -0.551 1.00 0.00 O ATOM 594 CB ILE A 401 6.896 -10.595 2.154 1.00 0.00 C ATOM 595 CG1 ILE A 401 7.178 -11.618 3.257 1.00 0.00 C ATOM 596 CG2 ILE A 401 7.263 -9.194 2.618 1.00 0.00 C ATOM 597 CD1 ILE A 401 8.548 -12.251 3.156 1.00 0.00 C ATOM 0 H ILE A 401 5.287 -12.215 0.336 1.00 0.00 H new ATOM 0 HA ILE A 401 4.789 -10.384 2.576 1.00 0.00 H new ATOM 0 HB ILE A 401 7.513 -10.850 1.292 1.00 0.00 H new ATOM 0 HG12 ILE A 401 7.082 -11.130 4.227 1.00 0.00 H new ATOM 0 HG13 ILE A 401 6.421 -12.401 3.218 1.00 0.00 H new ATOM 0 HG21 ILE A 401 8.310 -9.173 2.920 1.00 0.00 H new ATOM 0 HG22 ILE A 401 7.106 -8.488 1.803 1.00 0.00 H new ATOM 0 HG23 ILE A 401 6.636 -8.915 3.465 1.00 0.00 H new ATOM 0 HD11 ILE A 401 8.680 -12.965 3.969 1.00 0.00 H new ATOM 0 HD12 ILE A 401 8.641 -12.767 2.201 1.00 0.00 H new ATOM 0 HD13 ILE A 401 9.312 -11.477 3.226 1.00 0.00 H new ATOM 609 N VAL A 402 4.640 -8.486 0.878 1.00 0.00 N ATOM 610 CA VAL A 402 4.420 -7.481 -0.149 1.00 0.00 C ATOM 611 C VAL A 402 4.590 -6.079 0.431 1.00 0.00 C ATOM 612 O VAL A 402 4.293 -5.839 1.600 1.00 0.00 O ATOM 613 CB VAL A 402 3.013 -7.609 -0.766 1.00 0.00 C ATOM 614 CG1 VAL A 402 2.670 -6.382 -1.597 1.00 0.00 C ATOM 615 CG2 VAL A 402 2.916 -8.874 -1.604 1.00 0.00 C ATOM 0 H VAL A 402 4.321 -8.220 1.810 1.00 0.00 H new ATOM 0 HA VAL A 402 5.161 -7.645 -0.931 1.00 0.00 H new ATOM 0 HB VAL A 402 2.288 -7.676 0.045 1.00 0.00 H new ATOM 0 HG11 VAL A 402 1.673 -6.497 -2.021 1.00 0.00 H new ATOM 0 HG12 VAL A 402 2.695 -5.495 -0.964 1.00 0.00 H new ATOM 0 HG13 VAL A 402 3.396 -6.273 -2.402 1.00 0.00 H new ATOM 0 HG21 VAL A 402 1.917 -8.951 -2.033 1.00 0.00 H new ATOM 0 HG22 VAL A 402 3.653 -8.837 -2.406 1.00 0.00 H new ATOM 0 HG23 VAL A 402 3.108 -9.743 -0.975 1.00 0.00 H new ATOM 625 N GLU A 403 5.071 -5.161 -0.394 1.00 0.00 N ATOM 626 CA GLU A 403 5.285 -3.781 0.027 1.00 0.00 C ATOM 627 C GLU A 403 4.507 -2.827 -0.867 1.00 0.00 C ATOM 628 O GLU A 403 4.423 -3.035 -2.075 1.00 0.00 O ATOM 629 CB GLU A 403 6.776 -3.437 -0.018 1.00 0.00 C ATOM 630 CG GLU A 403 7.690 -4.640 0.167 1.00 0.00 C ATOM 631 CD GLU A 403 9.055 -4.438 -0.464 1.00 0.00 C ATOM 632 OE1 GLU A 403 9.338 -3.308 -0.916 1.00 0.00 O ATOM 633 OE2 GLU A 403 9.839 -5.409 -0.506 1.00 0.00 O ATOM 0 H GLU A 403 5.322 -5.347 -1.365 1.00 0.00 H new ATOM 0 HA GLU A 403 4.928 -3.674 1.051 1.00 0.00 H new ATOM 0 HB2 GLU A 403 7.002 -2.965 -0.974 1.00 0.00 H new ATOM 0 HB3 GLU A 403 6.994 -2.704 0.759 1.00 0.00 H new ATOM 0 HG2 GLU A 403 7.812 -4.839 1.232 1.00 0.00 H new ATOM 0 HG3 GLU A 403 7.219 -5.520 -0.270 1.00 0.00 H new ATOM 640 N CYS A 404 3.929 -1.783 -0.281 1.00 0.00 N ATOM 641 CA CYS A 404 3.164 -0.827 -1.057 1.00 0.00 C ATOM 642 C CYS A 404 4.012 0.387 -1.419 1.00 0.00 C ATOM 643 O CYS A 404 4.161 1.310 -0.617 1.00 0.00 O ATOM 644 CB CYS A 404 1.944 -0.377 -0.256 1.00 0.00 C ATOM 645 SG CYS A 404 0.734 -1.685 0.048 1.00 0.00 S ATOM 0 H CYS A 404 3.977 -1.583 0.718 1.00 0.00 H new ATOM 0 HA CYS A 404 2.844 -1.311 -1.980 1.00 0.00 H new ATOM 0 HB2 CYS A 404 2.279 0.022 0.701 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.455 0.439 -0.788 1.00 0.00 H new ATOM 0 HG CYS A 404 0.025 -1.878 -1.024 1.00 0.00 H new ATOM 651 N ARG A 405 4.574 0.381 -2.624 1.00 0.00 N ATOM 652 CA ARG A 405 5.416 1.481 -3.078 1.00 0.00 C ATOM 653 C ARG A 405 4.583 2.584 -3.717 1.00 0.00 C ATOM 654 O ARG A 405 3.354 2.532 -3.710 1.00 0.00 O ATOM 655 CB ARG A 405 6.460 0.980 -4.079 1.00 0.00 C ATOM 656 CG ARG A 405 6.634 -0.528 -4.076 1.00 0.00 C ATOM 657 CD ARG A 405 7.922 -0.937 -4.772 1.00 0.00 C ATOM 658 NE ARG A 405 7.775 -0.957 -6.224 1.00 0.00 N ATOM 659 CZ ARG A 405 7.954 0.108 -6.998 1.00 0.00 C ATOM 660 NH1 ARG A 405 8.305 1.270 -6.464 1.00 0.00 N ATOM 661 NH2 ARG A 405 7.783 0.011 -8.310 1.00 0.00 N ATOM 0 H ARG A 405 4.461 -0.372 -3.302 1.00 0.00 H new ATOM 0 HA ARG A 405 5.923 1.891 -2.205 1.00 0.00 H new ATOM 0 HB2 ARG A 405 6.174 1.302 -5.080 1.00 0.00 H new ATOM 0 HB3 ARG A 405 7.419 1.448 -3.855 1.00 0.00 H new ATOM 0 HG2 ARG A 405 6.641 -0.893 -3.049 1.00 0.00 H new ATOM 0 HG3 ARG A 405 5.785 -0.995 -4.574 1.00 0.00 H new ATOM 0 HD2 ARG A 405 8.718 -0.245 -4.498 1.00 0.00 H new ATOM 0 HD3 ARG A 405 8.224 -1.925 -4.424 1.00 0.00 H new ATOM 0 HE ARG A 405 7.520 -1.838 -6.670 1.00 0.00 H new ATOM 0 HH11 ARG A 405 8.439 1.348 -5.456 1.00 0.00 H new ATOM 0 HH12 ARG A 405 8.442 2.085 -7.061 1.00 0.00 H new ATOM 0 HH21 ARG A 405 7.514 -0.881 -8.725 1.00 0.00 H new ATOM 0 HH22 ARG A 405 7.920 0.829 -8.904 1.00 0.00 H new ATOM 675 N VAL A 406 5.266 3.581 -4.265 1.00 0.00 N ATOM 676 CA VAL A 406 4.595 4.702 -4.908 1.00 0.00 C ATOM 677 C VAL A 406 5.491 5.351 -5.955 1.00 0.00 C ATOM 678 O VAL A 406 6.706 5.158 -5.952 1.00 0.00 O ATOM 679 CB VAL A 406 4.158 5.763 -3.879 1.00 0.00 C ATOM 680 CG1 VAL A 406 2.656 5.697 -3.655 1.00 0.00 C ATOM 681 CG2 VAL A 406 4.906 5.581 -2.565 1.00 0.00 C ATOM 0 H VAL A 406 6.284 3.636 -4.277 1.00 0.00 H new ATOM 0 HA VAL A 406 3.707 4.302 -5.397 1.00 0.00 H new ATOM 0 HB VAL A 406 4.405 6.748 -4.275 1.00 0.00 H new ATOM 0 HG11 VAL A 406 2.363 6.452 -2.926 1.00 0.00 H new ATOM 0 HG12 VAL A 406 2.139 5.882 -4.597 1.00 0.00 H new ATOM 0 HG13 VAL A 406 2.387 4.709 -3.282 1.00 0.00 H new ATOM 0 HG21 VAL A 406 4.582 6.341 -1.854 1.00 0.00 H new ATOM 0 HG22 VAL A 406 4.695 4.591 -2.160 1.00 0.00 H new ATOM 0 HG23 VAL A 406 5.977 5.681 -2.739 1.00 0.00 H new ATOM 691 N GLY A 407 4.883 6.115 -6.858 1.00 0.00 N ATOM 692 CA GLY A 407 5.641 6.774 -7.904 1.00 0.00 C ATOM 693 C GLY A 407 6.918 7.414 -7.389 1.00 0.00 C ATOM 694 O GLY A 407 7.878 7.583 -8.140 1.00 0.00 O ATOM 0 H GLY A 407 3.878 6.289 -6.883 1.00 0.00 H new ATOM 0 HA2 GLY A 407 5.890 6.049 -8.678 1.00 0.00 H new ATOM 0 HA3 GLY A 407 5.019 7.538 -8.371 1.00 0.00 H new ATOM 698 N ASP A 408 6.927 7.775 -6.110 1.00 0.00 N ATOM 699 CA ASP A 408 8.095 8.404 -5.502 1.00 0.00 C ATOM 700 C ASP A 408 9.172 7.375 -5.170 1.00 0.00 C ATOM 701 O ASP A 408 10.221 7.717 -4.626 1.00 0.00 O ATOM 702 CB ASP A 408 7.691 9.157 -4.236 1.00 0.00 C ATOM 703 CG ASP A 408 8.756 10.134 -3.781 1.00 0.00 C ATOM 704 OD1 ASP A 408 9.660 10.444 -4.584 1.00 0.00 O ATOM 705 OD2 ASP A 408 8.688 10.588 -2.619 1.00 0.00 O ATOM 0 H ASP A 408 6.140 7.643 -5.475 1.00 0.00 H new ATOM 0 HA ASP A 408 8.508 9.107 -6.225 1.00 0.00 H new ATOM 0 HB2 ASP A 408 6.761 9.696 -4.418 1.00 0.00 H new ATOM 0 HB3 ASP A 408 7.494 8.441 -3.438 1.00 0.00 H new ATOM 710 N GLY A 409 8.907 6.117 -5.502 1.00 0.00 N ATOM 711 CA GLY A 409 9.866 5.061 -5.233 1.00 0.00 C ATOM 712 C GLY A 409 9.959 4.721 -3.759 1.00 0.00 C ATOM 713 O GLY A 409 10.802 3.921 -3.351 1.00 0.00 O ATOM 0 H GLY A 409 8.045 5.809 -5.953 1.00 0.00 H new ATOM 0 HA2 GLY A 409 9.584 4.168 -5.791 1.00 0.00 H new ATOM 0 HA3 GLY A 409 10.848 5.366 -5.595 1.00 0.00 H new ATOM 717 N THR A 410 9.093 5.332 -2.958 1.00 0.00 N ATOM 718 CA THR A 410 9.081 5.096 -1.520 1.00 0.00 C ATOM 719 C THR A 410 8.000 4.092 -1.134 1.00 0.00 C ATOM 720 O THR A 410 6.900 4.103 -1.687 1.00 0.00 O ATOM 721 CB THR A 410 8.851 6.403 -0.735 1.00 0.00 C ATOM 722 OG1 THR A 410 9.738 7.440 -1.174 1.00 0.00 O ATOM 723 CG2 THR A 410 9.065 6.185 0.756 1.00 0.00 C ATOM 0 H THR A 410 8.389 5.996 -3.281 1.00 0.00 H new ATOM 0 HA THR A 410 10.060 4.692 -1.261 1.00 0.00 H new ATOM 0 HB THR A 410 7.821 6.706 -0.921 1.00 0.00 H new ATOM 0 HG1 THR A 410 9.567 8.256 -0.659 1.00 0.00 H new ATOM 0 HG21 THR A 410 8.897 7.121 1.288 1.00 0.00 H new ATOM 0 HG22 THR A 410 8.365 5.431 1.118 1.00 0.00 H new ATOM 0 HG23 THR A 410 10.086 5.846 0.931 1.00 0.00 H new ATOM 731 N VAL A 411 8.321 3.230 -0.177 1.00 0.00 N ATOM 732 CA VAL A 411 7.378 2.221 0.293 1.00 0.00 C ATOM 733 C VAL A 411 6.511 2.777 1.416 1.00 0.00 C ATOM 734 O VAL A 411 6.974 2.936 2.545 1.00 0.00 O ATOM 735 CB VAL A 411 8.101 0.959 0.801 1.00 0.00 C ATOM 736 CG1 VAL A 411 7.093 -0.097 1.233 1.00 0.00 C ATOM 737 CG2 VAL A 411 9.036 0.410 -0.265 1.00 0.00 C ATOM 0 H VAL A 411 9.228 3.209 0.290 1.00 0.00 H new ATOM 0 HA VAL A 411 6.753 1.950 -0.558 1.00 0.00 H new ATOM 0 HB VAL A 411 8.701 1.233 1.669 1.00 0.00 H new ATOM 0 HG11 VAL A 411 7.622 -0.981 1.589 1.00 0.00 H new ATOM 0 HG12 VAL A 411 6.471 0.301 2.035 1.00 0.00 H new ATOM 0 HG13 VAL A 411 6.464 -0.368 0.385 1.00 0.00 H new ATOM 0 HG21 VAL A 411 9.537 -0.481 0.114 1.00 0.00 H new ATOM 0 HG22 VAL A 411 8.462 0.153 -1.155 1.00 0.00 H new ATOM 0 HG23 VAL A 411 9.781 1.164 -0.519 1.00 0.00 H new ATOM 747 N LEU A 412 5.255 3.078 1.102 1.00 0.00 N ATOM 748 CA LEU A 412 4.338 3.625 2.096 1.00 0.00 C ATOM 749 C LEU A 412 3.748 2.533 2.975 1.00 0.00 C ATOM 750 O LEU A 412 3.371 2.783 4.120 1.00 0.00 O ATOM 751 CB LEU A 412 3.214 4.428 1.432 1.00 0.00 C ATOM 752 CG LEU A 412 2.522 3.777 0.232 1.00 0.00 C ATOM 753 CD1 LEU A 412 1.451 2.803 0.696 1.00 0.00 C ATOM 754 CD2 LEU A 412 1.908 4.849 -0.654 1.00 0.00 C ATOM 0 H LEU A 412 4.851 2.954 0.174 1.00 0.00 H new ATOM 0 HA LEU A 412 4.919 4.296 2.729 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.457 4.642 2.187 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.624 5.386 1.111 1.00 0.00 H new ATOM 0 HG LEU A 412 3.265 3.223 -0.341 1.00 0.00 H new ATOM 0 HD11 LEU A 412 0.970 2.350 -0.171 1.00 0.00 H new ATOM 0 HD12 LEU A 412 1.908 2.023 1.306 1.00 0.00 H new ATOM 0 HD13 LEU A 412 0.706 3.336 1.287 1.00 0.00 H new ATOM 0 HD21 LEU A 412 1.417 4.379 -1.506 1.00 0.00 H new ATOM 0 HD22 LEU A 412 1.176 5.418 -0.082 1.00 0.00 H new ATOM 0 HD23 LEU A 412 2.691 5.519 -1.010 1.00 0.00 H new ATOM 766 N GLY A 413 3.663 1.321 2.442 1.00 0.00 N ATOM 767 CA GLY A 413 3.110 0.225 3.208 1.00 0.00 C ATOM 768 C GLY A 413 3.895 -1.056 3.050 1.00 0.00 C ATOM 769 O GLY A 413 4.739 -1.173 2.163 1.00 0.00 O ATOM 0 H GLY A 413 3.966 1.080 1.498 1.00 0.00 H new ATOM 0 HA2 GLY A 413 3.084 0.502 4.262 1.00 0.00 H new ATOM 0 HA3 GLY A 413 2.079 0.055 2.897 1.00 0.00 H new ATOM 773 N THR A 414 3.607 -2.023 3.910 1.00 0.00 N ATOM 774 CA THR A 414 4.268 -3.317 3.873 1.00 0.00 C ATOM 775 C THR A 414 3.456 -4.320 4.683 1.00 0.00 C ATOM 776 O THR A 414 3.056 -4.028 5.811 1.00 0.00 O ATOM 777 CB THR A 414 5.701 -3.239 4.433 1.00 0.00 C ATOM 778 OG1 THR A 414 6.470 -2.235 3.757 1.00 0.00 O ATOM 779 CG2 THR A 414 6.417 -4.573 4.280 1.00 0.00 C ATOM 0 H THR A 414 2.911 -1.932 4.650 1.00 0.00 H new ATOM 0 HA THR A 414 4.333 -3.636 2.833 1.00 0.00 H new ATOM 0 HB THR A 414 5.615 -2.983 5.489 1.00 0.00 H new ATOM 0 HG1 THR A 414 6.030 -1.999 2.914 1.00 0.00 H new ATOM 0 HG21 THR A 414 7.427 -4.492 4.683 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.870 -5.344 4.823 1.00 0.00 H new ATOM 0 HG23 THR A 414 6.468 -4.840 3.224 1.00 0.00 H new ATOM 787 N GLY A 415 3.198 -5.493 4.120 1.00 0.00 N ATOM 788 CA GLY A 415 2.419 -6.478 4.842 1.00 0.00 C ATOM 789 C GLY A 415 2.684 -7.898 4.395 1.00 0.00 C ATOM 790 O GLY A 415 2.963 -8.152 3.224 1.00 0.00 O ATOM 0 H GLY A 415 3.509 -5.777 3.191 1.00 0.00 H new ATOM 0 HA2 GLY A 415 2.637 -6.393 5.907 1.00 0.00 H new ATOM 0 HA3 GLY A 415 1.359 -6.257 4.715 1.00 0.00 H new ATOM 794 N VAL A 416 2.588 -8.825 5.339 1.00 0.00 N ATOM 795 CA VAL A 416 2.807 -10.232 5.063 1.00 0.00 C ATOM 796 C VAL A 416 1.505 -11.010 5.215 1.00 0.00 C ATOM 797 O VAL A 416 0.761 -10.803 6.173 1.00 0.00 O ATOM 798 CB VAL A 416 3.877 -10.812 6.013 1.00 0.00 C ATOM 799 CG1 VAL A 416 3.667 -12.298 6.263 1.00 0.00 C ATOM 800 CG2 VAL A 416 5.262 -10.555 5.454 1.00 0.00 C ATOM 0 H VAL A 416 2.357 -8.621 6.311 1.00 0.00 H new ATOM 0 HA VAL A 416 3.161 -10.327 4.036 1.00 0.00 H new ATOM 0 HB VAL A 416 3.780 -10.306 6.974 1.00 0.00 H new ATOM 0 HG11 VAL A 416 4.441 -12.667 6.936 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.688 -12.456 6.715 1.00 0.00 H new ATOM 0 HG13 VAL A 416 3.722 -12.837 5.317 1.00 0.00 H new ATOM 0 HG21 VAL A 416 6.010 -10.968 6.131 1.00 0.00 H new ATOM 0 HG22 VAL A 416 5.354 -11.031 4.478 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.419 -9.481 5.351 1.00 0.00 H new ATOM 810 N GLY A 417 1.241 -11.914 4.280 1.00 0.00 N ATOM 811 CA GLY A 417 0.031 -12.710 4.358 1.00 0.00 C ATOM 812 C GLY A 417 0.250 -14.122 3.864 1.00 0.00 C ATOM 813 O GLY A 417 1.389 -14.561 3.708 1.00 0.00 O ATOM 0 H GLY A 417 1.837 -12.109 3.476 1.00 0.00 H new ATOM 0 HA2 GLY A 417 -0.319 -12.737 5.390 1.00 0.00 H new ATOM 0 HA3 GLY A 417 -0.753 -12.237 3.767 1.00 0.00 H new ATOM 817 N ARG A 418 -0.841 -14.831 3.607 1.00 0.00 N ATOM 818 CA ARG A 418 -0.757 -16.196 3.106 1.00 0.00 C ATOM 819 C ARG A 418 -0.365 -16.185 1.643 1.00 0.00 C ATOM 820 O ARG A 418 0.431 -17.005 1.185 1.00 0.00 O ATOM 821 CB ARG A 418 -2.085 -16.907 3.243 1.00 0.00 C ATOM 822 CG ARG A 418 -3.234 -16.153 2.607 1.00 0.00 C ATOM 823 CD ARG A 418 -4.563 -16.519 3.245 1.00 0.00 C ATOM 824 NE ARG A 418 -5.026 -17.833 2.817 1.00 0.00 N ATOM 825 CZ ARG A 418 -6.301 -18.204 2.827 1.00 0.00 C ATOM 826 NH1 ARG A 418 -7.231 -17.378 3.284 1.00 0.00 N ATOM 827 NH2 ARG A 418 -6.646 -19.406 2.386 1.00 0.00 N ATOM 0 H ARG A 418 -1.792 -14.485 3.737 1.00 0.00 H new ATOM 0 HA ARG A 418 -0.006 -16.722 3.695 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -2.010 -17.894 2.787 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -2.300 -17.060 4.300 1.00 0.00 H new ATOM 0 HG2 ARG A 418 -3.065 -15.081 2.706 1.00 0.00 H new ATOM 0 HG3 ARG A 418 -3.269 -16.374 1.540 1.00 0.00 H new ATOM 0 HD2 ARG A 418 -4.461 -16.505 4.330 1.00 0.00 H new ATOM 0 HD3 ARG A 418 -5.310 -15.768 2.986 1.00 0.00 H new ATOM 0 HE ARG A 418 -4.332 -18.505 2.491 1.00 0.00 H new ATOM 0 HH11 ARG A 418 -6.968 -16.455 3.629 1.00 0.00 H new ATOM 0 HH12 ARG A 418 -8.210 -17.665 3.291 1.00 0.00 H new ATOM 0 HH21 ARG A 418 -5.932 -20.046 2.039 1.00 0.00 H new ATOM 0 HH22 ARG A 418 -7.626 -19.690 2.394 1.00 0.00 H new ATOM 841 N ASN A 419 -0.923 -15.225 0.922 1.00 0.00 N ATOM 842 CA ASN A 419 -0.641 -15.054 -0.493 1.00 0.00 C ATOM 843 C ASN A 419 -0.371 -13.587 -0.799 1.00 0.00 C ATOM 844 O ASN A 419 -0.707 -12.707 -0.006 1.00 0.00 O ATOM 845 CB ASN A 419 -1.814 -15.553 -1.337 1.00 0.00 C ATOM 846 CG ASN A 419 -1.393 -16.605 -2.345 1.00 0.00 C ATOM 847 OD1 ASN A 419 -0.307 -16.530 -2.921 1.00 0.00 O ATOM 848 ND2 ASN A 419 -2.252 -17.593 -2.564 1.00 0.00 N ATOM 0 H ASN A 419 -1.582 -14.545 1.301 1.00 0.00 H new ATOM 0 HA ASN A 419 0.244 -15.640 -0.742 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -2.580 -15.967 -0.681 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -2.265 -14.711 -1.862 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -2.023 -18.329 -3.232 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -3.141 -17.616 -2.065 1.00 0.00 H new ATOM 855 N ILE A 420 0.232 -13.328 -1.949 1.00 0.00 N ATOM 856 CA ILE A 420 0.546 -11.966 -2.364 1.00 0.00 C ATOM 857 C ILE A 420 -0.636 -11.023 -2.146 1.00 0.00 C ATOM 858 O ILE A 420 -0.455 -9.811 -2.032 1.00 0.00 O ATOM 859 CB ILE A 420 0.974 -11.930 -3.843 1.00 0.00 C ATOM 860 CG1 ILE A 420 2.399 -12.457 -3.970 1.00 0.00 C ATOM 861 CG2 ILE A 420 0.864 -10.522 -4.418 1.00 0.00 C ATOM 862 CD1 ILE A 420 2.470 -13.870 -4.504 1.00 0.00 C ATOM 0 H ILE A 420 0.516 -14.046 -2.616 1.00 0.00 H new ATOM 0 HA ILE A 420 1.374 -11.624 -1.743 1.00 0.00 H new ATOM 0 HB ILE A 420 0.302 -12.567 -4.418 1.00 0.00 H new ATOM 0 HG12 ILE A 420 2.965 -11.798 -4.629 1.00 0.00 H new ATOM 0 HG13 ILE A 420 2.881 -12.421 -2.993 1.00 0.00 H new ATOM 0 HG21 ILE A 420 1.173 -10.531 -5.463 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -0.169 -10.180 -4.348 1.00 0.00 H new ATOM 0 HG23 ILE A 420 1.509 -9.847 -3.854 1.00 0.00 H new ATOM 0 HD11 ILE A 420 3.512 -14.182 -4.569 1.00 0.00 H new ATOM 0 HD12 ILE A 420 1.932 -14.540 -3.834 1.00 0.00 H new ATOM 0 HD13 ILE A 420 2.017 -13.908 -5.495 1.00 0.00 H new ATOM 874 N LYS A 421 -1.837 -11.580 -2.070 1.00 0.00 N ATOM 875 CA LYS A 421 -3.012 -10.764 -1.843 1.00 0.00 C ATOM 876 C LYS A 421 -3.099 -10.381 -0.380 1.00 0.00 C ATOM 877 O LYS A 421 -3.095 -9.201 -0.036 1.00 0.00 O ATOM 878 CB LYS A 421 -4.268 -11.505 -2.267 1.00 0.00 C ATOM 879 CG LYS A 421 -5.538 -10.813 -1.829 1.00 0.00 C ATOM 880 CD LYS A 421 -5.429 -9.308 -2.003 1.00 0.00 C ATOM 881 CE LYS A 421 -5.306 -8.941 -3.468 1.00 0.00 C ATOM 882 NZ LYS A 421 -6.630 -8.653 -4.085 1.00 0.00 N ATOM 0 H LYS A 421 -2.018 -12.580 -2.161 1.00 0.00 H new ATOM 0 HA LYS A 421 -2.929 -9.858 -2.444 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.273 -11.609 -3.352 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.247 -12.512 -1.850 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.380 -11.189 -2.410 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -5.742 -11.048 -0.784 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.307 -8.824 -1.575 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -4.562 -8.936 -1.457 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -4.661 -8.068 -3.570 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -4.825 -9.757 -4.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -6.898 -9.437 -4.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -7.346 -8.548 -3.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -6.572 -7.772 -4.635 1.00 0.00 H new ATOM 896 N ILE A 422 -3.165 -11.377 0.482 1.00 0.00 N ATOM 897 CA ILE A 422 -3.239 -11.123 1.907 1.00 0.00 C ATOM 898 C ILE A 422 -2.091 -10.233 2.329 1.00 0.00 C ATOM 899 O ILE A 422 -2.233 -9.385 3.210 1.00 0.00 O ATOM 900 CB ILE A 422 -3.220 -12.428 2.709 1.00 0.00 C ATOM 901 CG1 ILE A 422 -4.464 -13.260 2.385 1.00 0.00 C ATOM 902 CG2 ILE A 422 -3.143 -12.135 4.199 1.00 0.00 C ATOM 903 CD1 ILE A 422 -5.629 -12.456 1.823 1.00 0.00 C ATOM 0 H ILE A 422 -3.169 -12.363 0.223 1.00 0.00 H new ATOM 0 HA ILE A 422 -4.183 -10.619 2.114 1.00 0.00 H new ATOM 0 HB ILE A 422 -2.336 -13.001 2.429 1.00 0.00 H new ATOM 0 HG12 ILE A 422 -4.192 -14.033 1.667 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -4.793 -13.768 3.292 1.00 0.00 H new ATOM 0 HG21 ILE A 422 -3.130 -13.073 4.754 1.00 0.00 H new ATOM 0 HG22 ILE A 422 -2.233 -11.574 4.413 1.00 0.00 H new ATOM 0 HG23 ILE A 422 -4.010 -11.547 4.500 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -6.468 -13.123 1.622 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -5.932 -11.700 2.547 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -5.322 -11.969 0.897 1.00 0.00 H new ATOM 915 N ALA A 423 -0.961 -10.400 1.657 1.00 0.00 N ATOM 916 CA ALA A 423 0.191 -9.575 1.932 1.00 0.00 C ATOM 917 C ALA A 423 -0.093 -8.178 1.407 1.00 0.00 C ATOM 918 O ALA A 423 0.004 -7.193 2.133 1.00 0.00 O ATOM 919 CB ALA A 423 1.451 -10.145 1.303 1.00 0.00 C ATOM 0 H ALA A 423 -0.824 -11.096 0.924 1.00 0.00 H new ATOM 0 HA ALA A 423 0.367 -9.544 3.007 1.00 0.00 H new ATOM 0 HB1 ALA A 423 2.297 -9.497 1.532 1.00 0.00 H new ATOM 0 HB2 ALA A 423 1.639 -11.141 1.703 1.00 0.00 H new ATOM 0 HB3 ALA A 423 1.323 -10.206 0.222 1.00 0.00 H new ATOM 925 N GLY A 424 -0.485 -8.116 0.136 1.00 0.00 N ATOM 926 CA GLY A 424 -0.827 -6.850 -0.476 1.00 0.00 C ATOM 927 C GLY A 424 -1.880 -6.135 0.336 1.00 0.00 C ATOM 928 O GLY A 424 -1.750 -4.947 0.635 1.00 0.00 O ATOM 0 H GLY A 424 -0.571 -8.925 -0.479 1.00 0.00 H new ATOM 0 HA2 GLY A 424 0.063 -6.227 -0.557 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -1.192 -7.017 -1.489 1.00 0.00 H new ATOM 932 N ILE A 425 -2.915 -6.874 0.728 1.00 0.00 N ATOM 933 CA ILE A 425 -3.970 -6.309 1.550 1.00 0.00 C ATOM 934 C ILE A 425 -3.354 -5.737 2.821 1.00 0.00 C ATOM 935 O ILE A 425 -3.451 -4.542 3.105 1.00 0.00 O ATOM 936 CB ILE A 425 -5.021 -7.365 1.953 1.00 0.00 C ATOM 937 CG1 ILE A 425 -5.711 -7.945 0.721 1.00 0.00 C ATOM 938 CG2 ILE A 425 -6.045 -6.756 2.898 1.00 0.00 C ATOM 939 CD1 ILE A 425 -6.025 -9.417 0.847 1.00 0.00 C ATOM 0 H ILE A 425 -3.041 -7.858 0.489 1.00 0.00 H new ATOM 0 HA ILE A 425 -4.468 -5.536 0.964 1.00 0.00 H new ATOM 0 HB ILE A 425 -4.509 -8.178 2.468 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -6.636 -7.398 0.540 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -5.074 -7.790 -0.150 1.00 0.00 H new ATOM 0 HG21 ILE A 425 -6.780 -7.512 3.174 1.00 0.00 H new ATOM 0 HG22 ILE A 425 -5.542 -6.394 3.795 1.00 0.00 H new ATOM 0 HG23 ILE A 425 -6.548 -5.925 2.403 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -6.514 -9.764 -0.063 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -5.101 -9.975 0.997 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -6.687 -9.576 1.698 1.00 0.00 H new ATOM 951 N ARG A 426 -2.714 -6.627 3.574 1.00 0.00 N ATOM 952 CA ARG A 426 -2.055 -6.276 4.827 1.00 0.00 C ATOM 953 C ARG A 426 -1.151 -5.061 4.656 1.00 0.00 C ATOM 954 O ARG A 426 -1.069 -4.218 5.542 1.00 0.00 O ATOM 955 CB ARG A 426 -1.247 -7.468 5.335 1.00 0.00 C ATOM 956 CG ARG A 426 -1.144 -7.543 6.850 1.00 0.00 C ATOM 957 CD ARG A 426 0.137 -6.897 7.348 1.00 0.00 C ATOM 958 NE ARG A 426 -0.043 -6.249 8.642 1.00 0.00 N ATOM 959 CZ ARG A 426 0.843 -5.414 9.174 1.00 0.00 C ATOM 960 NH1 ARG A 426 1.955 -5.116 8.517 1.00 0.00 N ATOM 961 NH2 ARG A 426 0.619 -4.874 10.363 1.00 0.00 N ATOM 0 H ARG A 426 -2.638 -7.615 3.331 1.00 0.00 H new ATOM 0 HA ARG A 426 -2.822 -6.020 5.558 1.00 0.00 H new ATOM 0 HB2 ARG A 426 -1.703 -8.387 4.966 1.00 0.00 H new ATOM 0 HB3 ARG A 426 -0.243 -7.419 4.915 1.00 0.00 H new ATOM 0 HG2 ARG A 426 -2.003 -7.046 7.300 1.00 0.00 H new ATOM 0 HG3 ARG A 426 -1.176 -8.585 7.168 1.00 0.00 H new ATOM 0 HD2 ARG A 426 0.917 -7.654 7.427 1.00 0.00 H new ATOM 0 HD3 ARG A 426 0.479 -6.162 6.619 1.00 0.00 H new ATOM 0 HE ARG A 426 -0.895 -6.447 9.167 1.00 0.00 H new ATOM 0 HH11 ARG A 426 2.132 -5.528 7.601 1.00 0.00 H new ATOM 0 HH12 ARG A 426 2.634 -4.475 8.928 1.00 0.00 H new ATOM 0 HH21 ARG A 426 -0.236 -5.099 10.873 1.00 0.00 H new ATOM 0 HH22 ARG A 426 1.301 -4.233 10.769 1.00 0.00 H new ATOM 975 N ALA A 427 -0.473 -4.978 3.516 1.00 0.00 N ATOM 976 CA ALA A 427 0.417 -3.854 3.242 1.00 0.00 C ATOM 977 C ALA A 427 -0.402 -2.592 2.995 1.00 0.00 C ATOM 978 O ALA A 427 -0.259 -1.589 3.690 1.00 0.00 O ATOM 979 CB ALA A 427 1.319 -4.145 2.051 1.00 0.00 C ATOM 0 H ALA A 427 -0.522 -5.672 2.770 1.00 0.00 H new ATOM 0 HA ALA A 427 1.055 -3.700 4.113 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.971 -3.290 1.871 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.926 -5.026 2.261 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.707 -4.328 1.167 1.00 0.00 H new ATOM 985 N ALA A 428 -1.275 -2.656 2.005 1.00 0.00 N ATOM 986 CA ALA A 428 -2.126 -1.521 1.690 1.00 0.00 C ATOM 987 C ALA A 428 -2.664 -0.966 3.000 1.00 0.00 C ATOM 988 O ALA A 428 -2.538 0.222 3.297 1.00 0.00 O ATOM 989 CB ALA A 428 -3.250 -1.924 0.752 1.00 0.00 C ATOM 0 H ALA A 428 -1.413 -3.473 1.410 1.00 0.00 H new ATOM 0 HA ALA A 428 -1.553 -0.753 1.171 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -3.871 -1.055 0.534 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -2.829 -2.311 -0.176 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -3.859 -2.695 1.224 1.00 0.00 H new ATOM 995 N GLU A 429 -3.230 -1.868 3.790 1.00 0.00 N ATOM 996 CA GLU A 429 -3.773 -1.549 5.104 1.00 0.00 C ATOM 997 C GLU A 429 -2.663 -1.117 6.053 1.00 0.00 C ATOM 998 O GLU A 429 -2.862 -0.294 6.940 1.00 0.00 O ATOM 999 CB GLU A 429 -4.449 -2.792 5.659 1.00 0.00 C ATOM 1000 CG GLU A 429 -5.883 -2.563 6.107 1.00 0.00 C ATOM 1001 CD GLU A 429 -6.132 -3.033 7.527 1.00 0.00 C ATOM 1002 OE1 GLU A 429 -6.034 -4.253 7.773 1.00 0.00 O ATOM 1003 OE2 GLU A 429 -6.429 -2.182 8.392 1.00 0.00 O ATOM 0 H GLU A 429 -3.326 -2.851 3.535 1.00 0.00 H new ATOM 0 HA GLU A 429 -4.487 -0.731 5.010 1.00 0.00 H new ATOM 0 HB2 GLU A 429 -4.436 -3.572 4.897 1.00 0.00 H new ATOM 0 HB3 GLU A 429 -3.869 -3.163 6.504 1.00 0.00 H new ATOM 0 HG2 GLU A 429 -6.118 -1.501 6.033 1.00 0.00 H new ATOM 0 HG3 GLU A 429 -6.559 -3.087 5.431 1.00 0.00 H new ATOM 1010 N ASN A 430 -1.491 -1.693 5.840 1.00 0.00 N ATOM 1011 CA ASN A 430 -0.333 -1.376 6.661 1.00 0.00 C ATOM 1012 C ASN A 430 -0.063 0.110 6.554 1.00 0.00 C ATOM 1013 O ASN A 430 -0.071 0.829 7.553 1.00 0.00 O ATOM 1014 CB ASN A 430 0.878 -2.189 6.226 1.00 0.00 C ATOM 1015 CG ASN A 430 2.164 -1.713 6.876 1.00 0.00 C ATOM 1016 OD1 ASN A 430 2.710 -2.379 7.755 1.00 0.00 O ATOM 1017 ND2 ASN A 430 2.653 -0.556 6.446 1.00 0.00 N ATOM 0 H ASN A 430 -1.316 -2.381 5.107 1.00 0.00 H new ATOM 0 HA ASN A 430 -0.534 -1.635 7.701 1.00 0.00 H new ATOM 0 HB2 ASN A 430 0.716 -3.238 6.475 1.00 0.00 H new ATOM 0 HB3 ASN A 430 0.980 -2.131 5.142 1.00 0.00 H new ATOM 0 HD21 ASN A 430 3.515 -0.186 6.847 1.00 0.00 H new ATOM 0 HD22 ASN A 430 2.167 -0.037 5.715 1.00 0.00 H new ATOM 1024 N ALA A 431 0.120 0.575 5.327 1.00 0.00 N ATOM 1025 CA ALA A 431 0.324 1.989 5.089 1.00 0.00 C ATOM 1026 C ALA A 431 -0.914 2.713 5.574 1.00 0.00 C ATOM 1027 O ALA A 431 -0.840 3.757 6.222 1.00 0.00 O ATOM 1028 CB ALA A 431 0.560 2.272 3.613 1.00 0.00 C ATOM 0 H ALA A 431 0.131 -0.005 4.488 1.00 0.00 H new ATOM 0 HA ALA A 431 1.209 2.333 5.624 1.00 0.00 H new ATOM 0 HB1 ALA A 431 0.710 3.342 3.467 1.00 0.00 H new ATOM 0 HB2 ALA A 431 1.445 1.732 3.276 1.00 0.00 H new ATOM 0 HB3 ALA A 431 -0.306 1.945 3.037 1.00 0.00 H new ATOM 1034 N LEU A 432 -2.057 2.118 5.256 1.00 0.00 N ATOM 1035 CA LEU A 432 -3.354 2.644 5.646 1.00 0.00 C ATOM 1036 C LEU A 432 -3.416 2.920 7.138 1.00 0.00 C ATOM 1037 O LEU A 432 -3.818 4.000 7.571 1.00 0.00 O ATOM 1038 CB LEU A 432 -4.419 1.614 5.289 1.00 0.00 C ATOM 1039 CG LEU A 432 -5.783 2.178 4.934 1.00 0.00 C ATOM 1040 CD1 LEU A 432 -6.449 1.289 3.899 1.00 0.00 C ATOM 1041 CD2 LEU A 432 -6.646 2.302 6.181 1.00 0.00 C ATOM 0 H LEU A 432 -2.108 1.253 4.718 1.00 0.00 H new ATOM 0 HA LEU A 432 -3.522 3.583 5.119 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -4.060 1.023 4.447 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -4.536 0.931 6.131 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.661 3.175 4.511 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -7.428 1.696 3.646 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -5.830 1.248 3.003 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -6.568 0.284 4.305 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -7.621 2.708 5.910 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -6.775 1.319 6.633 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -6.161 2.968 6.894 1.00 0.00 H new ATOM 1053 N ARG A 433 -3.028 1.920 7.914 1.00 0.00 N ATOM 1054 CA ARG A 433 -3.045 2.020 9.362 1.00 0.00 C ATOM 1055 C ARG A 433 -2.192 3.188 9.835 1.00 0.00 C ATOM 1056 O ARG A 433 -2.311 3.637 10.975 1.00 0.00 O ATOM 1057 CB ARG A 433 -2.562 0.707 9.965 1.00 0.00 C ATOM 1058 CG ARG A 433 -3.543 -0.434 9.758 1.00 0.00 C ATOM 1059 CD ARG A 433 -2.827 -1.748 9.502 1.00 0.00 C ATOM 1060 NE ARG A 433 -2.385 -2.381 10.740 1.00 0.00 N ATOM 1061 CZ ARG A 433 -3.213 -2.923 11.627 1.00 0.00 C ATOM 1062 NH1 ARG A 433 -4.520 -2.914 11.407 1.00 0.00 N ATOM 1063 NH2 ARG A 433 -2.734 -3.476 12.733 1.00 0.00 N ATOM 0 H ARG A 433 -2.695 1.023 7.560 1.00 0.00 H new ATOM 0 HA ARG A 433 -4.066 2.207 9.696 1.00 0.00 H new ATOM 0 HB2 ARG A 433 -1.603 0.440 9.521 1.00 0.00 H new ATOM 0 HB3 ARG A 433 -2.392 0.844 11.033 1.00 0.00 H new ATOM 0 HG2 ARG A 433 -4.179 -0.531 10.638 1.00 0.00 H new ATOM 0 HG3 ARG A 433 -4.196 -0.205 8.916 1.00 0.00 H new ATOM 0 HD2 ARG A 433 -3.493 -2.425 8.966 1.00 0.00 H new ATOM 0 HD3 ARG A 433 -1.966 -1.572 8.858 1.00 0.00 H new ATOM 0 HE ARG A 433 -1.384 -2.409 10.936 1.00 0.00 H new ATOM 0 HH11 ARG A 433 -4.891 -2.491 10.556 1.00 0.00 H new ATOM 0 HH12 ARG A 433 -5.155 -3.330 12.088 1.00 0.00 H new ATOM 0 HH21 ARG A 433 -1.728 -3.486 12.904 1.00 0.00 H new ATOM 0 HH22 ARG A 433 -3.371 -3.891 13.413 1.00 0.00 H new ATOM 1077 N ASP A 434 -1.348 3.687 8.943 1.00 0.00 N ATOM 1078 CA ASP A 434 -0.490 4.815 9.251 1.00 0.00 C ATOM 1079 C ASP A 434 -1.107 6.103 8.710 1.00 0.00 C ATOM 1080 O ASP A 434 -1.154 6.324 7.501 1.00 0.00 O ATOM 1081 CB ASP A 434 0.900 4.600 8.658 1.00 0.00 C ATOM 1082 CG ASP A 434 1.790 3.767 9.560 1.00 0.00 C ATOM 1083 OD1 ASP A 434 2.215 4.282 10.616 1.00 0.00 O ATOM 1084 OD2 ASP A 434 2.061 2.598 9.210 1.00 0.00 O ATOM 0 H ASP A 434 -1.241 3.324 7.996 1.00 0.00 H new ATOM 0 HA ASP A 434 -0.394 4.900 10.333 1.00 0.00 H new ATOM 0 HB2 ASP A 434 0.807 4.109 7.690 1.00 0.00 H new ATOM 0 HB3 ASP A 434 1.370 5.567 8.481 1.00 0.00 H new ATOM 1089 N LYS A 435 -1.580 6.944 9.618 1.00 0.00 N ATOM 1090 CA LYS A 435 -2.196 8.208 9.234 1.00 0.00 C ATOM 1091 C LYS A 435 -1.148 9.191 8.734 1.00 0.00 C ATOM 1092 O LYS A 435 -1.268 9.735 7.640 1.00 0.00 O ATOM 1093 CB LYS A 435 -2.971 8.814 10.403 1.00 0.00 C ATOM 1094 CG LYS A 435 -3.965 9.879 9.972 1.00 0.00 C ATOM 1095 CD LYS A 435 -5.400 9.402 10.134 1.00 0.00 C ATOM 1096 CE LYS A 435 -5.747 8.322 9.121 1.00 0.00 C ATOM 1097 NZ LYS A 435 -6.283 7.097 9.775 1.00 0.00 N ATOM 0 H LYS A 435 -1.550 6.776 10.624 1.00 0.00 H new ATOM 0 HA LYS A 435 -2.896 8.005 8.423 1.00 0.00 H new ATOM 0 HB2 LYS A 435 -3.503 8.021 10.928 1.00 0.00 H new ATOM 0 HB3 LYS A 435 -2.266 9.249 11.112 1.00 0.00 H new ATOM 0 HG2 LYS A 435 -3.812 10.782 10.564 1.00 0.00 H new ATOM 0 HG3 LYS A 435 -3.785 10.146 8.931 1.00 0.00 H new ATOM 0 HD2 LYS A 435 -5.544 9.016 11.143 1.00 0.00 H new ATOM 0 HD3 LYS A 435 -6.080 10.245 10.015 1.00 0.00 H new ATOM 0 HE2 LYS A 435 -6.483 8.709 8.416 1.00 0.00 H new ATOM 0 HE3 LYS A 435 -4.858 8.066 8.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 -6.507 6.386 9.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 -5.571 6.713 10.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 -7.146 7.335 10.304 1.00 0.00 H new ATOM 1111 N LYS A 436 -0.147 9.443 9.560 1.00 0.00 N ATOM 1112 CA LYS A 436 0.896 10.398 9.215 1.00 0.00 C ATOM 1113 C LYS A 436 1.222 10.326 7.727 1.00 0.00 C ATOM 1114 O LYS A 436 1.199 11.346 7.036 1.00 0.00 O ATOM 1115 CB LYS A 436 2.153 10.137 10.047 1.00 0.00 C ATOM 1116 CG LYS A 436 2.331 11.104 11.207 1.00 0.00 C ATOM 1117 CD LYS A 436 3.793 11.242 11.599 1.00 0.00 C ATOM 1118 CE LYS A 436 4.323 9.968 12.240 1.00 0.00 C ATOM 1119 NZ LYS A 436 5.677 9.610 11.730 1.00 0.00 N ATOM 0 H LYS A 436 -0.033 9.002 10.472 1.00 0.00 H new ATOM 0 HA LYS A 436 0.530 11.400 9.438 1.00 0.00 H new ATOM 0 HB2 LYS A 436 2.115 9.120 10.436 1.00 0.00 H new ATOM 0 HB3 LYS A 436 3.027 10.198 9.398 1.00 0.00 H new ATOM 0 HG2 LYS A 436 1.933 12.081 10.932 1.00 0.00 H new ATOM 0 HG3 LYS A 436 1.755 10.755 12.064 1.00 0.00 H new ATOM 0 HD2 LYS A 436 4.386 11.480 10.716 1.00 0.00 H new ATOM 0 HD3 LYS A 436 3.907 12.074 12.294 1.00 0.00 H new ATOM 0 HE2 LYS A 436 4.365 10.096 13.322 1.00 0.00 H new ATOM 0 HE3 LYS A 436 3.632 9.148 12.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 6.002 8.736 12.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 5.633 9.462 10.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 6.342 10.381 11.941 1.00 0.00 H new ATOM 1133 N MET A 437 1.495 9.128 7.220 1.00 0.00 N ATOM 1134 CA MET A 437 1.786 8.975 5.795 1.00 0.00 C ATOM 1135 C MET A 437 0.552 9.346 4.987 1.00 0.00 C ATOM 1136 O MET A 437 0.640 10.072 4.002 1.00 0.00 O ATOM 1137 CB MET A 437 2.243 7.554 5.437 1.00 0.00 C ATOM 1138 CG MET A 437 1.850 6.492 6.447 1.00 0.00 C ATOM 1139 SD MET A 437 2.411 4.849 5.960 1.00 0.00 S ATOM 1140 CE MET A 437 4.098 4.882 6.561 1.00 0.00 C ATOM 0 H MET A 437 1.521 8.263 7.760 1.00 0.00 H new ATOM 0 HA MET A 437 2.612 9.644 5.552 1.00 0.00 H new ATOM 0 HB2 MET A 437 1.826 7.286 4.466 1.00 0.00 H new ATOM 0 HB3 MET A 437 3.328 7.551 5.330 1.00 0.00 H new ATOM 0 HG2 MET A 437 2.272 6.745 7.420 1.00 0.00 H new ATOM 0 HG3 MET A 437 0.766 6.485 6.561 1.00 0.00 H new ATOM 0 HE1 MET A 437 4.583 3.932 6.336 1.00 0.00 H new ATOM 0 HE2 MET A 437 4.642 5.692 6.075 1.00 0.00 H new ATOM 0 HE3 MET A 437 4.097 5.042 7.639 1.00 0.00 H new ATOM 1150 N LEU A 438 -0.608 8.868 5.427 1.00 0.00 N ATOM 1151 CA LEU A 438 -1.856 9.190 4.751 1.00 0.00 C ATOM 1152 C LEU A 438 -1.936 10.703 4.577 1.00 0.00 C ATOM 1153 O LEU A 438 -1.923 11.224 3.462 1.00 0.00 O ATOM 1154 CB LEU A 438 -3.033 8.700 5.598 1.00 0.00 C ATOM 1155 CG LEU A 438 -4.136 7.965 4.841 1.00 0.00 C ATOM 1156 CD1 LEU A 438 -3.699 6.548 4.503 1.00 0.00 C ATOM 1157 CD2 LEU A 438 -5.410 7.952 5.673 1.00 0.00 C ATOM 0 H LEU A 438 -0.708 8.262 6.241 1.00 0.00 H new ATOM 0 HA LEU A 438 -1.895 8.704 3.776 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -2.647 8.038 6.373 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -3.475 9.559 6.103 1.00 0.00 H new ATOM 0 HG LEU A 438 -4.333 8.488 3.905 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -4.498 6.040 3.964 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -2.805 6.582 3.880 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -3.480 6.006 5.423 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -6.195 7.426 5.129 1.00 0.00 H new ATOM 0 HD22 LEU A 438 -5.222 7.444 6.619 1.00 0.00 H new ATOM 0 HD23 LEU A 438 -5.728 8.976 5.868 1.00 0.00 H new ATOM 1169 N ASP A 439 -1.999 11.394 5.712 1.00 0.00 N ATOM 1170 CA ASP A 439 -2.058 12.850 5.756 1.00 0.00 C ATOM 1171 C ASP A 439 -0.852 13.458 5.062 1.00 0.00 C ATOM 1172 O ASP A 439 -0.865 14.620 4.672 1.00 0.00 O ATOM 1173 CB ASP A 439 -2.088 13.318 7.212 1.00 0.00 C ATOM 1174 CG ASP A 439 -3.197 14.316 7.481 1.00 0.00 C ATOM 1175 OD1 ASP A 439 -3.033 15.499 7.115 1.00 0.00 O ATOM 1176 OD2 ASP A 439 -4.231 13.915 8.056 1.00 0.00 O ATOM 0 H ASP A 439 -2.011 10.955 6.633 1.00 0.00 H new ATOM 0 HA ASP A 439 -2.962 13.174 5.241 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -2.215 12.454 7.865 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -1.129 13.770 7.464 1.00 0.00 H new ATOM 1181 N PHE A 440 0.182 12.654 4.898 1.00 0.00 N ATOM 1182 CA PHE A 440 1.391 13.108 4.237 1.00 0.00 C ATOM 1183 C PHE A 440 1.160 13.136 2.737 1.00 0.00 C ATOM 1184 O PHE A 440 1.350 14.160 2.080 1.00 0.00 O ATOM 1185 CB PHE A 440 2.572 12.199 4.578 1.00 0.00 C ATOM 1186 CG PHE A 440 3.875 12.675 4.003 1.00 0.00 C ATOM 1187 CD1 PHE A 440 4.236 12.345 2.705 1.00 0.00 C ATOM 1188 CD2 PHE A 440 4.737 13.454 4.756 1.00 0.00 C ATOM 1189 CE1 PHE A 440 5.431 12.785 2.170 1.00 0.00 C ATOM 1190 CE2 PHE A 440 5.935 13.897 4.226 1.00 0.00 C ATOM 1191 CZ PHE A 440 6.282 13.561 2.932 1.00 0.00 C ATOM 0 H PHE A 440 0.209 11.684 5.213 1.00 0.00 H new ATOM 0 HA PHE A 440 1.632 14.112 4.587 1.00 0.00 H new ATOM 0 HB2 PHE A 440 2.666 12.128 5.662 1.00 0.00 H new ATOM 0 HB3 PHE A 440 2.366 11.194 4.209 1.00 0.00 H new ATOM 0 HD1 PHE A 440 3.575 11.737 2.106 1.00 0.00 H new ATOM 0 HD2 PHE A 440 4.471 13.719 5.769 1.00 0.00 H new ATOM 0 HE1 PHE A 440 5.699 12.523 1.157 1.00 0.00 H new ATOM 0 HE2 PHE A 440 6.598 14.505 4.823 1.00 0.00 H new ATOM 0 HZ PHE A 440 7.218 13.905 2.517 1.00 0.00 H new ATOM 1201 N TYR A 441 0.727 12.002 2.205 1.00 0.00 N ATOM 1202 CA TYR A 441 0.443 11.888 0.793 1.00 0.00 C ATOM 1203 C TYR A 441 -0.644 12.869 0.399 1.00 0.00 C ATOM 1204 O TYR A 441 -0.457 13.681 -0.507 1.00 0.00 O ATOM 1205 CB TYR A 441 0.029 10.467 0.454 1.00 0.00 C ATOM 1206 CG TYR A 441 1.205 9.529 0.366 1.00 0.00 C ATOM 1207 CD1 TYR A 441 2.306 9.842 -0.422 1.00 0.00 C ATOM 1208 CD2 TYR A 441 1.222 8.343 1.079 1.00 0.00 C ATOM 1209 CE1 TYR A 441 3.391 8.993 -0.498 1.00 0.00 C ATOM 1210 CE2 TYR A 441 2.304 7.488 1.012 1.00 0.00 C ATOM 1211 CZ TYR A 441 3.388 7.818 0.220 1.00 0.00 C ATOM 1212 OH TYR A 441 4.473 6.975 0.146 1.00 0.00 O ATOM 0 H TYR A 441 0.566 11.147 2.738 1.00 0.00 H new ATOM 0 HA TYR A 441 1.346 12.127 0.231 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -0.665 10.104 1.212 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -0.506 10.465 -0.496 1.00 0.00 H new ATOM 0 HD1 TYR A 441 2.313 10.764 -0.984 1.00 0.00 H new ATOM 0 HD2 TYR A 441 0.376 8.082 1.697 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.238 9.249 -1.117 1.00 0.00 H new ATOM 0 HE2 TYR A 441 2.304 6.566 1.575 1.00 0.00 H new ATOM 0 HH TYR A 441 4.926 6.948 1.014 1.00 0.00 H new ATOM 1222 N ALA A 442 -1.773 12.817 1.098 1.00 0.00 N ATOM 1223 CA ALA A 442 -2.851 13.741 0.804 1.00 0.00 C ATOM 1224 C ALA A 442 -2.279 15.149 0.807 1.00 0.00 C ATOM 1225 O ALA A 442 -2.265 15.834 -0.216 1.00 0.00 O ATOM 1226 CB ALA A 442 -3.983 13.620 1.816 1.00 0.00 C ATOM 0 H ALA A 442 -1.959 12.159 1.855 1.00 0.00 H new ATOM 0 HA ALA A 442 -3.274 13.505 -0.172 1.00 0.00 H new ATOM 0 HB1 ALA A 442 -4.773 14.327 1.564 1.00 0.00 H new ATOM 0 HB2 ALA A 442 -4.383 12.606 1.795 1.00 0.00 H new ATOM 0 HB3 ALA A 442 -3.604 13.840 2.814 1.00 0.00 H new ATOM 1232 N LYS A 443 -1.800 15.568 1.975 1.00 0.00 N ATOM 1233 CA LYS A 443 -1.215 16.892 2.133 1.00 0.00 C ATOM 1234 C LYS A 443 -0.293 17.185 0.966 1.00 0.00 C ATOM 1235 O LYS A 443 -0.201 18.319 0.493 1.00 0.00 O ATOM 1236 CB LYS A 443 -0.421 16.965 3.431 1.00 0.00 C ATOM 1237 CG LYS A 443 -1.278 17.098 4.672 1.00 0.00 C ATOM 1238 CD LYS A 443 -1.571 18.554 4.997 1.00 0.00 C ATOM 1239 CE LYS A 443 -2.045 19.320 3.771 1.00 0.00 C ATOM 1240 NZ LYS A 443 -2.269 20.762 4.068 1.00 0.00 N ATOM 0 H LYS A 443 -1.807 15.007 2.827 1.00 0.00 H new ATOM 0 HA LYS A 443 -2.018 17.629 2.162 1.00 0.00 H new ATOM 0 HB2 LYS A 443 0.192 16.068 3.520 1.00 0.00 H new ATOM 0 HB3 LYS A 443 0.261 17.814 3.380 1.00 0.00 H new ATOM 0 HG2 LYS A 443 -2.216 16.561 4.527 1.00 0.00 H new ATOM 0 HG3 LYS A 443 -0.771 16.631 5.517 1.00 0.00 H new ATOM 0 HD2 LYS A 443 -2.332 18.607 5.776 1.00 0.00 H new ATOM 0 HD3 LYS A 443 -0.673 19.026 5.396 1.00 0.00 H new ATOM 0 HE2 LYS A 443 -1.306 19.224 2.975 1.00 0.00 H new ATOM 0 HE3 LYS A 443 -2.970 18.878 3.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 -2.591 21.248 3.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 -2.992 20.855 4.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 -1.380 21.191 4.396 1.00 0.00 H new ATOM 1254 N GLN A 444 0.364 16.140 0.484 1.00 0.00 N ATOM 1255 CA GLN A 444 1.250 16.270 -0.661 1.00 0.00 C ATOM 1256 C GLN A 444 0.414 16.642 -1.884 1.00 0.00 C ATOM 1257 O GLN A 444 0.661 17.649 -2.545 1.00 0.00 O ATOM 1258 CB GLN A 444 2.007 14.960 -0.908 1.00 0.00 C ATOM 1259 CG GLN A 444 3.392 15.157 -1.506 1.00 0.00 C ATOM 1260 CD GLN A 444 4.457 14.360 -0.780 1.00 0.00 C ATOM 1261 OE1 GLN A 444 4.158 13.368 -0.113 1.00 0.00 O ATOM 1262 NE2 GLN A 444 5.707 14.790 -0.903 1.00 0.00 N ATOM 0 H GLN A 444 0.300 15.197 0.867 1.00 0.00 H new ATOM 0 HA GLN A 444 1.987 17.049 -0.467 1.00 0.00 H new ATOM 0 HB2 GLN A 444 2.101 14.422 0.035 1.00 0.00 H new ATOM 0 HB3 GLN A 444 1.419 14.331 -1.576 1.00 0.00 H new ATOM 0 HG2 GLN A 444 3.376 14.864 -2.556 1.00 0.00 H new ATOM 0 HG3 GLN A 444 3.650 16.215 -1.475 1.00 0.00 H new ATOM 0 HE21 GLN A 444 5.909 15.616 -1.466 1.00 0.00 H new ATOM 0 HE22 GLN A 444 6.465 14.294 -0.435 1.00 0.00 H new ATOM 1271 N ARG A 445 -0.568 15.795 -2.176 1.00 0.00 N ATOM 1272 CA ARG A 445 -1.446 16.006 -3.322 1.00 0.00 C ATOM 1273 C ARG A 445 -1.770 17.488 -3.454 1.00 0.00 C ATOM 1274 O ARG A 445 -1.615 18.077 -4.525 1.00 0.00 O ATOM 1275 CB ARG A 445 -2.741 15.205 -3.167 1.00 0.00 C ATOM 1276 CG ARG A 445 -3.880 15.715 -4.035 1.00 0.00 C ATOM 1277 CD ARG A 445 -3.375 16.192 -5.388 1.00 0.00 C ATOM 1278 NE ARG A 445 -4.133 15.616 -6.495 1.00 0.00 N ATOM 1279 CZ ARG A 445 -4.148 16.126 -7.723 1.00 0.00 C ATOM 1280 NH1 ARG A 445 -3.426 17.203 -8.005 1.00 0.00 N ATOM 1281 NH2 ARG A 445 -4.880 15.556 -8.670 1.00 0.00 N ATOM 0 H ARG A 445 -0.776 14.956 -1.635 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.933 15.663 -4.220 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -2.545 14.162 -3.415 1.00 0.00 H new ATOM 0 HB3 ARG A 445 -3.052 15.231 -2.123 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -4.614 14.922 -4.178 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -4.389 16.533 -3.526 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -3.437 17.279 -5.434 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -2.323 15.928 -5.495 1.00 0.00 H new ATOM 0 HE ARG A 445 -4.682 14.775 -6.316 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -2.858 17.641 -7.279 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -3.439 17.593 -8.947 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -5.432 14.725 -8.457 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -4.891 15.948 -9.612 1.00 0.00 H new ATOM 1295 N ALA A 446 -2.189 18.090 -2.349 1.00 0.00 N ATOM 1296 CA ALA A 446 -2.506 19.509 -2.322 1.00 0.00 C ATOM 1297 C ALA A 446 -1.217 20.324 -2.391 1.00 0.00 C ATOM 1298 O ALA A 446 -1.172 21.412 -2.966 1.00 0.00 O ATOM 1299 CB ALA A 446 -3.281 19.848 -1.060 1.00 0.00 C ATOM 0 H ALA A 446 -2.317 17.614 -1.456 1.00 0.00 H new ATOM 0 HA ALA A 446 -3.127 19.755 -3.184 1.00 0.00 H new ATOM 0 HB1 ALA A 446 -3.513 20.913 -1.050 1.00 0.00 H new ATOM 0 HB2 ALA A 446 -4.208 19.275 -1.037 1.00 0.00 H new ATOM 0 HB3 ALA A 446 -2.679 19.600 -0.186 1.00 0.00 H new ATOM 1305 N ALA A 447 -0.175 19.761 -1.794 1.00 0.00 N ATOM 1306 CA ALA A 447 1.148 20.371 -1.750 1.00 0.00 C ATOM 1307 C ALA A 447 1.969 20.002 -2.985 1.00 0.00 C ATOM 1308 O ALA A 447 3.190 19.873 -2.908 1.00 0.00 O ATOM 1309 CB ALA A 447 1.888 19.954 -0.489 1.00 0.00 C ATOM 0 H ALA A 447 -0.225 18.858 -1.322 1.00 0.00 H new ATOM 0 HA ALA A 447 1.013 21.453 -1.740 1.00 0.00 H new ATOM 0 HB1 ALA A 447 2.873 20.420 -0.475 1.00 0.00 H new ATOM 0 HB2 ALA A 447 1.323 20.273 0.387 1.00 0.00 H new ATOM 0 HB3 ALA A 447 1.999 18.870 -0.474 1.00 0.00 H new ATOM 1315 N ILE A 448 1.291 19.835 -4.119 1.00 0.00 N ATOM 1316 CA ILE A 448 1.960 19.481 -5.370 1.00 0.00 C ATOM 1317 C ILE A 448 3.355 20.096 -5.451 1.00 0.00 C ATOM 1318 O ILE A 448 3.529 21.299 -5.255 1.00 0.00 O ATOM 1319 CB ILE A 448 1.145 19.939 -6.597 1.00 0.00 C ATOM 1320 CG1 ILE A 448 -0.206 19.222 -6.638 1.00 0.00 C ATOM 1321 CG2 ILE A 448 1.929 19.680 -7.875 1.00 0.00 C ATOM 1322 CD1 ILE A 448 -0.089 17.717 -6.568 1.00 0.00 C ATOM 0 H ILE A 448 0.279 19.939 -4.198 1.00 0.00 H new ATOM 0 HA ILE A 448 2.043 18.394 -5.378 1.00 0.00 H new ATOM 0 HB ILE A 448 0.961 21.010 -6.515 1.00 0.00 H new ATOM 0 HG12 ILE A 448 -0.819 19.570 -5.807 1.00 0.00 H new ATOM 0 HG13 ILE A 448 -0.727 19.496 -7.555 1.00 0.00 H new ATOM 0 HG21 ILE A 448 1.343 20.007 -8.734 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.868 20.233 -7.844 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.138 18.614 -7.964 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -1.084 17.273 -6.602 1.00 0.00 H new ATOM 0 HD12 ILE A 448 0.498 17.358 -7.414 1.00 0.00 H new ATOM 0 HD13 ILE A 448 0.404 17.433 -5.638 1.00 0.00 H new ATOM 1334 N PRO A 449 4.371 19.270 -5.745 1.00 0.00 N ATOM 1335 CA PRO A 449 5.760 19.727 -5.856 1.00 0.00 C ATOM 1336 C PRO A 449 5.908 20.904 -6.813 1.00 0.00 C ATOM 1337 O PRO A 449 6.843 21.696 -6.700 1.00 0.00 O ATOM 1338 CB PRO A 449 6.494 18.500 -6.404 1.00 0.00 C ATOM 1339 CG PRO A 449 5.663 17.340 -5.974 1.00 0.00 C ATOM 1340 CD PRO A 449 4.241 17.823 -5.988 1.00 0.00 C ATOM 0 HA PRO A 449 6.149 20.084 -4.902 1.00 0.00 H new ATOM 0 HB2 PRO A 449 6.582 18.543 -7.490 1.00 0.00 H new ATOM 0 HB3 PRO A 449 7.506 18.432 -6.004 1.00 0.00 H new ATOM 0 HG2 PRO A 449 5.795 16.494 -6.649 1.00 0.00 H new ATOM 0 HG3 PRO A 449 5.951 17.001 -4.979 1.00 0.00 H new ATOM 0 HD2 PRO A 449 3.756 17.618 -6.942 1.00 0.00 H new ATOM 0 HD3 PRO A 449 3.644 17.338 -5.216 1.00 0.00 H new ATOM 1348 N ARG A 450 4.980 21.013 -7.757 1.00 0.00 N ATOM 1349 CA ARG A 450 5.008 22.095 -8.735 1.00 0.00 C ATOM 1350 C ARG A 450 3.978 21.860 -9.834 1.00 0.00 C ATOM 1351 O ARG A 450 2.850 22.346 -9.755 1.00 0.00 O ATOM 1352 CB ARG A 450 6.404 22.221 -9.349 1.00 0.00 C ATOM 1353 CG ARG A 450 7.169 23.446 -8.876 1.00 0.00 C ATOM 1354 CD ARG A 450 8.653 23.326 -9.183 1.00 0.00 C ATOM 1355 NE ARG A 450 8.994 23.921 -10.473 1.00 0.00 N ATOM 1356 CZ ARG A 450 8.990 25.230 -10.705 1.00 0.00 C ATOM 1357 NH1 ARG A 450 8.666 26.075 -9.736 1.00 0.00 N ATOM 1358 NH2 ARG A 450 9.311 25.695 -11.905 1.00 0.00 N ATOM 0 H ARG A 450 4.199 20.366 -7.866 1.00 0.00 H new ATOM 0 HA ARG A 450 4.760 23.023 -8.220 1.00 0.00 H new ATOM 0 HB2 ARG A 450 6.980 21.328 -9.107 1.00 0.00 H new ATOM 0 HB3 ARG A 450 6.312 22.257 -10.435 1.00 0.00 H new ATOM 0 HG2 ARG A 450 6.767 24.337 -9.359 1.00 0.00 H new ATOM 0 HG3 ARG A 450 7.027 23.574 -7.803 1.00 0.00 H new ATOM 0 HD2 ARG A 450 9.227 23.814 -8.395 1.00 0.00 H new ATOM 0 HD3 ARG A 450 8.940 22.274 -9.181 1.00 0.00 H new ATOM 0 HE ARG A 450 9.249 23.297 -11.238 1.00 0.00 H new ATOM 0 HH11 ARG A 450 8.420 25.721 -8.812 1.00 0.00 H new ATOM 0 HH12 ARG A 450 8.663 27.079 -9.915 1.00 0.00 H new ATOM 0 HH21 ARG A 450 9.562 25.048 -12.652 1.00 0.00 H new ATOM 0 HH22 ARG A 450 9.307 26.700 -12.080 1.00 0.00 H new ATOM 1372 N SER A 451 4.374 21.110 -10.857 1.00 0.00 N ATOM 1373 CA SER A 451 3.486 20.809 -11.974 1.00 0.00 C ATOM 1374 C SER A 451 3.126 22.077 -12.740 1.00 0.00 C ATOM 1375 O SER A 451 2.167 22.769 -12.398 1.00 0.00 O ATOM 1376 CB SER A 451 2.213 20.124 -11.471 1.00 0.00 C ATOM 1377 OG SER A 451 1.628 19.323 -12.484 1.00 0.00 O ATOM 0 H SER A 451 5.304 20.699 -10.936 1.00 0.00 H new ATOM 0 HA SER A 451 4.010 20.134 -12.651 1.00 0.00 H new ATOM 0 HB2 SER A 451 2.448 19.506 -10.605 1.00 0.00 H new ATOM 0 HB3 SER A 451 1.498 20.877 -11.141 1.00 0.00 H new ATOM 0 HG SER A 451 0.818 18.896 -12.136 1.00 0.00 H new ATOM 1383 N GLU A 452 3.900 22.376 -13.777 1.00 0.00 N ATOM 1384 CA GLU A 452 3.663 23.561 -14.592 1.00 0.00 C ATOM 1385 C GLU A 452 4.223 23.377 -15.998 1.00 0.00 C ATOM 1386 O GLU A 452 3.600 23.774 -16.983 1.00 0.00 O ATOM 1387 CB GLU A 452 4.293 24.791 -13.935 1.00 0.00 C ATOM 1388 CG GLU A 452 3.422 26.033 -14.007 1.00 0.00 C ATOM 1389 CD GLU A 452 4.095 27.175 -14.743 1.00 0.00 C ATOM 1390 OE1 GLU A 452 4.873 27.916 -14.104 1.00 0.00 O ATOM 1391 OE2 GLU A 452 3.844 27.329 -15.957 1.00 0.00 O ATOM 0 H GLU A 452 4.698 21.813 -14.073 1.00 0.00 H new ATOM 0 HA GLU A 452 2.586 23.710 -14.668 1.00 0.00 H new ATOM 0 HB2 GLU A 452 4.504 24.566 -12.890 1.00 0.00 H new ATOM 0 HB3 GLU A 452 5.249 25.000 -14.416 1.00 0.00 H new ATOM 0 HG2 GLU A 452 2.485 25.787 -14.506 1.00 0.00 H new ATOM 0 HG3 GLU A 452 3.170 26.355 -12.996 1.00 0.00 H new ATOM 1398 N SER A 453 5.400 22.769 -16.083 1.00 0.00 N ATOM 1399 CA SER A 453 6.045 22.529 -17.368 1.00 0.00 C ATOM 1400 C SER A 453 6.076 21.038 -17.689 1.00 0.00 C ATOM 1401 O SER A 453 4.988 20.432 -17.792 1.00 0.00 O ATOM 1402 CB SER A 453 7.468 23.091 -17.365 1.00 0.00 C ATOM 1403 OG SER A 453 7.556 24.249 -16.553 1.00 0.00 O ATOM 1404 OXT SER A 453 7.188 20.487 -17.836 1.00 0.00 O ATOM 0 H SER A 453 5.927 22.433 -15.277 1.00 0.00 H new ATOM 0 HA SER A 453 5.464 23.038 -18.137 1.00 0.00 H new ATOM 0 HB2 SER A 453 8.161 22.333 -17.000 1.00 0.00 H new ATOM 0 HB3 SER A 453 7.769 23.334 -18.384 1.00 0.00 H new ATOM 0 HG SER A 453 8.475 24.588 -16.566 1.00 0.00 H new TER 1410 SER A 453