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 -120:sc= 1.64 USER MOD Set 1.2: A 479 TYR OH : rot 114:sc= -1.01 USER MOD Set 2.1: A 421 LYS NZ :NH3+ 146:sc= 1.08 (180deg=0) USER MOD Set 2.2: A 439 THR OG1 : rot -90:sc= -0.996 USER MOD Single : A 413 ASN : amide:sc= -0.0369 K(o=-0.037,f=-1.3!) USER MOD Single : A 416 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 420 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 423 TYR OH : rot 150:sc= -1.62 USER MOD Single : A 424 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 427 GLN :FLIP amide:sc= -2.3! C(o=-3.1!,f=-2.3!) USER MOD Single : A 429 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -1.47 X(o=-1.5,f=-0.97) USER MOD Single : A 431 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 433 SER OG : rot 180:sc= -0.695 USER MOD Single : A 435 GLN :FLIP amide:sc= 0 F(o=-0.56,f=0) USER MOD Single : A 437 LYS NZ :NH3+ 148:sc= 0 (180deg=-0.00214) USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.367 X(o=-0.37,f=-0.083) USER MOD Single : A 447 HIS :FLIP no HE2:sc= -13.5! C(o=-15!,f=-14!) USER MOD Single : A 449 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 ASN : amide:sc= -2.32! X(o=-2.3!,f=-2.7) USER MOD Single : A 456 SER OG : rot 180:sc= 0 USER MOD Single : A 461 LYS NZ :NH3+ -178:sc= -0.137 (180deg=-0.149) USER MOD Single : A 462 THR OG1 : rot 160:sc= -1.04 USER MOD Single : A 466 CYS SG : rot -115:sc= 0.912 USER MOD Single : A 469 TYR OH : rot 48:sc= -4.3! USER MOD Single : A 470 TYR OH : rot 180:sc= 0 USER MOD Single : A 471 TYR OH : rot 180:sc= 0 USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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=-0.33) USER MOD Single : A 480 LYS NZ :NH3+ -153:sc= -0.158 (180deg=-1.04) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 413 -2.961 8.103 28.010 1.00 10.00 N ATOM 2 CA ASN A 413 -2.862 8.201 26.559 1.00 10.00 C ATOM 3 C ASN A 413 -1.785 7.263 26.023 1.00 10.00 C ATOM 4 O ASN A 413 -0.829 6.934 26.724 1.00 10.00 O ATOM 5 CB ASN A 413 -2.553 9.640 26.144 1.00 10.00 C ATOM 6 CG ASN A 413 -3.766 10.545 26.246 1.00 10.00 C ATOM 7 OD1 ASN A 413 -4.904 10.095 26.109 1.00 10.00 O ATOM 8 ND2 ASN A 413 -3.528 11.828 26.490 1.00 10.00 N ATOM 0 HA ASN A 413 -3.821 7.905 26.134 1.00 10.00 H new ATOM 0 HB2 ASN A 413 -1.756 10.034 26.774 1.00 10.00 H new ATOM 0 HB3 ASN A 413 -2.182 9.648 25.119 1.00 10.00 H new ATOM 0 HD21 ASN A 413 -4.305 12.484 26.571 1.00 10.00 H new ATOM 0 HD22 ASN A 413 -2.569 12.157 26.596 1.00 10.00 H new ATOM 15 N GLY A 414 -1.947 6.836 24.775 1.00 10.00 N ATOM 16 CA GLY A 414 -0.982 5.941 24.165 1.00 10.00 C ATOM 17 C GLY A 414 -1.638 4.880 23.302 1.00 10.00 C ATOM 18 O GLY A 414 -2.339 4.005 23.810 1.00 10.00 O ATOM 0 H GLY A 414 -2.730 7.094 24.175 1.00 10.00 H new ATOM 0 HA2 GLY A 414 -0.287 6.521 23.557 1.00 10.00 H new ATOM 0 HA3 GLY A 414 -0.395 5.458 24.946 1.00 10.00 H new ATOM 22 N LEU A 415 -1.409 4.959 21.996 1.00 10.00 N ATOM 23 CA LEU A 415 -1.982 3.999 21.061 1.00 10.00 C ATOM 24 C LEU A 415 -0.942 3.542 20.044 1.00 10.00 C ATOM 25 O LEU A 415 -0.910 4.026 18.913 1.00 10.00 O ATOM 26 CB LEU A 415 -3.184 4.613 20.338 1.00 10.00 C ATOM 27 CG LEU A 415 -4.146 5.395 21.232 1.00 10.00 C ATOM 28 CD1 LEU A 415 -4.781 6.541 20.459 1.00 10.00 C ATOM 29 CD2 LEU A 415 -5.217 4.473 21.796 1.00 10.00 C ATOM 0 H LEU A 415 -0.831 5.678 21.561 1.00 10.00 H new ATOM 0 HA LEU A 415 -2.314 3.130 21.630 1.00 10.00 H new ATOM 0 HB2 LEU A 415 -2.817 5.278 19.556 1.00 10.00 H new ATOM 0 HB3 LEU A 415 -3.738 3.815 19.844 1.00 10.00 H new ATOM 0 HG LEU A 415 -3.580 5.814 22.064 1.00 10.00 H new ATOM 0 HD11 LEU A 415 -5.463 7.086 21.112 1.00 10.00 H new ATOM 0 HD12 LEU A 415 -4.002 7.215 20.103 1.00 10.00 H new ATOM 0 HD13 LEU A 415 -5.334 6.144 19.608 1.00 10.00 H new ATOM 0 HD21 LEU A 415 -5.893 5.046 22.430 1.00 10.00 H new ATOM 0 HD22 LEU A 415 -5.780 4.025 20.977 1.00 10.00 H new ATOM 0 HD23 LEU A 415 -4.746 3.686 22.386 1.00 10.00 H new ATOM 41 N MET A 416 -0.093 2.605 20.454 1.00 10.00 N ATOM 42 CA MET A 416 0.949 2.083 19.579 1.00 10.00 C ATOM 43 C MET A 416 0.358 1.153 18.524 1.00 10.00 C ATOM 44 O MET A 416 -0.383 0.225 18.845 1.00 10.00 O ATOM 45 CB MET A 416 2.006 1.337 20.397 1.00 10.00 C ATOM 46 CG MET A 416 2.846 2.248 21.278 1.00 10.00 C ATOM 47 SD MET A 416 4.568 1.724 21.376 1.00 10.00 S ATOM 48 CE MET A 416 5.348 2.922 20.297 1.00 10.00 C ATOM 0 H MET A 416 -0.107 2.192 21.387 1.00 10.00 H new ATOM 0 HA MET A 416 1.419 2.926 19.073 1.00 10.00 H new ATOM 0 HB2 MET A 416 1.512 0.594 21.023 1.00 10.00 H new ATOM 0 HB3 MET A 416 2.664 0.795 19.718 1.00 10.00 H new ATOM 0 HG2 MET A 416 2.801 3.265 20.889 1.00 10.00 H new ATOM 0 HG3 MET A 416 2.420 2.271 22.281 1.00 10.00 H new ATOM 0 HE1 MET A 416 6.420 2.729 20.254 1.00 10.00 H new ATOM 0 HE2 MET A 416 4.924 2.841 19.296 1.00 10.00 H new ATOM 0 HE3 MET A 416 5.175 3.926 20.684 1.00 10.00 H new ATOM 58 N ALA A 417 0.692 1.409 17.263 1.00 10.00 N ATOM 59 CA ALA A 417 0.193 0.596 16.161 1.00 10.00 C ATOM 60 C ALA A 417 1.252 -0.394 15.686 1.00 10.00 C ATOM 61 O ALA A 417 2.413 -0.033 15.496 1.00 10.00 O ATOM 62 CB ALA A 417 -0.253 1.486 15.009 1.00 10.00 C ATOM 0 H ALA A 417 1.306 2.173 16.980 1.00 10.00 H new ATOM 0 HA ALA A 417 -0.664 0.027 16.521 1.00 10.00 H new ATOM 0 HB1 ALA A 417 -0.623 0.866 14.193 1.00 10.00 H new ATOM 0 HB2 ALA A 417 -1.047 2.151 15.349 1.00 10.00 H new ATOM 0 HB3 ALA A 417 0.592 2.079 14.659 1.00 10.00 H new ATOM 68 N ASP A 418 0.841 -1.645 15.498 1.00 10.00 N ATOM 69 CA ASP A 418 1.755 -2.688 15.046 1.00 10.00 C ATOM 70 C ASP A 418 1.526 -3.011 13.571 1.00 10.00 C ATOM 71 O ASP A 418 0.488 -2.666 13.005 1.00 10.00 O ATOM 72 CB ASP A 418 1.577 -3.951 15.890 1.00 10.00 C ATOM 73 CG ASP A 418 2.508 -3.983 17.087 1.00 10.00 C ATOM 74 OD1 ASP A 418 3.740 -3.963 16.881 1.00 10.00 O ATOM 75 OD2 ASP A 418 2.004 -4.027 18.229 1.00 10.00 O ATOM 0 H ASP A 418 -0.117 -1.960 15.651 1.00 10.00 H new ATOM 0 HA ASP A 418 2.774 -2.320 15.165 1.00 10.00 H new ATOM 0 HB2 ASP A 418 0.545 -4.012 16.234 1.00 10.00 H new ATOM 0 HB3 ASP A 418 1.758 -4.828 15.269 1.00 10.00 H new ATOM 80 N PRO A 419 2.496 -3.681 12.927 1.00 10.00 N ATOM 81 CA PRO A 419 2.396 -4.051 11.511 1.00 10.00 C ATOM 82 C PRO A 419 1.353 -5.137 11.269 1.00 10.00 C ATOM 83 O PRO A 419 1.480 -6.255 11.767 1.00 10.00 O ATOM 84 CB PRO A 419 3.796 -4.569 11.178 1.00 10.00 C ATOM 85 CG PRO A 419 4.344 -5.042 12.479 1.00 10.00 C ATOM 86 CD PRO A 419 3.766 -4.132 13.527 1.00 10.00 C ATOM 0 HA PRO A 419 2.081 -3.211 10.892 1.00 10.00 H new ATOM 0 HB2 PRO A 419 3.756 -5.377 10.448 1.00 10.00 H new ATOM 0 HB3 PRO A 419 4.417 -3.783 10.749 1.00 10.00 H new ATOM 0 HG2 PRO A 419 4.065 -6.079 12.666 1.00 10.00 H new ATOM 0 HG3 PRO A 419 5.433 -4.999 12.482 1.00 10.00 H new ATOM 0 HD2 PRO A 419 3.602 -4.657 14.468 1.00 10.00 H new ATOM 0 HD3 PRO A 419 4.429 -3.294 13.741 1.00 10.00 H new ATOM 94 N MET A 420 0.323 -4.800 10.501 1.00 10.00 N ATOM 95 CA MET A 420 -0.742 -5.743 10.190 1.00 10.00 C ATOM 96 C MET A 420 -0.961 -5.824 8.689 1.00 10.00 C ATOM 97 O MET A 420 -0.403 -6.698 8.030 1.00 10.00 O ATOM 98 CB MET A 420 -2.035 -5.328 10.897 1.00 10.00 C ATOM 99 CG MET A 420 -2.408 -6.226 12.064 1.00 10.00 C ATOM 100 SD MET A 420 -1.633 -5.715 13.610 1.00 10.00 S ATOM 101 CE MET A 420 -1.231 -7.305 14.329 1.00 10.00 C ATOM 0 H MET A 420 0.204 -3.878 10.082 1.00 10.00 H new ATOM 0 HA MET A 420 -0.448 -6.730 10.547 1.00 10.00 H new ATOM 0 HB2 MET A 420 -1.930 -4.305 11.257 1.00 10.00 H new ATOM 0 HB3 MET A 420 -2.851 -5.329 10.174 1.00 10.00 H new ATOM 0 HG2 MET A 420 -3.491 -6.224 12.187 1.00 10.00 H new ATOM 0 HG3 MET A 420 -2.115 -7.251 11.837 1.00 10.00 H new ATOM 0 HE1 MET A 420 -0.744 -7.156 15.293 1.00 10.00 H new ATOM 0 HE2 MET A 420 -2.145 -7.882 14.470 1.00 10.00 H new ATOM 0 HE3 MET A 420 -0.559 -7.846 13.663 1.00 10.00 H new ATOM 111 N LYS A 421 -1.766 -4.911 8.149 1.00 10.00 N ATOM 112 CA LYS A 421 -2.039 -4.901 6.714 1.00 10.00 C ATOM 113 C LYS A 421 -0.740 -4.996 5.938 1.00 10.00 C ATOM 114 O LYS A 421 -0.061 -3.998 5.700 1.00 10.00 O ATOM 115 CB LYS A 421 -2.808 -3.655 6.305 1.00 10.00 C ATOM 116 CG LYS A 421 -3.006 -3.540 4.801 1.00 10.00 C ATOM 117 CD LYS A 421 -4.094 -4.466 4.286 1.00 10.00 C ATOM 118 CE LYS A 421 -5.373 -4.369 5.106 1.00 10.00 C ATOM 119 NZ LYS A 421 -6.583 -4.633 4.281 1.00 10.00 N ATOM 0 H LYS A 421 -2.236 -4.176 8.677 1.00 10.00 H new ATOM 0 HA LYS A 421 -2.660 -5.766 6.482 1.00 10.00 H new ATOM 0 HB2 LYS A 421 -3.782 -3.660 6.794 1.00 10.00 H new ATOM 0 HB3 LYS A 421 -2.276 -2.774 6.663 1.00 10.00 H new ATOM 0 HG2 LYS A 421 -3.260 -2.510 4.549 1.00 10.00 H new ATOM 0 HG3 LYS A 421 -2.068 -3.770 4.296 1.00 10.00 H new ATOM 0 HD2 LYS A 421 -4.313 -4.223 3.246 1.00 10.00 H new ATOM 0 HD3 LYS A 421 -3.731 -5.494 4.303 1.00 10.00 H new ATOM 0 HE2 LYS A 421 -5.332 -5.083 5.929 1.00 10.00 H new ATOM 0 HE3 LYS A 421 -5.446 -3.376 5.549 1.00 10.00 H new ATOM 0 HZ1 LYS A 421 -7.300 -5.115 4.860 1.00 10.00 H new ATOM 0 HZ2 LYS A 421 -6.968 -3.732 3.932 1.00 10.00 H new ATOM 0 HZ3 LYS A 421 -6.328 -5.237 3.474 1.00 10.00 H new ATOM 133 N VAL A 422 -0.398 -6.217 5.575 1.00 10.00 N ATOM 134 CA VAL A 422 0.825 -6.495 4.859 1.00 10.00 C ATOM 135 C VAL A 422 0.923 -7.990 4.595 1.00 10.00 C ATOM 136 O VAL A 422 1.243 -8.431 3.491 1.00 10.00 O ATOM 137 CB VAL A 422 2.026 -6.001 5.681 1.00 10.00 C ATOM 138 CG1 VAL A 422 2.441 -7.017 6.740 1.00 10.00 C ATOM 139 CG2 VAL A 422 3.192 -5.650 4.774 1.00 10.00 C ATOM 0 H VAL A 422 -0.963 -7.043 5.770 1.00 10.00 H new ATOM 0 HA VAL A 422 0.826 -5.972 3.903 1.00 10.00 H new ATOM 0 HB VAL A 422 1.717 -5.096 6.205 1.00 10.00 H new ATOM 0 HG11 VAL A 422 3.293 -6.631 7.300 1.00 10.00 H new ATOM 0 HG12 VAL A 422 1.609 -7.193 7.421 1.00 10.00 H new ATOM 0 HG13 VAL A 422 2.719 -7.954 6.257 1.00 10.00 H new ATOM 0 HG21 VAL A 422 4.031 -5.303 5.377 1.00 10.00 H new ATOM 0 HG22 VAL A 422 3.492 -6.533 4.209 1.00 10.00 H new ATOM 0 HG23 VAL A 422 2.891 -4.862 4.083 1.00 10.00 H new ATOM 149 N TYR A 423 0.596 -8.753 5.628 1.00 10.00 N ATOM 150 CA TYR A 423 0.580 -10.210 5.563 1.00 10.00 C ATOM 151 C TYR A 423 -0.182 -10.689 4.325 1.00 10.00 C ATOM 152 O TYR A 423 0.032 -11.803 3.848 1.00 10.00 O ATOM 153 CB TYR A 423 -0.057 -10.800 6.841 1.00 10.00 C ATOM 154 CG TYR A 423 -1.021 -9.874 7.567 1.00 10.00 C ATOM 155 CD1 TYR A 423 -1.723 -8.883 6.892 1.00 10.00 C ATOM 156 CD2 TYR A 423 -1.212 -9.983 8.938 1.00 10.00 C ATOM 157 CE1 TYR A 423 -2.575 -8.035 7.551 1.00 10.00 C ATOM 158 CE2 TYR A 423 -2.072 -9.134 9.609 1.00 10.00 C ATOM 159 CZ TYR A 423 -2.749 -8.159 8.911 1.00 10.00 C ATOM 160 OH TYR A 423 -3.608 -7.313 9.573 1.00 10.00 O ATOM 0 H TYR A 423 0.333 -8.379 6.540 1.00 10.00 H new ATOM 0 HA TYR A 423 1.610 -10.558 5.491 1.00 10.00 H new ATOM 0 HB2 TYR A 423 -0.587 -11.715 6.575 1.00 10.00 H new ATOM 0 HB3 TYR A 423 0.740 -11.081 7.529 1.00 10.00 H new ATOM 0 HD1 TYR A 423 -1.595 -8.778 5.825 1.00 10.00 H new ATOM 0 HD2 TYR A 423 -0.680 -10.744 9.489 1.00 10.00 H new ATOM 0 HE1 TYR A 423 -3.109 -7.271 7.005 1.00 10.00 H new ATOM 0 HE2 TYR A 423 -2.212 -9.235 10.675 1.00 10.00 H new ATOM 0 HH TYR A 423 -3.989 -7.775 10.349 1.00 10.00 H new ATOM 170 N LYS A 424 -1.057 -9.832 3.797 1.00 10.00 N ATOM 171 CA LYS A 424 -1.827 -10.164 2.605 1.00 10.00 C ATOM 172 C LYS A 424 -1.270 -9.418 1.395 1.00 10.00 C ATOM 173 O LYS A 424 -1.464 -9.831 0.252 1.00 10.00 O ATOM 174 CB LYS A 424 -3.302 -9.808 2.806 1.00 10.00 C ATOM 175 CG LYS A 424 -4.129 -10.944 3.384 1.00 10.00 C ATOM 176 CD LYS A 424 -5.551 -10.927 2.849 1.00 10.00 C ATOM 177 CE LYS A 424 -6.067 -12.333 2.589 1.00 10.00 C ATOM 178 NZ LYS A 424 -6.550 -12.986 3.836 1.00 10.00 N ATOM 0 H LYS A 424 -1.248 -8.905 4.178 1.00 10.00 H new ATOM 0 HA LYS A 424 -1.747 -11.237 2.428 1.00 10.00 H new ATOM 0 HB2 LYS A 424 -3.372 -8.945 3.469 1.00 10.00 H new ATOM 0 HB3 LYS A 424 -3.729 -9.510 1.848 1.00 10.00 H new ATOM 0 HG2 LYS A 424 -3.659 -11.897 3.141 1.00 10.00 H new ATOM 0 HG3 LYS A 424 -4.147 -10.865 4.471 1.00 10.00 H new ATOM 0 HD2 LYS A 424 -6.203 -10.426 3.564 1.00 10.00 H new ATOM 0 HD3 LYS A 424 -5.586 -10.349 1.925 1.00 10.00 H new ATOM 0 HE2 LYS A 424 -6.878 -12.293 1.862 1.00 10.00 H new ATOM 0 HE3 LYS A 424 -5.273 -12.935 2.148 1.00 10.00 H new ATOM 0 HZ1 LYS A 424 -6.893 -13.943 3.616 1.00 10.00 H new ATOM 0 HZ2 LYS A 424 -5.770 -13.047 4.521 1.00 10.00 H new ATOM 0 HZ3 LYS A 424 -7.325 -12.425 4.244 1.00 10.00 H new ATOM 192 N ASP A 425 -0.572 -8.316 1.663 1.00 10.00 N ATOM 193 CA ASP A 425 0.023 -7.503 0.612 1.00 10.00 C ATOM 194 C ASP A 425 1.058 -8.294 -0.187 1.00 10.00 C ATOM 195 O ASP A 425 1.408 -7.918 -1.304 1.00 10.00 O ATOM 196 CB ASP A 425 0.679 -6.261 1.216 1.00 10.00 C ATOM 197 CG ASP A 425 -0.333 -5.197 1.592 1.00 10.00 C ATOM 198 OD1 ASP A 425 -1.154 -5.452 2.498 1.00 10.00 O ATOM 199 OD2 ASP A 425 -0.306 -4.110 0.979 1.00 10.00 O ATOM 0 H ASP A 425 -0.406 -7.967 2.607 1.00 10.00 H new ATOM 0 HA ASP A 425 -0.774 -7.202 -0.067 1.00 10.00 H new ATOM 0 HB2 ASP A 425 1.247 -6.548 2.101 1.00 10.00 H new ATOM 0 HB3 ASP A 425 1.390 -5.846 0.502 1.00 10.00 H new ATOM 204 N ARG A 426 1.547 -9.391 0.386 1.00 10.00 N ATOM 205 CA ARG A 426 2.541 -10.218 -0.290 1.00 10.00 C ATOM 206 C ARG A 426 2.072 -10.577 -1.696 1.00 10.00 C ATOM 207 O ARG A 426 2.875 -10.680 -2.623 1.00 10.00 O ATOM 208 CB ARG A 426 2.818 -11.488 0.519 1.00 10.00 C ATOM 209 CG ARG A 426 4.238 -12.007 0.368 1.00 10.00 C ATOM 210 CD ARG A 426 4.696 -12.747 1.614 1.00 10.00 C ATOM 211 NE ARG A 426 3.979 -14.007 1.796 1.00 10.00 N ATOM 212 CZ ARG A 426 4.295 -14.912 2.720 1.00 10.00 C ATOM 213 NH1 ARG A 426 5.312 -14.701 3.546 1.00 10.00 N ATOM 214 NH2 ARG A 426 3.592 -16.033 2.818 1.00 10.00 N ATOM 0 H ARG A 426 1.273 -9.725 1.310 1.00 10.00 H new ATOM 0 HA ARG A 426 3.466 -9.647 -0.370 1.00 10.00 H new ATOM 0 HB2 ARG A 426 2.623 -11.287 1.573 1.00 10.00 H new ATOM 0 HB3 ARG A 426 2.121 -12.266 0.208 1.00 10.00 H new ATOM 0 HG2 ARG A 426 4.293 -12.673 -0.493 1.00 10.00 H new ATOM 0 HG3 ARG A 426 4.912 -11.174 0.170 1.00 10.00 H new ATOM 0 HD2 ARG A 426 5.766 -12.945 1.546 1.00 10.00 H new ATOM 0 HD3 ARG A 426 4.544 -12.114 2.488 1.00 10.00 H new ATOM 0 HE ARG A 426 3.191 -14.205 1.180 1.00 10.00 H new ATOM 0 HH11 ARG A 426 5.857 -13.842 3.475 1.00 10.00 H new ATOM 0 HH12 ARG A 426 5.549 -15.398 4.252 1.00 10.00 H new ATOM 0 HH21 ARG A 426 2.810 -16.201 2.186 1.00 10.00 H new ATOM 0 HH22 ARG A 426 3.834 -16.726 3.526 1.00 10.00 H new ATOM 228 N GLN A 427 0.764 -10.740 -1.847 1.00 10.00 N ATOM 229 CA GLN A 427 0.179 -11.055 -3.144 1.00 10.00 C ATOM 230 C GLN A 427 -0.512 -9.821 -3.706 1.00 10.00 C ATOM 231 O GLN A 427 -1.481 -9.914 -4.459 1.00 10.00 O ATOM 232 CB GLN A 427 -0.808 -12.226 -3.039 1.00 10.00 C ATOM 233 CG GLN A 427 -1.376 -12.441 -1.642 1.00 10.00 C ATOM 234 CD GLN A 427 -0.359 -13.024 -0.677 1.00 10.00 C ATOM 235 OE1 GLN A 427 -0.318 -12.480 0.536 1.00 10.00 O flip ATOM 236 NE2 GLN A 427 0.379 -13.948 -1.016 1.00 10.00 N flip ATOM 0 H GLN A 427 0.088 -10.659 -1.087 1.00 10.00 H new ATOM 0 HA GLN A 427 0.978 -11.358 -3.821 1.00 10.00 H new ATOM 0 HB2 GLN A 427 -1.632 -12.055 -3.732 1.00 10.00 H new ATOM 0 HB3 GLN A 427 -0.306 -13.139 -3.360 1.00 10.00 H new ATOM 0 HG2 GLN A 427 -1.737 -11.490 -1.251 1.00 10.00 H new ATOM 0 HG3 GLN A 427 -2.236 -13.108 -1.703 1.00 10.00 H new ATOM 0 HE21 GLN A 427 0.313 -14.335 -1.958 1.00 10.00 H new ATOM 0 HE22 GLN A 427 1.057 -14.328 -0.356 1.00 10.00 H new ATOM 245 N VAL A 428 0.020 -8.665 -3.331 1.00 10.00 N ATOM 246 CA VAL A 428 -0.499 -7.382 -3.778 1.00 10.00 C ATOM 247 C VAL A 428 0.551 -6.651 -4.592 1.00 10.00 C ATOM 248 O VAL A 428 0.226 -5.931 -5.536 1.00 10.00 O ATOM 249 CB VAL A 428 -0.930 -6.502 -2.596 1.00 10.00 C ATOM 250 CG1 VAL A 428 -1.041 -5.044 -3.014 1.00 10.00 C ATOM 251 CG2 VAL A 428 -2.243 -6.995 -2.018 1.00 10.00 C ATOM 0 H VAL A 428 0.824 -8.592 -2.708 1.00 10.00 H new ATOM 0 HA VAL A 428 -1.376 -7.579 -4.395 1.00 10.00 H new ATOM 0 HB VAL A 428 -0.164 -6.572 -1.823 1.00 10.00 H new ATOM 0 HG11 VAL A 428 -1.348 -4.443 -2.158 1.00 10.00 H new ATOM 0 HG12 VAL A 428 -0.074 -4.694 -3.375 1.00 10.00 H new ATOM 0 HG13 VAL A 428 -1.781 -4.949 -3.808 1.00 10.00 H new ATOM 0 HG21 VAL A 428 -2.533 -6.360 -1.181 1.00 10.00 H new ATOM 0 HG22 VAL A 428 -3.015 -6.959 -2.786 1.00 10.00 H new ATOM 0 HG23 VAL A 428 -2.125 -8.021 -1.671 1.00 10.00 H new ATOM 261 N MET A 429 1.818 -6.848 -4.233 1.00 10.00 N ATOM 262 CA MET A 429 2.916 -6.215 -4.957 1.00 10.00 C ATOM 263 C MET A 429 2.701 -6.349 -6.465 1.00 10.00 C ATOM 264 O MET A 429 3.165 -5.522 -7.250 1.00 10.00 O ATOM 265 CB MET A 429 4.252 -6.846 -4.559 1.00 10.00 C ATOM 266 CG MET A 429 4.369 -8.313 -4.941 1.00 10.00 C ATOM 267 SD MET A 429 5.383 -9.253 -3.785 1.00 10.00 S ATOM 268 CE MET A 429 6.641 -9.898 -4.884 1.00 10.00 C ATOM 0 H MET A 429 2.107 -7.436 -3.451 1.00 10.00 H new ATOM 0 HA MET A 429 2.938 -5.157 -4.696 1.00 10.00 H new ATOM 0 HB2 MET A 429 5.062 -6.290 -5.031 1.00 10.00 H new ATOM 0 HB3 MET A 429 4.384 -6.748 -3.481 1.00 10.00 H new ATOM 0 HG2 MET A 429 3.373 -8.753 -4.986 1.00 10.00 H new ATOM 0 HG3 MET A 429 4.797 -8.391 -5.940 1.00 10.00 H new ATOM 0 HE1 MET A 429 7.346 -10.503 -4.314 1.00 10.00 H new ATOM 0 HE2 MET A 429 6.172 -10.513 -5.652 1.00 10.00 H new ATOM 0 HE3 MET A 429 7.171 -9.071 -5.355 1.00 10.00 H new ATOM 278 N ASN A 430 1.979 -7.401 -6.854 1.00 10.00 N ATOM 279 CA ASN A 430 1.677 -7.661 -8.253 1.00 10.00 C ATOM 280 C ASN A 430 0.172 -7.843 -8.458 1.00 10.00 C ATOM 281 O ASN A 430 -0.260 -8.506 -9.400 1.00 10.00 O ATOM 282 CB ASN A 430 2.423 -8.912 -8.720 1.00 10.00 C ATOM 283 CG ASN A 430 2.249 -9.175 -10.203 1.00 10.00 C ATOM 284 OD1 ASN A 430 2.853 -8.504 -11.039 1.00 10.00 O ATOM 285 ND2 ASN A 430 1.418 -10.156 -10.536 1.00 10.00 N ATOM 0 H ASN A 430 1.592 -8.090 -6.209 1.00 10.00 H new ATOM 0 HA ASN A 430 2.003 -6.805 -8.843 1.00 10.00 H new ATOM 0 HB2 ASN A 430 3.484 -8.802 -8.496 1.00 10.00 H new ATOM 0 HB3 ASN A 430 2.066 -9.775 -8.157 1.00 10.00 H new ATOM 0 HD21 ASN A 430 1.260 -10.379 -11.519 1.00 10.00 H new ATOM 0 HD22 ASN A 430 0.938 -10.687 -9.809 1.00 10.00 H new ATOM 292 N MET A 431 -0.621 -7.246 -7.568 1.00 10.00 N ATOM 293 CA MET A 431 -2.079 -7.336 -7.644 1.00 10.00 C ATOM 294 C MET A 431 -2.733 -6.811 -6.370 1.00 10.00 C ATOM 295 O MET A 431 -3.148 -7.588 -5.508 1.00 10.00 O ATOM 296 CB MET A 431 -2.527 -8.776 -7.872 1.00 10.00 C ATOM 297 CG MET A 431 -2.925 -9.075 -9.310 1.00 10.00 C ATOM 298 SD MET A 431 -4.472 -9.993 -9.428 1.00 10.00 S ATOM 299 CE MET A 431 -3.899 -11.528 -10.152 1.00 10.00 C ATOM 0 H MET A 431 -0.276 -6.693 -6.783 1.00 10.00 H new ATOM 0 HA MET A 431 -2.392 -6.721 -8.487 1.00 10.00 H new ATOM 0 HB2 MET A 431 -1.720 -9.448 -7.581 1.00 10.00 H new ATOM 0 HB3 MET A 431 -3.372 -8.991 -7.219 1.00 10.00 H new ATOM 0 HG2 MET A 431 -3.021 -8.138 -9.858 1.00 10.00 H new ATOM 0 HG3 MET A 431 -2.131 -9.646 -9.791 1.00 10.00 H new ATOM 0 HE1 MET A 431 -4.743 -12.204 -10.288 1.00 10.00 H new ATOM 0 HE2 MET A 431 -3.438 -11.325 -11.118 1.00 10.00 H new ATOM 0 HE3 MET A 431 -3.167 -11.991 -9.491 1.00 10.00 H new ATOM 309 N TRP A 432 -2.852 -5.500 -6.270 1.00 10.00 N ATOM 310 CA TRP A 432 -3.486 -4.881 -5.116 1.00 10.00 C ATOM 311 C TRP A 432 -4.989 -5.049 -5.234 1.00 10.00 C ATOM 312 O TRP A 432 -5.648 -4.384 -6.034 1.00 10.00 O ATOM 313 CB TRP A 432 -3.111 -3.401 -5.009 1.00 10.00 C ATOM 314 CG TRP A 432 -1.699 -3.079 -5.424 1.00 10.00 C ATOM 315 CD1 TRP A 432 -1.156 -3.225 -6.666 1.00 10.00 C ATOM 316 CD2 TRP A 432 -0.653 -2.543 -4.598 1.00 10.00 C ATOM 317 NE1 TRP A 432 0.140 -2.780 -6.670 1.00 10.00 N ATOM 318 CE2 TRP A 432 0.475 -2.366 -5.417 1.00 10.00 C ATOM 319 CE3 TRP A 432 -0.563 -2.186 -3.254 1.00 10.00 C ATOM 320 CZ2 TRP A 432 1.671 -1.842 -4.940 1.00 10.00 C ATOM 321 CZ3 TRP A 432 0.627 -1.675 -2.774 1.00 10.00 C ATOM 322 CH2 TRP A 432 1.730 -1.501 -3.617 1.00 10.00 C ATOM 0 H TRP A 432 -2.518 -4.841 -6.973 1.00 10.00 H new ATOM 0 HA TRP A 432 -3.134 -5.370 -4.207 1.00 10.00 H new ATOM 0 HB2 TRP A 432 -3.798 -2.820 -5.625 1.00 10.00 H new ATOM 0 HB3 TRP A 432 -3.255 -3.077 -3.978 1.00 10.00 H new ATOM 0 HD1 TRP A 432 -1.672 -3.632 -7.523 1.00 10.00 H new ATOM 0 HE1 TRP A 432 0.756 -2.762 -7.483 1.00 10.00 H new ATOM 0 HE3 TRP A 432 -1.412 -2.307 -2.597 1.00 10.00 H new ATOM 0 HZ2 TRP A 432 2.523 -1.709 -5.591 1.00 10.00 H new ATOM 0 HZ3 TRP A 432 0.707 -1.405 -1.731 1.00 10.00 H new ATOM 0 HH2 TRP A 432 2.645 -1.090 -3.216 1.00 10.00 H new ATOM 333 N SER A 433 -5.511 -5.970 -4.444 1.00 10.00 N ATOM 334 CA SER A 433 -6.937 -6.278 -4.457 1.00 10.00 C ATOM 335 C SER A 433 -7.774 -5.063 -4.087 1.00 10.00 C ATOM 336 O SER A 433 -7.347 -4.219 -3.300 1.00 10.00 O ATOM 337 CB SER A 433 -7.238 -7.435 -3.500 1.00 10.00 C ATOM 338 OG SER A 433 -7.506 -6.964 -2.190 1.00 10.00 O ATOM 0 H SER A 433 -4.968 -6.523 -3.780 1.00 10.00 H new ATOM 0 HA SER A 433 -7.204 -6.572 -5.472 1.00 10.00 H new ATOM 0 HB2 SER A 433 -8.094 -8.000 -3.868 1.00 10.00 H new ATOM 0 HB3 SER A 433 -6.390 -8.120 -3.476 1.00 10.00 H new ATOM 0 HG SER A 433 -7.696 -7.724 -1.602 1.00 10.00 H new ATOM 344 N GLU A 434 -8.980 -4.987 -4.647 1.00 10.00 N ATOM 345 CA GLU A 434 -9.885 -3.880 -4.359 1.00 10.00 C ATOM 346 C GLU A 434 -9.997 -3.677 -2.853 1.00 10.00 C ATOM 347 O GLU A 434 -10.215 -2.562 -2.376 1.00 10.00 O ATOM 348 CB GLU A 434 -11.266 -4.148 -4.959 1.00 10.00 C ATOM 349 CG GLU A 434 -11.283 -4.135 -6.478 1.00 10.00 C ATOM 350 CD GLU A 434 -12.573 -4.685 -7.053 1.00 10.00 C ATOM 351 OE1 GLU A 434 -13.639 -4.084 -6.801 1.00 10.00 O ATOM 352 OE2 GLU A 434 -12.519 -5.719 -7.752 1.00 10.00 O ATOM 0 H GLU A 434 -9.351 -5.677 -5.300 1.00 10.00 H new ATOM 0 HA GLU A 434 -9.482 -2.973 -4.810 1.00 10.00 H new ATOM 0 HB2 GLU A 434 -11.623 -5.116 -4.608 1.00 10.00 H new ATOM 0 HB3 GLU A 434 -11.965 -3.398 -4.590 1.00 10.00 H new ATOM 0 HG2 GLU A 434 -11.139 -3.114 -6.830 1.00 10.00 H new ATOM 0 HG3 GLU A 434 -10.444 -4.722 -6.852 1.00 10.00 H new ATOM 359 N GLN A 435 -9.829 -4.767 -2.111 1.00 10.00 N ATOM 360 CA GLN A 435 -9.891 -4.724 -0.659 1.00 10.00 C ATOM 361 C GLN A 435 -8.525 -4.379 -0.083 1.00 10.00 C ATOM 362 O GLN A 435 -8.424 -3.743 0.966 1.00 10.00 O ATOM 363 CB GLN A 435 -10.368 -6.067 -0.105 1.00 10.00 C ATOM 364 CG GLN A 435 -11.145 -5.948 1.195 1.00 10.00 C ATOM 365 CD GLN A 435 -12.645 -5.917 0.978 1.00 10.00 C ATOM 366 OE1 GLN A 435 -13.079 -5.194 -0.049 1.00 10.00 O flip ATOM 367 NE2 GLN A 435 -13.406 -6.533 1.724 1.00 10.00 N flip ATOM 0 H GLN A 435 -9.648 -5.694 -2.496 1.00 10.00 H new ATOM 0 HA GLN A 435 -10.603 -3.952 -0.367 1.00 10.00 H new ATOM 0 HB2 GLN A 435 -10.996 -6.555 -0.850 1.00 10.00 H new ATOM 0 HB3 GLN A 435 -9.504 -6.712 0.056 1.00 10.00 H new ATOM 0 HG2 GLN A 435 -10.893 -6.788 1.843 1.00 10.00 H new ATOM 0 HG3 GLN A 435 -10.838 -5.041 1.715 1.00 10.00 H new ATOM 0 HE21 GLN A 435 -13.030 -7.076 2.501 1.00 10.00 H new ATOM 0 HE22 GLN A 435 -14.413 -6.500 1.565 1.00 10.00 H new ATOM 376 N GLU A 436 -7.469 -4.789 -0.785 1.00 10.00 N ATOM 377 CA GLU A 436 -6.121 -4.511 -0.355 1.00 10.00 C ATOM 378 C GLU A 436 -5.808 -3.048 -0.607 1.00 10.00 C ATOM 379 O GLU A 436 -5.502 -2.300 0.323 1.00 10.00 O ATOM 380 CB GLU A 436 -5.163 -5.446 -1.097 1.00 10.00 C ATOM 381 CG GLU A 436 -4.787 -6.679 -0.291 1.00 10.00 C ATOM 382 CD GLU A 436 -3.736 -6.392 0.763 1.00 10.00 C ATOM 383 OE1 GLU A 436 -3.850 -5.357 1.449 1.00 10.00 O ATOM 384 OE2 GLU A 436 -2.796 -7.204 0.900 1.00 10.00 O ATOM 0 H GLU A 436 -7.534 -5.316 -1.656 1.00 10.00 H new ATOM 0 HA GLU A 436 -6.005 -4.692 0.714 1.00 10.00 H new ATOM 0 HB2 GLU A 436 -5.624 -5.759 -2.034 1.00 10.00 H new ATOM 0 HB3 GLU A 436 -4.257 -4.898 -1.355 1.00 10.00 H new ATOM 0 HG2 GLU A 436 -5.679 -7.079 0.191 1.00 10.00 H new ATOM 0 HG3 GLU A 436 -4.417 -7.450 -0.966 1.00 10.00 H new ATOM 391 N LYS A 437 -5.938 -2.625 -1.857 1.00 10.00 N ATOM 392 CA LYS A 437 -5.721 -1.227 -2.212 1.00 10.00 C ATOM 393 C LYS A 437 -6.595 -0.339 -1.338 1.00 10.00 C ATOM 394 O LYS A 437 -6.329 0.845 -1.173 1.00 10.00 O ATOM 395 CB LYS A 437 -6.047 -0.994 -3.688 1.00 10.00 C ATOM 396 CG LYS A 437 -5.834 0.442 -4.139 1.00 10.00 C ATOM 397 CD LYS A 437 -5.590 0.525 -5.636 1.00 10.00 C ATOM 398 CE LYS A 437 -6.880 0.361 -6.422 1.00 10.00 C ATOM 399 NZ LYS A 437 -7.074 -1.041 -6.886 1.00 10.00 N ATOM 0 H LYS A 437 -6.192 -3.227 -2.641 1.00 10.00 H new ATOM 0 HA LYS A 437 -4.673 -0.978 -2.047 1.00 10.00 H new ATOM 0 HB2 LYS A 437 -5.428 -1.653 -4.297 1.00 10.00 H new ATOM 0 HB3 LYS A 437 -7.085 -1.273 -3.871 1.00 10.00 H new ATOM 0 HG2 LYS A 437 -6.707 1.040 -3.878 1.00 10.00 H new ATOM 0 HG3 LYS A 437 -4.984 0.869 -3.607 1.00 10.00 H new ATOM 0 HD2 LYS A 437 -5.135 1.485 -5.879 1.00 10.00 H new ATOM 0 HD3 LYS A 437 -4.881 -0.248 -5.933 1.00 10.00 H new ATOM 0 HE2 LYS A 437 -7.724 0.657 -5.800 1.00 10.00 H new ATOM 0 HE3 LYS A 437 -6.868 1.030 -7.283 1.00 10.00 H new ATOM 0 HZ1 LYS A 437 -8.090 -1.260 -6.914 1.00 10.00 H new ATOM 0 HZ2 LYS A 437 -6.670 -1.151 -7.838 1.00 10.00 H new ATOM 0 HZ3 LYS A 437 -6.597 -1.693 -6.230 1.00 10.00 H new ATOM 413 N GLU A 438 -7.640 -0.934 -0.772 1.00 10.00 N ATOM 414 CA GLU A 438 -8.559 -0.208 0.091 1.00 10.00 C ATOM 415 C GLU A 438 -7.852 0.326 1.331 1.00 10.00 C ATOM 416 O GLU A 438 -8.251 1.350 1.881 1.00 10.00 O ATOM 417 CB GLU A 438 -9.717 -1.115 0.506 1.00 10.00 C ATOM 418 CG GLU A 438 -11.051 -0.393 0.606 1.00 10.00 C ATOM 419 CD GLU A 438 -11.922 -0.607 -0.616 1.00 10.00 C ATOM 420 OE1 GLU A 438 -11.807 0.185 -1.574 1.00 10.00 O ATOM 421 OE2 GLU A 438 -12.721 -1.568 -0.615 1.00 10.00 O ATOM 0 H GLU A 438 -7.870 -1.920 -0.897 1.00 10.00 H new ATOM 0 HA GLU A 438 -8.946 0.641 -0.472 1.00 10.00 H new ATOM 0 HB2 GLU A 438 -9.807 -1.928 -0.214 1.00 10.00 H new ATOM 0 HB3 GLU A 438 -9.485 -1.568 1.470 1.00 10.00 H new ATOM 0 HG2 GLU A 438 -11.583 -0.740 1.492 1.00 10.00 H new ATOM 0 HG3 GLU A 438 -10.873 0.674 0.739 1.00 10.00 H new ATOM 428 N THR A 439 -6.812 -0.371 1.781 1.00 10.00 N ATOM 429 CA THR A 439 -6.085 0.061 2.969 1.00 10.00 C ATOM 430 C THR A 439 -4.986 1.065 2.625 1.00 10.00 C ATOM 431 O THR A 439 -4.887 2.122 3.249 1.00 10.00 O ATOM 432 CB THR A 439 -5.489 -1.140 3.703 1.00 10.00 C ATOM 433 OG1 THR A 439 -6.507 -2.053 4.073 1.00 10.00 O ATOM 434 CG2 THR A 439 -4.739 -0.752 4.961 1.00 10.00 C ATOM 0 H THR A 439 -6.458 -1.224 1.348 1.00 10.00 H new ATOM 0 HA THR A 439 -6.800 0.558 3.624 1.00 10.00 H new ATOM 0 HB THR A 439 -4.787 -1.595 3.004 1.00 10.00 H new ATOM 0 HG1 THR A 439 -6.844 -1.824 4.964 1.00 10.00 H new ATOM 0 HG21 THR A 439 -4.339 -1.647 5.437 1.00 10.00 H new ATOM 0 HG22 THR A 439 -3.919 -0.081 4.704 1.00 10.00 H new ATOM 0 HG23 THR A 439 -5.418 -0.248 5.649 1.00 10.00 H new ATOM 442 N PHE A 440 -4.163 0.737 1.635 1.00 10.00 N ATOM 443 CA PHE A 440 -3.082 1.616 1.222 1.00 10.00 C ATOM 444 C PHE A 440 -3.639 2.840 0.503 1.00 10.00 C ATOM 445 O PHE A 440 -3.116 3.945 0.647 1.00 10.00 O ATOM 446 CB PHE A 440 -2.093 0.865 0.320 1.00 10.00 C ATOM 447 CG PHE A 440 -2.412 -0.583 0.141 1.00 10.00 C ATOM 448 CD1 PHE A 440 -2.393 -1.466 1.206 1.00 10.00 C ATOM 449 CD2 PHE A 440 -2.749 -1.052 -1.103 1.00 10.00 C ATOM 450 CE1 PHE A 440 -2.709 -2.791 1.015 1.00 10.00 C ATOM 451 CE2 PHE A 440 -3.061 -2.368 -1.299 1.00 10.00 C ATOM 452 CZ PHE A 440 -3.041 -3.233 -0.247 1.00 10.00 C ATOM 0 H PHE A 440 -4.226 -0.132 1.105 1.00 10.00 H new ATOM 0 HA PHE A 440 -2.548 1.951 2.112 1.00 10.00 H new ATOM 0 HB2 PHE A 440 -2.073 1.345 -0.658 1.00 10.00 H new ATOM 0 HB3 PHE A 440 -1.092 0.956 0.741 1.00 10.00 H new ATOM 0 HD1 PHE A 440 -2.129 -1.113 2.192 1.00 10.00 H new ATOM 0 HD2 PHE A 440 -2.768 -0.371 -1.941 1.00 10.00 H new ATOM 0 HE1 PHE A 440 -2.697 -3.479 1.847 1.00 10.00 H new ATOM 0 HE2 PHE A 440 -3.323 -2.721 -2.285 1.00 10.00 H new ATOM 0 HZ PHE A 440 -3.287 -4.273 -0.403 1.00 10.00 H new ATOM 462 N ARG A 441 -4.714 2.642 -0.258 1.00 10.00 N ATOM 463 CA ARG A 441 -5.344 3.744 -0.975 1.00 10.00 C ATOM 464 C ARG A 441 -6.103 4.638 0.000 1.00 10.00 C ATOM 465 O ARG A 441 -6.261 5.836 -0.233 1.00 10.00 O ATOM 466 CB ARG A 441 -6.298 3.230 -2.055 1.00 10.00 C ATOM 467 CG ARG A 441 -6.732 4.303 -3.041 1.00 10.00 C ATOM 468 CD ARG A 441 -7.850 5.163 -2.474 1.00 10.00 C ATOM 469 NE ARG A 441 -8.880 5.449 -3.470 1.00 10.00 N ATOM 470 CZ ARG A 441 -9.829 4.585 -3.824 1.00 10.00 C ATOM 471 NH1 ARG A 441 -9.880 3.380 -3.268 1.00 10.00 N ATOM 472 NH2 ARG A 441 -10.728 4.925 -4.735 1.00 10.00 N ATOM 0 H ARG A 441 -5.162 1.736 -0.392 1.00 10.00 H new ATOM 0 HA ARG A 441 -4.557 4.321 -1.460 1.00 10.00 H new ATOM 0 HB2 ARG A 441 -5.814 2.420 -2.601 1.00 10.00 H new ATOM 0 HB3 ARG A 441 -7.182 2.808 -1.577 1.00 10.00 H new ATOM 0 HG2 ARG A 441 -5.879 4.933 -3.293 1.00 10.00 H new ATOM 0 HG3 ARG A 441 -7.066 3.834 -3.967 1.00 10.00 H new ATOM 0 HD2 ARG A 441 -8.301 4.655 -1.622 1.00 10.00 H new ATOM 0 HD3 ARG A 441 -7.434 6.100 -2.103 1.00 10.00 H new ATOM 0 HE ARG A 441 -8.871 6.364 -3.920 1.00 10.00 H new ATOM 0 HH11 ARG A 441 -9.190 3.113 -2.566 1.00 10.00 H new ATOM 0 HH12 ARG A 441 -10.609 2.722 -3.543 1.00 10.00 H new ATOM 0 HH21 ARG A 441 -10.693 5.849 -5.166 1.00 10.00 H new ATOM 0 HH22 ARG A 441 -11.455 4.263 -5.006 1.00 10.00 H new ATOM 486 N GLU A 442 -6.563 4.045 1.102 1.00 10.00 N ATOM 487 CA GLU A 442 -7.295 4.788 2.119 1.00 10.00 C ATOM 488 C GLU A 442 -6.331 5.598 2.972 1.00 10.00 C ATOM 489 O GLU A 442 -6.603 6.749 3.311 1.00 10.00 O ATOM 490 CB GLU A 442 -8.112 3.840 3.001 1.00 10.00 C ATOM 491 CG GLU A 442 -8.800 4.529 4.168 1.00 10.00 C ATOM 492 CD GLU A 442 -9.540 3.556 5.066 1.00 10.00 C ATOM 493 OE1 GLU A 442 -10.373 2.785 4.544 1.00 10.00 O ATOM 494 OE2 GLU A 442 -9.289 3.566 6.288 1.00 10.00 O ATOM 0 H GLU A 442 -6.440 3.054 1.310 1.00 10.00 H new ATOM 0 HA GLU A 442 -7.983 5.469 1.618 1.00 10.00 H new ATOM 0 HB2 GLU A 442 -8.865 3.346 2.387 1.00 10.00 H new ATOM 0 HB3 GLU A 442 -7.455 3.061 3.387 1.00 10.00 H new ATOM 0 HG2 GLU A 442 -8.057 5.068 4.756 1.00 10.00 H new ATOM 0 HG3 GLU A 442 -9.502 5.270 3.785 1.00 10.00 H new ATOM 501 N LYS A 443 -5.191 4.998 3.299 1.00 10.00 N ATOM 502 CA LYS A 443 -4.184 5.676 4.089 1.00 10.00 C ATOM 503 C LYS A 443 -3.508 6.732 3.232 1.00 10.00 C ATOM 504 O LYS A 443 -3.246 7.843 3.684 1.00 10.00 O ATOM 505 CB LYS A 443 -3.150 4.678 4.615 1.00 10.00 C ATOM 506 CG LYS A 443 -3.699 3.734 5.671 1.00 10.00 C ATOM 507 CD LYS A 443 -3.439 4.258 7.075 1.00 10.00 C ATOM 508 CE LYS A 443 -4.645 5.001 7.625 1.00 10.00 C ATOM 509 NZ LYS A 443 -5.476 4.136 8.506 1.00 10.00 N ATOM 0 H LYS A 443 -4.947 4.046 3.027 1.00 10.00 H new ATOM 0 HA LYS A 443 -4.660 6.152 4.946 1.00 10.00 H new ATOM 0 HB2 LYS A 443 -2.765 4.092 3.780 1.00 10.00 H new ATOM 0 HB3 LYS A 443 -2.307 5.228 5.034 1.00 10.00 H new ATOM 0 HG2 LYS A 443 -4.771 3.604 5.523 1.00 10.00 H new ATOM 0 HG3 LYS A 443 -3.240 2.752 5.557 1.00 10.00 H new ATOM 0 HD2 LYS A 443 -3.191 3.426 7.735 1.00 10.00 H new ATOM 0 HD3 LYS A 443 -2.576 4.923 7.062 1.00 10.00 H new ATOM 0 HE2 LYS A 443 -4.309 5.874 8.185 1.00 10.00 H new ATOM 0 HE3 LYS A 443 -5.253 5.368 6.798 1.00 10.00 H new ATOM 0 HZ1 LYS A 443 -6.288 4.680 8.861 1.00 10.00 H new ATOM 0 HZ2 LYS A 443 -5.818 3.316 7.965 1.00 10.00 H new ATOM 0 HZ3 LYS A 443 -4.903 3.806 9.309 1.00 10.00 H new ATOM 523 N PHE A 444 -3.263 6.385 1.975 1.00 10.00 N ATOM 524 CA PHE A 444 -2.650 7.304 1.038 1.00 10.00 C ATOM 525 C PHE A 444 -3.597 8.459 0.792 1.00 10.00 C ATOM 526 O PHE A 444 -3.175 9.602 0.615 1.00 10.00 O ATOM 527 CB PHE A 444 -2.300 6.571 -0.254 1.00 10.00 C ATOM 528 CG PHE A 444 -1.729 7.455 -1.318 1.00 10.00 C ATOM 529 CD1 PHE A 444 -2.551 8.236 -2.114 1.00 10.00 C ATOM 530 CD2 PHE A 444 -0.364 7.498 -1.524 1.00 10.00 C ATOM 531 CE1 PHE A 444 -2.016 9.046 -3.099 1.00 10.00 C ATOM 532 CE2 PHE A 444 0.179 8.305 -2.505 1.00 10.00 C ATOM 533 CZ PHE A 444 -0.648 9.081 -3.294 1.00 10.00 C ATOM 0 H PHE A 444 -3.482 5.469 1.584 1.00 10.00 H new ATOM 0 HA PHE A 444 -1.722 7.702 1.448 1.00 10.00 H new ATOM 0 HB2 PHE A 444 -1.584 5.781 -0.029 1.00 10.00 H new ATOM 0 HB3 PHE A 444 -3.197 6.087 -0.640 1.00 10.00 H new ATOM 0 HD1 PHE A 444 -3.620 8.212 -1.964 1.00 10.00 H new ATOM 0 HD2 PHE A 444 0.287 6.893 -0.910 1.00 10.00 H new ATOM 0 HE1 PHE A 444 -2.666 9.650 -3.715 1.00 10.00 H new ATOM 0 HE2 PHE A 444 1.248 8.329 -2.655 1.00 10.00 H new ATOM 0 HZ PHE A 444 -0.227 9.713 -4.061 1.00 10.00 H new ATOM 543 N MET A 445 -4.890 8.162 0.850 1.00 10.00 N ATOM 544 CA MET A 445 -5.897 9.188 0.704 1.00 10.00 C ATOM 545 C MET A 445 -5.969 9.969 2.013 1.00 10.00 C ATOM 546 O MET A 445 -6.356 11.137 2.049 1.00 10.00 O ATOM 547 CB MET A 445 -7.259 8.574 0.370 1.00 10.00 C ATOM 548 CG MET A 445 -8.357 9.605 0.165 1.00 10.00 C ATOM 549 SD MET A 445 -8.409 10.238 -1.523 1.00 10.00 S ATOM 550 CE MET A 445 -8.517 12.000 -1.222 1.00 10.00 C ATOM 0 H MET A 445 -5.257 7.222 0.997 1.00 10.00 H new ATOM 0 HA MET A 445 -5.631 9.853 -0.118 1.00 10.00 H new ATOM 0 HB2 MET A 445 -7.165 7.971 -0.533 1.00 10.00 H new ATOM 0 HB3 MET A 445 -7.551 7.899 1.175 1.00 10.00 H new ATOM 0 HG2 MET A 445 -9.320 9.158 0.411 1.00 10.00 H new ATOM 0 HG3 MET A 445 -8.205 10.435 0.855 1.00 10.00 H new ATOM 0 HE1 MET A 445 -8.557 12.530 -2.174 1.00 10.00 H new ATOM 0 HE2 MET A 445 -9.418 12.216 -0.648 1.00 10.00 H new ATOM 0 HE3 MET A 445 -7.642 12.328 -0.661 1.00 10.00 H new ATOM 560 N GLN A 446 -5.559 9.290 3.087 1.00 10.00 N ATOM 561 CA GLN A 446 -5.523 9.857 4.426 1.00 10.00 C ATOM 562 C GLN A 446 -4.319 10.772 4.577 1.00 10.00 C ATOM 563 O GLN A 446 -4.387 11.822 5.219 1.00 10.00 O ATOM 564 CB GLN A 446 -5.415 8.726 5.452 1.00 10.00 C ATOM 565 CG GLN A 446 -5.869 9.118 6.848 1.00 10.00 C ATOM 566 CD GLN A 446 -6.598 7.995 7.559 1.00 10.00 C ATOM 567 OE1 GLN A 446 -6.276 7.651 8.696 1.00 10.00 O ATOM 568 NE2 GLN A 446 -7.588 7.416 6.889 1.00 10.00 N ATOM 0 H GLN A 446 -5.241 8.322 3.045 1.00 10.00 H new ATOM 0 HA GLN A 446 -6.435 10.430 4.590 1.00 10.00 H new ATOM 0 HB2 GLN A 446 -6.012 7.880 5.110 1.00 10.00 H new ATOM 0 HB3 GLN A 446 -4.380 8.388 5.498 1.00 10.00 H new ATOM 0 HG2 GLN A 446 -5.002 9.415 7.438 1.00 10.00 H new ATOM 0 HG3 GLN A 446 -6.523 9.987 6.783 1.00 10.00 H new ATOM 0 HE21 GLN A 446 -7.821 7.733 5.948 1.00 10.00 H new ATOM 0 HE22 GLN A 446 -8.115 6.654 7.315 1.00 10.00 H new ATOM 577 N HIS A 447 -3.210 10.340 3.994 1.00 10.00 N ATOM 578 CA HIS A 447 -1.960 11.074 4.061 1.00 10.00 C ATOM 579 C HIS A 447 -1.623 11.706 2.707 1.00 10.00 C ATOM 580 O HIS A 447 -1.445 11.004 1.712 1.00 10.00 O ATOM 581 CB HIS A 447 -0.852 10.120 4.513 1.00 10.00 C ATOM 582 CG HIS A 447 -1.261 9.270 5.684 1.00 10.00 C ATOM 583 ND1 HIS A 447 -1.616 7.958 5.765 1.00 10.00 N flip ATOM 584 CD2 HIS A 447 -1.370 9.770 6.964 1.00 10.00 C flip ATOM 585 CE1 HIS A 447 -1.930 7.706 7.078 1.00 10.00 C flip ATOM 586 NE2 HIS A 447 -1.772 8.811 7.779 1.00 10.00 N flip ATOM 0 H HIS A 447 -3.154 9.471 3.462 1.00 10.00 H new ATOM 0 HA HIS A 447 -2.054 11.887 4.781 1.00 10.00 H new ATOM 0 HB2 HIS A 447 -0.572 9.474 3.681 1.00 10.00 H new ATOM 0 HB3 HIS A 447 0.033 10.698 4.780 1.00 10.00 H new ATOM 0 HD1 HIS A 447 -1.644 7.289 4.996 1.00 10.00 H new ATOM 0 HD2 HIS A 447 -1.159 10.788 7.256 1.00 10.00 H new ATOM 0 HE1 HIS A 447 -2.254 6.755 7.473 1.00 10.00 H new ATOM 595 N PRO A 448 -1.547 13.051 2.652 1.00 10.00 N ATOM 596 CA PRO A 448 -1.249 13.785 1.416 1.00 10.00 C ATOM 597 C PRO A 448 -0.116 13.166 0.601 1.00 10.00 C ATOM 598 O PRO A 448 1.053 13.497 0.797 1.00 10.00 O ATOM 599 CB PRO A 448 -0.846 15.165 1.928 1.00 10.00 C ATOM 600 CG PRO A 448 -1.630 15.340 3.182 1.00 10.00 C ATOM 601 CD PRO A 448 -1.759 13.968 3.792 1.00 10.00 C ATOM 0 HA PRO A 448 -2.100 13.786 0.734 1.00 10.00 H new ATOM 0 HB2 PRO A 448 0.226 15.220 2.119 1.00 10.00 H new ATOM 0 HB3 PRO A 448 -1.081 15.942 1.201 1.00 10.00 H new ATOM 0 HG2 PRO A 448 -1.125 16.024 3.865 1.00 10.00 H new ATOM 0 HG3 PRO A 448 -2.611 15.766 2.972 1.00 10.00 H new ATOM 0 HD2 PRO A 448 -1.019 13.808 4.576 1.00 10.00 H new ATOM 0 HD3 PRO A 448 -2.740 13.823 4.245 1.00 10.00 H new ATOM 609 N LYS A 449 -0.480 12.277 -0.324 1.00 10.00 N ATOM 610 CA LYS A 449 0.489 11.609 -1.195 1.00 10.00 C ATOM 611 C LYS A 449 1.776 11.257 -0.453 1.00 10.00 C ATOM 612 O LYS A 449 2.863 11.294 -1.027 1.00 10.00 O ATOM 613 CB LYS A 449 0.814 12.494 -2.400 1.00 10.00 C ATOM 614 CG LYS A 449 1.247 11.713 -3.629 1.00 10.00 C ATOM 615 CD LYS A 449 2.358 12.428 -4.381 1.00 10.00 C ATOM 616 CE LYS A 449 3.676 12.359 -3.627 1.00 10.00 C ATOM 617 NZ LYS A 449 4.737 13.170 -4.287 1.00 10.00 N ATOM 0 H LYS A 449 -1.448 12.001 -0.490 1.00 10.00 H new ATOM 0 HA LYS A 449 0.034 10.679 -1.534 1.00 10.00 H new ATOM 0 HB2 LYS A 449 -0.064 13.090 -2.649 1.00 10.00 H new ATOM 0 HB3 LYS A 449 1.606 13.191 -2.125 1.00 10.00 H new ATOM 0 HG2 LYS A 449 1.588 10.722 -3.330 1.00 10.00 H new ATOM 0 HG3 LYS A 449 0.392 11.570 -4.290 1.00 10.00 H new ATOM 0 HD2 LYS A 449 2.478 11.980 -5.367 1.00 10.00 H new ATOM 0 HD3 LYS A 449 2.081 13.471 -4.536 1.00 10.00 H new ATOM 0 HE2 LYS A 449 3.530 12.714 -2.607 1.00 10.00 H new ATOM 0 HE3 LYS A 449 4.002 11.321 -3.560 1.00 10.00 H new ATOM 0 HZ1 LYS A 449 5.620 13.096 -3.742 1.00 10.00 H new ATOM 0 HZ2 LYS A 449 4.895 12.815 -5.252 1.00 10.00 H new ATOM 0 HZ3 LYS A 449 4.438 14.165 -4.329 1.00 10.00 H new ATOM 631 N ASN A 450 1.646 10.920 0.825 1.00 10.00 N ATOM 632 CA ASN A 450 2.800 10.566 1.641 1.00 10.00 C ATOM 633 C ASN A 450 3.617 9.454 0.994 1.00 10.00 C ATOM 634 O ASN A 450 4.736 9.676 0.533 1.00 10.00 O ATOM 635 CB ASN A 450 2.346 10.127 3.034 1.00 10.00 C ATOM 636 CG ASN A 450 2.310 11.276 4.020 1.00 10.00 C ATOM 637 OD1 ASN A 450 2.325 12.444 3.632 1.00 10.00 O ATOM 638 ND2 ASN A 450 2.261 10.950 5.306 1.00 10.00 N ATOM 0 H ASN A 450 0.754 10.885 1.318 1.00 10.00 H new ATOM 0 HA ASN A 450 3.432 11.450 1.725 1.00 10.00 H new ATOM 0 HB2 ASN A 450 1.354 9.680 2.965 1.00 10.00 H new ATOM 0 HB3 ASN A 450 3.019 9.354 3.406 1.00 10.00 H new ATOM 0 HD21 ASN A 450 2.234 11.681 6.017 1.00 10.00 H new ATOM 0 HD22 ASN A 450 2.250 9.968 5.583 1.00 10.00 H new ATOM 645 N PHE A 451 3.051 8.251 0.988 1.00 10.00 N ATOM 646 CA PHE A 451 3.715 7.073 0.424 1.00 10.00 C ATOM 647 C PHE A 451 4.769 6.529 1.388 1.00 10.00 C ATOM 648 O PHE A 451 5.220 5.391 1.250 1.00 10.00 O ATOM 649 CB PHE A 451 4.340 7.386 -0.944 1.00 10.00 C ATOM 650 CG PHE A 451 3.754 6.585 -2.079 1.00 10.00 C ATOM 651 CD1 PHE A 451 2.438 6.152 -2.033 1.00 10.00 C ATOM 652 CD2 PHE A 451 4.515 6.272 -3.194 1.00 10.00 C ATOM 653 CE1 PHE A 451 1.893 5.425 -3.070 1.00 10.00 C ATOM 654 CE2 PHE A 451 3.976 5.542 -4.237 1.00 10.00 C ATOM 655 CZ PHE A 451 2.663 5.118 -4.175 1.00 10.00 C ATOM 0 H PHE A 451 2.125 8.062 1.371 1.00 10.00 H new ATOM 0 HA PHE A 451 2.956 6.304 0.276 1.00 10.00 H new ATOM 0 HB2 PHE A 451 4.212 8.447 -1.157 1.00 10.00 H new ATOM 0 HB3 PHE A 451 5.412 7.198 -0.895 1.00 10.00 H new ATOM 0 HD1 PHE A 451 1.830 6.388 -1.172 1.00 10.00 H new ATOM 0 HD2 PHE A 451 5.542 6.602 -3.249 1.00 10.00 H new ATOM 0 HE1 PHE A 451 0.866 5.096 -3.018 1.00 10.00 H new ATOM 0 HE2 PHE A 451 4.581 5.304 -5.099 1.00 10.00 H new ATOM 0 HZ PHE A 451 2.239 4.548 -4.988 1.00 10.00 H new ATOM 665 N GLY A 452 5.136 7.334 2.382 1.00 10.00 N ATOM 666 CA GLY A 452 6.103 6.906 3.367 1.00 10.00 C ATOM 667 C GLY A 452 5.422 6.217 4.529 1.00 10.00 C ATOM 668 O GLY A 452 5.979 5.304 5.136 1.00 10.00 O ATOM 0 H GLY A 452 4.776 8.279 2.519 1.00 10.00 H new ATOM 0 HA2 GLY A 452 6.821 6.227 2.907 1.00 10.00 H new ATOM 0 HA3 GLY A 452 6.665 7.767 3.728 1.00 10.00 H new ATOM 672 N LEU A 453 4.195 6.649 4.824 1.00 10.00 N ATOM 673 CA LEU A 453 3.421 6.057 5.904 1.00 10.00 C ATOM 674 C LEU A 453 2.813 4.744 5.451 1.00 10.00 C ATOM 675 O LEU A 453 2.987 3.713 6.099 1.00 10.00 O ATOM 676 CB LEU A 453 2.310 6.998 6.372 1.00 10.00 C ATOM 677 CG LEU A 453 1.274 6.347 7.295 1.00 10.00 C ATOM 678 CD1 LEU A 453 0.694 7.371 8.252 1.00 10.00 C ATOM 679 CD2 LEU A 453 0.175 5.670 6.477 1.00 10.00 C ATOM 0 H LEU A 453 3.721 7.405 4.329 1.00 10.00 H new ATOM 0 HA LEU A 453 4.098 5.879 6.740 1.00 10.00 H new ATOM 0 HB2 LEU A 453 2.762 7.843 6.892 1.00 10.00 H new ATOM 0 HB3 LEU A 453 1.798 7.399 5.497 1.00 10.00 H new ATOM 0 HG LEU A 453 1.772 5.579 7.887 1.00 10.00 H new ATOM 0 HD11 LEU A 453 -0.039 6.890 8.899 1.00 10.00 H new ATOM 0 HD12 LEU A 453 1.493 7.794 8.861 1.00 10.00 H new ATOM 0 HD13 LEU A 453 0.211 8.167 7.685 1.00 10.00 H new ATOM 0 HD21 LEU A 453 -0.551 5.214 7.150 1.00 10.00 H new ATOM 0 HD22 LEU A 453 -0.324 6.412 5.854 1.00 10.00 H new ATOM 0 HD23 LEU A 453 0.615 4.901 5.843 1.00 10.00 H new ATOM 691 N ILE A 454 2.103 4.783 4.329 1.00 10.00 N ATOM 692 CA ILE A 454 1.484 3.586 3.795 1.00 10.00 C ATOM 693 C ILE A 454 2.534 2.510 3.604 1.00 10.00 C ATOM 694 O ILE A 454 2.331 1.357 3.969 1.00 10.00 O ATOM 695 CB ILE A 454 0.757 3.880 2.471 1.00 10.00 C ATOM 696 CG1 ILE A 454 -0.541 4.607 2.774 1.00 10.00 C ATOM 697 CG2 ILE A 454 0.492 2.604 1.680 1.00 10.00 C ATOM 698 CD1 ILE A 454 -0.415 6.103 2.614 1.00 10.00 C ATOM 0 H ILE A 454 1.945 5.627 3.778 1.00 10.00 H new ATOM 0 HA ILE A 454 0.738 3.233 4.507 1.00 10.00 H new ATOM 0 HB ILE A 454 1.395 4.510 1.851 1.00 10.00 H new ATOM 0 HG12 ILE A 454 -1.324 4.238 2.111 1.00 10.00 H new ATOM 0 HG13 ILE A 454 -0.853 4.379 3.793 1.00 10.00 H new ATOM 0 HG21 ILE A 454 -0.023 2.852 0.752 1.00 10.00 H new ATOM 0 HG22 ILE A 454 1.439 2.115 1.451 1.00 10.00 H new ATOM 0 HG23 ILE A 454 -0.130 1.932 2.271 1.00 10.00 H new ATOM 0 HD11 ILE A 454 -1.371 6.575 2.842 1.00 10.00 H new ATOM 0 HD12 ILE A 454 0.348 6.479 3.296 1.00 10.00 H new ATOM 0 HD13 ILE A 454 -0.131 6.337 1.588 1.00 10.00 H new ATOM 710 N ALA A 455 3.677 2.918 3.076 1.00 10.00 N ATOM 711 CA ALA A 455 4.794 2.010 2.874 1.00 10.00 C ATOM 712 C ALA A 455 5.392 1.594 4.217 1.00 10.00 C ATOM 713 O ALA A 455 6.351 0.825 4.270 1.00 10.00 O ATOM 714 CB ALA A 455 5.855 2.664 2.000 1.00 10.00 C ATOM 0 H ALA A 455 3.856 3.877 2.778 1.00 10.00 H new ATOM 0 HA ALA A 455 4.429 1.117 2.367 1.00 10.00 H new ATOM 0 HB1 ALA A 455 6.686 1.973 1.857 1.00 10.00 H new ATOM 0 HB2 ALA A 455 5.423 2.917 1.032 1.00 10.00 H new ATOM 0 HB3 ALA A 455 6.217 3.571 2.484 1.00 10.00 H new ATOM 720 N SER A 456 4.817 2.115 5.304 1.00 10.00 N ATOM 721 CA SER A 456 5.289 1.804 6.644 1.00 10.00 C ATOM 722 C SER A 456 4.401 0.758 7.310 1.00 10.00 C ATOM 723 O SER A 456 4.892 -0.103 8.039 1.00 10.00 O ATOM 724 CB SER A 456 5.328 3.073 7.499 1.00 10.00 C ATOM 725 OG SER A 456 6.258 2.944 8.561 1.00 10.00 O ATOM 0 H SER A 456 4.023 2.755 5.276 1.00 10.00 H new ATOM 0 HA SER A 456 6.296 1.396 6.560 1.00 10.00 H new ATOM 0 HB2 SER A 456 5.598 3.926 6.877 1.00 10.00 H new ATOM 0 HB3 SER A 456 4.336 3.274 7.903 1.00 10.00 H new ATOM 0 HG SER A 456 6.265 3.768 9.091 1.00 10.00 H new ATOM 731 N PHE A 457 3.093 0.825 7.058 1.00 10.00 N ATOM 732 CA PHE A 457 2.173 -0.138 7.649 1.00 10.00 C ATOM 733 C PHE A 457 2.175 -1.441 6.848 1.00 10.00 C ATOM 734 O PHE A 457 1.907 -2.514 7.388 1.00 10.00 O ATOM 735 CB PHE A 457 0.759 0.455 7.766 1.00 10.00 C ATOM 736 CG PHE A 457 -0.030 0.451 6.489 1.00 10.00 C ATOM 737 CD1 PHE A 457 -0.523 -0.736 5.971 1.00 10.00 C ATOM 738 CD2 PHE A 457 -0.289 1.636 5.810 1.00 10.00 C ATOM 739 CE1 PHE A 457 -1.253 -0.746 4.801 1.00 10.00 C ATOM 740 CE2 PHE A 457 -1.020 1.628 4.643 1.00 10.00 C ATOM 741 CZ PHE A 457 -1.501 0.442 4.137 1.00 10.00 C ATOM 0 H PHE A 457 2.656 1.525 6.459 1.00 10.00 H new ATOM 0 HA PHE A 457 2.512 -0.368 8.659 1.00 10.00 H new ATOM 0 HB2 PHE A 457 0.206 -0.105 8.521 1.00 10.00 H new ATOM 0 HB3 PHE A 457 0.839 1.481 8.125 1.00 10.00 H new ATOM 0 HD1 PHE A 457 -0.333 -1.664 6.490 1.00 10.00 H new ATOM 0 HD2 PHE A 457 0.086 2.570 6.201 1.00 10.00 H new ATOM 0 HE1 PHE A 457 -1.630 -1.677 4.405 1.00 10.00 H new ATOM 0 HE2 PHE A 457 -1.216 2.554 4.124 1.00 10.00 H new ATOM 0 HZ PHE A 457 -2.073 0.439 3.221 1.00 10.00 H new ATOM 751 N LEU A 458 2.514 -1.342 5.563 1.00 10.00 N ATOM 752 CA LEU A 458 2.594 -2.513 4.693 1.00 10.00 C ATOM 753 C LEU A 458 4.015 -2.647 4.150 1.00 10.00 C ATOM 754 O LEU A 458 4.231 -2.776 2.946 1.00 10.00 O ATOM 755 CB LEU A 458 1.578 -2.419 3.547 1.00 10.00 C ATOM 756 CG LEU A 458 1.430 -1.037 2.913 1.00 10.00 C ATOM 757 CD1 LEU A 458 2.757 -0.579 2.335 1.00 10.00 C ATOM 758 CD2 LEU A 458 0.352 -1.050 1.835 1.00 10.00 C ATOM 0 H LEU A 458 2.738 -0.460 5.101 1.00 10.00 H new ATOM 0 HA LEU A 458 2.349 -3.402 5.274 1.00 10.00 H new ATOM 0 HB2 LEU A 458 1.866 -3.127 2.770 1.00 10.00 H new ATOM 0 HB3 LEU A 458 0.604 -2.734 3.921 1.00 10.00 H new ATOM 0 HG LEU A 458 1.126 -0.333 3.688 1.00 10.00 H new ATOM 0 HD11 LEU A 458 2.637 0.407 1.886 1.00 10.00 H new ATOM 0 HD12 LEU A 458 3.502 -0.528 3.129 1.00 10.00 H new ATOM 0 HD13 LEU A 458 3.086 -1.286 1.574 1.00 10.00 H new ATOM 0 HD21 LEU A 458 0.263 -0.056 1.397 1.00 10.00 H new ATOM 0 HD22 LEU A 458 0.622 -1.766 1.059 1.00 10.00 H new ATOM 0 HD23 LEU A 458 -0.602 -1.338 2.278 1.00 10.00 H new ATOM 770 N GLU A 459 4.973 -2.595 5.075 1.00 10.00 N ATOM 771 CA GLU A 459 6.410 -2.683 4.781 1.00 10.00 C ATOM 772 C GLU A 459 6.715 -3.492 3.525 1.00 10.00 C ATOM 773 O GLU A 459 7.570 -3.107 2.728 1.00 10.00 O ATOM 774 CB GLU A 459 7.148 -3.293 5.973 1.00 10.00 C ATOM 775 CG GLU A 459 7.518 -2.280 7.044 1.00 10.00 C ATOM 776 CD GLU A 459 8.974 -1.862 6.973 1.00 10.00 C ATOM 777 OE1 GLU A 459 9.841 -2.752 6.837 1.00 10.00 O ATOM 778 OE2 GLU A 459 9.248 -0.646 7.054 1.00 10.00 O ATOM 0 H GLU A 459 4.772 -2.489 6.069 1.00 10.00 H new ATOM 0 HA GLU A 459 6.755 -1.665 4.598 1.00 10.00 H new ATOM 0 HB2 GLU A 459 6.524 -4.068 6.418 1.00 10.00 H new ATOM 0 HB3 GLU A 459 8.056 -3.780 5.617 1.00 10.00 H new ATOM 0 HG2 GLU A 459 6.885 -1.399 6.939 1.00 10.00 H new ATOM 0 HG3 GLU A 459 7.313 -2.705 8.027 1.00 10.00 H new ATOM 785 N ARG A 460 6.017 -4.609 3.350 1.00 10.00 N ATOM 786 CA ARG A 460 6.222 -5.464 2.181 1.00 10.00 C ATOM 787 C ARG A 460 6.297 -4.628 0.905 1.00 10.00 C ATOM 788 O ARG A 460 6.931 -5.022 -0.074 1.00 10.00 O ATOM 789 CB ARG A 460 5.092 -6.489 2.068 1.00 10.00 C ATOM 790 CG ARG A 460 5.324 -7.745 2.891 1.00 10.00 C ATOM 791 CD ARG A 460 5.825 -8.894 2.028 1.00 10.00 C ATOM 792 NE ARG A 460 6.970 -8.504 1.208 1.00 10.00 N ATOM 793 CZ ARG A 460 7.807 -9.372 0.644 1.00 10.00 C ATOM 794 NH1 ARG A 460 7.631 -10.677 0.808 1.00 10.00 N ATOM 795 NH2 ARG A 460 8.823 -8.933 -0.086 1.00 10.00 N ATOM 0 H ARG A 460 5.306 -4.945 3.999 1.00 10.00 H new ATOM 0 HA ARG A 460 7.168 -5.991 2.307 1.00 10.00 H new ATOM 0 HB2 ARG A 460 4.158 -6.024 2.385 1.00 10.00 H new ATOM 0 HB3 ARG A 460 4.970 -6.768 1.021 1.00 10.00 H new ATOM 0 HG2 ARG A 460 6.049 -7.537 3.678 1.00 10.00 H new ATOM 0 HG3 ARG A 460 4.395 -8.036 3.382 1.00 10.00 H new ATOM 0 HD2 ARG A 460 6.105 -9.732 2.667 1.00 10.00 H new ATOM 0 HD3 ARG A 460 5.018 -9.241 1.382 1.00 10.00 H new ATOM 0 HE ARG A 460 7.138 -7.509 1.059 1.00 10.00 H new ATOM 0 HH11 ARG A 460 6.851 -11.020 1.369 1.00 10.00 H new ATOM 0 HH12 ARG A 460 8.276 -11.337 0.373 1.00 10.00 H new ATOM 0 HH21 ARG A 460 8.963 -7.931 -0.215 1.00 10.00 H new ATOM 0 HH22 ARG A 460 9.465 -9.597 -0.519 1.00 10.00 H new ATOM 809 N LYS A 461 5.648 -3.468 0.934 1.00 10.00 N ATOM 810 CA LYS A 461 5.635 -2.563 -0.206 1.00 10.00 C ATOM 811 C LYS A 461 6.522 -1.353 0.060 1.00 10.00 C ATOM 812 O LYS A 461 6.428 -0.721 1.112 1.00 10.00 O ATOM 813 CB LYS A 461 4.206 -2.093 -0.507 1.00 10.00 C ATOM 814 CG LYS A 461 3.120 -3.045 -0.024 1.00 10.00 C ATOM 815 CD LYS A 461 2.699 -4.001 -1.129 1.00 10.00 C ATOM 816 CE LYS A 461 3.781 -5.028 -1.426 1.00 10.00 C ATOM 817 NZ LYS A 461 3.437 -6.371 -0.886 1.00 10.00 N ATOM 0 H LYS A 461 5.122 -3.133 1.741 1.00 10.00 H new ATOM 0 HA LYS A 461 6.021 -3.106 -1.069 1.00 10.00 H new ATOM 0 HB2 LYS A 461 4.051 -1.118 -0.044 1.00 10.00 H new ATOM 0 HB3 LYS A 461 4.100 -1.955 -1.583 1.00 10.00 H new ATOM 0 HG2 LYS A 461 3.484 -3.612 0.833 1.00 10.00 H new ATOM 0 HG3 LYS A 461 2.256 -2.474 0.316 1.00 10.00 H new ATOM 0 HD2 LYS A 461 1.782 -4.513 -0.838 1.00 10.00 H new ATOM 0 HD3 LYS A 461 2.475 -3.436 -2.034 1.00 10.00 H new ATOM 0 HE2 LYS A 461 3.929 -5.097 -2.504 1.00 10.00 H new ATOM 0 HE3 LYS A 461 4.725 -4.695 -0.995 1.00 10.00 H new ATOM 0 HZ1 LYS A 461 4.215 -7.033 -1.080 1.00 10.00 H new ATOM 0 HZ2 LYS A 461 3.287 -6.304 0.141 1.00 10.00 H new ATOM 0 HZ3 LYS A 461 2.568 -6.716 -1.341 1.00 10.00 H new ATOM 831 N THR A 462 7.379 -1.032 -0.901 1.00 10.00 N ATOM 832 CA THR A 462 8.277 0.110 -0.769 1.00 10.00 C ATOM 833 C THR A 462 7.628 1.366 -1.339 1.00 10.00 C ATOM 834 O THR A 462 6.658 1.286 -2.092 1.00 10.00 O ATOM 835 CB THR A 462 9.607 -0.167 -1.478 1.00 10.00 C ATOM 836 OG1 THR A 462 9.583 -1.429 -2.119 1.00 10.00 O ATOM 837 CG2 THR A 462 10.796 -0.152 -0.543 1.00 10.00 C ATOM 0 H THR A 462 7.472 -1.544 -1.778 1.00 10.00 H new ATOM 0 HA THR A 462 8.475 0.270 0.291 1.00 10.00 H new ATOM 0 HB THR A 462 9.721 0.640 -2.201 1.00 10.00 H new ATOM 0 HG1 THR A 462 10.276 -1.458 -2.811 1.00 10.00 H new ATOM 0 HG21 THR A 462 11.706 -0.355 -1.108 1.00 10.00 H new ATOM 0 HG22 THR A 462 10.874 0.826 -0.069 1.00 10.00 H new ATOM 0 HG23 THR A 462 10.666 -0.917 0.223 1.00 10.00 H new ATOM 845 N VAL A 463 8.167 2.526 -0.980 1.00 10.00 N ATOM 846 CA VAL A 463 7.630 3.792 -1.464 1.00 10.00 C ATOM 847 C VAL A 463 7.697 3.861 -2.986 1.00 10.00 C ATOM 848 O VAL A 463 6.810 4.417 -3.632 1.00 10.00 O ATOM 849 CB VAL A 463 8.382 4.996 -0.861 1.00 10.00 C ATOM 850 CG1 VAL A 463 7.708 6.303 -1.253 1.00 10.00 C ATOM 851 CG2 VAL A 463 8.469 4.868 0.654 1.00 10.00 C ATOM 0 H VAL A 463 8.971 2.616 -0.359 1.00 10.00 H new ATOM 0 HA VAL A 463 6.589 3.841 -1.146 1.00 10.00 H new ATOM 0 HB VAL A 463 9.395 5.003 -1.263 1.00 10.00 H new ATOM 0 HG11 VAL A 463 8.255 7.139 -0.817 1.00 10.00 H new ATOM 0 HG12 VAL A 463 7.704 6.399 -2.339 1.00 10.00 H new ATOM 0 HG13 VAL A 463 6.682 6.308 -0.884 1.00 10.00 H new ATOM 0 HG21 VAL A 463 9.003 5.726 1.062 1.00 10.00 H new ATOM 0 HG22 VAL A 463 7.464 4.833 1.074 1.00 10.00 H new ATOM 0 HG23 VAL A 463 9.003 3.953 0.912 1.00 10.00 H new ATOM 861 N ALA A 464 8.747 3.276 -3.551 1.00 10.00 N ATOM 862 CA ALA A 464 8.921 3.253 -4.998 1.00 10.00 C ATOM 863 C ALA A 464 8.119 2.110 -5.608 1.00 10.00 C ATOM 864 O ALA A 464 7.654 2.198 -6.744 1.00 10.00 O ATOM 865 CB ALA A 464 10.394 3.123 -5.355 1.00 10.00 C ATOM 0 H ALA A 464 9.490 2.812 -3.029 1.00 10.00 H new ATOM 0 HA ALA A 464 8.551 4.193 -5.408 1.00 10.00 H new ATOM 0 HB1 ALA A 464 10.506 3.107 -6.439 1.00 10.00 H new ATOM 0 HB2 ALA A 464 10.944 3.971 -4.946 1.00 10.00 H new ATOM 0 HB3 ALA A 464 10.790 2.198 -4.936 1.00 10.00 H new ATOM 871 N GLU A 465 7.952 1.040 -4.835 1.00 10.00 N ATOM 872 CA GLU A 465 7.197 -0.119 -5.289 1.00 10.00 C ATOM 873 C GLU A 465 5.698 0.145 -5.185 1.00 10.00 C ATOM 874 O GLU A 465 4.904 -0.445 -5.917 1.00 10.00 O ATOM 875 CB GLU A 465 7.567 -1.354 -4.467 1.00 10.00 C ATOM 876 CG GLU A 465 7.481 -2.653 -5.250 1.00 10.00 C ATOM 877 CD GLU A 465 8.362 -2.650 -6.484 1.00 10.00 C ATOM 878 OE1 GLU A 465 7.906 -2.156 -7.538 1.00 10.00 O ATOM 879 OE2 GLU A 465 9.507 -3.140 -6.398 1.00 10.00 O ATOM 0 H GLU A 465 8.330 0.954 -3.892 1.00 10.00 H new ATOM 0 HA GLU A 465 7.450 -0.303 -6.333 1.00 10.00 H new ATOM 0 HB2 GLU A 465 8.581 -1.236 -4.085 1.00 10.00 H new ATOM 0 HB3 GLU A 465 6.906 -1.416 -3.602 1.00 10.00 H new ATOM 0 HG2 GLU A 465 7.770 -3.482 -4.604 1.00 10.00 H new ATOM 0 HG3 GLU A 465 6.447 -2.826 -5.547 1.00 10.00 H new ATOM 886 N CYS A 466 5.318 1.043 -4.279 1.00 10.00 N ATOM 887 CA CYS A 466 3.915 1.387 -4.097 1.00 10.00 C ATOM 888 C CYS A 466 3.370 2.060 -5.350 1.00 10.00 C ATOM 889 O CYS A 466 2.166 2.038 -5.606 1.00 10.00 O ATOM 890 CB CYS A 466 3.739 2.301 -2.883 1.00 10.00 C ATOM 891 SG CYS A 466 2.049 2.361 -2.243 1.00 10.00 S ATOM 0 H CYS A 466 5.960 1.542 -3.664 1.00 10.00 H new ATOM 0 HA CYS A 466 3.354 0.469 -3.921 1.00 10.00 H new ATOM 0 HB2 CYS A 466 4.405 1.964 -2.089 1.00 10.00 H new ATOM 0 HB3 CYS A 466 4.050 3.310 -3.153 1.00 10.00 H new ATOM 0 HG CYS A 466 1.567 3.558 -2.401 1.00 10.00 H new ATOM 897 N VAL A 467 4.270 2.640 -6.142 1.00 10.00 N ATOM 898 CA VAL A 467 3.883 3.294 -7.383 1.00 10.00 C ATOM 899 C VAL A 467 3.192 2.297 -8.315 1.00 10.00 C ATOM 900 O VAL A 467 2.531 2.685 -9.276 1.00 10.00 O ATOM 901 CB VAL A 467 5.106 3.908 -8.100 1.00 10.00 C ATOM 902 CG1 VAL A 467 4.736 4.394 -9.497 1.00 10.00 C ATOM 903 CG2 VAL A 467 5.692 5.043 -7.277 1.00 10.00 C ATOM 0 H VAL A 467 5.270 2.669 -5.944 1.00 10.00 H new ATOM 0 HA VAL A 467 3.191 4.098 -7.131 1.00 10.00 H new ATOM 0 HB VAL A 467 5.862 3.129 -8.204 1.00 10.00 H new ATOM 0 HG11 VAL A 467 5.616 4.821 -9.978 1.00 10.00 H new ATOM 0 HG12 VAL A 467 4.370 3.555 -10.089 1.00 10.00 H new ATOM 0 HG13 VAL A 467 3.958 5.153 -9.424 1.00 10.00 H new ATOM 0 HG21 VAL A 467 6.552 5.463 -7.798 1.00 10.00 H new ATOM 0 HG22 VAL A 467 4.938 5.818 -7.137 1.00 10.00 H new ATOM 0 HG23 VAL A 467 6.006 4.663 -6.305 1.00 10.00 H new ATOM 913 N LEU A 468 3.351 1.007 -8.021 1.00 10.00 N ATOM 914 CA LEU A 468 2.745 -0.041 -8.828 1.00 10.00 C ATOM 915 C LEU A 468 1.260 -0.215 -8.504 1.00 10.00 C ATOM 916 O LEU A 468 0.603 -1.092 -9.056 1.00 10.00 O ATOM 917 CB LEU A 468 3.492 -1.360 -8.618 1.00 10.00 C ATOM 918 CG LEU A 468 4.076 -1.983 -9.887 1.00 10.00 C ATOM 919 CD1 LEU A 468 5.275 -1.183 -10.372 1.00 10.00 C ATOM 920 CD2 LEU A 468 4.465 -3.433 -9.637 1.00 10.00 C ATOM 0 H LEU A 468 3.896 0.667 -7.228 1.00 10.00 H new ATOM 0 HA LEU A 468 2.821 0.255 -9.874 1.00 10.00 H new ATOM 0 HB2 LEU A 468 4.302 -1.192 -7.908 1.00 10.00 H new ATOM 0 HB3 LEU A 468 2.810 -2.077 -8.160 1.00 10.00 H new ATOM 0 HG LEU A 468 3.313 -1.961 -10.665 1.00 10.00 H new ATOM 0 HD11 LEU A 468 5.677 -1.641 -11.276 1.00 10.00 H new ATOM 0 HD12 LEU A 468 4.966 -0.161 -10.590 1.00 10.00 H new ATOM 0 HD13 LEU A 468 6.043 -1.173 -9.598 1.00 10.00 H new ATOM 0 HD21 LEU A 468 4.879 -3.861 -10.550 1.00 10.00 H new ATOM 0 HD22 LEU A 468 5.212 -3.478 -8.844 1.00 10.00 H new ATOM 0 HD23 LEU A 468 3.583 -4.000 -9.337 1.00 10.00 H new ATOM 932 N TYR A 469 0.743 0.629 -7.613 1.00 10.00 N ATOM 933 CA TYR A 469 -0.662 0.587 -7.224 1.00 10.00 C ATOM 934 C TYR A 469 -1.336 1.936 -7.488 1.00 10.00 C ATOM 935 O TYR A 469 -2.551 2.070 -7.347 1.00 10.00 O ATOM 936 CB TYR A 469 -0.784 0.169 -5.746 1.00 10.00 C ATOM 937 CG TYR A 469 -1.347 1.195 -4.778 1.00 10.00 C ATOM 938 CD1 TYR A 469 -0.965 2.529 -4.838 1.00 10.00 C ATOM 939 CD2 TYR A 469 -2.245 0.813 -3.782 1.00 10.00 C ATOM 940 CE1 TYR A 469 -1.460 3.455 -3.946 1.00 10.00 C ATOM 941 CE2 TYR A 469 -2.746 1.739 -2.890 1.00 10.00 C ATOM 942 CZ TYR A 469 -2.350 3.058 -2.976 1.00 10.00 C ATOM 943 OH TYR A 469 -2.835 3.980 -2.085 1.00 10.00 O ATOM 0 H TYR A 469 1.283 1.356 -7.144 1.00 10.00 H new ATOM 0 HA TYR A 469 -1.179 -0.157 -7.830 1.00 10.00 H new ATOM 0 HB2 TYR A 469 -1.411 -0.721 -5.697 1.00 10.00 H new ATOM 0 HB3 TYR A 469 0.206 -0.120 -5.394 1.00 10.00 H new ATOM 0 HD1 TYR A 469 -0.267 2.846 -5.598 1.00 10.00 H new ATOM 0 HD2 TYR A 469 -2.552 -0.220 -3.708 1.00 10.00 H new ATOM 0 HE1 TYR A 469 -1.150 4.488 -4.008 1.00 10.00 H new ATOM 0 HE2 TYR A 469 -3.446 1.432 -2.127 1.00 10.00 H new ATOM 0 HH TYR A 469 -3.137 4.776 -2.570 1.00 10.00 H new ATOM 953 N TYR A 470 -0.530 2.939 -7.846 1.00 10.00 N ATOM 954 CA TYR A 470 -1.039 4.279 -8.099 1.00 10.00 C ATOM 955 C TYR A 470 -1.394 4.483 -9.570 1.00 10.00 C ATOM 956 O TYR A 470 -2.277 5.276 -9.889 1.00 10.00 O ATOM 957 CB TYR A 470 -0.014 5.327 -7.627 1.00 10.00 C ATOM 958 CG TYR A 470 0.618 6.152 -8.733 1.00 10.00 C ATOM 959 CD1 TYR A 470 1.361 5.550 -9.740 1.00 10.00 C ATOM 960 CD2 TYR A 470 0.476 7.534 -8.762 1.00 10.00 C ATOM 961 CE1 TYR A 470 1.942 6.298 -10.745 1.00 10.00 C ATOM 962 CE2 TYR A 470 1.054 8.290 -9.765 1.00 10.00 C ATOM 963 CZ TYR A 470 1.785 7.667 -10.754 1.00 10.00 C ATOM 964 OH TYR A 470 2.363 8.417 -11.754 1.00 10.00 O ATOM 0 H TYR A 470 0.478 2.843 -7.966 1.00 10.00 H new ATOM 0 HA TYR A 470 -1.960 4.404 -7.530 1.00 10.00 H new ATOM 0 HB2 TYR A 470 -0.504 6.002 -6.926 1.00 10.00 H new ATOM 0 HB3 TYR A 470 0.777 4.817 -7.078 1.00 10.00 H new ATOM 0 HD1 TYR A 470 1.487 4.477 -9.737 1.00 10.00 H new ATOM 0 HD2 TYR A 470 -0.095 8.026 -7.988 1.00 10.00 H new ATOM 0 HE1 TYR A 470 2.517 5.812 -11.520 1.00 10.00 H new ATOM 0 HE2 TYR A 470 0.933 9.363 -9.774 1.00 10.00 H new ATOM 0 HH TYR A 470 2.155 9.364 -11.614 1.00 10.00 H new ATOM 974 N TYR A 471 -0.706 3.778 -10.467 1.00 10.00 N ATOM 975 CA TYR A 471 -0.983 3.927 -11.892 1.00 10.00 C ATOM 976 C TYR A 471 -2.210 3.118 -12.310 1.00 10.00 C ATOM 977 O TYR A 471 -2.647 3.193 -13.460 1.00 10.00 O ATOM 978 CB TYR A 471 0.241 3.547 -12.735 1.00 10.00 C ATOM 979 CG TYR A 471 0.536 2.064 -12.799 1.00 10.00 C ATOM 980 CD1 TYR A 471 -0.276 1.200 -13.526 1.00 10.00 C ATOM 981 CD2 TYR A 471 1.640 1.529 -12.146 1.00 10.00 C ATOM 982 CE1 TYR A 471 0.003 -0.151 -13.597 1.00 10.00 C ATOM 983 CE2 TYR A 471 1.924 0.178 -12.212 1.00 10.00 C ATOM 984 CZ TYR A 471 1.103 -0.656 -12.939 1.00 10.00 C ATOM 985 OH TYR A 471 1.383 -2.002 -13.008 1.00 10.00 O ATOM 0 H TYR A 471 0.032 3.112 -10.238 1.00 10.00 H new ATOM 0 HA TYR A 471 -1.204 4.979 -12.075 1.00 10.00 H new ATOM 0 HB2 TYR A 471 0.094 3.917 -13.750 1.00 10.00 H new ATOM 0 HB3 TYR A 471 1.115 4.059 -12.332 1.00 10.00 H new ATOM 0 HD1 TYR A 471 -1.139 1.592 -14.044 1.00 10.00 H new ATOM 0 HD2 TYR A 471 2.287 2.180 -11.577 1.00 10.00 H new ATOM 0 HE1 TYR A 471 -0.638 -0.808 -14.166 1.00 10.00 H new ATOM 0 HE2 TYR A 471 2.785 -0.222 -11.697 1.00 10.00 H new ATOM 0 HH TYR A 471 2.193 -2.195 -12.490 1.00 10.00 H new ATOM 995 N LEU A 472 -2.778 2.362 -11.372 1.00 10.00 N ATOM 996 CA LEU A 472 -3.969 1.566 -11.653 1.00 10.00 C ATOM 997 C LEU A 472 -5.188 2.154 -10.946 1.00 10.00 C ATOM 998 O LEU A 472 -6.325 1.773 -11.223 1.00 10.00 O ATOM 999 CB LEU A 472 -3.768 0.116 -11.216 1.00 10.00 C ATOM 1000 CG LEU A 472 -2.357 -0.428 -11.430 1.00 10.00 C ATOM 1001 CD1 LEU A 472 -1.762 -0.893 -10.114 1.00 10.00 C ATOM 1002 CD2 LEU A 472 -2.365 -1.557 -12.449 1.00 10.00 C ATOM 0 H LEU A 472 -2.434 2.285 -10.415 1.00 10.00 H new ATOM 0 HA LEU A 472 -4.139 1.587 -12.729 1.00 10.00 H new ATOM 0 HB2 LEU A 472 -4.018 0.032 -10.158 1.00 10.00 H new ATOM 0 HB3 LEU A 472 -4.471 -0.514 -11.761 1.00 10.00 H new ATOM 0 HG LEU A 472 -1.734 0.376 -11.822 1.00 10.00 H new ATOM 0 HD11 LEU A 472 -0.757 -1.278 -10.285 1.00 10.00 H new ATOM 0 HD12 LEU A 472 -1.717 -0.055 -9.419 1.00 10.00 H new ATOM 0 HD13 LEU A 472 -2.385 -1.681 -9.691 1.00 10.00 H new ATOM 0 HD21 LEU A 472 -1.350 -1.930 -12.587 1.00 10.00 H new ATOM 0 HD22 LEU A 472 -3.003 -2.365 -12.092 1.00 10.00 H new ATOM 0 HD23 LEU A 472 -2.747 -1.186 -13.400 1.00 10.00 H new ATOM 1014 N THR A 473 -4.938 3.094 -10.037 1.00 10.00 N ATOM 1015 CA THR A 473 -6.005 3.748 -9.293 1.00 10.00 C ATOM 1016 C THR A 473 -6.241 5.154 -9.832 1.00 10.00 C ATOM 1017 O THR A 473 -7.297 5.747 -9.608 1.00 10.00 O ATOM 1018 CB THR A 473 -5.660 3.789 -7.801 1.00 10.00 C ATOM 1019 OG1 THR A 473 -6.694 4.414 -7.061 1.00 10.00 O ATOM 1020 CG2 THR A 473 -4.367 4.517 -7.499 1.00 10.00 C ATOM 0 H THR A 473 -4.001 3.419 -9.799 1.00 10.00 H new ATOM 0 HA THR A 473 -6.924 3.176 -9.418 1.00 10.00 H new ATOM 0 HB THR A 473 -5.542 2.746 -7.507 1.00 10.00 H new ATOM 0 HG1 THR A 473 -6.337 5.203 -6.603 1.00 10.00 H new ATOM 0 HG21 THR A 473 -4.186 4.507 -6.424 1.00 10.00 H new ATOM 0 HG22 THR A 473 -3.542 4.021 -8.011 1.00 10.00 H new ATOM 0 HG23 THR A 473 -4.441 5.548 -7.845 1.00 10.00 H new ATOM 1028 N LYS A 474 -5.254 5.681 -10.551 1.00 10.00 N ATOM 1029 CA LYS A 474 -5.354 7.013 -11.127 1.00 10.00 C ATOM 1030 C LYS A 474 -5.722 6.937 -12.606 1.00 10.00 C ATOM 1031 O LYS A 474 -6.401 7.816 -13.134 1.00 10.00 O ATOM 1032 CB LYS A 474 -4.029 7.760 -10.949 1.00 10.00 C ATOM 1033 CG LYS A 474 -2.891 7.188 -11.780 1.00 10.00 C ATOM 1034 CD LYS A 474 -2.952 7.677 -13.217 1.00 10.00 C ATOM 1035 CE LYS A 474 -1.625 8.269 -13.666 1.00 10.00 C ATOM 1036 NZ LYS A 474 -1.736 8.937 -14.992 1.00 10.00 N ATOM 0 H LYS A 474 -4.375 5.202 -10.747 1.00 10.00 H new ATOM 0 HA LYS A 474 -6.143 7.557 -10.607 1.00 10.00 H new ATOM 0 HB2 LYS A 474 -4.173 8.807 -11.217 1.00 10.00 H new ATOM 0 HB3 LYS A 474 -3.747 7.736 -9.896 1.00 10.00 H new ATOM 0 HG2 LYS A 474 -1.937 7.473 -11.337 1.00 10.00 H new ATOM 0 HG3 LYS A 474 -2.938 6.099 -11.763 1.00 10.00 H new ATOM 0 HD2 LYS A 474 -3.221 6.849 -13.872 1.00 10.00 H new ATOM 0 HD3 LYS A 474 -3.737 8.428 -13.313 1.00 10.00 H new ATOM 0 HE2 LYS A 474 -1.279 8.989 -12.924 1.00 10.00 H new ATOM 0 HE3 LYS A 474 -0.875 7.480 -13.718 1.00 10.00 H new ATOM 0 HZ1 LYS A 474 -0.811 9.327 -15.263 1.00 10.00 H new ATOM 0 HZ2 LYS A 474 -2.042 8.244 -15.705 1.00 10.00 H new ATOM 0 HZ3 LYS A 474 -2.433 9.706 -14.936 1.00 10.00 H new ATOM 1050 N LYS A 475 -5.266 5.881 -13.268 1.00 10.00 N ATOM 1051 CA LYS A 475 -5.547 5.691 -14.686 1.00 10.00 C ATOM 1052 C LYS A 475 -7.049 5.584 -14.939 1.00 10.00 C ATOM 1053 O LYS A 475 -7.510 5.786 -16.063 1.00 10.00 O ATOM 1054 CB LYS A 475 -4.839 4.436 -15.202 1.00 10.00 C ATOM 1055 CG LYS A 475 -3.496 4.720 -15.855 1.00 10.00 C ATOM 1056 CD LYS A 475 -3.622 4.818 -17.367 1.00 10.00 C ATOM 1057 CE LYS A 475 -2.371 4.306 -18.063 1.00 10.00 C ATOM 1058 NZ LYS A 475 -1.343 5.374 -18.212 1.00 10.00 N ATOM 0 H LYS A 475 -4.701 5.144 -12.847 1.00 10.00 H new ATOM 0 HA LYS A 475 -5.171 6.561 -15.224 1.00 10.00 H new ATOM 0 HB2 LYS A 475 -4.691 3.745 -14.372 1.00 10.00 H new ATOM 0 HB3 LYS A 475 -5.485 3.935 -15.923 1.00 10.00 H new ATOM 0 HG2 LYS A 475 -3.088 5.651 -15.462 1.00 10.00 H new ATOM 0 HG3 LYS A 475 -2.791 3.930 -15.598 1.00 10.00 H new ATOM 0 HD2 LYS A 475 -4.486 4.243 -17.699 1.00 10.00 H new ATOM 0 HD3 LYS A 475 -3.800 5.855 -17.652 1.00 10.00 H new ATOM 0 HE2 LYS A 475 -1.953 3.476 -17.494 1.00 10.00 H new ATOM 0 HE3 LYS A 475 -2.636 3.917 -19.046 1.00 10.00 H new ATOM 0 HZ1 LYS A 475 -0.506 4.985 -18.691 1.00 10.00 H new ATOM 0 HZ2 LYS A 475 -1.733 6.155 -18.777 1.00 10.00 H new ATOM 0 HZ3 LYS A 475 -1.071 5.728 -17.273 1.00 10.00 H new ATOM 1072 N ASN A 476 -7.807 5.259 -13.895 1.00 10.00 N ATOM 1073 CA ASN A 476 -9.254 5.120 -14.020 1.00 10.00 C ATOM 1074 C ASN A 476 -10.003 6.050 -13.065 1.00 10.00 C ATOM 1075 O ASN A 476 -11.211 6.245 -13.206 1.00 10.00 O ATOM 1076 CB ASN A 476 -9.667 3.670 -13.760 1.00 10.00 C ATOM 1077 CG ASN A 476 -9.566 2.809 -15.003 1.00 10.00 C ATOM 1078 OD1 ASN A 476 -10.323 2.986 -15.959 1.00 10.00 O ATOM 1079 ND2 ASN A 476 -8.630 1.867 -14.996 1.00 10.00 N ATOM 0 H ASN A 476 -7.445 5.088 -12.957 1.00 10.00 H new ATOM 0 HA ASN A 476 -9.522 5.403 -15.038 1.00 10.00 H new ATOM 0 HB2 ASN A 476 -9.035 3.250 -12.978 1.00 10.00 H new ATOM 0 HB3 ASN A 476 -10.691 3.648 -13.388 1.00 10.00 H new ATOM 0 HD21 ASN A 476 -8.516 1.255 -15.804 1.00 10.00 H new ATOM 0 HD22 ASN A 476 -8.025 1.756 -14.183 1.00 10.00 H new ATOM 1086 N GLU A 477 -9.297 6.618 -12.088 1.00 10.00 N ATOM 1087 CA GLU A 477 -9.927 7.515 -11.124 1.00 10.00 C ATOM 1088 C GLU A 477 -9.387 8.938 -11.245 1.00 10.00 C ATOM 1089 O GLU A 477 -10.034 9.893 -10.815 1.00 10.00 O ATOM 1090 CB GLU A 477 -9.713 6.999 -9.701 1.00 10.00 C ATOM 1091 CG GLU A 477 -10.835 7.366 -8.744 1.00 10.00 C ATOM 1092 CD GLU A 477 -10.418 7.265 -7.290 1.00 10.00 C ATOM 1093 OE1 GLU A 477 -9.205 7.371 -7.012 1.00 10.00 O ATOM 1094 OE2 GLU A 477 -11.304 7.079 -6.429 1.00 10.00 O ATOM 0 H GLU A 477 -8.297 6.474 -11.945 1.00 10.00 H new ATOM 0 HA GLU A 477 -10.994 7.538 -11.345 1.00 10.00 H new ATOM 0 HB2 GLU A 477 -9.611 5.914 -9.729 1.00 10.00 H new ATOM 0 HB3 GLU A 477 -8.774 7.398 -9.317 1.00 10.00 H new ATOM 0 HG2 GLU A 477 -11.168 8.383 -8.953 1.00 10.00 H new ATOM 0 HG3 GLU A 477 -11.687 6.709 -8.920 1.00 10.00 H new ATOM 1101 N ASN A 478 -8.199 9.076 -11.826 1.00 10.00 N ATOM 1102 CA ASN A 478 -7.579 10.385 -11.991 1.00 10.00 C ATOM 1103 C ASN A 478 -7.427 11.077 -10.641 1.00 10.00 C ATOM 1104 O ASN A 478 -8.296 11.843 -10.224 1.00 10.00 O ATOM 1105 CB ASN A 478 -8.414 11.255 -12.933 1.00 10.00 C ATOM 1106 CG ASN A 478 -8.370 10.762 -14.366 1.00 10.00 C ATOM 1107 OD1 ASN A 478 -7.305 10.443 -14.892 1.00 10.00 O ATOM 1108 ND2 ASN A 478 -9.532 10.698 -15.006 1.00 10.00 N ATOM 0 H ASN A 478 -7.648 8.299 -12.190 1.00 10.00 H new ATOM 0 HA ASN A 478 -6.590 10.244 -12.426 1.00 10.00 H new ATOM 0 HB2 ASN A 478 -9.448 11.270 -12.588 1.00 10.00 H new ATOM 0 HB3 ASN A 478 -8.050 12.282 -12.893 1.00 10.00 H new ATOM 0 HD21 ASN A 478 -9.565 10.374 -15.973 1.00 10.00 H new ATOM 0 HD22 ASN A 478 -10.392 10.973 -14.531 1.00 10.00 H new ATOM 1115 N TYR A 479 -6.321 10.798 -9.960 1.00 10.00 N ATOM 1116 CA TYR A 479 -6.063 11.389 -8.655 1.00 10.00 C ATOM 1117 C TYR A 479 -4.661 11.040 -8.167 1.00 10.00 C ATOM 1118 O TYR A 479 -4.259 9.877 -8.175 1.00 10.00 O ATOM 1119 CB TYR A 479 -7.111 10.906 -7.645 1.00 10.00 C ATOM 1120 CG TYR A 479 -6.786 9.569 -7.013 1.00 10.00 C ATOM 1121 CD1 TYR A 479 -6.610 8.430 -7.791 1.00 10.00 C ATOM 1122 CD2 TYR A 479 -6.655 9.449 -5.635 1.00 10.00 C ATOM 1123 CE1 TYR A 479 -6.313 7.209 -7.210 1.00 10.00 C ATOM 1124 CE2 TYR A 479 -6.357 8.235 -5.049 1.00 10.00 C ATOM 1125 CZ TYR A 479 -6.188 7.118 -5.840 1.00 10.00 C ATOM 1126 OH TYR A 479 -5.891 5.909 -5.258 1.00 10.00 O ATOM 0 H TYR A 479 -5.591 10.167 -10.290 1.00 10.00 H new ATOM 0 HA TYR A 479 -6.130 12.473 -8.749 1.00 10.00 H new ATOM 0 HB2 TYR A 479 -7.214 11.653 -6.858 1.00 10.00 H new ATOM 0 HB3 TYR A 479 -8.077 10.835 -8.145 1.00 10.00 H new ATOM 0 HD1 TYR A 479 -6.706 8.499 -8.864 1.00 10.00 H new ATOM 0 HD2 TYR A 479 -6.789 10.321 -5.011 1.00 10.00 H new ATOM 0 HE1 TYR A 479 -6.180 6.332 -7.827 1.00 10.00 H new ATOM 0 HE2 TYR A 479 -6.257 8.160 -3.976 1.00 10.00 H new ATOM 0 HH TYR A 479 -5.004 5.954 -4.845 1.00 10.00 H new ATOM 1136 N LYS A 480 -3.923 12.056 -7.739 1.00 10.00 N ATOM 1137 CA LYS A 480 -2.568 11.857 -7.241 1.00 10.00 C ATOM 1138 C LYS A 480 -2.260 12.823 -6.102 1.00 10.00 C ATOM 1139 O LYS A 480 -2.780 13.959 -6.133 1.00 10.00 O ATOM 1140 CB LYS A 480 -1.555 12.042 -8.373 1.00 10.00 C ATOM 1141 CG LYS A 480 -1.128 10.738 -9.026 1.00 10.00 C ATOM 1142 CD LYS A 480 -0.870 10.919 -10.512 1.00 10.00 C ATOM 1143 CE LYS A 480 0.296 11.861 -10.765 1.00 10.00 C ATOM 1144 NZ LYS A 480 -0.153 13.273 -10.921 1.00 10.00 N ATOM 1145 OXT LYS A 480 -1.502 12.437 -5.187 1.00 10.00 O ATOM 0 H LYS A 480 -4.239 13.026 -7.727 1.00 10.00 H new ATOM 0 HA LYS A 480 -2.493 10.839 -6.859 1.00 10.00 H new ATOM 0 HB2 LYS A 480 -1.986 12.695 -9.132 1.00 10.00 H new ATOM 0 HB3 LYS A 480 -0.673 12.548 -7.981 1.00 10.00 H new ATOM 0 HG2 LYS A 480 -0.225 10.366 -8.541 1.00 10.00 H new ATOM 0 HG3 LYS A 480 -1.903 9.985 -8.879 1.00 10.00 H new ATOM 0 HD2 LYS A 480 -0.662 9.950 -10.967 1.00 10.00 H new ATOM 0 HD3 LYS A 480 -1.766 11.311 -10.993 1.00 10.00 H new ATOM 0 HE2 LYS A 480 1.003 11.794 -9.938 1.00 10.00 H new ATOM 0 HE3 LYS A 480 0.827 11.548 -11.664 1.00 10.00 H new ATOM 0 HZ1 LYS A 480 0.526 13.790 -11.516 1.00 10.00 H new ATOM 0 HZ2 LYS A 480 -1.091 13.291 -11.370 1.00 10.00 H new ATOM 0 HZ3 LYS A 480 -0.208 13.725 -9.986 1.00 10.00 H new TER 1159 LYS A 480