USER MOD reduce.3.24.130724 H: found=0, std=0, add=576, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 577 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 473 THR OG1 : rot 127:sc= 1.44 USER MOD Set 1.2: A 479 TYR OH : rot 180:sc= -0.457 USER MOD Set 2.1: A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 447 HIS : no HE2:sc= -15.2! C(o=-15!,f=-14!) USER MOD Single : A 413 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 416 MET CE :methyl 163:sc= -0.779 (180deg=-1.8!) USER MOD Single : A 420 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 421 LYS NZ :NH3+ -125:sc= -1.61! (180deg=-4.86!) USER MOD Single : A 423 TYR OH : rot 180:sc= 0 USER MOD Single : A 424 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 427 GLN : amide:sc= -3.7! C(o=-3.7!,f=-2.1!) USER MOD Single : A 429 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 431 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 435 GLN : amide:sc= -0.693 K(o=-0.69,f=0) USER MOD Single : A 437 LYS NZ :NH3+ 132:sc= -0.888 (180deg=-1.9) USER MOD Single : A 439 THR OG1 : rot -120:sc= -0.524 USER MOD Single : A 445 MET CE :methyl 177:sc= 0 (180deg=-0.00673) USER MOD Single : A 446 GLN : amide:sc= -0.487 X(o=-0.49,f=-0.1) USER MOD Single : A 449 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 ASN : amide:sc= -8.79! C(o=-8.8!,f=-14!) USER MOD Single : A 456 SER OG : rot 180:sc= 0 USER MOD Single : A 461 LYS NZ :NH3+ -172:sc= -1.39 (180deg=-2.02) USER MOD Single : A 462 THR OG1 : rot 180:sc= -0.0191 USER MOD Single : A 466 CYS SG : rot 42:sc= 1.09 USER MOD Single : A 469 TYR OH : rot -99:sc= -3.01! USER MOD Single : A 470 TYR OH : rot 180:sc= 0 USER MOD Single : A 471 TYR OH : rot 150:sc= -0.277 USER MOD Single : A 474 LYS NZ :NH3+ -154:sc= -1.41 (180deg=-3.13!) USER MOD Single : A 475 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 476 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 478 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 480 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 413 12.723 7.480 22.230 1.00 10.00 N ATOM 2 CA ASN A 413 11.702 7.281 21.209 1.00 10.00 C ATOM 3 C ASN A 413 10.434 6.690 21.815 1.00 10.00 C ATOM 4 O ASN A 413 10.491 5.933 22.785 1.00 10.00 O ATOM 5 CB ASN A 413 12.229 6.362 20.104 1.00 10.00 C ATOM 6 CG ASN A 413 13.598 6.784 19.607 1.00 10.00 C ATOM 7 OD1 ASN A 413 13.772 7.891 19.097 1.00 10.00 O ATOM 8 ND2 ASN A 413 14.578 5.899 19.752 1.00 10.00 N ATOM 0 HA ASN A 413 11.459 8.253 20.780 1.00 10.00 H new ATOM 0 HB2 ASN A 413 12.280 5.340 20.479 1.00 10.00 H new ATOM 0 HB3 ASN A 413 11.527 6.361 19.270 1.00 10.00 H new ATOM 0 HD21 ASN A 413 15.521 6.125 19.435 1.00 10.00 H new ATOM 0 HD22 ASN A 413 14.388 4.993 20.181 1.00 10.00 H new ATOM 15 N GLY A 414 9.289 7.039 21.237 1.00 10.00 N ATOM 16 CA GLY A 414 8.022 6.535 21.734 1.00 10.00 C ATOM 17 C GLY A 414 6.907 6.664 20.716 1.00 10.00 C ATOM 18 O GLY A 414 6.165 7.646 20.720 1.00 10.00 O ATOM 0 H GLY A 414 9.216 7.662 20.433 1.00 10.00 H new ATOM 0 HA2 GLY A 414 8.136 5.487 22.013 1.00 10.00 H new ATOM 0 HA3 GLY A 414 7.748 7.078 22.639 1.00 10.00 H new ATOM 22 N LEU A 415 6.787 5.670 19.841 1.00 10.00 N ATOM 23 CA LEU A 415 5.754 5.677 18.812 1.00 10.00 C ATOM 24 C LEU A 415 4.662 4.662 19.132 1.00 10.00 C ATOM 25 O LEU A 415 3.477 4.998 19.158 1.00 10.00 O ATOM 26 CB LEU A 415 6.365 5.372 17.444 1.00 10.00 C ATOM 27 CG LEU A 415 7.152 6.524 16.814 1.00 10.00 C ATOM 28 CD1 LEU A 415 6.288 7.772 16.722 1.00 10.00 C ATOM 29 CD2 LEU A 415 8.415 6.805 17.614 1.00 10.00 C ATOM 0 H LEU A 415 7.393 4.850 19.824 1.00 10.00 H new ATOM 0 HA LEU A 415 5.306 6.671 18.788 1.00 10.00 H new ATOM 0 HB2 LEU A 415 7.027 4.511 17.542 1.00 10.00 H new ATOM 0 HB3 LEU A 415 5.565 5.083 16.762 1.00 10.00 H new ATOM 0 HG LEU A 415 7.442 6.233 15.804 1.00 10.00 H new ATOM 0 HD11 LEU A 415 6.864 8.581 16.272 1.00 10.00 H new ATOM 0 HD12 LEU A 415 5.412 7.564 16.107 1.00 10.00 H new ATOM 0 HD13 LEU A 415 5.968 8.067 17.721 1.00 10.00 H new ATOM 0 HD21 LEU A 415 8.963 7.627 17.153 1.00 10.00 H new ATOM 0 HD22 LEU A 415 8.146 7.076 18.635 1.00 10.00 H new ATOM 0 HD23 LEU A 415 9.042 5.914 17.629 1.00 10.00 H new ATOM 41 N MET A 416 5.067 3.420 19.374 1.00 10.00 N ATOM 42 CA MET A 416 4.123 2.355 19.692 1.00 10.00 C ATOM 43 C MET A 416 3.149 2.129 18.540 1.00 10.00 C ATOM 44 O MET A 416 2.330 2.993 18.228 1.00 10.00 O ATOM 45 CB MET A 416 3.351 2.693 20.969 1.00 10.00 C ATOM 46 CG MET A 416 4.246 3.039 22.148 1.00 10.00 C ATOM 47 SD MET A 416 4.495 1.644 23.263 1.00 10.00 S ATOM 48 CE MET A 416 5.313 0.481 22.175 1.00 10.00 C ATOM 0 H MET A 416 6.044 3.126 19.356 1.00 10.00 H new ATOM 0 HA MET A 416 4.689 1.437 19.850 1.00 10.00 H new ATOM 0 HB2 MET A 416 2.686 3.533 20.770 1.00 10.00 H new ATOM 0 HB3 MET A 416 2.721 1.845 21.238 1.00 10.00 H new ATOM 0 HG2 MET A 416 5.213 3.380 21.778 1.00 10.00 H new ATOM 0 HG3 MET A 416 3.806 3.868 22.702 1.00 10.00 H new ATOM 0 HE1 MET A 416 5.797 -0.294 22.769 1.00 10.00 H new ATOM 0 HE2 MET A 416 4.578 0.024 21.512 1.00 10.00 H new ATOM 0 HE3 MET A 416 6.062 1.004 21.581 1.00 10.00 H new ATOM 58 N ALA A 417 3.244 0.962 17.913 1.00 10.00 N ATOM 59 CA ALA A 417 2.371 0.621 16.796 1.00 10.00 C ATOM 60 C ALA A 417 2.242 -0.890 16.642 1.00 10.00 C ATOM 61 O ALA A 417 3.052 -1.651 17.171 1.00 10.00 O ATOM 62 CB ALA A 417 2.896 1.241 15.510 1.00 10.00 C ATOM 0 H ALA A 417 3.917 0.236 18.159 1.00 10.00 H new ATOM 0 HA ALA A 417 1.380 1.024 17.004 1.00 10.00 H new ATOM 0 HB1 ALA A 417 2.235 0.979 14.684 1.00 10.00 H new ATOM 0 HB2 ALA A 417 2.931 2.325 15.617 1.00 10.00 H new ATOM 0 HB3 ALA A 417 3.898 0.864 15.307 1.00 10.00 H new ATOM 68 N ASP A 418 1.216 -1.319 15.914 1.00 10.00 N ATOM 69 CA ASP A 418 0.979 -2.741 15.690 1.00 10.00 C ATOM 70 C ASP A 418 0.722 -3.024 14.212 1.00 10.00 C ATOM 71 O ASP A 418 -0.428 -3.103 13.778 1.00 10.00 O ATOM 72 CB ASP A 418 -0.208 -3.220 16.527 1.00 10.00 C ATOM 73 CG ASP A 418 -0.064 -4.665 16.962 1.00 10.00 C ATOM 74 OD1 ASP A 418 1.020 -5.028 17.466 1.00 10.00 O ATOM 75 OD2 ASP A 418 -1.035 -5.433 16.799 1.00 10.00 O ATOM 0 H ASP A 418 0.536 -0.703 15.469 1.00 10.00 H new ATOM 0 HA ASP A 418 1.873 -3.285 15.995 1.00 10.00 H new ATOM 0 HB2 ASP A 418 -0.307 -2.586 17.408 1.00 10.00 H new ATOM 0 HB3 ASP A 418 -1.125 -3.107 15.949 1.00 10.00 H new ATOM 80 N PRO A 419 1.794 -3.184 13.417 1.00 10.00 N ATOM 81 CA PRO A 419 1.679 -3.460 11.981 1.00 10.00 C ATOM 82 C PRO A 419 0.767 -4.649 11.692 1.00 10.00 C ATOM 83 O PRO A 419 0.905 -5.710 12.299 1.00 10.00 O ATOM 84 CB PRO A 419 3.116 -3.773 11.562 1.00 10.00 C ATOM 85 CG PRO A 419 3.965 -3.069 12.561 1.00 10.00 C ATOM 86 CD PRO A 419 3.200 -3.107 13.855 1.00 10.00 C ATOM 0 HA PRO A 419 1.237 -2.624 11.439 1.00 10.00 H new ATOM 0 HB2 PRO A 419 3.305 -4.846 11.569 1.00 10.00 H new ATOM 0 HB3 PRO A 419 3.319 -3.420 10.551 1.00 10.00 H new ATOM 0 HG2 PRO A 419 4.933 -3.559 12.665 1.00 10.00 H new ATOM 0 HG3 PRO A 419 4.160 -2.042 12.253 1.00 10.00 H new ATOM 0 HD2 PRO A 419 3.480 -3.968 14.462 1.00 10.00 H new ATOM 0 HD3 PRO A 419 3.385 -2.218 14.458 1.00 10.00 H new ATOM 94 N MET A 420 -0.163 -4.462 10.762 1.00 10.00 N ATOM 95 CA MET A 420 -1.096 -5.519 10.392 1.00 10.00 C ATOM 96 C MET A 420 -1.124 -5.714 8.884 1.00 10.00 C ATOM 97 O MET A 420 -0.455 -6.600 8.361 1.00 10.00 O ATOM 98 CB MET A 420 -2.499 -5.195 10.916 1.00 10.00 C ATOM 99 CG MET A 420 -3.551 -6.219 10.520 1.00 10.00 C ATOM 100 SD MET A 420 -4.933 -6.278 11.676 1.00 10.00 S ATOM 101 CE MET A 420 -4.994 -8.030 12.044 1.00 10.00 C ATOM 0 H MET A 420 -0.291 -3.589 10.251 1.00 10.00 H new ATOM 0 HA MET A 420 -0.758 -6.450 10.848 1.00 10.00 H new ATOM 0 HB2 MET A 420 -2.464 -5.125 12.003 1.00 10.00 H new ATOM 0 HB3 MET A 420 -2.799 -4.216 10.543 1.00 10.00 H new ATOM 0 HG2 MET A 420 -3.925 -5.983 9.524 1.00 10.00 H new ATOM 0 HG3 MET A 420 -3.089 -7.205 10.461 1.00 10.00 H new ATOM 0 HE1 MET A 420 -5.802 -8.226 12.749 1.00 10.00 H new ATOM 0 HE2 MET A 420 -5.171 -8.589 11.125 1.00 10.00 H new ATOM 0 HE3 MET A 420 -4.046 -8.343 12.482 1.00 10.00 H new ATOM 111 N LYS A 421 -1.898 -4.890 8.184 1.00 10.00 N ATOM 112 CA LYS A 421 -2.001 -4.996 6.731 1.00 10.00 C ATOM 113 C LYS A 421 -0.634 -5.162 6.089 1.00 10.00 C ATOM 114 O LYS A 421 0.095 -4.190 5.890 1.00 10.00 O ATOM 115 CB LYS A 421 -2.690 -3.779 6.132 1.00 10.00 C ATOM 116 CG LYS A 421 -2.954 -3.940 4.646 1.00 10.00 C ATOM 117 CD LYS A 421 -4.304 -4.570 4.401 1.00 10.00 C ATOM 118 CE LYS A 421 -4.433 -5.092 2.979 1.00 10.00 C ATOM 119 NZ LYS A 421 -5.416 -6.207 2.882 1.00 10.00 N ATOM 0 H LYS A 421 -2.460 -4.145 8.596 1.00 10.00 H new ATOM 0 HA LYS A 421 -2.601 -5.882 6.524 1.00 10.00 H new ATOM 0 HB2 LYS A 421 -3.634 -3.607 6.650 1.00 10.00 H new ATOM 0 HB3 LYS A 421 -2.071 -2.897 6.295 1.00 10.00 H new ATOM 0 HG2 LYS A 421 -2.909 -2.967 4.158 1.00 10.00 H new ATOM 0 HG3 LYS A 421 -2.174 -4.557 4.199 1.00 10.00 H new ATOM 0 HD2 LYS A 421 -4.456 -5.389 5.104 1.00 10.00 H new ATOM 0 HD3 LYS A 421 -5.087 -3.837 4.592 1.00 10.00 H new ATOM 0 HE2 LYS A 421 -4.740 -4.279 2.321 1.00 10.00 H new ATOM 0 HE3 LYS A 421 -3.459 -5.435 2.629 1.00 10.00 H new ATOM 0 HZ1 LYS A 421 -4.960 -7.035 2.448 1.00 10.00 H new ATOM 0 HZ2 LYS A 421 -5.753 -6.456 3.834 1.00 10.00 H new ATOM 0 HZ3 LYS A 421 -6.222 -5.909 2.296 1.00 10.00 H new ATOM 133 N VAL A 422 -0.299 -6.402 5.770 1.00 10.00 N ATOM 134 CA VAL A 422 0.975 -6.718 5.153 1.00 10.00 C ATOM 135 C VAL A 422 1.080 -8.223 4.913 1.00 10.00 C ATOM 136 O VAL A 422 1.367 -8.677 3.805 1.00 10.00 O ATOM 137 CB VAL A 422 2.141 -6.197 6.021 1.00 10.00 C ATOM 138 CG1 VAL A 422 2.453 -7.133 7.182 1.00 10.00 C ATOM 139 CG2 VAL A 422 3.378 -5.954 5.171 1.00 10.00 C ATOM 0 H VAL A 422 -0.899 -7.211 5.931 1.00 10.00 H new ATOM 0 HA VAL A 422 1.038 -6.218 4.187 1.00 10.00 H new ATOM 0 HB VAL A 422 1.825 -5.247 6.452 1.00 10.00 H new ATOM 0 HG11 VAL A 422 3.279 -6.727 7.765 1.00 10.00 H new ATOM 0 HG12 VAL A 422 1.573 -7.230 7.818 1.00 10.00 H new ATOM 0 HG13 VAL A 422 2.730 -8.113 6.795 1.00 10.00 H new ATOM 0 HG21 VAL A 422 4.187 -5.587 5.803 1.00 10.00 H new ATOM 0 HG22 VAL A 422 3.682 -6.887 4.696 1.00 10.00 H new ATOM 0 HG23 VAL A 422 3.153 -5.213 4.404 1.00 10.00 H new ATOM 149 N TYR A 423 0.793 -8.980 5.964 1.00 10.00 N ATOM 150 CA TYR A 423 0.782 -10.439 5.931 1.00 10.00 C ATOM 151 C TYR A 423 0.172 -10.947 4.629 1.00 10.00 C ATOM 152 O TYR A 423 0.703 -11.853 3.987 1.00 10.00 O ATOM 153 CB TYR A 423 -0.047 -10.944 7.121 1.00 10.00 C ATOM 154 CG TYR A 423 -1.415 -10.295 7.194 1.00 10.00 C ATOM 155 CD1 TYR A 423 -1.532 -8.927 7.384 1.00 10.00 C ATOM 156 CD2 TYR A 423 -2.583 -11.032 7.049 1.00 10.00 C ATOM 157 CE1 TYR A 423 -2.748 -8.304 7.431 1.00 10.00 C ATOM 158 CE2 TYR A 423 -3.822 -10.415 7.098 1.00 10.00 C ATOM 159 CZ TYR A 423 -3.899 -9.049 7.289 1.00 10.00 C ATOM 160 OH TYR A 423 -5.127 -8.429 7.334 1.00 10.00 O ATOM 0 H TYR A 423 0.558 -8.593 6.878 1.00 10.00 H new ATOM 0 HA TYR A 423 1.805 -10.810 5.993 1.00 10.00 H new ATOM 0 HB2 TYR A 423 -0.165 -12.025 7.044 1.00 10.00 H new ATOM 0 HB3 TYR A 423 0.495 -10.747 8.046 1.00 10.00 H new ATOM 0 HD1 TYR A 423 -0.636 -8.335 7.498 1.00 10.00 H new ATOM 0 HD2 TYR A 423 -2.524 -12.100 6.896 1.00 10.00 H new ATOM 0 HE1 TYR A 423 -2.806 -7.236 7.578 1.00 10.00 H new ATOM 0 HE2 TYR A 423 -4.724 -10.999 6.987 1.00 10.00 H new ATOM 0 HH TYR A 423 -5.835 -9.096 7.216 1.00 10.00 H new ATOM 170 N LYS A 424 -0.945 -10.341 4.246 1.00 10.00 N ATOM 171 CA LYS A 424 -1.640 -10.708 3.018 1.00 10.00 C ATOM 172 C LYS A 424 -1.237 -9.776 1.878 1.00 10.00 C ATOM 173 O LYS A 424 -1.378 -10.116 0.704 1.00 10.00 O ATOM 174 CB LYS A 424 -3.154 -10.655 3.226 1.00 10.00 C ATOM 175 CG LYS A 424 -3.729 -11.925 3.832 1.00 10.00 C ATOM 176 CD LYS A 424 -5.248 -11.936 3.766 1.00 10.00 C ATOM 177 CE LYS A 424 -5.853 -12.628 4.976 1.00 10.00 C ATOM 178 NZ LYS A 424 -7.144 -12.006 5.383 1.00 10.00 N ATOM 0 H LYS A 424 -1.391 -9.589 4.771 1.00 10.00 H new ATOM 0 HA LYS A 424 -1.357 -11.727 2.755 1.00 10.00 H new ATOM 0 HB2 LYS A 424 -3.394 -9.812 3.874 1.00 10.00 H new ATOM 0 HB3 LYS A 424 -3.638 -10.468 2.267 1.00 10.00 H new ATOM 0 HG2 LYS A 424 -3.335 -12.793 3.303 1.00 10.00 H new ATOM 0 HG3 LYS A 424 -3.408 -12.012 4.870 1.00 10.00 H new ATOM 0 HD2 LYS A 424 -5.618 -10.912 3.708 1.00 10.00 H new ATOM 0 HD3 LYS A 424 -5.570 -12.443 2.857 1.00 10.00 H new ATOM 0 HE2 LYS A 424 -6.013 -13.682 4.749 1.00 10.00 H new ATOM 0 HE3 LYS A 424 -5.151 -12.584 5.808 1.00 10.00 H new ATOM 0 HZ1 LYS A 424 -7.524 -12.506 6.212 1.00 10.00 H new ATOM 0 HZ2 LYS A 424 -6.987 -11.007 5.624 1.00 10.00 H new ATOM 0 HZ3 LYS A 424 -7.823 -12.070 4.598 1.00 10.00 H new ATOM 192 N ASP A 425 -0.734 -8.599 2.235 1.00 10.00 N ATOM 193 CA ASP A 425 -0.305 -7.617 1.250 1.00 10.00 C ATOM 194 C ASP A 425 0.868 -8.141 0.421 1.00 10.00 C ATOM 195 O ASP A 425 1.177 -7.605 -0.640 1.00 10.00 O ATOM 196 CB ASP A 425 0.094 -6.318 1.951 1.00 10.00 C ATOM 197 CG ASP A 425 -0.299 -5.081 1.168 1.00 10.00 C ATOM 198 OD1 ASP A 425 -0.381 -5.164 -0.074 1.00 10.00 O ATOM 199 OD2 ASP A 425 -0.520 -4.027 1.800 1.00 10.00 O ATOM 0 H ASP A 425 -0.614 -8.303 3.204 1.00 10.00 H new ATOM 0 HA ASP A 425 -1.139 -7.426 0.575 1.00 10.00 H new ATOM 0 HB2 ASP A 425 -0.374 -6.283 2.935 1.00 10.00 H new ATOM 0 HB3 ASP A 425 1.172 -6.314 2.111 1.00 10.00 H new ATOM 204 N ARG A 426 1.523 -9.191 0.911 1.00 10.00 N ATOM 205 CA ARG A 426 2.662 -9.775 0.209 1.00 10.00 C ATOM 206 C ARG A 426 2.275 -10.217 -1.197 1.00 10.00 C ATOM 207 O ARG A 426 3.103 -10.209 -2.108 1.00 10.00 O ATOM 208 CB ARG A 426 3.224 -10.957 1.002 1.00 10.00 C ATOM 209 CG ARG A 426 4.728 -11.124 0.862 1.00 10.00 C ATOM 210 CD ARG A 426 5.319 -11.863 2.051 1.00 10.00 C ATOM 211 NE ARG A 426 5.436 -13.298 1.800 1.00 10.00 N ATOM 212 CZ ARG A 426 6.349 -13.839 0.997 1.00 10.00 C ATOM 213 NH1 ARG A 426 7.226 -13.069 0.365 1.00 10.00 N ATOM 214 NH2 ARG A 426 6.384 -15.153 0.826 1.00 10.00 N ATOM 0 H ARG A 426 1.285 -9.653 1.789 1.00 10.00 H new ATOM 0 HA ARG A 426 3.433 -9.009 0.121 1.00 10.00 H new ATOM 0 HB2 ARG A 426 2.978 -10.826 2.056 1.00 10.00 H new ATOM 0 HB3 ARG A 426 2.733 -11.872 0.671 1.00 10.00 H new ATOM 0 HG2 ARG A 426 4.951 -11.670 -0.055 1.00 10.00 H new ATOM 0 HG3 ARG A 426 5.197 -10.144 0.771 1.00 10.00 H new ATOM 0 HD2 ARG A 426 6.303 -11.454 2.280 1.00 10.00 H new ATOM 0 HD3 ARG A 426 4.693 -11.698 2.928 1.00 10.00 H new ATOM 0 HE ARG A 426 4.779 -13.922 2.268 1.00 10.00 H new ATOM 0 HH11 ARG A 426 7.202 -12.057 0.494 1.00 10.00 H new ATOM 0 HH12 ARG A 426 7.924 -13.489 -0.249 1.00 10.00 H new ATOM 0 HH21 ARG A 426 5.712 -15.748 1.310 1.00 10.00 H new ATOM 0 HH22 ARG A 426 7.083 -15.569 0.211 1.00 10.00 H new ATOM 228 N GLN A 427 1.010 -10.581 -1.378 1.00 10.00 N ATOM 229 CA GLN A 427 0.523 -11.001 -2.689 1.00 10.00 C ATOM 230 C GLN A 427 -0.207 -9.846 -3.363 1.00 10.00 C ATOM 231 O GLN A 427 -1.142 -10.045 -4.139 1.00 10.00 O ATOM 232 CB GLN A 427 -0.390 -12.235 -2.589 1.00 10.00 C ATOM 233 CG GLN A 427 -0.801 -12.607 -1.171 1.00 10.00 C ATOM 234 CD GLN A 427 0.366 -13.084 -0.324 1.00 10.00 C ATOM 235 OE1 GLN A 427 1.163 -13.915 -0.757 1.00 10.00 O ATOM 236 NE2 GLN A 427 0.467 -12.558 0.893 1.00 10.00 N ATOM 0 H GLN A 427 0.307 -10.594 -0.639 1.00 10.00 H new ATOM 0 HA GLN A 427 1.384 -11.285 -3.295 1.00 10.00 H new ATOM 0 HB2 GLN A 427 -1.289 -12.054 -3.178 1.00 10.00 H new ATOM 0 HB3 GLN A 427 0.121 -13.086 -3.040 1.00 10.00 H new ATOM 0 HG2 GLN A 427 -1.261 -11.742 -0.693 1.00 10.00 H new ATOM 0 HG3 GLN A 427 -1.558 -13.390 -1.211 1.00 10.00 H new ATOM 0 HE21 GLN A 427 -0.217 -11.871 1.210 1.00 10.00 H new ATOM 0 HE22 GLN A 427 1.229 -12.841 1.509 1.00 10.00 H new ATOM 245 N VAL A 428 0.249 -8.637 -3.059 1.00 10.00 N ATOM 246 CA VAL A 428 -0.321 -7.422 -3.622 1.00 10.00 C ATOM 247 C VAL A 428 0.681 -6.750 -4.541 1.00 10.00 C ATOM 248 O VAL A 428 0.302 -6.115 -5.524 1.00 10.00 O ATOM 249 CB VAL A 428 -0.737 -6.436 -2.523 1.00 10.00 C ATOM 250 CG1 VAL A 428 -1.115 -5.091 -3.119 1.00 10.00 C ATOM 251 CG2 VAL A 428 -1.881 -7.006 -1.704 1.00 10.00 C ATOM 0 H VAL A 428 1.023 -8.473 -2.416 1.00 10.00 H new ATOM 0 HA VAL A 428 -1.208 -7.707 -4.187 1.00 10.00 H new ATOM 0 HB VAL A 428 0.114 -6.281 -1.860 1.00 10.00 H new ATOM 0 HG11 VAL A 428 -1.406 -4.408 -2.321 1.00 10.00 H new ATOM 0 HG12 VAL A 428 -0.261 -4.678 -3.656 1.00 10.00 H new ATOM 0 HG13 VAL A 428 -1.949 -5.220 -3.809 1.00 10.00 H new ATOM 0 HG21 VAL A 428 -2.164 -6.294 -0.929 1.00 10.00 H new ATOM 0 HG22 VAL A 428 -2.736 -7.193 -2.354 1.00 10.00 H new ATOM 0 HG23 VAL A 428 -1.566 -7.941 -1.240 1.00 10.00 H new ATOM 261 N MET A 429 1.964 -6.906 -4.229 1.00 10.00 N ATOM 262 CA MET A 429 3.019 -6.325 -5.055 1.00 10.00 C ATOM 263 C MET A 429 2.740 -6.598 -6.535 1.00 10.00 C ATOM 264 O MET A 429 3.166 -5.843 -7.409 1.00 10.00 O ATOM 265 CB MET A 429 4.382 -6.899 -4.662 1.00 10.00 C ATOM 266 CG MET A 429 4.442 -8.416 -4.719 1.00 10.00 C ATOM 267 SD MET A 429 6.105 -9.055 -4.441 1.00 10.00 S ATOM 268 CE MET A 429 6.243 -10.237 -5.779 1.00 10.00 C ATOM 0 H MET A 429 2.297 -7.425 -3.417 1.00 10.00 H new ATOM 0 HA MET A 429 3.035 -5.247 -4.891 1.00 10.00 H new ATOM 0 HB2 MET A 429 5.144 -6.488 -5.324 1.00 10.00 H new ATOM 0 HB3 MET A 429 4.627 -6.572 -3.652 1.00 10.00 H new ATOM 0 HG2 MET A 429 3.767 -8.831 -3.970 1.00 10.00 H new ATOM 0 HG3 MET A 429 4.085 -8.754 -5.692 1.00 10.00 H new ATOM 0 HE1 MET A 429 7.221 -10.717 -5.741 1.00 10.00 H new ATOM 0 HE2 MET A 429 5.464 -10.993 -5.679 1.00 10.00 H new ATOM 0 HE3 MET A 429 6.128 -9.722 -6.733 1.00 10.00 H new ATOM 278 N ASN A 430 2.011 -7.683 -6.798 1.00 10.00 N ATOM 279 CA ASN A 430 1.655 -8.066 -8.157 1.00 10.00 C ATOM 280 C ASN A 430 0.143 -8.260 -8.295 1.00 10.00 C ATOM 281 O ASN A 430 -0.319 -8.973 -9.184 1.00 10.00 O ATOM 282 CB ASN A 430 2.379 -9.357 -8.539 1.00 10.00 C ATOM 283 CG ASN A 430 3.765 -9.101 -9.100 1.00 10.00 C ATOM 284 OD1 ASN A 430 4.580 -8.419 -8.480 1.00 10.00 O ATOM 285 ND2 ASN A 430 4.036 -9.648 -10.279 1.00 10.00 N ATOM 0 H ASN A 430 1.655 -8.314 -6.079 1.00 10.00 H new ATOM 0 HA ASN A 430 1.960 -7.264 -8.829 1.00 10.00 H new ATOM 0 HB2 ASN A 430 2.458 -9.999 -7.661 1.00 10.00 H new ATOM 0 HB3 ASN A 430 1.786 -9.898 -9.277 1.00 10.00 H new ATOM 0 HD21 ASN A 430 4.952 -9.510 -10.707 1.00 10.00 H new ATOM 0 HD22 ASN A 430 3.329 -10.206 -10.757 1.00 10.00 H new ATOM 292 N MET A 431 -0.624 -7.619 -7.411 1.00 10.00 N ATOM 293 CA MET A 431 -2.084 -7.721 -7.437 1.00 10.00 C ATOM 294 C MET A 431 -2.716 -7.053 -6.219 1.00 10.00 C ATOM 295 O MET A 431 -2.988 -7.709 -5.214 1.00 10.00 O ATOM 296 CB MET A 431 -2.525 -9.182 -7.483 1.00 10.00 C ATOM 297 CG MET A 431 -2.948 -9.650 -8.867 1.00 10.00 C ATOM 298 SD MET A 431 -4.463 -10.629 -8.839 1.00 10.00 S ATOM 299 CE MET A 431 -5.375 -9.881 -10.186 1.00 10.00 C ATOM 0 H MET A 431 -0.258 -7.024 -6.668 1.00 10.00 H new ATOM 0 HA MET A 431 -2.421 -7.206 -8.337 1.00 10.00 H new ATOM 0 HB2 MET A 431 -1.707 -9.810 -7.131 1.00 10.00 H new ATOM 0 HB3 MET A 431 -3.356 -9.323 -6.792 1.00 10.00 H new ATOM 0 HG2 MET A 431 -3.093 -8.782 -9.511 1.00 10.00 H new ATOM 0 HG3 MET A 431 -2.146 -10.243 -9.307 1.00 10.00 H new ATOM 0 HE1 MET A 431 -6.338 -10.380 -10.294 1.00 10.00 H new ATOM 0 HE2 MET A 431 -5.535 -8.824 -9.974 1.00 10.00 H new ATOM 0 HE3 MET A 431 -4.807 -9.983 -11.111 1.00 10.00 H new ATOM 309 N TRP A 432 -2.984 -5.762 -6.328 1.00 10.00 N ATOM 310 CA TRP A 432 -3.620 -5.021 -5.246 1.00 10.00 C ATOM 311 C TRP A 432 -5.128 -5.152 -5.374 1.00 10.00 C ATOM 312 O TRP A 432 -5.760 -4.486 -6.192 1.00 10.00 O ATOM 313 CB TRP A 432 -3.205 -3.548 -5.270 1.00 10.00 C ATOM 314 CG TRP A 432 -1.777 -3.303 -5.668 1.00 10.00 C ATOM 315 CD1 TRP A 432 -1.204 -3.589 -6.868 1.00 10.00 C ATOM 316 CD2 TRP A 432 -0.743 -2.703 -4.873 1.00 10.00 C ATOM 317 NE1 TRP A 432 0.102 -3.178 -6.880 1.00 10.00 N ATOM 318 CE2 TRP A 432 0.411 -2.643 -5.668 1.00 10.00 C ATOM 319 CE3 TRP A 432 -0.684 -2.204 -3.576 1.00 10.00 C ATOM 320 CZ2 TRP A 432 1.606 -2.101 -5.211 1.00 10.00 C ATOM 321 CZ3 TRP A 432 0.503 -1.671 -3.113 1.00 10.00 C ATOM 322 CH2 TRP A 432 1.637 -1.620 -3.933 1.00 10.00 C ATOM 0 H TRP A 432 -2.772 -5.203 -7.155 1.00 10.00 H new ATOM 0 HA TRP A 432 -3.297 -5.438 -4.292 1.00 10.00 H new ATOM 0 HB2 TRP A 432 -3.857 -3.012 -5.960 1.00 10.00 H new ATOM 0 HB3 TRP A 432 -3.370 -3.122 -4.280 1.00 10.00 H new ATOM 0 HD1 TRP A 432 -1.707 -4.071 -7.693 1.00 10.00 H new ATOM 0 HE1 TRP A 432 0.741 -3.260 -7.671 1.00 10.00 H new ATOM 0 HE3 TRP A 432 -1.556 -2.233 -2.939 1.00 10.00 H new ATOM 0 HZ2 TRP A 432 2.480 -2.061 -5.844 1.00 10.00 H new ATOM 0 HZ3 TRP A 432 0.557 -1.288 -2.105 1.00 10.00 H new ATOM 0 HH2 TRP A 432 2.551 -1.193 -3.548 1.00 10.00 H new ATOM 333 N SER A 433 -5.686 -6.043 -4.572 1.00 10.00 N ATOM 334 CA SER A 433 -7.121 -6.311 -4.592 1.00 10.00 C ATOM 335 C SER A 433 -7.929 -5.074 -4.226 1.00 10.00 C ATOM 336 O SER A 433 -7.475 -4.226 -3.458 1.00 10.00 O ATOM 337 CB SER A 433 -7.459 -7.454 -3.633 1.00 10.00 C ATOM 338 OG SER A 433 -8.746 -7.981 -3.902 1.00 10.00 O ATOM 0 H SER A 433 -5.166 -6.599 -3.893 1.00 10.00 H new ATOM 0 HA SER A 433 -7.388 -6.599 -5.609 1.00 10.00 H new ATOM 0 HB2 SER A 433 -6.713 -8.243 -3.725 1.00 10.00 H new ATOM 0 HB3 SER A 433 -7.417 -7.095 -2.605 1.00 10.00 H new ATOM 0 HG SER A 433 -8.938 -8.711 -3.277 1.00 10.00 H new ATOM 344 N GLU A 434 -9.142 -4.985 -4.772 1.00 10.00 N ATOM 345 CA GLU A 434 -10.027 -3.859 -4.492 1.00 10.00 C ATOM 346 C GLU A 434 -10.121 -3.624 -2.990 1.00 10.00 C ATOM 347 O GLU A 434 -10.299 -2.495 -2.533 1.00 10.00 O ATOM 348 CB GLU A 434 -11.419 -4.119 -5.069 1.00 10.00 C ATOM 349 CG GLU A 434 -12.258 -2.861 -5.226 1.00 10.00 C ATOM 350 CD GLU A 434 -13.747 -3.148 -5.217 1.00 10.00 C ATOM 351 OE1 GLU A 434 -14.343 -3.164 -4.120 1.00 10.00 O ATOM 352 OE2 GLU A 434 -14.317 -3.358 -6.308 1.00 10.00 O ATOM 0 H GLU A 434 -9.532 -5.679 -5.410 1.00 10.00 H new ATOM 0 HA GLU A 434 -9.613 -2.968 -4.964 1.00 10.00 H new ATOM 0 HB2 GLU A 434 -11.316 -4.600 -6.041 1.00 10.00 H new ATOM 0 HB3 GLU A 434 -11.947 -4.819 -4.421 1.00 10.00 H new ATOM 0 HG2 GLU A 434 -12.021 -2.167 -4.419 1.00 10.00 H new ATOM 0 HG3 GLU A 434 -11.993 -2.366 -6.160 1.00 10.00 H new ATOM 359 N GLN A 435 -9.986 -4.705 -2.229 1.00 10.00 N ATOM 360 CA GLN A 435 -10.038 -4.632 -0.777 1.00 10.00 C ATOM 361 C GLN A 435 -8.663 -4.304 -0.215 1.00 10.00 C ATOM 362 O GLN A 435 -8.545 -3.662 0.829 1.00 10.00 O ATOM 363 CB GLN A 435 -10.537 -5.955 -0.196 1.00 10.00 C ATOM 364 CG GLN A 435 -11.292 -5.799 1.114 1.00 10.00 C ATOM 365 CD GLN A 435 -12.794 -5.726 0.918 1.00 10.00 C ATOM 366 OE1 GLN A 435 -13.560 -6.308 1.686 1.00 10.00 O ATOM 367 NE2 GLN A 435 -13.222 -5.011 -0.116 1.00 10.00 N ATOM 0 H GLN A 435 -9.839 -5.645 -2.598 1.00 10.00 H new ATOM 0 HA GLN A 435 -10.732 -3.840 -0.496 1.00 10.00 H new ATOM 0 HB2 GLN A 435 -11.187 -6.440 -0.925 1.00 10.00 H new ATOM 0 HB3 GLN A 435 -9.685 -6.617 -0.038 1.00 10.00 H new ATOM 0 HG2 GLN A 435 -11.055 -6.639 1.767 1.00 10.00 H new ATOM 0 HG3 GLN A 435 -10.951 -4.896 1.620 1.00 10.00 H new ATOM 0 HE21 GLN A 435 -12.551 -4.545 -0.727 1.00 10.00 H new ATOM 0 HE22 GLN A 435 -14.222 -4.928 -0.299 1.00 10.00 H new ATOM 376 N GLU A 436 -7.620 -4.738 -0.919 1.00 10.00 N ATOM 377 CA GLU A 436 -6.262 -4.482 -0.498 1.00 10.00 C ATOM 378 C GLU A 436 -5.918 -3.025 -0.743 1.00 10.00 C ATOM 379 O GLU A 436 -5.547 -2.304 0.184 1.00 10.00 O ATOM 380 CB GLU A 436 -5.321 -5.432 -1.241 1.00 10.00 C ATOM 381 CG GLU A 436 -4.694 -6.481 -0.337 1.00 10.00 C ATOM 382 CD GLU A 436 -4.660 -7.858 -0.970 1.00 10.00 C ATOM 383 OE1 GLU A 436 -5.522 -8.138 -1.831 1.00 10.00 O ATOM 384 OE2 GLU A 436 -3.773 -8.657 -0.606 1.00 10.00 O ATOM 0 H GLU A 436 -7.699 -5.270 -1.786 1.00 10.00 H new ATOM 0 HA GLU A 436 -6.150 -4.667 0.570 1.00 10.00 H new ATOM 0 HB2 GLU A 436 -5.873 -5.931 -2.037 1.00 10.00 H new ATOM 0 HB3 GLU A 436 -4.530 -4.852 -1.717 1.00 10.00 H new ATOM 0 HG2 GLU A 436 -3.678 -6.177 -0.085 1.00 10.00 H new ATOM 0 HG3 GLU A 436 -5.253 -6.530 0.598 1.00 10.00 H new ATOM 391 N LYS A 437 -6.092 -2.574 -1.977 1.00 10.00 N ATOM 392 CA LYS A 437 -5.848 -1.175 -2.309 1.00 10.00 C ATOM 393 C LYS A 437 -6.670 -0.289 -1.384 1.00 10.00 C ATOM 394 O LYS A 437 -6.376 0.885 -1.205 1.00 10.00 O ATOM 395 CB LYS A 437 -6.225 -0.894 -3.764 1.00 10.00 C ATOM 396 CG LYS A 437 -5.491 -1.771 -4.760 1.00 10.00 C ATOM 397 CD LYS A 437 -6.121 -1.703 -6.141 1.00 10.00 C ATOM 398 CE LYS A 437 -7.551 -2.218 -6.127 1.00 10.00 C ATOM 399 NZ LYS A 437 -8.542 -1.106 -6.105 1.00 10.00 N ATOM 0 H LYS A 437 -6.399 -3.150 -2.761 1.00 10.00 H new ATOM 0 HA LYS A 437 -4.787 -0.960 -2.180 1.00 10.00 H new ATOM 0 HB2 LYS A 437 -7.298 -1.038 -3.887 1.00 10.00 H new ATOM 0 HB3 LYS A 437 -6.016 0.152 -3.990 1.00 10.00 H new ATOM 0 HG2 LYS A 437 -4.448 -1.459 -4.820 1.00 10.00 H new ATOM 0 HG3 LYS A 437 -5.495 -2.803 -4.409 1.00 10.00 H new ATOM 0 HD2 LYS A 437 -6.108 -0.673 -6.498 1.00 10.00 H new ATOM 0 HD3 LYS A 437 -5.528 -2.291 -6.842 1.00 10.00 H new ATOM 0 HE2 LYS A 437 -7.722 -2.839 -7.006 1.00 10.00 H new ATOM 0 HE3 LYS A 437 -7.699 -2.854 -5.254 1.00 10.00 H new ATOM 0 HZ1 LYS A 437 -9.272 -1.277 -6.826 1.00 10.00 H new ATOM 0 HZ2 LYS A 437 -8.987 -1.056 -5.166 1.00 10.00 H new ATOM 0 HZ3 LYS A 437 -8.060 -0.207 -6.308 1.00 10.00 H new ATOM 413 N GLU A 438 -7.700 -0.875 -0.788 1.00 10.00 N ATOM 414 CA GLU A 438 -8.563 -0.147 0.125 1.00 10.00 C ATOM 415 C GLU A 438 -7.789 0.340 1.340 1.00 10.00 C ATOM 416 O GLU A 438 -8.189 1.306 1.986 1.00 10.00 O ATOM 417 CB GLU A 438 -9.729 -1.031 0.571 1.00 10.00 C ATOM 418 CG GLU A 438 -11.007 -0.258 0.852 1.00 10.00 C ATOM 419 CD GLU A 438 -11.888 -0.944 1.878 1.00 10.00 C ATOM 420 OE1 GLU A 438 -11.342 -1.630 2.766 1.00 10.00 O ATOM 421 OE2 GLU A 438 -13.125 -0.793 1.792 1.00 10.00 O ATOM 0 H GLU A 438 -7.956 -1.853 -0.922 1.00 10.00 H new ATOM 0 HA GLU A 438 -8.954 0.722 -0.404 1.00 10.00 H new ATOM 0 HB2 GLU A 438 -9.926 -1.774 -0.201 1.00 10.00 H new ATOM 0 HB3 GLU A 438 -9.438 -1.575 1.470 1.00 10.00 H new ATOM 0 HG2 GLU A 438 -10.753 0.741 1.206 1.00 10.00 H new ATOM 0 HG3 GLU A 438 -11.565 -0.135 -0.076 1.00 10.00 H new ATOM 428 N THR A 439 -6.687 -0.331 1.664 1.00 10.00 N ATOM 429 CA THR A 439 -5.891 0.065 2.821 1.00 10.00 C ATOM 430 C THR A 439 -4.749 1.005 2.435 1.00 10.00 C ATOM 431 O THR A 439 -4.507 2.003 3.113 1.00 10.00 O ATOM 432 CB THR A 439 -5.343 -1.168 3.543 1.00 10.00 C ATOM 433 OG1 THR A 439 -6.399 -2.030 3.929 1.00 10.00 O ATOM 434 CG2 THR A 439 -4.553 -0.824 4.789 1.00 10.00 C ATOM 0 H THR A 439 -6.330 -1.137 1.152 1.00 10.00 H new ATOM 0 HA THR A 439 -6.550 0.610 3.497 1.00 10.00 H new ATOM 0 HB THR A 439 -4.677 -1.654 2.830 1.00 10.00 H new ATOM 0 HG1 THR A 439 -6.393 -2.138 4.903 1.00 10.00 H new ATOM 0 HG21 THR A 439 -4.192 -1.741 5.255 1.00 10.00 H new ATOM 0 HG22 THR A 439 -3.705 -0.195 4.520 1.00 10.00 H new ATOM 0 HG23 THR A 439 -5.194 -0.289 5.490 1.00 10.00 H new ATOM 442 N PHE A 440 -4.050 0.691 1.351 1.00 10.00 N ATOM 443 CA PHE A 440 -2.942 1.519 0.898 1.00 10.00 C ATOM 444 C PHE A 440 -3.460 2.723 0.121 1.00 10.00 C ATOM 445 O PHE A 440 -2.860 3.796 0.151 1.00 10.00 O ATOM 446 CB PHE A 440 -1.982 0.700 0.031 1.00 10.00 C ATOM 447 CG PHE A 440 -2.376 -0.730 -0.122 1.00 10.00 C ATOM 448 CD1 PHE A 440 -2.397 -1.592 0.958 1.00 10.00 C ATOM 449 CD2 PHE A 440 -2.744 -1.204 -1.357 1.00 10.00 C ATOM 450 CE1 PHE A 440 -2.780 -2.903 0.792 1.00 10.00 C ATOM 451 CE2 PHE A 440 -3.124 -2.505 -1.527 1.00 10.00 C ATOM 452 CZ PHE A 440 -3.142 -3.349 -0.460 1.00 10.00 C ATOM 0 H PHE A 440 -4.231 -0.129 0.772 1.00 10.00 H new ATOM 0 HA PHE A 440 -2.400 1.878 1.773 1.00 10.00 H new ATOM 0 HB2 PHE A 440 -1.920 1.157 -0.957 1.00 10.00 H new ATOM 0 HB3 PHE A 440 -0.984 0.747 0.467 1.00 10.00 H new ATOM 0 HD1 PHE A 440 -2.112 -1.235 1.937 1.00 10.00 H new ATOM 0 HD2 PHE A 440 -2.733 -0.538 -2.207 1.00 10.00 H new ATOM 0 HE1 PHE A 440 -2.797 -3.577 1.636 1.00 10.00 H new ATOM 0 HE2 PHE A 440 -3.409 -2.863 -2.505 1.00 10.00 H new ATOM 0 HZ PHE A 440 -3.443 -4.377 -0.596 1.00 10.00 H new ATOM 462 N ARG A 441 -4.588 2.544 -0.563 1.00 10.00 N ATOM 463 CA ARG A 441 -5.185 3.627 -1.329 1.00 10.00 C ATOM 464 C ARG A 441 -5.977 4.552 -0.409 1.00 10.00 C ATOM 465 O ARG A 441 -6.193 5.721 -0.726 1.00 10.00 O ATOM 466 CB ARG A 441 -6.096 3.087 -2.434 1.00 10.00 C ATOM 467 CG ARG A 441 -6.331 4.074 -3.567 1.00 10.00 C ATOM 468 CD ARG A 441 -7.783 4.072 -4.020 1.00 10.00 C ATOM 469 NE ARG A 441 -8.480 5.295 -3.626 1.00 10.00 N ATOM 470 CZ ARG A 441 -9.802 5.444 -3.680 1.00 10.00 C ATOM 471 NH1 ARG A 441 -10.572 4.452 -4.108 1.00 10.00 N ATOM 472 NH2 ARG A 441 -10.355 6.589 -3.303 1.00 10.00 N ATOM 0 H ARG A 441 -5.102 1.664 -0.600 1.00 10.00 H new ATOM 0 HA ARG A 441 -4.378 4.191 -1.796 1.00 10.00 H new ATOM 0 HB2 ARG A 441 -5.657 2.176 -2.842 1.00 10.00 H new ATOM 0 HB3 ARG A 441 -7.057 2.811 -1.999 1.00 10.00 H new ATOM 0 HG2 ARG A 441 -6.053 5.076 -3.241 1.00 10.00 H new ATOM 0 HG3 ARG A 441 -5.686 3.822 -4.409 1.00 10.00 H new ATOM 0 HD2 ARG A 441 -7.825 3.964 -5.104 1.00 10.00 H new ATOM 0 HD3 ARG A 441 -8.295 3.209 -3.594 1.00 10.00 H new ATOM 0 HE ARG A 441 -7.921 6.080 -3.290 1.00 10.00 H new ATOM 0 HH11 ARG A 441 -10.152 3.569 -4.398 1.00 10.00 H new ATOM 0 HH12 ARG A 441 -11.584 4.572 -4.147 1.00 10.00 H new ATOM 0 HH21 ARG A 441 -9.768 7.354 -2.972 1.00 10.00 H new ATOM 0 HH22 ARG A 441 -11.368 6.704 -3.344 1.00 10.00 H new ATOM 486 N GLU A 442 -6.405 4.022 0.741 1.00 10.00 N ATOM 487 CA GLU A 442 -7.165 4.812 1.701 1.00 10.00 C ATOM 488 C GLU A 442 -6.226 5.547 2.647 1.00 10.00 C ATOM 489 O GLU A 442 -6.524 6.655 3.092 1.00 10.00 O ATOM 490 CB GLU A 442 -8.119 3.924 2.500 1.00 10.00 C ATOM 491 CG GLU A 442 -8.956 4.687 3.513 1.00 10.00 C ATOM 492 CD GLU A 442 -10.381 4.910 3.044 1.00 10.00 C ATOM 493 OE1 GLU A 442 -10.577 5.146 1.834 1.00 10.00 O ATOM 494 OE2 GLU A 442 -11.300 4.848 3.887 1.00 10.00 O ATOM 0 H GLU A 442 -6.237 3.056 1.024 1.00 10.00 H new ATOM 0 HA GLU A 442 -7.753 5.543 1.146 1.00 10.00 H new ATOM 0 HB2 GLU A 442 -8.784 3.405 1.809 1.00 10.00 H new ATOM 0 HB3 GLU A 442 -7.541 3.160 3.020 1.00 10.00 H new ATOM 0 HG2 GLU A 442 -8.969 4.138 4.455 1.00 10.00 H new ATOM 0 HG3 GLU A 442 -8.488 5.651 3.713 1.00 10.00 H new ATOM 501 N LYS A 443 -5.084 4.934 2.941 1.00 10.00 N ATOM 502 CA LYS A 443 -4.107 5.548 3.819 1.00 10.00 C ATOM 503 C LYS A 443 -3.373 6.649 3.074 1.00 10.00 C ATOM 504 O LYS A 443 -3.198 7.750 3.588 1.00 10.00 O ATOM 505 CB LYS A 443 -3.116 4.505 4.336 1.00 10.00 C ATOM 506 CG LYS A 443 -3.671 3.641 5.457 1.00 10.00 C ATOM 507 CD LYS A 443 -4.165 4.488 6.621 1.00 10.00 C ATOM 508 CE LYS A 443 -3.767 3.885 7.958 1.00 10.00 C ATOM 509 NZ LYS A 443 -3.915 4.859 9.073 1.00 10.00 N ATOM 0 H LYS A 443 -4.817 4.017 2.584 1.00 10.00 H new ATOM 0 HA LYS A 443 -4.625 5.978 4.676 1.00 10.00 H new ATOM 0 HB2 LYS A 443 -2.813 3.862 3.509 1.00 10.00 H new ATOM 0 HB3 LYS A 443 -2.219 5.013 4.690 1.00 10.00 H new ATOM 0 HG2 LYS A 443 -4.490 3.031 5.076 1.00 10.00 H new ATOM 0 HG3 LYS A 443 -2.899 2.956 5.806 1.00 10.00 H new ATOM 0 HD2 LYS A 443 -3.756 5.495 6.539 1.00 10.00 H new ATOM 0 HD3 LYS A 443 -5.250 4.580 6.571 1.00 10.00 H new ATOM 0 HE2 LYS A 443 -4.383 3.008 8.158 1.00 10.00 H new ATOM 0 HE3 LYS A 443 -2.733 3.544 7.909 1.00 10.00 H new ATOM 0 HZ1 LYS A 443 -3.633 4.409 9.967 1.00 10.00 H new ATOM 0 HZ2 LYS A 443 -3.308 5.685 8.895 1.00 10.00 H new ATOM 0 HZ3 LYS A 443 -4.907 5.165 9.137 1.00 10.00 H new ATOM 523 N PHE A 444 -2.972 6.359 1.840 1.00 10.00 N ATOM 524 CA PHE A 444 -2.287 7.342 1.022 1.00 10.00 C ATOM 525 C PHE A 444 -3.235 8.490 0.748 1.00 10.00 C ATOM 526 O PHE A 444 -2.823 9.645 0.641 1.00 10.00 O ATOM 527 CB PHE A 444 -1.782 6.703 -0.272 1.00 10.00 C ATOM 528 CG PHE A 444 -0.951 7.624 -1.116 1.00 10.00 C ATOM 529 CD1 PHE A 444 -1.521 8.725 -1.733 1.00 10.00 C ATOM 530 CD2 PHE A 444 0.402 7.385 -1.292 1.00 10.00 C ATOM 531 CE1 PHE A 444 -0.756 9.575 -2.510 1.00 10.00 C ATOM 532 CE2 PHE A 444 1.173 8.230 -2.068 1.00 10.00 C ATOM 533 CZ PHE A 444 0.593 9.326 -2.678 1.00 10.00 C ATOM 0 H PHE A 444 -3.111 5.454 1.390 1.00 10.00 H new ATOM 0 HA PHE A 444 -1.413 7.725 1.549 1.00 10.00 H new ATOM 0 HB2 PHE A 444 -1.192 5.820 -0.025 1.00 10.00 H new ATOM 0 HB3 PHE A 444 -2.637 6.362 -0.856 1.00 10.00 H new ATOM 0 HD1 PHE A 444 -2.575 8.922 -1.606 1.00 10.00 H new ATOM 0 HD2 PHE A 444 0.859 6.529 -0.818 1.00 10.00 H new ATOM 0 HE1 PHE A 444 -1.212 10.432 -2.985 1.00 10.00 H new ATOM 0 HE2 PHE A 444 2.227 8.034 -2.197 1.00 10.00 H new ATOM 0 HZ PHE A 444 1.193 9.987 -3.285 1.00 10.00 H new ATOM 543 N MET A 445 -4.523 8.168 0.703 1.00 10.00 N ATOM 544 CA MET A 445 -5.540 9.180 0.520 1.00 10.00 C ATOM 545 C MET A 445 -5.690 9.934 1.837 1.00 10.00 C ATOM 546 O MET A 445 -5.981 11.130 1.866 1.00 10.00 O ATOM 547 CB MET A 445 -6.871 8.549 0.105 1.00 10.00 C ATOM 548 CG MET A 445 -7.067 8.479 -1.400 1.00 10.00 C ATOM 549 SD MET A 445 -8.031 9.863 -2.040 1.00 10.00 S ATOM 550 CE MET A 445 -6.745 10.843 -2.809 1.00 10.00 C ATOM 0 H MET A 445 -4.880 7.217 0.791 1.00 10.00 H new ATOM 0 HA MET A 445 -5.247 9.864 -0.276 1.00 10.00 H new ATOM 0 HB2 MET A 445 -6.931 7.542 0.518 1.00 10.00 H new ATOM 0 HB3 MET A 445 -7.688 9.122 0.543 1.00 10.00 H new ATOM 0 HG2 MET A 445 -6.093 8.463 -1.889 1.00 10.00 H new ATOM 0 HG3 MET A 445 -7.567 7.544 -1.654 1.00 10.00 H new ATOM 0 HE1 MET A 445 -7.191 11.709 -3.298 1.00 10.00 H new ATOM 0 HE2 MET A 445 -6.039 11.178 -2.049 1.00 10.00 H new ATOM 0 HE3 MET A 445 -6.221 10.239 -3.549 1.00 10.00 H new ATOM 560 N GLN A 446 -5.448 9.203 2.926 1.00 10.00 N ATOM 561 CA GLN A 446 -5.502 9.746 4.275 1.00 10.00 C ATOM 562 C GLN A 446 -4.306 10.654 4.506 1.00 10.00 C ATOM 563 O GLN A 446 -4.399 11.686 5.173 1.00 10.00 O ATOM 564 CB GLN A 446 -5.459 8.600 5.290 1.00 10.00 C ATOM 565 CG GLN A 446 -5.897 9.005 6.689 1.00 10.00 C ATOM 566 CD GLN A 446 -7.022 8.139 7.221 1.00 10.00 C ATOM 567 OE1 GLN A 446 -7.956 8.632 7.853 1.00 10.00 O ATOM 568 NE2 GLN A 446 -6.938 6.837 6.968 1.00 10.00 N ATOM 0 H GLN A 446 -5.208 8.212 2.892 1.00 10.00 H new ATOM 0 HA GLN A 446 -6.425 10.313 4.397 1.00 10.00 H new ATOM 0 HB2 GLN A 446 -6.099 7.791 4.938 1.00 10.00 H new ATOM 0 HB3 GLN A 446 -4.444 8.206 5.337 1.00 10.00 H new ATOM 0 HG2 GLN A 446 -5.044 8.942 7.365 1.00 10.00 H new ATOM 0 HG3 GLN A 446 -6.219 10.046 6.678 1.00 10.00 H new ATOM 0 HE21 GLN A 446 -6.146 6.470 6.440 1.00 10.00 H new ATOM 0 HE22 GLN A 446 -7.665 6.205 7.302 1.00 10.00 H new ATOM 577 N HIS A 447 -3.179 10.233 3.953 1.00 10.00 N ATOM 578 CA HIS A 447 -1.927 10.955 4.081 1.00 10.00 C ATOM 579 C HIS A 447 -1.557 11.618 2.751 1.00 10.00 C ATOM 580 O HIS A 447 -1.038 10.963 1.848 1.00 10.00 O ATOM 581 CB HIS A 447 -0.842 9.975 4.531 1.00 10.00 C ATOM 582 CG HIS A 447 -1.277 9.124 5.689 1.00 10.00 C ATOM 583 ND1 HIS A 447 -1.405 9.619 6.969 1.00 10.00 N ATOM 584 CD2 HIS A 447 -1.651 7.816 5.757 1.00 10.00 C ATOM 585 CE1 HIS A 447 -1.837 8.663 7.769 1.00 10.00 C ATOM 586 NE2 HIS A 447 -1.997 7.561 7.061 1.00 10.00 N ATOM 0 H HIS A 447 -3.109 9.378 3.401 1.00 10.00 H new ATOM 0 HA HIS A 447 -2.026 11.746 4.824 1.00 10.00 H new ATOM 0 HB2 HIS A 447 -0.569 9.332 3.694 1.00 10.00 H new ATOM 0 HB3 HIS A 447 0.052 10.532 4.810 1.00 10.00 H new ATOM 0 HD1 HIS A 447 -1.198 10.576 7.254 1.00 10.00 H new ATOM 0 HD2 HIS A 447 -1.672 7.112 4.939 1.00 10.00 H new ATOM 0 HE1 HIS A 447 -2.028 8.765 8.827 1.00 10.00 H new ATOM 595 N PRO A 448 -1.840 12.929 2.608 1.00 10.00 N ATOM 596 CA PRO A 448 -1.556 13.677 1.378 1.00 10.00 C ATOM 597 C PRO A 448 -0.142 13.448 0.853 1.00 10.00 C ATOM 598 O PRO A 448 0.819 14.036 1.348 1.00 10.00 O ATOM 599 CB PRO A 448 -1.748 15.149 1.782 1.00 10.00 C ATOM 600 CG PRO A 448 -1.945 15.147 3.264 1.00 10.00 C ATOM 601 CD PRO A 448 -2.471 13.788 3.617 1.00 10.00 C ATOM 0 HA PRO A 448 -2.209 13.358 0.566 1.00 10.00 H new ATOM 0 HB2 PRO A 448 -0.879 15.746 1.505 1.00 10.00 H new ATOM 0 HB3 PRO A 448 -2.609 15.584 1.274 1.00 10.00 H new ATOM 0 HG2 PRO A 448 -1.007 15.347 3.781 1.00 10.00 H new ATOM 0 HG3 PRO A 448 -2.647 15.925 3.564 1.00 10.00 H new ATOM 0 HD2 PRO A 448 -2.193 13.496 4.630 1.00 10.00 H new ATOM 0 HD3 PRO A 448 -3.559 13.747 3.561 1.00 10.00 H new ATOM 609 N LYS A 449 -0.032 12.596 -0.166 1.00 10.00 N ATOM 610 CA LYS A 449 1.255 12.286 -0.787 1.00 10.00 C ATOM 611 C LYS A 449 2.351 12.074 0.253 1.00 10.00 C ATOM 612 O LYS A 449 2.975 13.031 0.714 1.00 10.00 O ATOM 613 CB LYS A 449 1.661 13.406 -1.746 1.00 10.00 C ATOM 614 CG LYS A 449 2.392 12.913 -2.984 1.00 10.00 C ATOM 615 CD LYS A 449 3.791 12.424 -2.648 1.00 10.00 C ATOM 616 CE LYS A 449 4.505 11.887 -3.878 1.00 10.00 C ATOM 617 NZ LYS A 449 4.206 10.447 -4.109 1.00 10.00 N ATOM 0 H LYS A 449 -0.824 12.106 -0.581 1.00 10.00 H new ATOM 0 HA LYS A 449 1.135 11.355 -1.341 1.00 10.00 H new ATOM 0 HB2 LYS A 449 0.768 13.950 -2.054 1.00 10.00 H new ATOM 0 HB3 LYS A 449 2.298 14.114 -1.216 1.00 10.00 H new ATOM 0 HG2 LYS A 449 1.824 12.105 -3.445 1.00 10.00 H new ATOM 0 HG3 LYS A 449 2.453 13.718 -3.716 1.00 10.00 H new ATOM 0 HD2 LYS A 449 4.370 13.242 -2.218 1.00 10.00 H new ATOM 0 HD3 LYS A 449 3.732 11.643 -1.890 1.00 10.00 H new ATOM 0 HE2 LYS A 449 4.206 12.465 -4.753 1.00 10.00 H new ATOM 0 HE3 LYS A 449 5.580 12.020 -3.761 1.00 10.00 H new ATOM 0 HZ1 LYS A 449 4.712 10.119 -4.957 1.00 10.00 H new ATOM 0 HZ2 LYS A 449 4.514 9.892 -3.285 1.00 10.00 H new ATOM 0 HZ3 LYS A 449 3.183 10.323 -4.247 1.00 10.00 H new ATOM 631 N ASN A 450 2.588 10.818 0.612 1.00 10.00 N ATOM 632 CA ASN A 450 3.615 10.489 1.591 1.00 10.00 C ATOM 633 C ASN A 450 4.299 9.175 1.247 1.00 10.00 C ATOM 634 O ASN A 450 5.523 9.111 1.121 1.00 10.00 O ATOM 635 CB ASN A 450 3.015 10.413 3.001 1.00 10.00 C ATOM 636 CG ASN A 450 1.795 9.513 3.067 1.00 10.00 C ATOM 637 OD1 ASN A 450 0.955 9.527 2.168 1.00 10.00 O ATOM 638 ND2 ASN A 450 1.692 8.716 4.131 1.00 10.00 N ATOM 0 H ASN A 450 2.084 10.013 0.241 1.00 10.00 H new ATOM 0 HA ASN A 450 4.361 11.283 1.567 1.00 10.00 H new ATOM 0 HB2 ASN A 450 3.771 10.045 3.695 1.00 10.00 H new ATOM 0 HB3 ASN A 450 2.741 11.415 3.330 1.00 10.00 H new ATOM 0 HD21 ASN A 450 0.894 8.087 4.222 1.00 10.00 H new ATOM 0 HD22 ASN A 450 2.411 8.735 4.854 1.00 10.00 H new ATOM 645 N PHE A 451 3.503 8.121 1.118 1.00 10.00 N ATOM 646 CA PHE A 451 4.023 6.794 0.812 1.00 10.00 C ATOM 647 C PHE A 451 4.974 6.308 1.909 1.00 10.00 C ATOM 648 O PHE A 451 5.560 5.234 1.797 1.00 10.00 O ATOM 649 CB PHE A 451 4.739 6.789 -0.543 1.00 10.00 C ATOM 650 CG PHE A 451 3.908 6.270 -1.689 1.00 10.00 C ATOM 651 CD1 PHE A 451 2.887 5.352 -1.480 1.00 10.00 C ATOM 652 CD2 PHE A 451 4.157 6.699 -2.984 1.00 10.00 C ATOM 653 CE1 PHE A 451 2.133 4.881 -2.535 1.00 10.00 C ATOM 654 CE2 PHE A 451 3.406 6.227 -4.043 1.00 10.00 C ATOM 655 CZ PHE A 451 2.391 5.317 -3.818 1.00 10.00 C ATOM 0 H PHE A 451 2.489 8.160 1.221 1.00 10.00 H new ATOM 0 HA PHE A 451 3.175 6.111 0.763 1.00 10.00 H new ATOM 0 HB2 PHE A 451 5.059 7.805 -0.774 1.00 10.00 H new ATOM 0 HB3 PHE A 451 5.641 6.182 -0.461 1.00 10.00 H new ATOM 0 HD1 PHE A 451 2.681 5.002 -0.479 1.00 10.00 H new ATOM 0 HD2 PHE A 451 4.948 7.411 -3.167 1.00 10.00 H new ATOM 0 HE1 PHE A 451 1.340 4.170 -2.356 1.00 10.00 H new ATOM 0 HE2 PHE A 451 3.612 6.569 -5.046 1.00 10.00 H new ATOM 0 HZ PHE A 451 1.801 4.948 -4.644 1.00 10.00 H new ATOM 665 N GLY A 452 5.109 7.096 2.975 1.00 10.00 N ATOM 666 CA GLY A 452 5.971 6.715 4.075 1.00 10.00 C ATOM 667 C GLY A 452 5.204 5.947 5.125 1.00 10.00 C ATOM 668 O GLY A 452 5.698 4.962 5.673 1.00 10.00 O ATOM 0 H GLY A 452 4.635 7.991 3.093 1.00 10.00 H new ATOM 0 HA2 GLY A 452 6.794 6.105 3.702 1.00 10.00 H new ATOM 0 HA3 GLY A 452 6.412 7.606 4.521 1.00 10.00 H new ATOM 672 N LEU A 453 3.978 6.391 5.391 1.00 10.00 N ATOM 673 CA LEU A 453 3.127 5.726 6.364 1.00 10.00 C ATOM 674 C LEU A 453 2.602 4.426 5.783 1.00 10.00 C ATOM 675 O LEU A 453 2.689 3.369 6.408 1.00 10.00 O ATOM 676 CB LEU A 453 1.956 6.619 6.772 1.00 10.00 C ATOM 677 CG LEU A 453 0.905 5.921 7.635 1.00 10.00 C ATOM 678 CD1 LEU A 453 0.314 6.885 8.649 1.00 10.00 C ATOM 679 CD2 LEU A 453 -0.183 5.307 6.762 1.00 10.00 C ATOM 0 H LEU A 453 3.556 7.206 4.946 1.00 10.00 H new ATOM 0 HA LEU A 453 3.723 5.516 7.252 1.00 10.00 H new ATOM 0 HB2 LEU A 453 2.343 7.480 7.317 1.00 10.00 H new ATOM 0 HB3 LEU A 453 1.475 7.001 5.872 1.00 10.00 H new ATOM 0 HG LEU A 453 1.391 5.115 8.185 1.00 10.00 H new ATOM 0 HD11 LEU A 453 -0.432 6.367 9.252 1.00 10.00 H new ATOM 0 HD12 LEU A 453 1.106 7.263 9.296 1.00 10.00 H new ATOM 0 HD13 LEU A 453 -0.157 7.718 8.127 1.00 10.00 H new ATOM 0 HD21 LEU A 453 -0.922 4.815 7.394 1.00 10.00 H new ATOM 0 HD22 LEU A 453 -0.668 6.091 6.180 1.00 10.00 H new ATOM 0 HD23 LEU A 453 0.262 4.576 6.087 1.00 10.00 H new ATOM 691 N ILE A 454 2.067 4.507 4.571 1.00 10.00 N ATOM 692 CA ILE A 454 1.545 3.334 3.899 1.00 10.00 C ATOM 693 C ILE A 454 2.649 2.310 3.730 1.00 10.00 C ATOM 694 O ILE A 454 2.555 1.192 4.231 1.00 10.00 O ATOM 695 CB ILE A 454 0.932 3.709 2.540 1.00 10.00 C ATOM 696 CG1 ILE A 454 -0.401 4.390 2.780 1.00 10.00 C ATOM 697 CG2 ILE A 454 0.766 2.490 1.640 1.00 10.00 C ATOM 698 CD1 ILE A 454 -0.296 5.895 2.724 1.00 10.00 C ATOM 0 H ILE A 454 1.985 5.373 4.038 1.00 10.00 H new ATOM 0 HA ILE A 454 0.753 2.901 4.510 1.00 10.00 H new ATOM 0 HB ILE A 454 1.607 4.390 2.022 1.00 10.00 H new ATOM 0 HG12 ILE A 454 -1.119 4.050 2.034 1.00 10.00 H new ATOM 0 HG13 ILE A 454 -0.788 4.091 3.754 1.00 10.00 H new ATOM 0 HG21 ILE A 454 0.330 2.796 0.689 1.00 10.00 H new ATOM 0 HG22 ILE A 454 1.740 2.034 1.462 1.00 10.00 H new ATOM 0 HG23 ILE A 454 0.109 1.767 2.124 1.00 10.00 H new ATOM 0 HD11 ILE A 454 -1.277 6.335 2.902 1.00 10.00 H new ATOM 0 HD12 ILE A 454 0.400 6.240 3.488 1.00 10.00 H new ATOM 0 HD13 ILE A 454 0.065 6.198 1.741 1.00 10.00 H new ATOM 710 N ALA A 455 3.718 2.723 3.067 1.00 10.00 N ATOM 711 CA ALA A 455 4.874 1.861 2.870 1.00 10.00 C ATOM 712 C ALA A 455 5.452 1.422 4.214 1.00 10.00 C ATOM 713 O ALA A 455 6.324 0.555 4.271 1.00 10.00 O ATOM 714 CB ALA A 455 5.934 2.574 2.046 1.00 10.00 C ATOM 0 H ALA A 455 3.809 3.652 2.655 1.00 10.00 H new ATOM 0 HA ALA A 455 4.551 0.973 2.327 1.00 10.00 H new ATOM 0 HB1 ALA A 455 6.792 1.915 1.908 1.00 10.00 H new ATOM 0 HB2 ALA A 455 5.521 2.840 1.073 1.00 10.00 H new ATOM 0 HB3 ALA A 455 6.251 3.478 2.565 1.00 10.00 H new ATOM 720 N SER A 456 4.959 2.026 5.300 1.00 10.00 N ATOM 721 CA SER A 456 5.432 1.690 6.636 1.00 10.00 C ATOM 722 C SER A 456 4.528 0.651 7.292 1.00 10.00 C ATOM 723 O SER A 456 5.001 -0.203 8.042 1.00 10.00 O ATOM 724 CB SER A 456 5.509 2.946 7.509 1.00 10.00 C ATOM 725 OG SER A 456 5.553 2.610 8.885 1.00 10.00 O ATOM 0 H SER A 456 4.237 2.746 5.275 1.00 10.00 H new ATOM 0 HA SER A 456 6.431 1.264 6.541 1.00 10.00 H new ATOM 0 HB2 SER A 456 6.395 3.523 7.244 1.00 10.00 H new ATOM 0 HB3 SER A 456 4.645 3.581 7.314 1.00 10.00 H new ATOM 0 HG SER A 456 5.603 3.429 9.420 1.00 10.00 H new ATOM 731 N PHE A 457 3.228 0.717 7.007 1.00 10.00 N ATOM 732 CA PHE A 457 2.287 -0.236 7.583 1.00 10.00 C ATOM 733 C PHE A 457 2.244 -1.518 6.749 1.00 10.00 C ATOM 734 O PHE A 457 2.026 -2.607 7.278 1.00 10.00 O ATOM 735 CB PHE A 457 0.892 0.396 7.737 1.00 10.00 C ATOM 736 CG PHE A 457 0.013 0.312 6.519 1.00 10.00 C ATOM 737 CD1 PHE A 457 -0.489 -0.909 6.094 1.00 10.00 C ATOM 738 CD2 PHE A 457 -0.319 1.454 5.804 1.00 10.00 C ATOM 739 CE1 PHE A 457 -1.302 -0.990 4.985 1.00 10.00 C ATOM 740 CE2 PHE A 457 -1.133 1.377 4.692 1.00 10.00 C ATOM 741 CZ PHE A 457 -1.625 0.156 4.282 1.00 10.00 C ATOM 0 H PHE A 457 2.809 1.412 6.389 1.00 10.00 H new ATOM 0 HA PHE A 457 2.631 -0.505 8.582 1.00 10.00 H new ATOM 0 HB2 PHE A 457 0.381 -0.089 8.569 1.00 10.00 H new ATOM 0 HB3 PHE A 457 1.014 1.445 8.006 1.00 10.00 H new ATOM 0 HD1 PHE A 457 -0.239 -1.807 6.639 1.00 10.00 H new ATOM 0 HD2 PHE A 457 0.064 2.413 6.121 1.00 10.00 H new ATOM 0 HE1 PHE A 457 -1.687 -1.947 4.665 1.00 10.00 H new ATOM 0 HE2 PHE A 457 -1.384 2.273 4.143 1.00 10.00 H new ATOM 0 HZ PHE A 457 -2.262 0.095 3.412 1.00 10.00 H new ATOM 751 N LEU A 458 2.485 -1.383 5.444 1.00 10.00 N ATOM 752 CA LEU A 458 2.507 -2.532 4.542 1.00 10.00 C ATOM 753 C LEU A 458 3.916 -2.718 3.982 1.00 10.00 C ATOM 754 O LEU A 458 4.117 -2.778 2.772 1.00 10.00 O ATOM 755 CB LEU A 458 1.490 -2.359 3.407 1.00 10.00 C ATOM 756 CG LEU A 458 1.388 -0.948 2.828 1.00 10.00 C ATOM 757 CD1 LEU A 458 2.731 -0.507 2.274 1.00 10.00 C ATOM 758 CD2 LEU A 458 0.316 -0.885 1.746 1.00 10.00 C ATOM 0 H LEU A 458 2.668 -0.488 4.989 1.00 10.00 H new ATOM 0 HA LEU A 458 2.227 -3.424 5.103 1.00 10.00 H new ATOM 0 HB2 LEU A 458 1.749 -3.046 2.602 1.00 10.00 H new ATOM 0 HB3 LEU A 458 0.507 -2.655 3.774 1.00 10.00 H new ATOM 0 HG LEU A 458 1.102 -0.267 3.630 1.00 10.00 H new ATOM 0 HD11 LEU A 458 2.643 0.500 1.865 1.00 10.00 H new ATOM 0 HD12 LEU A 458 3.473 -0.511 3.073 1.00 10.00 H new ATOM 0 HD13 LEU A 458 3.043 -1.193 1.486 1.00 10.00 H new ATOM 0 HD21 LEU A 458 0.260 0.128 1.348 1.00 10.00 H new ATOM 0 HD22 LEU A 458 0.569 -1.577 0.943 1.00 10.00 H new ATOM 0 HD23 LEU A 458 -0.648 -1.161 2.173 1.00 10.00 H new ATOM 770 N GLU A 459 4.879 -2.785 4.901 1.00 10.00 N ATOM 771 CA GLU A 459 6.305 -2.941 4.582 1.00 10.00 C ATOM 772 C GLU A 459 6.548 -3.690 3.275 1.00 10.00 C ATOM 773 O GLU A 459 7.427 -3.319 2.497 1.00 10.00 O ATOM 774 CB GLU A 459 7.017 -3.665 5.725 1.00 10.00 C ATOM 775 CG GLU A 459 7.139 -2.831 6.991 1.00 10.00 C ATOM 776 CD GLU A 459 7.874 -3.559 8.099 1.00 10.00 C ATOM 777 OE1 GLU A 459 8.642 -4.494 7.789 1.00 10.00 O ATOM 778 OE2 GLU A 459 7.683 -3.194 9.279 1.00 10.00 O ATOM 0 H GLU A 459 4.692 -2.732 5.902 1.00 10.00 H new ATOM 0 HA GLU A 459 6.709 -1.937 4.455 1.00 10.00 H new ATOM 0 HB2 GLU A 459 6.476 -4.583 5.955 1.00 10.00 H new ATOM 0 HB3 GLU A 459 8.014 -3.957 5.394 1.00 10.00 H new ATOM 0 HG2 GLU A 459 7.662 -1.903 6.761 1.00 10.00 H new ATOM 0 HG3 GLU A 459 6.143 -2.558 7.339 1.00 10.00 H new ATOM 785 N ARG A 460 5.771 -4.741 3.033 1.00 10.00 N ATOM 786 CA ARG A 460 5.916 -5.532 1.812 1.00 10.00 C ATOM 787 C ARG A 460 6.001 -4.627 0.582 1.00 10.00 C ATOM 788 O ARG A 460 6.567 -5.004 -0.443 1.00 10.00 O ATOM 789 CB ARG A 460 4.744 -6.504 1.666 1.00 10.00 C ATOM 790 CG ARG A 460 4.818 -7.690 2.614 1.00 10.00 C ATOM 791 CD ARG A 460 6.100 -8.482 2.416 1.00 10.00 C ATOM 792 NE ARG A 460 7.188 -7.981 3.252 1.00 10.00 N ATOM 793 CZ ARG A 460 7.241 -8.141 4.573 1.00 10.00 C ATOM 794 NH1 ARG A 460 6.272 -8.785 5.211 1.00 10.00 N ATOM 795 NH2 ARG A 460 8.266 -7.653 5.258 1.00 10.00 N ATOM 0 H ARG A 460 5.037 -5.065 3.662 1.00 10.00 H new ATOM 0 HA ARG A 460 6.843 -6.101 1.886 1.00 10.00 H new ATOM 0 HB2 ARG A 460 3.812 -5.966 1.842 1.00 10.00 H new ATOM 0 HB3 ARG A 460 4.712 -6.871 0.640 1.00 10.00 H new ATOM 0 HG2 ARG A 460 4.762 -7.338 3.644 1.00 10.00 H new ATOM 0 HG3 ARG A 460 3.958 -8.341 2.452 1.00 10.00 H new ATOM 0 HD2 ARG A 460 5.918 -9.531 2.649 1.00 10.00 H new ATOM 0 HD3 ARG A 460 6.397 -8.435 1.368 1.00 10.00 H new ATOM 0 HE ARG A 460 7.951 -7.480 2.798 1.00 10.00 H new ATOM 0 HH11 ARG A 460 5.480 -9.161 4.689 1.00 10.00 H new ATOM 0 HH12 ARG A 460 6.319 -8.904 6.223 1.00 10.00 H new ATOM 0 HH21 ARG A 460 9.013 -7.156 4.773 1.00 10.00 H new ATOM 0 HH22 ARG A 460 8.308 -7.775 6.270 1.00 10.00 H new ATOM 809 N LYS A 461 5.433 -3.430 0.700 1.00 10.00 N ATOM 810 CA LYS A 461 5.440 -2.462 -0.388 1.00 10.00 C ATOM 811 C LYS A 461 6.301 -1.255 -0.023 1.00 10.00 C ATOM 812 O LYS A 461 6.435 -0.911 1.151 1.00 10.00 O ATOM 813 CB LYS A 461 4.010 -2.002 -0.714 1.00 10.00 C ATOM 814 CG LYS A 461 2.912 -2.911 -0.169 1.00 10.00 C ATOM 815 CD LYS A 461 2.405 -3.874 -1.232 1.00 10.00 C ATOM 816 CE LYS A 461 3.488 -4.841 -1.682 1.00 10.00 C ATOM 817 NZ LYS A 461 3.278 -6.206 -1.126 1.00 10.00 N ATOM 0 H LYS A 461 4.960 -3.108 1.544 1.00 10.00 H new ATOM 0 HA LYS A 461 5.862 -2.946 -1.269 1.00 10.00 H new ATOM 0 HB2 LYS A 461 3.865 -0.998 -0.314 1.00 10.00 H new ATOM 0 HB3 LYS A 461 3.902 -1.932 -1.796 1.00 10.00 H new ATOM 0 HG2 LYS A 461 3.294 -3.475 0.682 1.00 10.00 H new ATOM 0 HG3 LYS A 461 2.084 -2.304 0.198 1.00 10.00 H new ATOM 0 HD2 LYS A 461 1.557 -4.435 -0.839 1.00 10.00 H new ATOM 0 HD3 LYS A 461 2.043 -3.309 -2.091 1.00 10.00 H new ATOM 0 HE2 LYS A 461 3.501 -4.890 -2.771 1.00 10.00 H new ATOM 0 HE3 LYS A 461 4.462 -4.467 -1.368 1.00 10.00 H new ATOM 0 HZ1 LYS A 461 4.104 -6.800 -1.342 1.00 10.00 H new ATOM 0 HZ2 LYS A 461 3.155 -6.146 -0.095 1.00 10.00 H new ATOM 0 HZ3 LYS A 461 2.428 -6.627 -1.552 1.00 10.00 H new ATOM 831 N THR A 462 6.885 -0.617 -1.033 1.00 10.00 N ATOM 832 CA THR A 462 7.733 0.551 -0.811 1.00 10.00 C ATOM 833 C THR A 462 7.124 1.795 -1.453 1.00 10.00 C ATOM 834 O THR A 462 6.146 1.706 -2.190 1.00 10.00 O ATOM 835 CB THR A 462 9.136 0.307 -1.370 1.00 10.00 C ATOM 836 OG1 THR A 462 9.328 -1.065 -1.668 1.00 10.00 O ATOM 837 CG2 THR A 462 10.239 0.728 -0.423 1.00 10.00 C ATOM 0 H THR A 462 6.787 -0.888 -2.011 1.00 10.00 H new ATOM 0 HA THR A 462 7.805 0.717 0.264 1.00 10.00 H new ATOM 0 HB THR A 462 9.197 0.919 -2.270 1.00 10.00 H new ATOM 0 HG1 THR A 462 10.231 -1.199 -2.026 1.00 10.00 H new ATOM 0 HG21 THR A 462 11.208 0.528 -0.881 1.00 10.00 H new ATOM 0 HG22 THR A 462 10.151 1.794 -0.212 1.00 10.00 H new ATOM 0 HG23 THR A 462 10.154 0.166 0.507 1.00 10.00 H new ATOM 845 N VAL A 463 7.712 2.952 -1.169 1.00 10.00 N ATOM 846 CA VAL A 463 7.223 4.211 -1.723 1.00 10.00 C ATOM 847 C VAL A 463 7.320 4.209 -3.245 1.00 10.00 C ATOM 848 O VAL A 463 6.312 4.329 -3.941 1.00 10.00 O ATOM 849 CB VAL A 463 8.008 5.415 -1.158 1.00 10.00 C ATOM 850 CG1 VAL A 463 7.553 6.720 -1.804 1.00 10.00 C ATOM 851 CG2 VAL A 463 7.865 5.484 0.358 1.00 10.00 C ATOM 0 H VAL A 463 8.525 3.045 -0.561 1.00 10.00 H new ATOM 0 HA VAL A 463 6.177 4.308 -1.432 1.00 10.00 H new ATOM 0 HB VAL A 463 9.062 5.273 -1.398 1.00 10.00 H new ATOM 0 HG11 VAL A 463 8.123 7.550 -1.387 1.00 10.00 H new ATOM 0 HG12 VAL A 463 7.719 6.670 -2.880 1.00 10.00 H new ATOM 0 HG13 VAL A 463 6.492 6.873 -1.607 1.00 10.00 H new ATOM 0 HG21 VAL A 463 8.425 6.339 0.738 1.00 10.00 H new ATOM 0 HG22 VAL A 463 6.813 5.594 0.620 1.00 10.00 H new ATOM 0 HG23 VAL A 463 8.255 4.568 0.802 1.00 10.00 H new ATOM 861 N ALA A 464 8.538 4.068 -3.756 1.00 10.00 N ATOM 862 CA ALA A 464 8.760 4.046 -5.196 1.00 10.00 C ATOM 863 C ALA A 464 8.265 2.740 -5.814 1.00 10.00 C ATOM 864 O ALA A 464 8.246 2.592 -7.036 1.00 10.00 O ATOM 865 CB ALA A 464 10.235 4.251 -5.503 1.00 10.00 C ATOM 0 H ALA A 464 9.384 3.968 -3.196 1.00 10.00 H new ATOM 0 HA ALA A 464 8.189 4.862 -5.638 1.00 10.00 H new ATOM 0 HB1 ALA A 464 10.388 4.233 -6.582 1.00 10.00 H new ATOM 0 HB2 ALA A 464 10.559 5.214 -5.107 1.00 10.00 H new ATOM 0 HB3 ALA A 464 10.817 3.454 -5.040 1.00 10.00 H new ATOM 871 N GLU A 465 7.869 1.791 -4.966 1.00 10.00 N ATOM 872 CA GLU A 465 7.382 0.501 -5.440 1.00 10.00 C ATOM 873 C GLU A 465 5.860 0.406 -5.343 1.00 10.00 C ATOM 874 O GLU A 465 5.247 -0.442 -5.991 1.00 10.00 O ATOM 875 CB GLU A 465 8.025 -0.632 -4.637 1.00 10.00 C ATOM 876 CG GLU A 465 7.593 -2.018 -5.087 1.00 10.00 C ATOM 877 CD GLU A 465 8.184 -3.121 -4.230 1.00 10.00 C ATOM 878 OE1 GLU A 465 9.425 -3.270 -4.227 1.00 10.00 O ATOM 879 OE2 GLU A 465 7.407 -3.834 -3.562 1.00 10.00 O ATOM 0 H GLU A 465 7.877 1.893 -3.951 1.00 10.00 H new ATOM 0 HA GLU A 465 7.660 0.407 -6.490 1.00 10.00 H new ATOM 0 HB2 GLU A 465 9.109 -0.554 -4.719 1.00 10.00 H new ATOM 0 HB3 GLU A 465 7.775 -0.507 -3.583 1.00 10.00 H new ATOM 0 HG2 GLU A 465 6.505 -2.083 -5.057 1.00 10.00 H new ATOM 0 HG3 GLU A 465 7.893 -2.169 -6.124 1.00 10.00 H new ATOM 886 N CYS A 466 5.249 1.274 -4.537 1.00 10.00 N ATOM 887 CA CYS A 466 3.799 1.260 -4.380 1.00 10.00 C ATOM 888 C CYS A 466 3.125 2.034 -5.505 1.00 10.00 C ATOM 889 O CYS A 466 1.979 1.754 -5.856 1.00 10.00 O ATOM 890 CB CYS A 466 3.395 1.842 -3.023 1.00 10.00 C ATOM 891 SG CYS A 466 1.663 1.559 -2.590 1.00 10.00 S ATOM 0 H CYS A 466 5.731 1.987 -3.989 1.00 10.00 H new ATOM 0 HA CYS A 466 3.467 0.223 -4.426 1.00 10.00 H new ATOM 0 HB2 CYS A 466 4.028 1.407 -2.249 1.00 10.00 H new ATOM 0 HB3 CYS A 466 3.588 2.915 -3.027 1.00 10.00 H new ATOM 0 HG CYS A 466 1.329 0.344 -2.910 1.00 10.00 H new ATOM 897 N VAL A 467 3.845 2.997 -6.085 1.00 10.00 N ATOM 898 CA VAL A 467 3.305 3.788 -7.187 1.00 10.00 C ATOM 899 C VAL A 467 2.659 2.876 -8.215 1.00 10.00 C ATOM 900 O VAL A 467 1.695 3.251 -8.876 1.00 10.00 O ATOM 901 CB VAL A 467 4.403 4.623 -7.884 1.00 10.00 C ATOM 902 CG1 VAL A 467 3.887 5.223 -9.190 1.00 10.00 C ATOM 903 CG2 VAL A 467 4.916 5.712 -6.956 1.00 10.00 C ATOM 0 H VAL A 467 4.796 3.245 -5.811 1.00 10.00 H new ATOM 0 HA VAL A 467 2.565 4.468 -6.765 1.00 10.00 H new ATOM 0 HB VAL A 467 5.233 3.959 -8.125 1.00 10.00 H new ATOM 0 HG11 VAL A 467 4.679 5.806 -9.661 1.00 10.00 H new ATOM 0 HG12 VAL A 467 3.578 4.422 -9.861 1.00 10.00 H new ATOM 0 HG13 VAL A 467 3.035 5.870 -8.981 1.00 10.00 H new ATOM 0 HG21 VAL A 467 5.688 6.289 -7.464 1.00 10.00 H new ATOM 0 HG22 VAL A 467 4.093 6.371 -6.679 1.00 10.00 H new ATOM 0 HG23 VAL A 467 5.335 5.257 -6.058 1.00 10.00 H new ATOM 913 N LEU A 468 3.196 1.671 -8.336 1.00 10.00 N ATOM 914 CA LEU A 468 2.674 0.701 -9.279 1.00 10.00 C ATOM 915 C LEU A 468 1.162 0.576 -9.143 1.00 10.00 C ATOM 916 O LEU A 468 0.437 0.534 -10.136 1.00 10.00 O ATOM 917 CB LEU A 468 3.338 -0.660 -9.053 1.00 10.00 C ATOM 918 CG LEU A 468 3.776 -1.389 -10.323 1.00 10.00 C ATOM 919 CD1 LEU A 468 5.061 -0.786 -10.869 1.00 10.00 C ATOM 920 CD2 LEU A 468 3.957 -2.874 -10.048 1.00 10.00 C ATOM 0 H LEU A 468 3.994 1.344 -7.791 1.00 10.00 H new ATOM 0 HA LEU A 468 2.900 1.045 -10.288 1.00 10.00 H new ATOM 0 HB2 LEU A 468 4.210 -0.519 -8.415 1.00 10.00 H new ATOM 0 HB3 LEU A 468 2.644 -1.299 -8.507 1.00 10.00 H new ATOM 0 HG LEU A 468 2.996 -1.271 -11.075 1.00 10.00 H new ATOM 0 HD11 LEU A 468 5.357 -1.318 -11.773 1.00 10.00 H new ATOM 0 HD12 LEU A 468 4.898 0.266 -11.104 1.00 10.00 H new ATOM 0 HD13 LEU A 468 5.850 -0.873 -10.122 1.00 10.00 H new ATOM 0 HD21 LEU A 468 4.269 -3.378 -10.963 1.00 10.00 H new ATOM 0 HD22 LEU A 468 4.718 -3.012 -9.280 1.00 10.00 H new ATOM 0 HD23 LEU A 468 3.014 -3.298 -9.704 1.00 10.00 H new ATOM 932 N TYR A 469 0.703 0.518 -7.899 1.00 10.00 N ATOM 933 CA TYR A 469 -0.717 0.387 -7.599 1.00 10.00 C ATOM 934 C TYR A 469 -1.476 1.695 -7.836 1.00 10.00 C ATOM 935 O TYR A 469 -2.703 1.730 -7.760 1.00 10.00 O ATOM 936 CB TYR A 469 -0.905 -0.116 -6.157 1.00 10.00 C ATOM 937 CG TYR A 469 -1.330 0.910 -5.130 1.00 10.00 C ATOM 938 CD1 TYR A 469 -0.827 2.201 -5.166 1.00 10.00 C ATOM 939 CD2 TYR A 469 -2.230 0.581 -4.116 1.00 10.00 C ATOM 940 CE1 TYR A 469 -1.202 3.143 -4.232 1.00 10.00 C ATOM 941 CE2 TYR A 469 -2.610 1.523 -3.179 1.00 10.00 C ATOM 942 CZ TYR A 469 -2.095 2.801 -3.243 1.00 10.00 C ATOM 943 OH TYR A 469 -2.465 3.737 -2.308 1.00 10.00 O ATOM 0 H TYR A 469 1.301 0.560 -7.074 1.00 10.00 H new ATOM 0 HA TYR A 469 -1.141 -0.347 -8.284 1.00 10.00 H new ATOM 0 HB2 TYR A 469 -1.648 -0.914 -6.169 1.00 10.00 H new ATOM 0 HB3 TYR A 469 0.034 -0.560 -5.826 1.00 10.00 H new ATOM 0 HD1 TYR A 469 -0.127 2.475 -5.942 1.00 10.00 H new ATOM 0 HD2 TYR A 469 -2.634 -0.419 -4.063 1.00 10.00 H new ATOM 0 HE1 TYR A 469 -0.797 4.143 -4.276 1.00 10.00 H new ATOM 0 HE2 TYR A 469 -3.308 1.259 -2.399 1.00 10.00 H new ATOM 0 HH TYR A 469 -1.943 3.605 -1.489 1.00 10.00 H new ATOM 953 N TYR A 470 -0.742 2.773 -8.110 1.00 10.00 N ATOM 954 CA TYR A 470 -1.356 4.073 -8.338 1.00 10.00 C ATOM 955 C TYR A 470 -1.745 4.249 -9.803 1.00 10.00 C ATOM 956 O TYR A 470 -2.543 5.125 -10.137 1.00 10.00 O ATOM 957 CB TYR A 470 -0.406 5.193 -7.873 1.00 10.00 C ATOM 958 CG TYR A 470 0.141 6.083 -8.975 1.00 10.00 C ATOM 959 CD1 TYR A 470 0.755 5.542 -10.099 1.00 10.00 C ATOM 960 CD2 TYR A 470 0.048 7.466 -8.884 1.00 10.00 C ATOM 961 CE1 TYR A 470 1.258 6.350 -11.097 1.00 10.00 C ATOM 962 CE2 TYR A 470 0.550 8.282 -9.879 1.00 10.00 C ATOM 963 CZ TYR A 470 1.155 7.720 -10.983 1.00 10.00 C ATOM 964 OH TYR A 470 1.656 8.530 -11.977 1.00 10.00 O ATOM 0 H TYR A 470 0.276 2.768 -8.179 1.00 10.00 H new ATOM 0 HA TYR A 470 -2.273 4.132 -7.751 1.00 10.00 H new ATOM 0 HB2 TYR A 470 -0.934 5.818 -7.153 1.00 10.00 H new ATOM 0 HB3 TYR A 470 0.433 4.739 -7.346 1.00 10.00 H new ATOM 0 HD1 TYR A 470 0.840 4.469 -10.192 1.00 10.00 H new ATOM 0 HD2 TYR A 470 -0.425 7.911 -8.021 1.00 10.00 H new ATOM 0 HE1 TYR A 470 1.730 5.912 -11.964 1.00 10.00 H new ATOM 0 HE2 TYR A 470 0.469 9.355 -9.793 1.00 10.00 H new ATOM 0 HH TYR A 470 1.501 9.469 -11.743 1.00 10.00 H new ATOM 974 N TYR A 471 -1.186 3.414 -10.676 1.00 10.00 N ATOM 975 CA TYR A 471 -1.499 3.503 -12.096 1.00 10.00 C ATOM 976 C TYR A 471 -2.444 2.383 -12.516 1.00 10.00 C ATOM 977 O TYR A 471 -3.057 2.444 -13.580 1.00 10.00 O ATOM 978 CB TYR A 471 -0.218 3.490 -12.941 1.00 10.00 C ATOM 979 CG TYR A 471 0.465 2.143 -13.039 1.00 10.00 C ATOM 980 CD1 TYR A 471 -0.071 1.125 -13.821 1.00 10.00 C ATOM 981 CD2 TYR A 471 1.654 1.895 -12.363 1.00 10.00 C ATOM 982 CE1 TYR A 471 0.558 -0.101 -13.924 1.00 10.00 C ATOM 983 CE2 TYR A 471 2.288 0.670 -12.466 1.00 10.00 C ATOM 984 CZ TYR A 471 1.735 -0.323 -13.247 1.00 10.00 C ATOM 985 OH TYR A 471 2.366 -1.542 -13.350 1.00 10.00 O ATOM 0 H TYR A 471 -0.524 2.679 -10.428 1.00 10.00 H new ATOM 0 HA TYR A 471 -2.006 4.452 -12.271 1.00 10.00 H new ATOM 0 HB2 TYR A 471 -0.460 3.833 -13.947 1.00 10.00 H new ATOM 0 HB3 TYR A 471 0.485 4.208 -12.520 1.00 10.00 H new ATOM 0 HD1 TYR A 471 -0.993 1.296 -14.356 1.00 10.00 H new ATOM 0 HD2 TYR A 471 2.089 2.670 -11.749 1.00 10.00 H new ATOM 0 HE1 TYR A 471 0.127 -0.882 -14.533 1.00 10.00 H new ATOM 0 HE2 TYR A 471 3.212 0.492 -11.937 1.00 10.00 H new ATOM 0 HH TYR A 471 3.333 -1.419 -13.251 1.00 10.00 H new ATOM 995 N LEU A 472 -2.575 1.370 -11.663 1.00 10.00 N ATOM 996 CA LEU A 472 -3.468 0.255 -11.944 1.00 10.00 C ATOM 997 C LEU A 472 -4.855 0.519 -11.359 1.00 10.00 C ATOM 998 O LEU A 472 -5.840 -0.100 -11.763 1.00 10.00 O ATOM 999 CB LEU A 472 -2.888 -1.040 -11.382 1.00 10.00 C ATOM 1000 CG LEU A 472 -1.429 -1.289 -11.758 1.00 10.00 C ATOM 1001 CD1 LEU A 472 -0.669 -1.885 -10.588 1.00 10.00 C ATOM 1002 CD2 LEU A 472 -1.341 -2.192 -12.978 1.00 10.00 C ATOM 0 H LEU A 472 -2.076 1.300 -10.776 1.00 10.00 H new ATOM 0 HA LEU A 472 -3.566 0.152 -13.025 1.00 10.00 H new ATOM 0 HB2 LEU A 472 -2.973 -1.021 -10.295 1.00 10.00 H new ATOM 0 HB3 LEU A 472 -3.490 -1.877 -11.735 1.00 10.00 H new ATOM 0 HG LEU A 472 -0.969 -0.333 -12.008 1.00 10.00 H new ATOM 0 HD11 LEU A 472 0.368 -2.055 -10.877 1.00 10.00 H new ATOM 0 HD12 LEU A 472 -0.703 -1.197 -9.744 1.00 10.00 H new ATOM 0 HD13 LEU A 472 -1.126 -2.832 -10.302 1.00 10.00 H new ATOM 0 HD21 LEU A 472 -0.294 -2.359 -13.232 1.00 10.00 H new ATOM 0 HD22 LEU A 472 -1.818 -3.147 -12.759 1.00 10.00 H new ATOM 0 HD23 LEU A 472 -1.847 -1.718 -13.819 1.00 10.00 H new ATOM 1014 N THR A 473 -4.923 1.456 -10.416 1.00 10.00 N ATOM 1015 CA THR A 473 -6.184 1.822 -9.785 1.00 10.00 C ATOM 1016 C THR A 473 -6.971 2.768 -10.683 1.00 10.00 C ATOM 1017 O THR A 473 -8.202 2.787 -10.660 1.00 10.00 O ATOM 1018 CB THR A 473 -5.928 2.486 -8.429 1.00 10.00 C ATOM 1019 OG1 THR A 473 -4.985 3.538 -8.554 1.00 10.00 O ATOM 1020 CG2 THR A 473 -5.413 1.529 -7.375 1.00 10.00 C ATOM 0 H THR A 473 -4.115 1.976 -10.073 1.00 10.00 H new ATOM 0 HA THR A 473 -6.767 0.914 -9.630 1.00 10.00 H new ATOM 0 HB THR A 473 -6.899 2.862 -8.107 1.00 10.00 H new ATOM 0 HG1 THR A 473 -5.357 4.358 -8.168 1.00 10.00 H new ATOM 0 HG21 THR A 473 -5.254 2.068 -6.441 1.00 10.00 H new ATOM 0 HG22 THR A 473 -6.143 0.735 -7.216 1.00 10.00 H new ATOM 0 HG23 THR A 473 -4.471 1.094 -7.708 1.00 10.00 H new ATOM 1028 N LYS A 474 -6.249 3.558 -11.472 1.00 10.00 N ATOM 1029 CA LYS A 474 -6.871 4.516 -12.377 1.00 10.00 C ATOM 1030 C LYS A 474 -7.101 3.909 -13.758 1.00 10.00 C ATOM 1031 O LYS A 474 -7.924 4.401 -14.531 1.00 10.00 O ATOM 1032 CB LYS A 474 -5.996 5.765 -12.496 1.00 10.00 C ATOM 1033 CG LYS A 474 -4.661 5.512 -13.174 1.00 10.00 C ATOM 1034 CD LYS A 474 -3.709 6.682 -12.985 1.00 10.00 C ATOM 1035 CE LYS A 474 -2.435 6.500 -13.794 1.00 10.00 C ATOM 1036 NZ LYS A 474 -2.479 7.255 -15.077 1.00 10.00 N ATOM 0 H LYS A 474 -5.229 3.553 -11.502 1.00 10.00 H new ATOM 0 HA LYS A 474 -7.842 4.789 -11.963 1.00 10.00 H new ATOM 0 HB2 LYS A 474 -6.539 6.527 -13.056 1.00 10.00 H new ATOM 0 HB3 LYS A 474 -5.817 6.169 -11.500 1.00 10.00 H new ATOM 0 HG2 LYS A 474 -4.211 4.606 -12.767 1.00 10.00 H new ATOM 0 HG3 LYS A 474 -4.819 5.339 -14.238 1.00 10.00 H new ATOM 0 HD2 LYS A 474 -4.203 7.606 -13.285 1.00 10.00 H new ATOM 0 HD3 LYS A 474 -3.459 6.782 -11.929 1.00 10.00 H new ATOM 0 HE2 LYS A 474 -1.580 6.834 -13.205 1.00 10.00 H new ATOM 0 HE3 LYS A 474 -2.285 5.440 -14.001 1.00 10.00 H new ATOM 0 HZ1 LYS A 474 -1.856 6.796 -15.771 1.00 10.00 H new ATOM 0 HZ2 LYS A 474 -3.453 7.266 -15.440 1.00 10.00 H new ATOM 0 HZ3 LYS A 474 -2.159 8.231 -14.916 1.00 10.00 H new ATOM 1050 N LYS A 475 -6.375 2.839 -14.068 1.00 10.00 N ATOM 1051 CA LYS A 475 -6.510 2.176 -15.360 1.00 10.00 C ATOM 1052 C LYS A 475 -7.959 1.768 -15.623 1.00 10.00 C ATOM 1053 O LYS A 475 -8.370 1.614 -16.773 1.00 10.00 O ATOM 1054 CB LYS A 475 -5.601 0.946 -15.423 1.00 10.00 C ATOM 1055 CG LYS A 475 -6.029 -0.179 -14.493 1.00 10.00 C ATOM 1056 CD LYS A 475 -6.661 -1.329 -15.261 1.00 10.00 C ATOM 1057 CE LYS A 475 -7.105 -2.444 -14.327 1.00 10.00 C ATOM 1058 NZ LYS A 475 -7.572 -3.643 -15.076 1.00 10.00 N ATOM 0 H LYS A 475 -5.689 2.414 -13.444 1.00 10.00 H new ATOM 0 HA LYS A 475 -6.209 2.884 -16.133 1.00 10.00 H new ATOM 0 HB2 LYS A 475 -5.581 0.572 -16.447 1.00 10.00 H new ATOM 0 HB3 LYS A 475 -4.583 1.244 -15.173 1.00 10.00 H new ATOM 0 HG2 LYS A 475 -5.164 -0.543 -13.939 1.00 10.00 H new ATOM 0 HG3 LYS A 475 -6.739 0.204 -13.760 1.00 10.00 H new ATOM 0 HD2 LYS A 475 -7.518 -0.963 -15.826 1.00 10.00 H new ATOM 0 HD3 LYS A 475 -5.946 -1.722 -15.984 1.00 10.00 H new ATOM 0 HE2 LYS A 475 -6.277 -2.723 -13.675 1.00 10.00 H new ATOM 0 HE3 LYS A 475 -7.908 -2.082 -13.685 1.00 10.00 H new ATOM 0 HZ1 LYS A 475 -7.866 -4.380 -14.403 1.00 10.00 H new ATOM 0 HZ2 LYS A 475 -8.379 -3.383 -15.679 1.00 10.00 H new ATOM 0 HZ3 LYS A 475 -6.798 -4.005 -15.670 1.00 10.00 H new ATOM 1072 N ASN A 476 -8.728 1.589 -14.552 1.00 10.00 N ATOM 1073 CA ASN A 476 -10.127 1.191 -14.675 1.00 10.00 C ATOM 1074 C ASN A 476 -11.061 2.185 -13.985 1.00 10.00 C ATOM 1075 O ASN A 476 -12.230 2.303 -14.352 1.00 10.00 O ATOM 1076 CB ASN A 476 -10.331 -0.206 -14.087 1.00 10.00 C ATOM 1077 CG ASN A 476 -11.535 -0.912 -14.680 1.00 10.00 C ATOM 1078 OD1 ASN A 476 -11.432 -1.586 -15.705 1.00 10.00 O ATOM 1079 ND2 ASN A 476 -12.686 -0.760 -14.035 1.00 10.00 N ATOM 0 H ASN A 476 -8.407 1.713 -13.592 1.00 10.00 H new ATOM 0 HA ASN A 476 -10.374 1.180 -15.737 1.00 10.00 H new ATOM 0 HB2 ASN A 476 -9.438 -0.806 -14.264 1.00 10.00 H new ATOM 0 HB3 ASN A 476 -10.454 -0.128 -13.007 1.00 10.00 H new ATOM 0 HD21 ASN A 476 -13.531 -1.211 -14.386 1.00 10.00 H new ATOM 0 HD22 ASN A 476 -12.725 -0.192 -13.189 1.00 10.00 H new ATOM 1086 N GLU A 477 -10.549 2.893 -12.981 1.00 10.00 N ATOM 1087 CA GLU A 477 -11.355 3.864 -12.247 1.00 10.00 C ATOM 1088 C GLU A 477 -11.179 5.269 -12.816 1.00 10.00 C ATOM 1089 O GLU A 477 -12.096 6.088 -12.767 1.00 10.00 O ATOM 1090 CB GLU A 477 -10.981 3.852 -10.765 1.00 10.00 C ATOM 1091 CG GLU A 477 -11.119 2.485 -10.114 1.00 10.00 C ATOM 1092 CD GLU A 477 -10.435 2.410 -8.764 1.00 10.00 C ATOM 1093 OE1 GLU A 477 -10.727 3.266 -7.902 1.00 10.00 O ATOM 1094 OE2 GLU A 477 -9.607 1.496 -8.568 1.00 10.00 O ATOM 0 H GLU A 477 -9.585 2.813 -12.659 1.00 10.00 H new ATOM 0 HA GLU A 477 -12.402 3.580 -12.355 1.00 10.00 H new ATOM 0 HB2 GLU A 477 -9.952 4.195 -10.656 1.00 10.00 H new ATOM 0 HB3 GLU A 477 -11.613 4.564 -10.234 1.00 10.00 H new ATOM 0 HG2 GLU A 477 -12.176 2.249 -9.995 1.00 10.00 H new ATOM 0 HG3 GLU A 477 -10.696 1.728 -10.774 1.00 10.00 H new ATOM 1101 N ASN A 478 -9.995 5.541 -13.352 1.00 10.00 N ATOM 1102 CA ASN A 478 -9.697 6.847 -13.927 1.00 10.00 C ATOM 1103 C ASN A 478 -9.813 7.943 -12.871 1.00 10.00 C ATOM 1104 O ASN A 478 -10.835 8.622 -12.776 1.00 10.00 O ATOM 1105 CB ASN A 478 -10.643 7.144 -15.092 1.00 10.00 C ATOM 1106 CG ASN A 478 -10.197 6.482 -16.381 1.00 10.00 C ATOM 1107 OD1 ASN A 478 -10.646 5.387 -16.717 1.00 10.00 O ATOM 1108 ND2 ASN A 478 -9.308 7.146 -17.110 1.00 10.00 N ATOM 0 H ASN A 478 -9.225 4.874 -13.400 1.00 10.00 H new ATOM 0 HA ASN A 478 -8.672 6.828 -14.297 1.00 10.00 H new ATOM 0 HB2 ASN A 478 -11.646 6.801 -14.839 1.00 10.00 H new ATOM 0 HB3 ASN A 478 -10.703 8.222 -15.242 1.00 10.00 H new ATOM 0 HD21 ASN A 478 -8.970 6.750 -17.987 1.00 10.00 H new ATOM 0 HD22 ASN A 478 -8.963 8.052 -16.793 1.00 10.00 H new ATOM 1115 N TYR A 479 -8.758 8.108 -12.079 1.00 10.00 N ATOM 1116 CA TYR A 479 -8.741 9.120 -11.030 1.00 10.00 C ATOM 1117 C TYR A 479 -7.311 9.551 -10.713 1.00 10.00 C ATOM 1118 O TYR A 479 -6.488 8.742 -10.287 1.00 10.00 O ATOM 1119 CB TYR A 479 -9.424 8.585 -9.767 1.00 10.00 C ATOM 1120 CG TYR A 479 -8.599 7.571 -9.004 1.00 10.00 C ATOM 1121 CD1 TYR A 479 -8.558 6.239 -9.399 1.00 10.00 C ATOM 1122 CD2 TYR A 479 -7.864 7.948 -7.889 1.00 10.00 C ATOM 1123 CE1 TYR A 479 -7.805 5.312 -8.701 1.00 10.00 C ATOM 1124 CE2 TYR A 479 -7.108 7.027 -7.187 1.00 10.00 C ATOM 1125 CZ TYR A 479 -7.083 5.712 -7.597 1.00 10.00 C ATOM 1126 OH TYR A 479 -6.333 4.792 -6.901 1.00 10.00 O ATOM 0 H TYR A 479 -7.904 7.554 -12.144 1.00 10.00 H new ATOM 0 HA TYR A 479 -9.290 9.991 -11.387 1.00 10.00 H new ATOM 0 HB2 TYR A 479 -9.653 9.422 -9.108 1.00 10.00 H new ATOM 0 HB3 TYR A 479 -10.374 8.130 -10.045 1.00 10.00 H new ATOM 0 HD1 TYR A 479 -9.122 5.923 -10.264 1.00 10.00 H new ATOM 0 HD2 TYR A 479 -7.883 8.978 -7.564 1.00 10.00 H new ATOM 0 HE1 TYR A 479 -7.783 4.280 -9.019 1.00 10.00 H new ATOM 0 HE2 TYR A 479 -6.540 7.337 -6.322 1.00 10.00 H new ATOM 0 HH TYR A 479 -5.884 5.236 -6.151 1.00 10.00 H new ATOM 1136 N LYS A 480 -7.026 10.831 -10.923 1.00 10.00 N ATOM 1137 CA LYS A 480 -5.696 11.369 -10.658 1.00 10.00 C ATOM 1138 C LYS A 480 -5.785 12.769 -10.060 1.00 10.00 C ATOM 1139 O LYS A 480 -4.750 13.272 -9.576 1.00 10.00 O ATOM 1140 CB LYS A 480 -4.871 11.403 -11.946 1.00 10.00 C ATOM 1141 CG LYS A 480 -4.975 10.130 -12.770 1.00 10.00 C ATOM 1142 CD LYS A 480 -3.949 10.108 -13.892 1.00 10.00 C ATOM 1143 CE LYS A 480 -4.536 9.536 -15.172 1.00 10.00 C ATOM 1144 NZ LYS A 480 -5.325 10.552 -15.922 1.00 10.00 N ATOM 1145 OXT LYS A 480 -6.891 13.351 -10.081 1.00 10.00 O ATOM 0 H LYS A 480 -7.696 11.515 -11.275 1.00 10.00 H new ATOM 0 HA LYS A 480 -5.204 10.716 -9.937 1.00 10.00 H new ATOM 0 HB2 LYS A 480 -5.197 12.247 -12.554 1.00 10.00 H new ATOM 0 HB3 LYS A 480 -3.825 11.578 -11.693 1.00 10.00 H new ATOM 0 HG2 LYS A 480 -4.828 9.264 -12.124 1.00 10.00 H new ATOM 0 HG3 LYS A 480 -5.977 10.048 -13.190 1.00 10.00 H new ATOM 0 HD2 LYS A 480 -3.588 11.120 -14.076 1.00 10.00 H new ATOM 0 HD3 LYS A 480 -3.088 9.513 -13.588 1.00 10.00 H new ATOM 0 HE2 LYS A 480 -3.732 9.161 -15.805 1.00 10.00 H new ATOM 0 HE3 LYS A 480 -5.174 8.686 -14.931 1.00 10.00 H new ATOM 0 HZ1 LYS A 480 -5.709 10.123 -16.788 1.00 10.00 H new ATOM 0 HZ2 LYS A 480 -6.108 10.891 -15.328 1.00 10.00 H new ATOM 0 HZ3 LYS A 480 -4.710 11.352 -16.175 1.00 10.00 H new TER 1159 LYS A 480