USER MOD reduce.3.24.130724 H: found=0, std=0, add=576, rem=0, adj=19 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 470 TYR OH : rot 30:sc= 0.239 USER MOD Set 1.2: A 474 LYS NZ :NH3+ -147:sc= 0.291 (180deg=0.041) USER MOD Set 2.1: A 473 THR OG1 : rot 115:sc= 2.11! USER MOD Set 2.2: A 479 TYR OH : rot -150:sc= 1.48! USER MOD Single : A 413 ASN : amide:sc= 0 X(o=0,f=0.17) 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 421 LYS NZ :NH3+ 172:sc= -1.5 (180deg=-1.69) USER MOD Single : A 423 TYR OH : rot 130:sc= -3.42 USER MOD Single : A 424 LYS NZ :NH3+ 162:sc= -0.128 (180deg=-0.538) USER MOD Single : A 427 GLN : amide:sc= -3.28 K(o=-3.3,f=-3.9!) USER MOD Single : A 429 MET CE :methyl -163:sc=-5.64e-05 (180deg=-0.352) USER MOD Single : A 430 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 431 MET CE :methyl -139:sc= -1.38 (180deg=-3.98!) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 435 GLN : amide:sc= -1.7 K(o=-1.7,f=-0.36) USER MOD Single : A 437 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.142) USER MOD Single : A 439 THR OG1 : rot -146:sc= -0.84 USER MOD Single : A 443 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0461) USER MOD Single : A 445 MET CE :methyl -154:sc= -1.64! (180deg=-3.41!) USER MOD Single : A 446 GLN : amide:sc= -0.383 X(o=-0.38,f=-0.059) USER MOD Single : A 447 HIS : no HD1:sc= -14.4! C(o=-14!,f=-12!) USER MOD Single : A 449 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 ASN : amide:sc= -7.55! C(o=-7.5!,f=-13!) USER MOD Single : A 456 SER OG : rot 180:sc= 0 USER MOD Single : A 461 LYS NZ :NH3+ 180:sc= -0.845 (180deg=-0.845) USER MOD Single : A 462 THR OG1 : rot 180:sc= -1.15 USER MOD Single : A 466 CYS SG : rot 81:sc= -0.552 USER MOD Single : A 469 TYR OH : rot 30:sc= -2.89! USER MOD Single : A 471 TYR OH : rot 180:sc= 0 USER MOD Single : A 475 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 476 ASN : amide:sc= -0.421 X(o=-0.42,f=0) USER MOD Single : A 478 ASN : amide:sc= -0.91 X(o=-0.91,f=-1.2!) USER MOD Single : A 480 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 413 -1.421 3.922 22.775 1.00 10.00 N ATOM 2 CA ASN A 413 -0.080 3.948 22.201 1.00 10.00 C ATOM 3 C ASN A 413 0.177 5.265 21.476 1.00 10.00 C ATOM 4 O ASN A 413 1.252 5.852 21.595 1.00 10.00 O ATOM 5 CB ASN A 413 0.108 2.776 21.236 1.00 10.00 C ATOM 6 CG ASN A 413 0.170 1.441 21.953 1.00 10.00 C ATOM 7 OD1 ASN A 413 -0.762 1.060 22.660 1.00 10.00 O ATOM 8 ND2 ASN A 413 1.273 0.724 21.772 1.00 10.00 N ATOM 0 HA ASN A 413 0.638 3.857 23.016 1.00 10.00 H new ATOM 0 HB2 ASN A 413 -0.714 2.763 20.520 1.00 10.00 H new ATOM 0 HB3 ASN A 413 1.025 2.922 20.666 1.00 10.00 H new ATOM 0 HD21 ASN A 413 1.372 -0.183 22.228 1.00 10.00 H new ATOM 0 HD22 ASN A 413 2.021 1.080 21.177 1.00 10.00 H new ATOM 15 N GLY A 414 -0.819 5.725 20.725 1.00 10.00 N ATOM 16 CA GLY A 414 -0.681 6.969 19.992 1.00 10.00 C ATOM 17 C GLY A 414 -1.682 7.090 18.860 1.00 10.00 C ATOM 18 O GLY A 414 -2.867 7.334 19.094 1.00 10.00 O ATOM 0 H GLY A 414 -1.719 5.258 20.611 1.00 10.00 H new ATOM 0 HA2 GLY A 414 -0.809 7.807 20.677 1.00 10.00 H new ATOM 0 HA3 GLY A 414 0.329 7.039 19.588 1.00 10.00 H new ATOM 22 N LEU A 415 -1.207 6.919 17.631 1.00 10.00 N ATOM 23 CA LEU A 415 -2.068 7.010 16.458 1.00 10.00 C ATOM 24 C LEU A 415 -2.249 5.642 15.808 1.00 10.00 C ATOM 25 O LEU A 415 -3.311 5.337 15.266 1.00 10.00 O ATOM 26 CB LEU A 415 -1.484 7.996 15.445 1.00 10.00 C ATOM 27 CG LEU A 415 -0.072 7.663 14.958 1.00 10.00 C ATOM 28 CD1 LEU A 415 0.108 8.090 13.510 1.00 10.00 C ATOM 29 CD2 LEU A 415 0.967 8.332 15.846 1.00 10.00 C ATOM 0 H LEU A 415 -0.230 6.716 17.421 1.00 10.00 H new ATOM 0 HA LEU A 415 -3.044 7.370 16.783 1.00 10.00 H new ATOM 0 HB2 LEU A 415 -2.148 8.043 14.582 1.00 10.00 H new ATOM 0 HB3 LEU A 415 -1.473 8.990 15.893 1.00 10.00 H new ATOM 0 HG LEU A 415 0.068 6.584 15.016 1.00 10.00 H new ATOM 0 HD11 LEU A 415 1.118 7.845 13.181 1.00 10.00 H new ATOM 0 HD12 LEU A 415 -0.614 7.566 12.884 1.00 10.00 H new ATOM 0 HD13 LEU A 415 -0.050 9.165 13.425 1.00 10.00 H new ATOM 0 HD21 LEU A 415 1.966 8.085 15.486 1.00 10.00 H new ATOM 0 HD22 LEU A 415 0.828 9.413 15.818 1.00 10.00 H new ATOM 0 HD23 LEU A 415 0.852 7.978 16.870 1.00 10.00 H new ATOM 41 N MET A 416 -1.205 4.822 15.867 1.00 10.00 N ATOM 42 CA MET A 416 -1.249 3.486 15.284 1.00 10.00 C ATOM 43 C MET A 416 0.043 2.727 15.565 1.00 10.00 C ATOM 44 O MET A 416 1.081 3.329 15.842 1.00 10.00 O ATOM 45 CB MET A 416 -1.485 3.573 13.775 1.00 10.00 C ATOM 46 CG MET A 416 -2.214 2.367 13.203 1.00 10.00 C ATOM 47 SD MET A 416 -2.616 2.564 11.456 1.00 10.00 S ATOM 48 CE MET A 416 -4.397 2.369 11.495 1.00 10.00 C ATOM 0 H MET A 416 -0.319 5.059 16.312 1.00 10.00 H new ATOM 0 HA MET A 416 -2.075 2.943 15.743 1.00 10.00 H new ATOM 0 HB2 MET A 416 -2.061 4.472 13.557 1.00 10.00 H new ATOM 0 HB3 MET A 416 -0.524 3.679 13.271 1.00 10.00 H new ATOM 0 HG2 MET A 416 -1.596 1.479 13.332 1.00 10.00 H new ATOM 0 HG3 MET A 416 -3.132 2.201 13.767 1.00 10.00 H new ATOM 0 HE1 MET A 416 -4.796 2.465 10.485 1.00 10.00 H new ATOM 0 HE2 MET A 416 -4.647 1.385 11.892 1.00 10.00 H new ATOM 0 HE3 MET A 416 -4.833 3.138 12.132 1.00 10.00 H new ATOM 58 N ALA A 417 -0.028 1.401 15.492 1.00 10.00 N ATOM 59 CA ALA A 417 1.137 0.559 15.739 1.00 10.00 C ATOM 60 C ALA A 417 0.841 -0.897 15.398 1.00 10.00 C ATOM 61 O ALA A 417 -0.276 -1.240 15.010 1.00 10.00 O ATOM 62 CB ALA A 417 1.581 0.685 17.188 1.00 10.00 C ATOM 0 H ALA A 417 -0.879 0.887 15.264 1.00 10.00 H new ATOM 0 HA ALA A 417 1.946 0.899 15.093 1.00 10.00 H new ATOM 0 HB1 ALA A 417 2.451 0.051 17.358 1.00 10.00 H new ATOM 0 HB2 ALA A 417 1.840 1.722 17.400 1.00 10.00 H new ATOM 0 HB3 ALA A 417 0.770 0.372 17.846 1.00 10.00 H new ATOM 68 N ASP A 418 1.850 -1.750 15.544 1.00 10.00 N ATOM 69 CA ASP A 418 1.697 -3.171 15.250 1.00 10.00 C ATOM 70 C ASP A 418 1.309 -3.387 13.789 1.00 10.00 C ATOM 71 O ASP A 418 0.128 -3.376 13.445 1.00 10.00 O ATOM 72 CB ASP A 418 0.639 -3.789 16.166 1.00 10.00 C ATOM 73 CG ASP A 418 1.226 -4.298 17.468 1.00 10.00 C ATOM 74 OD1 ASP A 418 2.188 -5.094 17.414 1.00 10.00 O ATOM 75 OD2 ASP A 418 0.724 -3.903 18.541 1.00 10.00 O ATOM 0 H ASP A 418 2.781 -1.483 15.864 1.00 10.00 H new ATOM 0 HA ASP A 418 2.655 -3.659 15.428 1.00 10.00 H new ATOM 0 HB2 ASP A 418 -0.128 -3.046 16.383 1.00 10.00 H new ATOM 0 HB3 ASP A 418 0.148 -4.612 15.646 1.00 10.00 H new ATOM 80 N PRO A 419 2.304 -3.585 12.906 1.00 10.00 N ATOM 81 CA PRO A 419 2.060 -3.804 11.476 1.00 10.00 C ATOM 82 C PRO A 419 1.007 -4.879 11.225 1.00 10.00 C ATOM 83 O PRO A 419 1.072 -5.970 11.792 1.00 10.00 O ATOM 84 CB PRO A 419 3.422 -4.255 10.950 1.00 10.00 C ATOM 85 CG PRO A 419 4.408 -3.641 11.881 1.00 10.00 C ATOM 86 CD PRO A 419 3.744 -3.613 13.231 1.00 10.00 C ATOM 0 HA PRO A 419 1.674 -2.910 10.986 1.00 10.00 H new ATOM 0 HB2 PRO A 419 3.505 -5.342 10.946 1.00 10.00 H new ATOM 0 HB3 PRO A 419 3.582 -3.919 9.926 1.00 10.00 H new ATOM 0 HG2 PRO A 419 5.330 -4.222 11.912 1.00 10.00 H new ATOM 0 HG3 PRO A 419 4.676 -2.635 11.557 1.00 10.00 H new ATOM 0 HD2 PRO A 419 4.005 -4.489 13.825 1.00 10.00 H new ATOM 0 HD3 PRO A 419 4.043 -2.737 13.807 1.00 10.00 H new ATOM 94 N MET A 420 0.039 -4.563 10.372 1.00 10.00 N ATOM 95 CA MET A 420 -1.029 -5.499 10.045 1.00 10.00 C ATOM 96 C MET A 420 -1.144 -5.678 8.539 1.00 10.00 C ATOM 97 O MET A 420 -0.590 -6.624 7.986 1.00 10.00 O ATOM 98 CB MET A 420 -2.357 -5.013 10.634 1.00 10.00 C ATOM 99 CG MET A 420 -2.890 -5.900 11.747 1.00 10.00 C ATOM 100 SD MET A 420 -2.033 -5.641 13.312 1.00 10.00 S ATOM 101 CE MET A 420 -1.705 -7.332 13.803 1.00 10.00 C ATOM 0 H MET A 420 -0.028 -3.664 9.894 1.00 10.00 H new ATOM 0 HA MET A 420 -0.788 -6.467 10.484 1.00 10.00 H new ATOM 0 HB2 MET A 420 -2.226 -4.001 11.018 1.00 10.00 H new ATOM 0 HB3 MET A 420 -3.099 -4.958 9.838 1.00 10.00 H new ATOM 0 HG2 MET A 420 -3.954 -5.706 11.883 1.00 10.00 H new ATOM 0 HG3 MET A 420 -2.792 -6.945 11.452 1.00 10.00 H new ATOM 0 HE1 MET A 420 -1.177 -7.338 14.757 1.00 10.00 H new ATOM 0 HE2 MET A 420 -2.647 -7.870 13.906 1.00 10.00 H new ATOM 0 HE3 MET A 420 -1.091 -7.818 13.045 1.00 10.00 H new ATOM 111 N LYS A 421 -1.861 -4.770 7.876 1.00 10.00 N ATOM 112 CA LYS A 421 -2.034 -4.855 6.425 1.00 10.00 C ATOM 113 C LYS A 421 -0.709 -5.129 5.746 1.00 10.00 C ATOM 114 O LYS A 421 0.074 -4.217 5.481 1.00 10.00 O ATOM 115 CB LYS A 421 -2.650 -3.585 5.861 1.00 10.00 C ATOM 116 CG LYS A 421 -2.831 -3.630 4.351 1.00 10.00 C ATOM 117 CD LYS A 421 -4.122 -4.319 3.968 1.00 10.00 C ATOM 118 CE LYS A 421 -3.879 -5.532 3.082 1.00 10.00 C ATOM 119 NZ LYS A 421 -2.983 -6.528 3.732 1.00 10.00 N ATOM 0 H LYS A 421 -2.327 -3.975 8.314 1.00 10.00 H new ATOM 0 HA LYS A 421 -2.716 -5.681 6.226 1.00 10.00 H new ATOM 0 HB2 LYS A 421 -3.618 -3.418 6.332 1.00 10.00 H new ATOM 0 HB3 LYS A 421 -2.018 -2.735 6.120 1.00 10.00 H new ATOM 0 HG2 LYS A 421 -2.827 -2.615 3.953 1.00 10.00 H new ATOM 0 HG3 LYS A 421 -1.989 -4.154 3.898 1.00 10.00 H new ATOM 0 HD2 LYS A 421 -4.649 -4.629 4.870 1.00 10.00 H new ATOM 0 HD3 LYS A 421 -4.769 -3.613 3.447 1.00 10.00 H new ATOM 0 HE2 LYS A 421 -4.832 -6.003 2.844 1.00 10.00 H new ATOM 0 HE3 LYS A 421 -3.438 -5.209 2.139 1.00 10.00 H new ATOM 0 HZ1 LYS A 421 -2.952 -7.394 3.157 1.00 10.00 H new ATOM 0 HZ2 LYS A 421 -2.025 -6.132 3.814 1.00 10.00 H new ATOM 0 HZ3 LYS A 421 -3.346 -6.755 4.680 1.00 10.00 H new ATOM 133 N VAL A 422 -0.466 -6.401 5.492 1.00 10.00 N ATOM 134 CA VAL A 422 0.763 -6.843 4.872 1.00 10.00 C ATOM 135 C VAL A 422 0.756 -8.361 4.760 1.00 10.00 C ATOM 136 O VAL A 422 1.055 -8.931 3.711 1.00 10.00 O ATOM 137 CB VAL A 422 1.968 -6.351 5.698 1.00 10.00 C ATOM 138 CG1 VAL A 422 2.266 -7.276 6.872 1.00 10.00 C ATOM 139 CG2 VAL A 422 3.190 -6.180 4.813 1.00 10.00 C ATOM 0 H VAL A 422 -1.117 -7.155 5.711 1.00 10.00 H new ATOM 0 HA VAL A 422 0.845 -6.424 3.869 1.00 10.00 H new ATOM 0 HB VAL A 422 1.707 -5.378 6.115 1.00 10.00 H new ATOM 0 HG11 VAL A 422 3.122 -6.894 7.428 1.00 10.00 H new ATOM 0 HG12 VAL A 422 1.397 -7.322 7.529 1.00 10.00 H new ATOM 0 HG13 VAL A 422 2.492 -8.275 6.500 1.00 10.00 H new ATOM 0 HG21 VAL A 422 4.029 -5.832 5.415 1.00 10.00 H new ATOM 0 HG22 VAL A 422 3.444 -7.136 4.354 1.00 10.00 H new ATOM 0 HG23 VAL A 422 2.975 -5.449 4.033 1.00 10.00 H new ATOM 149 N TYR A 423 0.367 -8.998 5.858 1.00 10.00 N ATOM 150 CA TYR A 423 0.254 -10.450 5.932 1.00 10.00 C ATOM 151 C TYR A 423 -0.463 -10.999 4.698 1.00 10.00 C ATOM 152 O TYR A 423 -0.226 -12.133 4.283 1.00 10.00 O ATOM 153 CB TYR A 423 -0.495 -10.871 7.215 1.00 10.00 C ATOM 154 CG TYR A 423 -1.425 -9.818 7.802 1.00 10.00 C ATOM 155 CD1 TYR A 423 -2.003 -8.830 7.013 1.00 10.00 C ATOM 156 CD2 TYR A 423 -1.715 -9.811 9.161 1.00 10.00 C ATOM 157 CE1 TYR A 423 -2.827 -7.876 7.550 1.00 10.00 C ATOM 158 CE2 TYR A 423 -2.549 -8.855 9.709 1.00 10.00 C ATOM 159 CZ TYR A 423 -3.099 -7.886 8.900 1.00 10.00 C ATOM 160 OH TYR A 423 -3.933 -6.934 9.438 1.00 10.00 O ATOM 0 H TYR A 423 0.120 -8.521 6.725 1.00 10.00 H new ATOM 0 HA TYR A 423 1.260 -10.868 5.963 1.00 10.00 H new ATOM 0 HB2 TYR A 423 -1.078 -11.766 6.998 1.00 10.00 H new ATOM 0 HB3 TYR A 423 0.240 -11.145 7.972 1.00 10.00 H new ATOM 0 HD1 TYR A 423 -1.798 -8.814 5.953 1.00 10.00 H new ATOM 0 HD2 TYR A 423 -1.281 -10.566 9.800 1.00 10.00 H new ATOM 0 HE1 TYR A 423 -3.262 -7.118 6.916 1.00 10.00 H new ATOM 0 HE2 TYR A 423 -2.768 -8.868 10.766 1.00 10.00 H new ATOM 0 HH TYR A 423 -4.617 -7.371 9.988 1.00 10.00 H new ATOM 170 N LYS A 424 -1.325 -10.176 4.106 1.00 10.00 N ATOM 171 CA LYS A 424 -2.060 -10.560 2.911 1.00 10.00 C ATOM 172 C LYS A 424 -1.538 -9.777 1.712 1.00 10.00 C ATOM 173 O LYS A 424 -1.572 -10.253 0.579 1.00 10.00 O ATOM 174 CB LYS A 424 -3.557 -10.304 3.096 1.00 10.00 C ATOM 175 CG LYS A 424 -4.225 -11.276 4.056 1.00 10.00 C ATOM 176 CD LYS A 424 -4.029 -10.852 5.503 1.00 10.00 C ATOM 177 CE LYS A 424 -4.752 -9.549 5.805 1.00 10.00 C ATOM 178 NZ LYS A 424 -6.160 -9.570 5.321 1.00 10.00 N ATOM 0 H LYS A 424 -1.530 -9.234 4.439 1.00 10.00 H new ATOM 0 HA LYS A 424 -1.913 -11.626 2.735 1.00 10.00 H new ATOM 0 HB2 LYS A 424 -3.701 -9.287 3.462 1.00 10.00 H new ATOM 0 HB3 LYS A 424 -4.051 -10.367 2.126 1.00 10.00 H new ATOM 0 HG2 LYS A 424 -5.291 -11.334 3.834 1.00 10.00 H new ATOM 0 HG3 LYS A 424 -3.814 -12.275 3.909 1.00 10.00 H new ATOM 0 HD2 LYS A 424 -4.397 -11.635 6.166 1.00 10.00 H new ATOM 0 HD3 LYS A 424 -2.965 -10.735 5.708 1.00 10.00 H new ATOM 0 HE2 LYS A 424 -4.740 -9.368 6.880 1.00 10.00 H new ATOM 0 HE3 LYS A 424 -4.219 -8.721 5.337 1.00 10.00 H new ATOM 0 HZ1 LYS A 424 -6.702 -8.820 5.796 1.00 10.00 H new ATOM 0 HZ2 LYS A 424 -6.176 -9.411 4.293 1.00 10.00 H new ATOM 0 HZ3 LYS A 424 -6.587 -10.494 5.535 1.00 10.00 H new ATOM 192 N ASP A 425 -1.047 -8.567 1.979 1.00 10.00 N ATOM 193 CA ASP A 425 -0.506 -7.708 0.935 1.00 10.00 C ATOM 194 C ASP A 425 0.641 -8.392 0.192 1.00 10.00 C ATOM 195 O ASP A 425 1.003 -7.989 -0.912 1.00 10.00 O ATOM 196 CB ASP A 425 -0.022 -6.389 1.539 1.00 10.00 C ATOM 197 CG ASP A 425 -0.296 -5.203 0.637 1.00 10.00 C ATOM 198 OD1 ASP A 425 -1.211 -5.300 -0.207 1.00 10.00 O ATOM 199 OD2 ASP A 425 0.403 -4.178 0.775 1.00 10.00 O ATOM 0 H ASP A 425 -1.014 -8.162 2.914 1.00 10.00 H new ATOM 0 HA ASP A 425 -1.303 -7.508 0.218 1.00 10.00 H new ATOM 0 HB2 ASP A 425 -0.512 -6.232 2.500 1.00 10.00 H new ATOM 0 HB3 ASP A 425 1.048 -6.453 1.734 1.00 10.00 H new ATOM 204 N ARG A 426 1.219 -9.427 0.797 1.00 10.00 N ATOM 205 CA ARG A 426 2.323 -10.147 0.171 1.00 10.00 C ATOM 206 C ARG A 426 1.964 -10.558 -1.256 1.00 10.00 C ATOM 207 O ARG A 426 2.830 -10.636 -2.126 1.00 10.00 O ATOM 208 CB ARG A 426 2.697 -11.378 1.004 1.00 10.00 C ATOM 209 CG ARG A 426 4.194 -11.547 1.197 1.00 10.00 C ATOM 210 CD ARG A 426 4.779 -12.526 0.192 1.00 10.00 C ATOM 211 NE ARG A 426 4.776 -13.897 0.695 1.00 10.00 N ATOM 212 CZ ARG A 426 5.530 -14.316 1.709 1.00 10.00 C ATOM 213 NH1 ARG A 426 6.349 -13.475 2.328 1.00 10.00 N ATOM 214 NH2 ARG A 426 5.466 -15.581 2.104 1.00 10.00 N ATOM 0 H ARG A 426 0.944 -9.783 1.712 1.00 10.00 H new ATOM 0 HA ARG A 426 3.184 -9.480 0.127 1.00 10.00 H new ATOM 0 HB2 ARG A 426 2.219 -11.305 1.981 1.00 10.00 H new ATOM 0 HB3 ARG A 426 2.298 -12.269 0.520 1.00 10.00 H new ATOM 0 HG2 ARG A 426 4.687 -10.580 1.094 1.00 10.00 H new ATOM 0 HG3 ARG A 426 4.394 -11.900 2.209 1.00 10.00 H new ATOM 0 HD2 ARG A 426 4.207 -12.479 -0.735 1.00 10.00 H new ATOM 0 HD3 ARG A 426 5.800 -12.231 -0.049 1.00 10.00 H new ATOM 0 HE ARG A 426 4.160 -14.573 0.243 1.00 10.00 H new ATOM 0 HH11 ARG A 426 6.403 -12.502 2.027 1.00 10.00 H new ATOM 0 HH12 ARG A 426 6.924 -13.802 3.104 1.00 10.00 H new ATOM 0 HH21 ARG A 426 4.839 -16.232 1.631 1.00 10.00 H new ATOM 0 HH22 ARG A 426 6.044 -15.903 2.881 1.00 10.00 H new ATOM 228 N GLN A 427 0.678 -10.799 -1.490 1.00 10.00 N ATOM 229 CA GLN A 427 0.199 -11.177 -2.817 1.00 10.00 C ATOM 230 C GLN A 427 -0.478 -9.989 -3.484 1.00 10.00 C ATOM 231 O GLN A 427 -1.395 -10.144 -4.292 1.00 10.00 O ATOM 232 CB GLN A 427 -0.769 -12.361 -2.727 1.00 10.00 C ATOM 233 CG GLN A 427 -0.440 -13.343 -1.610 1.00 10.00 C ATOM 234 CD GLN A 427 -1.016 -12.920 -0.272 1.00 10.00 C ATOM 235 OE1 GLN A 427 -2.178 -12.521 -0.183 1.00 10.00 O ATOM 236 NE2 GLN A 427 -0.205 -13.008 0.778 1.00 10.00 N ATOM 0 H GLN A 427 -0.051 -10.740 -0.779 1.00 10.00 H new ATOM 0 HA GLN A 427 1.054 -11.482 -3.421 1.00 10.00 H new ATOM 0 HB2 GLN A 427 -1.780 -11.981 -2.578 1.00 10.00 H new ATOM 0 HB3 GLN A 427 -0.766 -12.893 -3.678 1.00 10.00 H new ATOM 0 HG2 GLN A 427 -0.826 -14.328 -1.872 1.00 10.00 H new ATOM 0 HG3 GLN A 427 0.642 -13.438 -1.522 1.00 10.00 H new ATOM 0 HE21 GLN A 427 0.750 -13.344 0.658 1.00 10.00 H new ATOM 0 HE22 GLN A 427 -0.538 -12.739 1.704 1.00 10.00 H new ATOM 245 N VAL A 428 0.000 -8.804 -3.136 1.00 10.00 N ATOM 246 CA VAL A 428 -0.521 -7.559 -3.682 1.00 10.00 C ATOM 247 C VAL A 428 0.564 -6.840 -4.459 1.00 10.00 C ATOM 248 O VAL A 428 0.290 -6.175 -5.456 1.00 10.00 O ATOM 249 CB VAL A 428 -1.058 -6.644 -2.572 1.00 10.00 C ATOM 250 CG1 VAL A 428 -1.009 -5.180 -2.985 1.00 10.00 C ATOM 251 CG2 VAL A 428 -2.472 -7.053 -2.196 1.00 10.00 C ATOM 0 H VAL A 428 0.760 -8.678 -2.467 1.00 10.00 H new ATOM 0 HA VAL A 428 -1.347 -7.804 -4.350 1.00 10.00 H new ATOM 0 HB VAL A 428 -0.416 -6.757 -1.698 1.00 10.00 H new ATOM 0 HG11 VAL A 428 -1.396 -4.561 -2.176 1.00 10.00 H new ATOM 0 HG12 VAL A 428 0.022 -4.896 -3.198 1.00 10.00 H new ATOM 0 HG13 VAL A 428 -1.617 -5.033 -3.878 1.00 10.00 H new ATOM 0 HG21 VAL A 428 -2.843 -6.398 -1.408 1.00 10.00 H new ATOM 0 HG22 VAL A 428 -3.119 -6.972 -3.070 1.00 10.00 H new ATOM 0 HG23 VAL A 428 -2.470 -8.083 -1.840 1.00 10.00 H new ATOM 261 N MET A 429 1.804 -6.987 -4.005 1.00 10.00 N ATOM 262 CA MET A 429 2.939 -6.364 -4.684 1.00 10.00 C ATOM 263 C MET A 429 2.806 -6.539 -6.198 1.00 10.00 C ATOM 264 O MET A 429 3.290 -5.719 -6.978 1.00 10.00 O ATOM 265 CB MET A 429 4.254 -6.982 -4.204 1.00 10.00 C ATOM 266 CG MET A 429 5.413 -6.001 -4.178 1.00 10.00 C ATOM 267 SD MET A 429 6.983 -6.766 -4.628 1.00 10.00 S ATOM 268 CE MET A 429 6.999 -8.178 -3.527 1.00 10.00 C ATOM 0 H MET A 429 2.050 -7.528 -3.176 1.00 10.00 H new ATOM 0 HA MET A 429 2.943 -5.300 -4.446 1.00 10.00 H new ATOM 0 HB2 MET A 429 4.111 -7.389 -3.203 1.00 10.00 H new ATOM 0 HB3 MET A 429 4.511 -7.818 -4.854 1.00 10.00 H new ATOM 0 HG2 MET A 429 5.204 -5.180 -4.864 1.00 10.00 H new ATOM 0 HG3 MET A 429 5.496 -5.570 -3.180 1.00 10.00 H new ATOM 0 HE1 MET A 429 8.012 -8.576 -3.460 1.00 10.00 H new ATOM 0 HE2 MET A 429 6.664 -7.871 -2.536 1.00 10.00 H new ATOM 0 HE3 MET A 429 6.331 -8.948 -3.913 1.00 10.00 H new ATOM 278 N ASN A 430 2.131 -7.619 -6.597 1.00 10.00 N ATOM 279 CA ASN A 430 1.908 -7.921 -8.002 1.00 10.00 C ATOM 280 C ASN A 430 0.420 -8.122 -8.286 1.00 10.00 C ATOM 281 O ASN A 430 0.048 -8.825 -9.226 1.00 10.00 O ATOM 282 CB ASN A 430 2.684 -9.181 -8.387 1.00 10.00 C ATOM 283 CG ASN A 430 4.125 -8.886 -8.750 1.00 10.00 C ATOM 284 OD1 ASN A 430 4.441 -8.601 -9.906 1.00 10.00 O ATOM 285 ND2 ASN A 430 5.011 -8.953 -7.763 1.00 10.00 N ATOM 0 H ASN A 430 1.728 -8.302 -5.955 1.00 10.00 H new ATOM 0 HA ASN A 430 2.260 -7.079 -8.597 1.00 10.00 H new ATOM 0 HB2 ASN A 430 2.659 -9.887 -7.557 1.00 10.00 H new ATOM 0 HB3 ASN A 430 2.191 -9.664 -9.231 1.00 10.00 H new ATOM 0 HD21 ASN A 430 5.996 -8.765 -7.948 1.00 10.00 H new ATOM 0 HD22 ASN A 430 4.706 -9.193 -6.820 1.00 10.00 H new ATOM 292 N MET A 431 -0.424 -7.496 -7.467 1.00 10.00 N ATOM 293 CA MET A 431 -1.875 -7.595 -7.617 1.00 10.00 C ATOM 294 C MET A 431 -2.592 -7.062 -6.381 1.00 10.00 C ATOM 295 O MET A 431 -3.128 -7.828 -5.580 1.00 10.00 O ATOM 296 CB MET A 431 -2.304 -9.040 -7.856 1.00 10.00 C ATOM 297 CG MET A 431 -2.618 -9.354 -9.309 1.00 10.00 C ATOM 298 SD MET A 431 -2.159 -11.036 -9.770 1.00 10.00 S ATOM 299 CE MET A 431 -0.908 -10.718 -11.011 1.00 10.00 C ATOM 0 H MET A 431 -0.125 -6.911 -6.687 1.00 10.00 H new ATOM 0 HA MET A 431 -2.150 -6.990 -8.481 1.00 10.00 H new ATOM 0 HB2 MET A 431 -1.512 -9.706 -7.513 1.00 10.00 H new ATOM 0 HB3 MET A 431 -3.184 -9.253 -7.250 1.00 10.00 H new ATOM 0 HG2 MET A 431 -3.684 -9.211 -9.486 1.00 10.00 H new ATOM 0 HG3 MET A 431 -2.091 -8.649 -9.951 1.00 10.00 H new ATOM 0 HE1 MET A 431 -1.032 -11.415 -11.840 1.00 10.00 H new ATOM 0 HE2 MET A 431 -1.010 -9.697 -11.377 1.00 10.00 H new ATOM 0 HE3 MET A 431 0.081 -10.849 -10.572 1.00 10.00 H new ATOM 309 N TRP A 432 -2.625 -5.747 -6.246 1.00 10.00 N ATOM 310 CA TRP A 432 -3.306 -5.119 -5.124 1.00 10.00 C ATOM 311 C TRP A 432 -4.801 -5.267 -5.313 1.00 10.00 C ATOM 312 O TRP A 432 -5.401 -4.647 -6.192 1.00 10.00 O ATOM 313 CB TRP A 432 -2.923 -3.643 -4.986 1.00 10.00 C ATOM 314 CG TRP A 432 -1.521 -3.302 -5.418 1.00 10.00 C ATOM 315 CD1 TRP A 432 -0.981 -3.452 -6.662 1.00 10.00 C ATOM 316 CD2 TRP A 432 -0.480 -2.735 -4.604 1.00 10.00 C ATOM 317 NE1 TRP A 432 0.306 -2.986 -6.678 1.00 10.00 N ATOM 318 CE2 TRP A 432 0.639 -2.547 -5.433 1.00 10.00 C ATOM 319 CE3 TRP A 432 -0.389 -2.358 -3.264 1.00 10.00 C ATOM 320 CZ2 TRP A 432 1.829 -1.996 -4.970 1.00 10.00 C ATOM 321 CZ3 TRP A 432 0.796 -1.818 -2.799 1.00 10.00 C ATOM 322 CH2 TRP A 432 1.889 -1.635 -3.652 1.00 10.00 C ATOM 0 H TRP A 432 -2.190 -5.094 -6.897 1.00 10.00 H new ATOM 0 HA TRP A 432 -2.999 -5.615 -4.204 1.00 10.00 H new ATOM 0 HB2 TRP A 432 -3.622 -3.046 -5.572 1.00 10.00 H new ATOM 0 HB3 TRP A 432 -3.047 -3.348 -3.944 1.00 10.00 H new ATOM 0 HD1 TRP A 432 -1.495 -3.877 -7.512 1.00 10.00 H new ATOM 0 HE1 TRP A 432 0.918 -2.970 -7.493 1.00 10.00 H new ATOM 0 HE3 TRP A 432 -1.231 -2.486 -2.600 1.00 10.00 H new ATOM 0 HZ2 TRP A 432 2.675 -1.858 -5.627 1.00 10.00 H new ATOM 0 HZ3 TRP A 432 0.879 -1.533 -1.761 1.00 10.00 H new ATOM 0 HH2 TRP A 432 2.798 -1.200 -3.263 1.00 10.00 H new ATOM 333 N SER A 433 -5.387 -6.121 -4.493 1.00 10.00 N ATOM 334 CA SER A 433 -6.815 -6.398 -4.567 1.00 10.00 C ATOM 335 C SER A 433 -7.636 -5.146 -4.302 1.00 10.00 C ATOM 336 O SER A 433 -7.236 -4.285 -3.519 1.00 10.00 O ATOM 337 CB SER A 433 -7.194 -7.492 -3.566 1.00 10.00 C ATOM 338 OG SER A 433 -8.422 -8.103 -3.920 1.00 10.00 O ATOM 0 H SER A 433 -4.895 -6.638 -3.764 1.00 10.00 H new ATOM 0 HA SER A 433 -7.037 -6.741 -5.577 1.00 10.00 H new ATOM 0 HB2 SER A 433 -6.407 -8.245 -3.530 1.00 10.00 H new ATOM 0 HB3 SER A 433 -7.272 -7.064 -2.567 1.00 10.00 H new ATOM 0 HG SER A 433 -8.641 -8.799 -3.266 1.00 10.00 H new ATOM 344 N GLU A 434 -8.797 -5.057 -4.946 1.00 10.00 N ATOM 345 CA GLU A 434 -9.681 -3.912 -4.760 1.00 10.00 C ATOM 346 C GLU A 434 -9.895 -3.658 -3.272 1.00 10.00 C ATOM 347 O GLU A 434 -10.131 -2.528 -2.847 1.00 10.00 O ATOM 348 CB GLU A 434 -11.025 -4.157 -5.450 1.00 10.00 C ATOM 349 CG GLU A 434 -11.762 -2.878 -5.815 1.00 10.00 C ATOM 350 CD GLU A 434 -12.490 -2.983 -7.141 1.00 10.00 C ATOM 351 OE1 GLU A 434 -13.545 -3.651 -7.188 1.00 10.00 O ATOM 352 OE2 GLU A 434 -12.005 -2.400 -8.132 1.00 10.00 O ATOM 0 H GLU A 434 -9.145 -5.760 -5.598 1.00 10.00 H new ATOM 0 HA GLU A 434 -9.216 -3.034 -5.208 1.00 10.00 H new ATOM 0 HB2 GLU A 434 -10.859 -4.742 -6.355 1.00 10.00 H new ATOM 0 HB3 GLU A 434 -11.657 -4.757 -4.795 1.00 10.00 H new ATOM 0 HG2 GLU A 434 -12.479 -2.639 -5.029 1.00 10.00 H new ATOM 0 HG3 GLU A 434 -11.051 -2.053 -5.859 1.00 10.00 H new ATOM 359 N GLN A 435 -9.793 -4.728 -2.486 1.00 10.00 N ATOM 360 CA GLN A 435 -9.956 -4.640 -1.045 1.00 10.00 C ATOM 361 C GLN A 435 -8.624 -4.314 -0.380 1.00 10.00 C ATOM 362 O GLN A 435 -8.588 -3.673 0.670 1.00 10.00 O ATOM 363 CB GLN A 435 -10.507 -5.954 -0.491 1.00 10.00 C ATOM 364 CG GLN A 435 -11.829 -6.369 -1.114 1.00 10.00 C ATOM 365 CD GLN A 435 -12.936 -5.368 -0.855 1.00 10.00 C ATOM 366 OE1 GLN A 435 -13.819 -5.600 -0.029 1.00 10.00 O ATOM 367 NE2 GLN A 435 -12.896 -4.244 -1.562 1.00 10.00 N ATOM 0 H GLN A 435 -9.597 -5.668 -2.830 1.00 10.00 H new ATOM 0 HA GLN A 435 -10.664 -3.841 -0.826 1.00 10.00 H new ATOM 0 HB2 GLN A 435 -9.774 -6.744 -0.655 1.00 10.00 H new ATOM 0 HB3 GLN A 435 -10.637 -5.858 0.587 1.00 10.00 H new ATOM 0 HG2 GLN A 435 -11.698 -6.489 -2.189 1.00 10.00 H new ATOM 0 HG3 GLN A 435 -12.123 -7.341 -0.718 1.00 10.00 H new ATOM 0 HE21 GLN A 435 -12.146 -4.092 -2.236 1.00 10.00 H new ATOM 0 HE22 GLN A 435 -13.615 -3.533 -1.430 1.00 10.00 H new ATOM 376 N GLU A 436 -7.528 -4.749 -1.000 1.00 10.00 N ATOM 377 CA GLU A 436 -6.209 -4.488 -0.468 1.00 10.00 C ATOM 378 C GLU A 436 -5.842 -3.034 -0.708 1.00 10.00 C ATOM 379 O GLU A 436 -5.458 -2.320 0.219 1.00 10.00 O ATOM 380 CB GLU A 436 -5.209 -5.447 -1.109 1.00 10.00 C ATOM 381 CG GLU A 436 -4.506 -6.343 -0.102 1.00 10.00 C ATOM 382 CD GLU A 436 -4.747 -7.819 -0.363 1.00 10.00 C ATOM 383 OE1 GLU A 436 -5.769 -8.150 -1.000 1.00 10.00 O ATOM 384 OE2 GLU A 436 -3.914 -8.642 0.071 1.00 10.00 O ATOM 0 H GLU A 436 -7.536 -5.282 -1.869 1.00 10.00 H new ATOM 0 HA GLU A 436 -6.191 -4.657 0.609 1.00 10.00 H new ATOM 0 HB2 GLU A 436 -5.728 -6.069 -1.838 1.00 10.00 H new ATOM 0 HB3 GLU A 436 -4.463 -4.871 -1.656 1.00 10.00 H new ATOM 0 HG2 GLU A 436 -3.435 -6.143 -0.130 1.00 10.00 H new ATOM 0 HG3 GLU A 436 -4.851 -6.095 0.902 1.00 10.00 H new ATOM 391 N LYS A 437 -6.014 -2.580 -1.945 1.00 10.00 N ATOM 392 CA LYS A 437 -5.752 -1.184 -2.286 1.00 10.00 C ATOM 393 C LYS A 437 -6.569 -0.283 -1.373 1.00 10.00 C ATOM 394 O LYS A 437 -6.265 0.891 -1.203 1.00 10.00 O ATOM 395 CB LYS A 437 -6.114 -0.917 -3.750 1.00 10.00 C ATOM 396 CG LYS A 437 -4.913 -0.894 -4.682 1.00 10.00 C ATOM 397 CD LYS A 437 -5.297 -1.295 -6.097 1.00 10.00 C ATOM 398 CE LYS A 437 -4.126 -1.144 -7.057 1.00 10.00 C ATOM 399 NZ LYS A 437 -4.230 -2.082 -8.210 1.00 10.00 N ATOM 0 H LYS A 437 -6.332 -3.154 -2.726 1.00 10.00 H new ATOM 0 HA LYS A 437 -4.691 -0.974 -2.150 1.00 10.00 H new ATOM 0 HB2 LYS A 437 -6.811 -1.684 -4.088 1.00 10.00 H new ATOM 0 HB3 LYS A 437 -6.634 0.039 -3.818 1.00 10.00 H new ATOM 0 HG2 LYS A 437 -4.478 0.105 -4.692 1.00 10.00 H new ATOM 0 HG3 LYS A 437 -4.147 -1.572 -4.306 1.00 10.00 H new ATOM 0 HD2 LYS A 437 -5.642 -2.329 -6.102 1.00 10.00 H new ATOM 0 HD3 LYS A 437 -6.130 -0.679 -6.437 1.00 10.00 H new ATOM 0 HE2 LYS A 437 -4.088 -0.119 -7.425 1.00 10.00 H new ATOM 0 HE3 LYS A 437 -3.193 -1.326 -6.524 1.00 10.00 H new ATOM 0 HZ1 LYS A 437 -3.346 -2.058 -8.757 1.00 10.00 H new ATOM 0 HZ2 LYS A 437 -4.394 -3.047 -7.859 1.00 10.00 H new ATOM 0 HZ3 LYS A 437 -5.023 -1.796 -8.820 1.00 10.00 H new ATOM 413 N GLU A 438 -7.606 -0.856 -0.777 1.00 10.00 N ATOM 414 CA GLU A 438 -8.473 -0.121 0.128 1.00 10.00 C ATOM 415 C GLU A 438 -7.706 0.369 1.349 1.00 10.00 C ATOM 416 O GLU A 438 -8.080 1.365 1.962 1.00 10.00 O ATOM 417 CB GLU A 438 -9.636 -1.003 0.573 1.00 10.00 C ATOM 418 CG GLU A 438 -10.936 -0.243 0.776 1.00 10.00 C ATOM 419 CD GLU A 438 -11.623 0.095 -0.533 1.00 10.00 C ATOM 420 OE1 GLU A 438 -11.329 1.171 -1.097 1.00 10.00 O ATOM 421 OE2 GLU A 438 -12.454 -0.714 -0.995 1.00 10.00 O ATOM 0 H GLU A 438 -7.867 -1.834 -0.907 1.00 10.00 H new ATOM 0 HA GLU A 438 -8.858 0.747 -0.408 1.00 10.00 H new ATOM 0 HB2 GLU A 438 -9.794 -1.783 -0.171 1.00 10.00 H new ATOM 0 HB3 GLU A 438 -9.367 -1.501 1.505 1.00 10.00 H new ATOM 0 HG2 GLU A 438 -11.609 -0.839 1.392 1.00 10.00 H new ATOM 0 HG3 GLU A 438 -10.733 0.677 1.324 1.00 10.00 H new ATOM 428 N THR A 439 -6.644 -0.341 1.711 1.00 10.00 N ATOM 429 CA THR A 439 -5.853 0.038 2.875 1.00 10.00 C ATOM 430 C THR A 439 -4.741 1.019 2.507 1.00 10.00 C ATOM 431 O THR A 439 -4.597 2.067 3.137 1.00 10.00 O ATOM 432 CB THR A 439 -5.270 -1.208 3.543 1.00 10.00 C ATOM 433 OG1 THR A 439 -6.304 -2.102 3.918 1.00 10.00 O ATOM 434 CG2 THR A 439 -4.459 -0.903 4.783 1.00 10.00 C ATOM 0 H THR A 439 -6.314 -1.173 1.222 1.00 10.00 H new ATOM 0 HA THR A 439 -6.514 0.543 3.579 1.00 10.00 H new ATOM 0 HB THR A 439 -4.609 -1.652 2.798 1.00 10.00 H new ATOM 0 HG1 THR A 439 -6.053 -2.563 4.746 1.00 10.00 H new ATOM 0 HG21 THR A 439 -4.076 -1.832 5.205 1.00 10.00 H new ATOM 0 HG22 THR A 439 -3.625 -0.252 4.521 1.00 10.00 H new ATOM 0 HG23 THR A 439 -5.091 -0.404 5.518 1.00 10.00 H new ATOM 442 N PHE A 440 -3.962 0.683 1.486 1.00 10.00 N ATOM 443 CA PHE A 440 -2.873 1.541 1.042 1.00 10.00 C ATOM 444 C PHE A 440 -3.419 2.774 0.329 1.00 10.00 C ATOM 445 O PHE A 440 -2.840 3.855 0.409 1.00 10.00 O ATOM 446 CB PHE A 440 -1.929 0.772 0.110 1.00 10.00 C ATOM 447 CG PHE A 440 -2.297 -0.660 -0.084 1.00 10.00 C ATOM 448 CD1 PHE A 440 -2.210 -1.578 0.946 1.00 10.00 C ATOM 449 CD2 PHE A 440 -2.750 -1.078 -1.309 1.00 10.00 C ATOM 450 CE1 PHE A 440 -2.569 -2.889 0.739 1.00 10.00 C ATOM 451 CE2 PHE A 440 -3.112 -2.378 -1.520 1.00 10.00 C ATOM 452 CZ PHE A 440 -3.020 -3.281 -0.502 1.00 10.00 C ATOM 0 H PHE A 440 -4.065 -0.179 0.950 1.00 10.00 H new ATOM 0 HA PHE A 440 -2.314 1.863 1.920 1.00 10.00 H new ATOM 0 HB2 PHE A 440 -1.913 1.266 -0.861 1.00 10.00 H new ATOM 0 HB3 PHE A 440 -0.917 0.825 0.512 1.00 10.00 H new ATOM 0 HD1 PHE A 440 -1.858 -1.264 1.918 1.00 10.00 H new ATOM 0 HD2 PHE A 440 -2.822 -0.368 -2.120 1.00 10.00 H new ATOM 0 HE1 PHE A 440 -2.498 -3.606 1.543 1.00 10.00 H new ATOM 0 HE2 PHE A 440 -3.470 -2.690 -2.490 1.00 10.00 H new ATOM 0 HZ PHE A 440 -3.303 -4.310 -0.670 1.00 10.00 H new ATOM 462 N ARG A 441 -4.540 2.605 -0.368 1.00 10.00 N ATOM 463 CA ARG A 441 -5.153 3.716 -1.087 1.00 10.00 C ATOM 464 C ARG A 441 -5.925 4.621 -0.131 1.00 10.00 C ATOM 465 O ARG A 441 -6.068 5.818 -0.379 1.00 10.00 O ATOM 466 CB ARG A 441 -6.085 3.216 -2.193 1.00 10.00 C ATOM 467 CG ARG A 441 -6.414 4.273 -3.235 1.00 10.00 C ATOM 468 CD ARG A 441 -7.120 3.670 -4.439 1.00 10.00 C ATOM 469 NE ARG A 441 -8.238 4.497 -4.887 1.00 10.00 N ATOM 470 CZ ARG A 441 -9.199 4.066 -5.701 1.00 10.00 C ATOM 471 NH1 ARG A 441 -9.184 2.819 -6.156 1.00 10.00 N ATOM 472 NH2 ARG A 441 -10.180 4.882 -6.060 1.00 10.00 N ATOM 0 H ARG A 441 -5.037 1.718 -0.449 1.00 10.00 H new ATOM 0 HA ARG A 441 -4.348 4.290 -1.547 1.00 10.00 H new ATOM 0 HB2 ARG A 441 -5.623 2.362 -2.688 1.00 10.00 H new ATOM 0 HB3 ARG A 441 -7.012 2.861 -1.743 1.00 10.00 H new ATOM 0 HG2 ARG A 441 -7.046 5.041 -2.789 1.00 10.00 H new ATOM 0 HG3 ARG A 441 -5.496 4.764 -3.559 1.00 10.00 H new ATOM 0 HD2 ARG A 441 -6.407 3.550 -5.255 1.00 10.00 H new ATOM 0 HD3 ARG A 441 -7.484 2.674 -4.185 1.00 10.00 H new ATOM 0 HE ARG A 441 -8.285 5.461 -4.557 1.00 10.00 H new ATOM 0 HH11 ARG A 441 -8.433 2.185 -5.882 1.00 10.00 H new ATOM 0 HH12 ARG A 441 -9.923 2.495 -6.779 1.00 10.00 H new ATOM 0 HH21 ARG A 441 -10.199 5.841 -5.712 1.00 10.00 H new ATOM 0 HH22 ARG A 441 -10.916 4.551 -6.684 1.00 10.00 H new ATOM 486 N GLU A 442 -6.423 4.045 0.965 1.00 10.00 N ATOM 487 CA GLU A 442 -7.178 4.817 1.947 1.00 10.00 C ATOM 488 C GLU A 442 -6.242 5.594 2.862 1.00 10.00 C ATOM 489 O GLU A 442 -6.537 6.725 3.247 1.00 10.00 O ATOM 490 CB GLU A 442 -8.080 3.903 2.779 1.00 10.00 C ATOM 491 CG GLU A 442 -8.856 4.631 3.864 1.00 10.00 C ATOM 492 CD GLU A 442 -10.030 3.825 4.383 1.00 10.00 C ATOM 493 OE1 GLU A 442 -9.811 2.934 5.230 1.00 10.00 O ATOM 494 OE2 GLU A 442 -11.170 4.085 3.942 1.00 10.00 O ATOM 0 H GLU A 442 -6.317 3.056 1.191 1.00 10.00 H new ATOM 0 HA GLU A 442 -7.803 5.526 1.404 1.00 10.00 H new ATOM 0 HB2 GLU A 442 -8.785 3.401 2.116 1.00 10.00 H new ATOM 0 HB3 GLU A 442 -7.469 3.127 3.240 1.00 10.00 H new ATOM 0 HG2 GLU A 442 -8.185 4.863 4.691 1.00 10.00 H new ATOM 0 HG3 GLU A 442 -9.218 5.581 3.471 1.00 10.00 H new ATOM 501 N LYS A 443 -5.109 4.990 3.200 1.00 10.00 N ATOM 502 CA LYS A 443 -4.138 5.643 4.058 1.00 10.00 C ATOM 503 C LYS A 443 -3.520 6.824 3.330 1.00 10.00 C ATOM 504 O LYS A 443 -3.315 7.886 3.909 1.00 10.00 O ATOM 505 CB LYS A 443 -3.051 4.659 4.490 1.00 10.00 C ATOM 506 CG LYS A 443 -3.350 3.960 5.806 1.00 10.00 C ATOM 507 CD LYS A 443 -4.565 3.054 5.694 1.00 10.00 C ATOM 508 CE LYS A 443 -5.273 2.903 7.031 1.00 10.00 C ATOM 509 NZ LYS A 443 -6.434 1.974 6.943 1.00 10.00 N ATOM 0 H LYS A 443 -4.844 4.054 2.893 1.00 10.00 H new ATOM 0 HA LYS A 443 -4.647 6.002 4.952 1.00 10.00 H new ATOM 0 HB2 LYS A 443 -2.922 3.908 3.711 1.00 10.00 H new ATOM 0 HB3 LYS A 443 -2.104 5.192 4.578 1.00 10.00 H new ATOM 0 HG2 LYS A 443 -2.484 3.373 6.112 1.00 10.00 H new ATOM 0 HG3 LYS A 443 -3.521 4.704 6.584 1.00 10.00 H new ATOM 0 HD2 LYS A 443 -5.258 3.462 4.958 1.00 10.00 H new ATOM 0 HD3 LYS A 443 -4.257 2.073 5.332 1.00 10.00 H new ATOM 0 HE2 LYS A 443 -4.568 2.533 7.775 1.00 10.00 H new ATOM 0 HE3 LYS A 443 -5.615 3.880 7.373 1.00 10.00 H new ATOM 0 HZ1 LYS A 443 -6.998 2.040 7.814 1.00 10.00 H new ATOM 0 HZ2 LYS A 443 -7.025 2.233 6.128 1.00 10.00 H new ATOM 0 HZ3 LYS A 443 -6.091 0.999 6.825 1.00 10.00 H new ATOM 523 N PHE A 444 -3.248 6.641 2.042 1.00 10.00 N ATOM 524 CA PHE A 444 -2.677 7.701 1.234 1.00 10.00 C ATOM 525 C PHE A 444 -3.670 8.839 1.148 1.00 10.00 C ATOM 526 O PHE A 444 -3.296 10.012 1.114 1.00 10.00 O ATOM 527 CB PHE A 444 -2.302 7.171 -0.148 1.00 10.00 C ATOM 528 CG PHE A 444 -1.633 8.184 -1.029 1.00 10.00 C ATOM 529 CD1 PHE A 444 -2.330 9.282 -1.507 1.00 10.00 C ATOM 530 CD2 PHE A 444 -0.303 8.035 -1.378 1.00 10.00 C ATOM 531 CE1 PHE A 444 -1.709 10.213 -2.318 1.00 10.00 C ATOM 532 CE2 PHE A 444 0.324 8.961 -2.189 1.00 10.00 C ATOM 533 CZ PHE A 444 -0.380 10.053 -2.660 1.00 10.00 C ATOM 0 H PHE A 444 -3.415 5.769 1.540 1.00 10.00 H new ATOM 0 HA PHE A 444 -1.761 8.072 1.695 1.00 10.00 H new ATOM 0 HB2 PHE A 444 -1.639 6.314 -0.030 1.00 10.00 H new ATOM 0 HB3 PHE A 444 -3.203 6.811 -0.645 1.00 10.00 H new ATOM 0 HD1 PHE A 444 -3.369 9.412 -1.243 1.00 10.00 H new ATOM 0 HD2 PHE A 444 0.252 7.184 -1.012 1.00 10.00 H new ATOM 0 HE1 PHE A 444 -2.262 11.065 -2.684 1.00 10.00 H new ATOM 0 HE2 PHE A 444 1.363 8.832 -2.455 1.00 10.00 H new ATOM 0 HZ PHE A 444 0.107 10.779 -3.294 1.00 10.00 H new ATOM 543 N MET A 445 -4.950 8.483 1.179 1.00 10.00 N ATOM 544 CA MET A 445 -5.999 9.477 1.175 1.00 10.00 C ATOM 545 C MET A 445 -6.044 10.120 2.558 1.00 10.00 C ATOM 546 O MET A 445 -6.404 11.286 2.716 1.00 10.00 O ATOM 547 CB MET A 445 -7.349 8.846 0.830 1.00 10.00 C ATOM 548 CG MET A 445 -8.498 9.841 0.805 1.00 10.00 C ATOM 549 SD MET A 445 -8.775 10.542 -0.832 1.00 10.00 S ATOM 550 CE MET A 445 -7.290 11.523 -1.037 1.00 10.00 C ATOM 0 H MET A 445 -5.277 7.517 1.207 1.00 10.00 H new ATOM 0 HA MET A 445 -5.792 10.231 0.416 1.00 10.00 H new ATOM 0 HB2 MET A 445 -7.276 8.363 -0.145 1.00 10.00 H new ATOM 0 HB3 MET A 445 -7.572 8.065 1.557 1.00 10.00 H new ATOM 0 HG2 MET A 445 -9.409 9.347 1.143 1.00 10.00 H new ATOM 0 HG3 MET A 445 -8.292 10.646 1.510 1.00 10.00 H new ATOM 0 HE1 MET A 445 -7.489 12.344 -1.726 1.00 10.00 H new ATOM 0 HE2 MET A 445 -6.984 11.926 -0.071 1.00 10.00 H new ATOM 0 HE3 MET A 445 -6.493 10.897 -1.438 1.00 10.00 H new ATOM 560 N GLN A 446 -5.637 9.327 3.551 1.00 10.00 N ATOM 561 CA GLN A 446 -5.574 9.760 4.938 1.00 10.00 C ATOM 562 C GLN A 446 -4.391 10.692 5.137 1.00 10.00 C ATOM 563 O GLN A 446 -4.463 11.676 5.874 1.00 10.00 O ATOM 564 CB GLN A 446 -5.403 8.537 5.844 1.00 10.00 C ATOM 565 CG GLN A 446 -5.787 8.788 7.293 1.00 10.00 C ATOM 566 CD GLN A 446 -6.838 7.816 7.794 1.00 10.00 C ATOM 567 OE1 GLN A 446 -7.763 8.199 8.510 1.00 10.00 O ATOM 568 NE2 GLN A 446 -6.699 6.548 7.420 1.00 10.00 N ATOM 0 H GLN A 446 -5.341 8.361 3.409 1.00 10.00 H new ATOM 0 HA GLN A 446 -6.495 10.285 5.189 1.00 10.00 H new ATOM 0 HB2 GLN A 446 -6.009 7.720 5.454 1.00 10.00 H new ATOM 0 HB3 GLN A 446 -4.364 8.210 5.805 1.00 10.00 H new ATOM 0 HG2 GLN A 446 -4.898 8.711 7.919 1.00 10.00 H new ATOM 0 HG3 GLN A 446 -6.161 9.807 7.395 1.00 10.00 H new ATOM 0 HE21 GLN A 446 -5.917 6.274 6.825 1.00 10.00 H new ATOM 0 HE22 GLN A 446 -7.375 5.849 7.728 1.00 10.00 H new ATOM 577 N HIS A 447 -3.294 10.349 4.477 1.00 10.00 N ATOM 578 CA HIS A 447 -2.061 11.111 4.561 1.00 10.00 C ATOM 579 C HIS A 447 -1.838 11.919 3.282 1.00 10.00 C ATOM 580 O HIS A 447 -1.363 11.391 2.277 1.00 10.00 O ATOM 581 CB HIS A 447 -0.901 10.147 4.816 1.00 10.00 C ATOM 582 CG HIS A 447 -1.189 9.176 5.924 1.00 10.00 C ATOM 583 ND1 HIS A 447 -1.176 9.539 7.254 1.00 10.00 N ATOM 584 CD2 HIS A 447 -1.528 7.858 5.902 1.00 10.00 C ATOM 585 CE1 HIS A 447 -1.494 8.496 7.999 1.00 10.00 C ATOM 586 NE2 HIS A 447 -1.712 7.466 7.204 1.00 10.00 N ATOM 0 H HIS A 447 -3.236 9.533 3.868 1.00 10.00 H new ATOM 0 HA HIS A 447 -2.123 11.821 5.386 1.00 10.00 H new ATOM 0 HB2 HIS A 447 -0.685 9.595 3.901 1.00 10.00 H new ATOM 0 HB3 HIS A 447 -0.006 10.719 5.062 1.00 10.00 H new ATOM 0 HD2 HIS A 447 -1.633 7.237 5.024 1.00 10.00 H new ATOM 0 HE1 HIS A 447 -1.564 8.488 9.077 1.00 10.00 H new ATOM 0 HE2 HIS A 447 -1.975 6.529 7.508 1.00 10.00 H new ATOM 595 N PRO A 448 -2.200 13.218 3.302 1.00 10.00 N ATOM 596 CA PRO A 448 -2.061 14.109 2.147 1.00 10.00 C ATOM 597 C PRO A 448 -0.759 13.912 1.374 1.00 10.00 C ATOM 598 O PRO A 448 0.257 14.532 1.685 1.00 10.00 O ATOM 599 CB PRO A 448 -2.098 15.493 2.786 1.00 10.00 C ATOM 600 CG PRO A 448 -2.990 15.332 3.969 1.00 10.00 C ATOM 601 CD PRO A 448 -2.791 13.920 4.462 1.00 10.00 C ATOM 0 HA PRO A 448 -2.838 13.928 1.404 1.00 10.00 H new ATOM 0 HB2 PRO A 448 -1.101 15.821 3.082 1.00 10.00 H new ATOM 0 HB3 PRO A 448 -2.487 16.240 2.094 1.00 10.00 H new ATOM 0 HG2 PRO A 448 -2.739 16.054 4.746 1.00 10.00 H new ATOM 0 HG3 PRO A 448 -4.031 15.506 3.697 1.00 10.00 H new ATOM 0 HD2 PRO A 448 -2.129 13.889 5.328 1.00 10.00 H new ATOM 0 HD3 PRO A 448 -3.734 13.466 4.765 1.00 10.00 H new ATOM 609 N LYS A 449 -0.812 13.056 0.354 1.00 10.00 N ATOM 610 CA LYS A 449 0.349 12.776 -0.494 1.00 10.00 C ATOM 611 C LYS A 449 1.628 12.609 0.321 1.00 10.00 C ATOM 612 O LYS A 449 2.254 13.590 0.723 1.00 10.00 O ATOM 613 CB LYS A 449 0.532 13.896 -1.520 1.00 10.00 C ATOM 614 CG LYS A 449 1.593 13.595 -2.565 1.00 10.00 C ATOM 615 CD LYS A 449 1.576 14.621 -3.687 1.00 10.00 C ATOM 616 CE LYS A 449 0.746 14.143 -4.867 1.00 10.00 C ATOM 617 NZ LYS A 449 0.762 15.121 -5.990 1.00 10.00 N ATOM 0 H LYS A 449 -1.652 12.541 0.093 1.00 10.00 H new ATOM 0 HA LYS A 449 0.158 11.833 -1.007 1.00 10.00 H new ATOM 0 HB2 LYS A 449 -0.419 14.077 -2.021 1.00 10.00 H new ATOM 0 HB3 LYS A 449 0.798 14.815 -0.998 1.00 10.00 H new ATOM 0 HG2 LYS A 449 2.576 13.585 -2.095 1.00 10.00 H new ATOM 0 HG3 LYS A 449 1.427 12.600 -2.978 1.00 10.00 H new ATOM 0 HD2 LYS A 449 1.172 15.562 -3.314 1.00 10.00 H new ATOM 0 HD3 LYS A 449 2.596 14.820 -4.015 1.00 10.00 H new ATOM 0 HE2 LYS A 449 1.129 13.184 -5.215 1.00 10.00 H new ATOM 0 HE3 LYS A 449 -0.282 13.977 -4.544 1.00 10.00 H new ATOM 0 HZ1 LYS A 449 0.184 14.758 -6.775 1.00 10.00 H new ATOM 0 HZ2 LYS A 449 0.373 16.029 -5.665 1.00 10.00 H new ATOM 0 HZ3 LYS A 449 1.740 15.260 -6.315 1.00 10.00 H new ATOM 631 N ASN A 450 2.022 11.360 0.549 1.00 10.00 N ATOM 632 CA ASN A 450 3.234 11.071 1.304 1.00 10.00 C ATOM 633 C ASN A 450 3.945 9.844 0.746 1.00 10.00 C ATOM 634 O ASN A 450 5.106 9.916 0.346 1.00 10.00 O ATOM 635 CB ASN A 450 2.911 10.866 2.789 1.00 10.00 C ATOM 636 CG ASN A 450 1.704 9.975 3.012 1.00 10.00 C ATOM 637 OD1 ASN A 450 0.718 10.045 2.279 1.00 10.00 O ATOM 638 ND2 ASN A 450 1.776 9.125 4.032 1.00 10.00 N ATOM 0 H ASN A 450 1.520 10.534 0.222 1.00 10.00 H new ATOM 0 HA ASN A 450 3.901 11.928 1.207 1.00 10.00 H new ATOM 0 HB2 ASN A 450 3.776 10.429 3.287 1.00 10.00 H new ATOM 0 HB3 ASN A 450 2.732 11.835 3.254 1.00 10.00 H new ATOM 0 HD21 ASN A 450 0.995 8.499 4.231 1.00 10.00 H new ATOM 0 HD22 ASN A 450 2.612 9.099 4.616 1.00 10.00 H new ATOM 645 N PHE A 451 3.239 8.720 0.724 1.00 10.00 N ATOM 646 CA PHE A 451 3.796 7.467 0.219 1.00 10.00 C ATOM 647 C PHE A 451 4.873 6.913 1.153 1.00 10.00 C ATOM 648 O PHE A 451 5.428 5.844 0.903 1.00 10.00 O ATOM 649 CB PHE A 451 4.363 7.666 -1.192 1.00 10.00 C ATOM 650 CG PHE A 451 3.758 6.757 -2.228 1.00 10.00 C ATOM 651 CD1 PHE A 451 2.430 6.374 -2.142 1.00 10.00 C ATOM 652 CD2 PHE A 451 4.516 6.293 -3.292 1.00 10.00 C ATOM 653 CE1 PHE A 451 1.868 5.545 -3.091 1.00 10.00 C ATOM 654 CE2 PHE A 451 3.958 5.465 -4.248 1.00 10.00 C ATOM 655 CZ PHE A 451 2.633 5.090 -4.147 1.00 10.00 C ATOM 0 H PHE A 451 2.275 8.649 1.051 1.00 10.00 H new ATOM 0 HA PHE A 451 2.987 6.737 0.177 1.00 10.00 H new ATOM 0 HB2 PHE A 451 4.204 8.701 -1.494 1.00 10.00 H new ATOM 0 HB3 PHE A 451 5.441 7.504 -1.166 1.00 10.00 H new ATOM 0 HD1 PHE A 451 1.826 6.729 -1.320 1.00 10.00 H new ATOM 0 HD2 PHE A 451 5.553 6.581 -3.375 1.00 10.00 H new ATOM 0 HE1 PHE A 451 0.832 5.252 -3.008 1.00 10.00 H new ATOM 0 HE2 PHE A 451 4.558 5.112 -5.073 1.00 10.00 H new ATOM 0 HZ PHE A 451 2.196 4.442 -4.892 1.00 10.00 H new ATOM 665 N GLY A 452 5.154 7.633 2.237 1.00 10.00 N ATOM 666 CA GLY A 452 6.146 7.183 3.190 1.00 10.00 C ATOM 667 C GLY A 452 5.524 6.356 4.295 1.00 10.00 C ATOM 668 O GLY A 452 6.144 5.424 4.807 1.00 10.00 O ATOM 0 H GLY A 452 4.710 8.521 2.469 1.00 10.00 H new ATOM 0 HA2 GLY A 452 6.904 6.592 2.675 1.00 10.00 H new ATOM 0 HA3 GLY A 452 6.653 8.045 3.622 1.00 10.00 H new ATOM 672 N LEU A 453 4.287 6.691 4.654 1.00 10.00 N ATOM 673 CA LEU A 453 3.576 5.963 5.695 1.00 10.00 C ATOM 674 C LEU A 453 2.963 4.694 5.132 1.00 10.00 C ATOM 675 O LEU A 453 3.156 3.606 5.676 1.00 10.00 O ATOM 676 CB LEU A 453 2.478 6.822 6.322 1.00 10.00 C ATOM 677 CG LEU A 453 1.475 6.045 7.182 1.00 10.00 C ATOM 678 CD1 LEU A 453 0.942 6.919 8.302 1.00 10.00 C ATOM 679 CD2 LEU A 453 0.338 5.504 6.320 1.00 10.00 C ATOM 0 H LEU A 453 3.760 7.460 4.239 1.00 10.00 H new ATOM 0 HA LEU A 453 4.300 5.705 6.467 1.00 10.00 H new ATOM 0 HB2 LEU A 453 2.944 7.592 6.936 1.00 10.00 H new ATOM 0 HB3 LEU A 453 1.936 7.333 5.527 1.00 10.00 H new ATOM 0 HG LEU A 453 1.990 5.197 7.634 1.00 10.00 H new ATOM 0 HD11 LEU A 453 0.232 6.350 8.901 1.00 10.00 H new ATOM 0 HD12 LEU A 453 1.768 7.246 8.933 1.00 10.00 H new ATOM 0 HD13 LEU A 453 0.443 7.790 7.878 1.00 10.00 H new ATOM 0 HD21 LEU A 453 -0.365 4.955 6.947 1.00 10.00 H new ATOM 0 HD22 LEU A 453 -0.178 6.333 5.837 1.00 10.00 H new ATOM 0 HD23 LEU A 453 0.744 4.837 5.560 1.00 10.00 H new ATOM 691 N ILE A 454 2.219 4.834 4.043 1.00 10.00 N ATOM 692 CA ILE A 454 1.582 3.692 3.417 1.00 10.00 C ATOM 693 C ILE A 454 2.606 2.618 3.113 1.00 10.00 C ATOM 694 O ILE A 454 2.368 1.440 3.347 1.00 10.00 O ATOM 695 CB ILE A 454 0.827 4.106 2.146 1.00 10.00 C ATOM 696 CG1 ILE A 454 -0.510 4.690 2.553 1.00 10.00 C ATOM 697 CG2 ILE A 454 0.640 2.935 1.188 1.00 10.00 C ATOM 698 CD1 ILE A 454 -0.479 6.197 2.631 1.00 10.00 C ATOM 0 H ILE A 454 2.044 5.725 3.579 1.00 10.00 H new ATOM 0 HA ILE A 454 0.852 3.284 4.116 1.00 10.00 H new ATOM 0 HB ILE A 454 1.414 4.852 1.611 1.00 10.00 H new ATOM 0 HG12 ILE A 454 -1.272 4.381 1.837 1.00 10.00 H new ATOM 0 HG13 ILE A 454 -0.801 4.284 3.522 1.00 10.00 H new ATOM 0 HG21 ILE A 454 0.101 3.272 0.302 1.00 10.00 H new ATOM 0 HG22 ILE A 454 1.615 2.546 0.894 1.00 10.00 H new ATOM 0 HG23 ILE A 454 0.070 2.148 1.682 1.00 10.00 H new ATOM 0 HD11 ILE A 454 -1.461 6.566 2.926 1.00 10.00 H new ATOM 0 HD12 ILE A 454 0.262 6.508 3.367 1.00 10.00 H new ATOM 0 HD13 ILE A 454 -0.216 6.606 1.656 1.00 10.00 H new ATOM 710 N ALA A 455 3.763 3.045 2.635 1.00 10.00 N ATOM 711 CA ALA A 455 4.848 2.123 2.342 1.00 10.00 C ATOM 712 C ALA A 455 5.563 1.721 3.631 1.00 10.00 C ATOM 713 O ALA A 455 6.635 1.117 3.594 1.00 10.00 O ATOM 714 CB ALA A 455 5.828 2.753 1.365 1.00 10.00 C ATOM 0 H ALA A 455 3.975 4.024 2.442 1.00 10.00 H new ATOM 0 HA ALA A 455 4.430 1.227 1.883 1.00 10.00 H new ATOM 0 HB1 ALA A 455 6.635 2.051 1.155 1.00 10.00 H new ATOM 0 HB2 ALA A 455 5.310 2.998 0.438 1.00 10.00 H new ATOM 0 HB3 ALA A 455 6.242 3.662 1.801 1.00 10.00 H new ATOM 720 N SER A 456 4.962 2.067 4.771 1.00 10.00 N ATOM 721 CA SER A 456 5.540 1.751 6.069 1.00 10.00 C ATOM 722 C SER A 456 4.669 0.758 6.834 1.00 10.00 C ATOM 723 O SER A 456 5.186 -0.079 7.575 1.00 10.00 O ATOM 724 CB SER A 456 5.722 3.029 6.892 1.00 10.00 C ATOM 725 OG SER A 456 7.061 3.163 7.335 1.00 10.00 O ATOM 0 H SER A 456 4.074 2.567 4.817 1.00 10.00 H new ATOM 0 HA SER A 456 6.514 1.291 5.900 1.00 10.00 H new ATOM 0 HB2 SER A 456 5.446 3.895 6.291 1.00 10.00 H new ATOM 0 HB3 SER A 456 5.051 3.011 7.751 1.00 10.00 H new ATOM 0 HG SER A 456 7.152 3.988 7.857 1.00 10.00 H new ATOM 731 N PHE A 457 3.349 0.843 6.657 1.00 10.00 N ATOM 732 CA PHE A 457 2.449 -0.074 7.350 1.00 10.00 C ATOM 733 C PHE A 457 2.410 -1.424 6.636 1.00 10.00 C ATOM 734 O PHE A 457 2.208 -2.464 7.263 1.00 10.00 O ATOM 735 CB PHE A 457 1.044 0.532 7.483 1.00 10.00 C ATOM 736 CG PHE A 457 0.216 0.469 6.233 1.00 10.00 C ATOM 737 CD1 PHE A 457 -0.285 -0.742 5.779 1.00 10.00 C ATOM 738 CD2 PHE A 457 -0.064 1.620 5.510 1.00 10.00 C ATOM 739 CE1 PHE A 457 -1.046 -0.806 4.633 1.00 10.00 C ATOM 740 CE2 PHE A 457 -0.826 1.559 4.363 1.00 10.00 C ATOM 741 CZ PHE A 457 -1.317 0.349 3.924 1.00 10.00 C ATOM 0 H PHE A 457 2.889 1.523 6.052 1.00 10.00 H new ATOM 0 HA PHE A 457 2.830 -0.238 8.358 1.00 10.00 H new ATOM 0 HB2 PHE A 457 0.513 0.014 8.281 1.00 10.00 H new ATOM 0 HB3 PHE A 457 1.139 1.574 7.788 1.00 10.00 H new ATOM 0 HD1 PHE A 457 -0.076 -1.646 6.331 1.00 10.00 H new ATOM 0 HD2 PHE A 457 0.318 2.572 5.849 1.00 10.00 H new ATOM 0 HE1 PHE A 457 -1.430 -1.755 4.290 1.00 10.00 H new ATOM 0 HE2 PHE A 457 -1.038 2.461 3.808 1.00 10.00 H new ATOM 0 HZ PHE A 457 -1.914 0.303 3.025 1.00 10.00 H new ATOM 751 N LEU A 458 2.629 -1.398 5.324 1.00 10.00 N ATOM 752 CA LEU A 458 2.647 -2.618 4.521 1.00 10.00 C ATOM 753 C LEU A 458 4.068 -2.884 4.029 1.00 10.00 C ATOM 754 O LEU A 458 4.302 -3.096 2.842 1.00 10.00 O ATOM 755 CB LEU A 458 1.678 -2.500 3.339 1.00 10.00 C ATOM 756 CG LEU A 458 1.605 -1.115 2.699 1.00 10.00 C ATOM 757 CD1 LEU A 458 2.972 -0.712 2.170 1.00 10.00 C ATOM 758 CD2 LEU A 458 0.563 -1.084 1.585 1.00 10.00 C ATOM 0 H LEU A 458 2.797 -0.543 4.793 1.00 10.00 H new ATOM 0 HA LEU A 458 2.322 -3.456 5.138 1.00 10.00 H new ATOM 0 HB2 LEU A 458 1.970 -3.221 2.576 1.00 10.00 H new ATOM 0 HB3 LEU A 458 0.680 -2.780 3.677 1.00 10.00 H new ATOM 0 HG LEU A 458 1.300 -0.397 3.460 1.00 10.00 H new ATOM 0 HD11 LEU A 458 2.909 0.277 1.716 1.00 10.00 H new ATOM 0 HD12 LEU A 458 3.688 -0.689 2.992 1.00 10.00 H new ATOM 0 HD13 LEU A 458 3.300 -1.434 1.423 1.00 10.00 H new ATOM 0 HD21 LEU A 458 0.530 -0.087 1.145 1.00 10.00 H new ATOM 0 HD22 LEU A 458 0.829 -1.811 0.817 1.00 10.00 H new ATOM 0 HD23 LEU A 458 -0.416 -1.332 1.995 1.00 10.00 H new ATOM 770 N GLU A 459 5.005 -2.848 4.978 1.00 10.00 N ATOM 771 CA GLU A 459 6.438 -3.059 4.726 1.00 10.00 C ATOM 772 C GLU A 459 6.711 -3.929 3.500 1.00 10.00 C ATOM 773 O GLU A 459 7.624 -3.644 2.726 1.00 10.00 O ATOM 774 CB GLU A 459 7.096 -3.689 5.955 1.00 10.00 C ATOM 775 CG GLU A 459 8.597 -3.463 6.025 1.00 10.00 C ATOM 776 CD GLU A 459 9.380 -4.509 5.257 1.00 10.00 C ATOM 777 OE1 GLU A 459 8.879 -5.645 5.122 1.00 10.00 O ATOM 778 OE2 GLU A 459 10.494 -4.193 4.790 1.00 10.00 O ATOM 0 H GLU A 459 4.790 -2.669 5.959 1.00 10.00 H new ATOM 0 HA GLU A 459 6.867 -2.077 4.524 1.00 10.00 H new ATOM 0 HB2 GLU A 459 6.633 -3.281 6.854 1.00 10.00 H new ATOM 0 HB3 GLU A 459 6.898 -4.761 5.953 1.00 10.00 H new ATOM 0 HG2 GLU A 459 8.831 -2.475 5.628 1.00 10.00 H new ATOM 0 HG3 GLU A 459 8.914 -3.471 7.068 1.00 10.00 H new ATOM 785 N ARG A 460 5.923 -4.985 3.326 1.00 10.00 N ATOM 786 CA ARG A 460 6.092 -5.886 2.186 1.00 10.00 C ATOM 787 C ARG A 460 6.272 -5.093 0.893 1.00 10.00 C ATOM 788 O ARG A 460 6.921 -5.552 -0.046 1.00 10.00 O ATOM 789 CB ARG A 460 4.887 -6.821 2.063 1.00 10.00 C ATOM 790 CG ARG A 460 5.063 -8.137 2.802 1.00 10.00 C ATOM 791 CD ARG A 460 6.303 -8.881 2.332 1.00 10.00 C ATOM 792 NE ARG A 460 7.453 -8.630 3.197 1.00 10.00 N ATOM 793 CZ ARG A 460 7.545 -9.062 4.452 1.00 10.00 C ATOM 794 NH1 ARG A 460 6.559 -9.767 4.993 1.00 10.00 N ATOM 795 NH2 ARG A 460 8.627 -8.789 5.169 1.00 10.00 N ATOM 0 H ARG A 460 5.163 -5.239 3.956 1.00 10.00 H new ATOM 0 HA ARG A 460 6.988 -6.484 2.354 1.00 10.00 H new ATOM 0 HB2 ARG A 460 4.002 -6.313 2.447 1.00 10.00 H new ATOM 0 HB3 ARG A 460 4.703 -7.027 1.009 1.00 10.00 H new ATOM 0 HG2 ARG A 460 5.136 -7.947 3.873 1.00 10.00 H new ATOM 0 HG3 ARG A 460 4.183 -8.762 2.649 1.00 10.00 H new ATOM 0 HD2 ARG A 460 6.096 -9.951 2.306 1.00 10.00 H new ATOM 0 HD3 ARG A 460 6.543 -8.578 1.313 1.00 10.00 H new ATOM 0 HE ARG A 460 8.231 -8.092 2.816 1.00 10.00 H new ATOM 0 HH11 ARG A 460 5.725 -9.980 4.446 1.00 10.00 H new ATOM 0 HH12 ARG A 460 6.635 -10.095 5.956 1.00 10.00 H new ATOM 0 HH21 ARG A 460 9.388 -8.248 4.758 1.00 10.00 H new ATOM 0 HH22 ARG A 460 8.698 -9.120 6.131 1.00 10.00 H new ATOM 809 N LYS A 461 5.696 -3.896 0.863 1.00 10.00 N ATOM 810 CA LYS A 461 5.790 -3.022 -0.301 1.00 10.00 C ATOM 811 C LYS A 461 6.893 -1.985 -0.097 1.00 10.00 C ATOM 812 O LYS A 461 7.758 -2.147 0.763 1.00 10.00 O ATOM 813 CB LYS A 461 4.451 -2.317 -0.557 1.00 10.00 C ATOM 814 CG LYS A 461 3.228 -3.109 -0.113 1.00 10.00 C ATOM 815 CD LYS A 461 2.744 -4.044 -1.208 1.00 10.00 C ATOM 816 CE LYS A 461 3.570 -5.317 -1.257 1.00 10.00 C ATOM 817 NZ LYS A 461 2.976 -6.395 -0.423 1.00 10.00 N ATOM 0 H LYS A 461 5.156 -3.507 1.636 1.00 10.00 H new ATOM 0 HA LYS A 461 6.034 -3.634 -1.169 1.00 10.00 H new ATOM 0 HB2 LYS A 461 4.455 -1.357 -0.040 1.00 10.00 H new ATOM 0 HB3 LYS A 461 4.364 -2.105 -1.623 1.00 10.00 H new ATOM 0 HG2 LYS A 461 3.471 -3.686 0.779 1.00 10.00 H new ATOM 0 HG3 LYS A 461 2.427 -2.422 0.160 1.00 10.00 H new ATOM 0 HD2 LYS A 461 1.697 -4.295 -1.038 1.00 10.00 H new ATOM 0 HD3 LYS A 461 2.798 -3.537 -2.171 1.00 10.00 H new ATOM 0 HE2 LYS A 461 3.650 -5.659 -2.289 1.00 10.00 H new ATOM 0 HE3 LYS A 461 4.582 -5.107 -0.912 1.00 10.00 H new ATOM 0 HZ1 LYS A 461 3.569 -7.247 -0.483 1.00 10.00 H new ATOM 0 HZ2 LYS A 461 2.923 -6.079 0.566 1.00 10.00 H new ATOM 0 HZ3 LYS A 461 2.020 -6.614 -0.768 1.00 10.00 H new ATOM 831 N THR A 462 6.854 -0.917 -0.888 1.00 10.00 N ATOM 832 CA THR A 462 7.846 0.148 -0.786 1.00 10.00 C ATOM 833 C THR A 462 7.282 1.454 -1.331 1.00 10.00 C ATOM 834 O THR A 462 6.259 1.457 -2.013 1.00 10.00 O ATOM 835 CB THR A 462 9.122 -0.233 -1.546 1.00 10.00 C ATOM 836 OG1 THR A 462 9.002 -1.524 -2.118 1.00 10.00 O ATOM 837 CG2 THR A 462 10.359 -0.233 -0.674 1.00 10.00 C ATOM 0 H THR A 462 6.146 -0.766 -1.607 1.00 10.00 H new ATOM 0 HA THR A 462 8.094 0.286 0.266 1.00 10.00 H new ATOM 0 HB THR A 462 9.237 0.530 -2.316 1.00 10.00 H new ATOM 0 HG1 THR A 462 9.826 -1.746 -2.599 1.00 10.00 H new ATOM 0 HG21 THR A 462 11.226 -0.511 -1.273 1.00 10.00 H new ATOM 0 HG22 THR A 462 10.510 0.763 -0.257 1.00 10.00 H new ATOM 0 HG23 THR A 462 10.233 -0.951 0.137 1.00 10.00 H new ATOM 845 N VAL A 463 7.948 2.563 -1.029 1.00 10.00 N ATOM 846 CA VAL A 463 7.496 3.865 -1.501 1.00 10.00 C ATOM 847 C VAL A 463 7.659 3.978 -3.011 1.00 10.00 C ATOM 848 O VAL A 463 6.777 4.483 -3.706 1.00 10.00 O ATOM 849 CB VAL A 463 8.262 5.019 -0.823 1.00 10.00 C ATOM 850 CG1 VAL A 463 7.633 6.358 -1.175 1.00 10.00 C ATOM 851 CG2 VAL A 463 8.305 4.823 0.687 1.00 10.00 C ATOM 0 H VAL A 463 8.797 2.586 -0.464 1.00 10.00 H new ATOM 0 HA VAL A 463 6.441 3.947 -1.238 1.00 10.00 H new ATOM 0 HB VAL A 463 9.287 5.015 -1.195 1.00 10.00 H new ATOM 0 HG11 VAL A 463 8.187 7.160 -0.687 1.00 10.00 H new ATOM 0 HG12 VAL A 463 7.663 6.501 -2.255 1.00 10.00 H new ATOM 0 HG13 VAL A 463 6.597 6.374 -0.835 1.00 10.00 H new ATOM 0 HG21 VAL A 463 8.850 5.648 1.146 1.00 10.00 H new ATOM 0 HG22 VAL A 463 7.288 4.797 1.080 1.00 10.00 H new ATOM 0 HG23 VAL A 463 8.807 3.884 0.918 1.00 10.00 H new ATOM 861 N ALA A 464 8.787 3.491 -3.515 1.00 10.00 N ATOM 862 CA ALA A 464 9.061 3.524 -4.946 1.00 10.00 C ATOM 863 C ALA A 464 8.348 2.379 -5.657 1.00 10.00 C ATOM 864 O ALA A 464 8.057 2.461 -6.851 1.00 10.00 O ATOM 865 CB ALA A 464 10.559 3.457 -5.199 1.00 10.00 C ATOM 0 H ALA A 464 9.526 3.069 -2.954 1.00 10.00 H new ATOM 0 HA ALA A 464 8.682 4.464 -5.347 1.00 10.00 H new ATOM 0 HB1 ALA A 464 10.748 3.483 -6.272 1.00 10.00 H new ATOM 0 HB2 ALA A 464 11.047 4.308 -4.724 1.00 10.00 H new ATOM 0 HB3 ALA A 464 10.957 2.532 -4.782 1.00 10.00 H new ATOM 871 N GLU A 465 8.066 1.313 -4.914 1.00 10.00 N ATOM 872 CA GLU A 465 7.384 0.150 -5.470 1.00 10.00 C ATOM 873 C GLU A 465 5.869 0.303 -5.359 1.00 10.00 C ATOM 874 O GLU A 465 5.120 -0.272 -6.148 1.00 10.00 O ATOM 875 CB GLU A 465 7.833 -1.123 -4.751 1.00 10.00 C ATOM 876 CG GLU A 465 7.340 -2.400 -5.411 1.00 10.00 C ATOM 877 CD GLU A 465 8.146 -2.768 -6.642 1.00 10.00 C ATOM 878 OE1 GLU A 465 9.369 -2.515 -6.649 1.00 10.00 O ATOM 879 OE2 GLU A 465 7.553 -3.311 -7.599 1.00 10.00 O ATOM 0 H GLU A 465 8.300 1.231 -3.925 1.00 10.00 H new ATOM 0 HA GLU A 465 7.648 0.075 -6.525 1.00 10.00 H new ATOM 0 HB2 GLU A 465 8.922 -1.142 -4.710 1.00 10.00 H new ATOM 0 HB3 GLU A 465 7.475 -1.094 -3.722 1.00 10.00 H new ATOM 0 HG2 GLU A 465 7.387 -3.218 -4.692 1.00 10.00 H new ATOM 0 HG3 GLU A 465 6.293 -2.280 -5.689 1.00 10.00 H new ATOM 886 N CYS A 466 5.422 1.084 -4.379 1.00 10.00 N ATOM 887 CA CYS A 466 3.997 1.310 -4.175 1.00 10.00 C ATOM 888 C CYS A 466 3.376 1.952 -5.407 1.00 10.00 C ATOM 889 O CYS A 466 2.185 1.788 -5.672 1.00 10.00 O ATOM 890 CB CYS A 466 3.760 2.189 -2.944 1.00 10.00 C ATOM 891 SG CYS A 466 3.408 1.262 -1.432 1.00 10.00 S ATOM 0 H CYS A 466 6.026 1.569 -3.716 1.00 10.00 H new ATOM 0 HA CYS A 466 3.520 0.344 -4.008 1.00 10.00 H new ATOM 0 HB2 CYS A 466 4.640 2.811 -2.780 1.00 10.00 H new ATOM 0 HB3 CYS A 466 2.927 2.863 -3.147 1.00 10.00 H new ATOM 0 HG CYS A 466 4.523 0.842 -0.911 1.00 10.00 H new ATOM 897 N VAL A 467 4.196 2.670 -6.173 1.00 10.00 N ATOM 898 CA VAL A 467 3.727 3.315 -7.392 1.00 10.00 C ATOM 899 C VAL A 467 3.091 2.294 -8.332 1.00 10.00 C ATOM 900 O VAL A 467 2.347 2.651 -9.244 1.00 10.00 O ATOM 901 CB VAL A 467 4.875 4.034 -8.127 1.00 10.00 C ATOM 902 CG1 VAL A 467 5.961 3.046 -8.523 1.00 10.00 C ATOM 903 CG2 VAL A 467 4.349 4.776 -9.348 1.00 10.00 C ATOM 0 H VAL A 467 5.185 2.818 -5.970 1.00 10.00 H new ATOM 0 HA VAL A 467 2.982 4.054 -7.099 1.00 10.00 H new ATOM 0 HB VAL A 467 5.312 4.765 -7.447 1.00 10.00 H new ATOM 0 HG11 VAL A 467 6.762 3.574 -9.041 1.00 10.00 H new ATOM 0 HG12 VAL A 467 6.360 2.567 -7.629 1.00 10.00 H new ATOM 0 HG13 VAL A 467 5.540 2.288 -9.184 1.00 10.00 H new ATOM 0 HG21 VAL A 467 5.175 5.277 -9.853 1.00 10.00 H new ATOM 0 HG22 VAL A 467 3.882 4.067 -10.032 1.00 10.00 H new ATOM 0 HG23 VAL A 467 3.613 5.516 -9.035 1.00 10.00 H new ATOM 913 N LEU A 468 3.389 1.017 -8.103 1.00 10.00 N ATOM 914 CA LEU A 468 2.846 -0.055 -8.925 1.00 10.00 C ATOM 915 C LEU A 468 1.365 -0.297 -8.629 1.00 10.00 C ATOM 916 O LEU A 468 0.741 -1.160 -9.242 1.00 10.00 O ATOM 917 CB LEU A 468 3.648 -1.340 -8.704 1.00 10.00 C ATOM 918 CG LEU A 468 4.109 -2.043 -9.982 1.00 10.00 C ATOM 919 CD1 LEU A 468 5.385 -1.406 -10.511 1.00 10.00 C ATOM 920 CD2 LEU A 468 4.319 -3.528 -9.725 1.00 10.00 C ATOM 0 H LEU A 468 4.005 0.702 -7.353 1.00 10.00 H new ATOM 0 HA LEU A 468 2.929 0.247 -9.969 1.00 10.00 H new ATOM 0 HB2 LEU A 468 4.525 -1.104 -8.101 1.00 10.00 H new ATOM 0 HB3 LEU A 468 3.040 -2.035 -8.124 1.00 10.00 H new ATOM 0 HG LEU A 468 3.332 -1.931 -10.738 1.00 10.00 H new ATOM 0 HD11 LEU A 468 5.698 -1.919 -11.420 1.00 10.00 H new ATOM 0 HD12 LEU A 468 5.202 -0.355 -10.732 1.00 10.00 H new ATOM 0 HD13 LEU A 468 6.171 -1.487 -9.760 1.00 10.00 H new ATOM 0 HD21 LEU A 468 4.647 -4.014 -10.644 1.00 10.00 H new ATOM 0 HD22 LEU A 468 5.078 -3.660 -8.954 1.00 10.00 H new ATOM 0 HD23 LEU A 468 3.383 -3.976 -9.392 1.00 10.00 H new ATOM 932 N TYR A 469 0.811 0.463 -7.690 1.00 10.00 N ATOM 933 CA TYR A 469 -0.596 0.331 -7.329 1.00 10.00 C ATOM 934 C TYR A 469 -1.364 1.626 -7.612 1.00 10.00 C ATOM 935 O TYR A 469 -2.594 1.648 -7.568 1.00 10.00 O ATOM 936 CB TYR A 469 -0.729 -0.071 -5.853 1.00 10.00 C ATOM 937 CG TYR A 469 -1.224 1.005 -4.913 1.00 10.00 C ATOM 938 CD1 TYR A 469 -0.697 2.286 -4.959 1.00 10.00 C ATOM 939 CD2 TYR A 469 -2.209 0.731 -3.971 1.00 10.00 C ATOM 940 CE1 TYR A 469 -1.137 3.270 -4.098 1.00 10.00 C ATOM 941 CE2 TYR A 469 -2.653 1.709 -3.106 1.00 10.00 C ATOM 942 CZ TYR A 469 -2.114 2.978 -3.174 1.00 10.00 C ATOM 943 OH TYR A 469 -2.547 3.955 -2.311 1.00 10.00 O ATOM 0 H TYR A 469 1.315 1.177 -7.165 1.00 10.00 H new ATOM 0 HA TYR A 469 -1.035 -0.454 -7.945 1.00 10.00 H new ATOM 0 HB2 TYR A 469 -1.408 -0.922 -5.789 1.00 10.00 H new ATOM 0 HB3 TYR A 469 0.244 -0.413 -5.501 1.00 10.00 H new ATOM 0 HD1 TYR A 469 0.072 2.518 -5.681 1.00 10.00 H new ATOM 0 HD2 TYR A 469 -2.632 -0.261 -3.916 1.00 10.00 H new ATOM 0 HE1 TYR A 469 -0.717 4.264 -4.149 1.00 10.00 H new ATOM 0 HE2 TYR A 469 -3.419 1.483 -2.379 1.00 10.00 H new ATOM 0 HH TYR A 469 -2.464 4.832 -2.741 1.00 10.00 H new ATOM 953 N TYR A 470 -0.633 2.710 -7.881 1.00 10.00 N ATOM 954 CA TYR A 470 -1.256 4.000 -8.142 1.00 10.00 C ATOM 955 C TYR A 470 -1.584 4.177 -9.623 1.00 10.00 C ATOM 956 O TYR A 470 -2.557 4.847 -9.967 1.00 10.00 O ATOM 957 CB TYR A 470 -0.353 5.136 -7.631 1.00 10.00 C ATOM 958 CG TYR A 470 0.218 6.032 -8.712 1.00 10.00 C ATOM 959 CD1 TYR A 470 1.080 5.526 -9.674 1.00 10.00 C ATOM 960 CD2 TYR A 470 -0.106 7.382 -8.767 1.00 10.00 C ATOM 961 CE1 TYR A 470 1.605 6.336 -10.660 1.00 10.00 C ATOM 962 CE2 TYR A 470 0.415 8.200 -9.751 1.00 10.00 C ATOM 963 CZ TYR A 470 1.270 7.673 -10.695 1.00 10.00 C ATOM 964 OH TYR A 470 1.792 8.484 -11.676 1.00 10.00 O ATOM 0 H TYR A 470 0.386 2.716 -7.923 1.00 10.00 H new ATOM 0 HA TYR A 470 -2.201 4.037 -7.600 1.00 10.00 H new ATOM 0 HB2 TYR A 470 -0.925 5.750 -6.935 1.00 10.00 H new ATOM 0 HB3 TYR A 470 0.472 4.700 -7.068 1.00 10.00 H new ATOM 0 HD1 TYR A 470 1.345 4.479 -9.651 1.00 10.00 H new ATOM 0 HD2 TYR A 470 -0.776 7.798 -8.029 1.00 10.00 H new ATOM 0 HE1 TYR A 470 2.275 5.925 -11.401 1.00 10.00 H new ATOM 0 HE2 TYR A 470 0.154 9.247 -9.780 1.00 10.00 H new ATOM 0 HH TYR A 470 1.955 7.955 -12.485 1.00 10.00 H new ATOM 974 N TYR A 471 -0.780 3.581 -10.501 1.00 10.00 N ATOM 975 CA TYR A 471 -1.031 3.704 -11.934 1.00 10.00 C ATOM 976 C TYR A 471 -2.090 2.700 -12.393 1.00 10.00 C ATOM 977 O TYR A 471 -2.479 2.684 -13.560 1.00 10.00 O ATOM 978 CB TYR A 471 0.271 3.550 -12.736 1.00 10.00 C ATOM 979 CG TYR A 471 0.692 2.119 -12.983 1.00 10.00 C ATOM 980 CD1 TYR A 471 0.087 1.359 -13.976 1.00 10.00 C ATOM 981 CD2 TYR A 471 1.697 1.529 -12.226 1.00 10.00 C ATOM 982 CE1 TYR A 471 0.469 0.052 -14.207 1.00 10.00 C ATOM 983 CE2 TYR A 471 2.085 0.223 -12.453 1.00 10.00 C ATOM 984 CZ TYR A 471 1.469 -0.512 -13.443 1.00 10.00 C ATOM 985 OH TYR A 471 1.853 -1.813 -13.671 1.00 10.00 O ATOM 0 H TYR A 471 0.034 3.019 -10.252 1.00 10.00 H new ATOM 0 HA TYR A 471 -1.420 4.704 -12.124 1.00 10.00 H new ATOM 0 HB2 TYR A 471 0.152 4.051 -13.697 1.00 10.00 H new ATOM 0 HB3 TYR A 471 1.072 4.064 -12.205 1.00 10.00 H new ATOM 0 HD1 TYR A 471 -0.695 1.798 -14.578 1.00 10.00 H new ATOM 0 HD2 TYR A 471 2.182 2.100 -11.448 1.00 10.00 H new ATOM 0 HE1 TYR A 471 -0.013 -0.525 -14.982 1.00 10.00 H new ATOM 0 HE2 TYR A 471 2.868 -0.221 -11.857 1.00 10.00 H new ATOM 0 HH TYR A 471 2.569 -2.057 -13.048 1.00 10.00 H new ATOM 995 N LEU A 472 -2.573 1.886 -11.457 1.00 10.00 N ATOM 996 CA LEU A 472 -3.608 0.903 -11.750 1.00 10.00 C ATOM 997 C LEU A 472 -4.941 1.403 -11.214 1.00 10.00 C ATOM 998 O LEU A 472 -5.992 1.195 -11.821 1.00 10.00 O ATOM 999 CB LEU A 472 -3.267 -0.447 -11.114 1.00 10.00 C ATOM 1000 CG LEU A 472 -1.971 -1.089 -11.602 1.00 10.00 C ATOM 1001 CD1 LEU A 472 -1.995 -1.255 -13.114 1.00 10.00 C ATOM 1002 CD2 LEU A 472 -0.772 -0.260 -11.175 1.00 10.00 C ATOM 0 H LEU A 472 -2.261 1.890 -10.486 1.00 10.00 H new ATOM 0 HA LEU A 472 -3.671 0.768 -12.830 1.00 10.00 H new ATOM 0 HB2 LEU A 472 -3.204 -0.316 -10.034 1.00 10.00 H new ATOM 0 HB3 LEU A 472 -4.089 -1.137 -11.304 1.00 10.00 H new ATOM 0 HG LEU A 472 -1.884 -2.077 -11.149 1.00 10.00 H new ATOM 0 HD11 LEU A 472 -1.063 -1.714 -13.444 1.00 10.00 H new ATOM 0 HD12 LEU A 472 -2.833 -1.891 -13.397 1.00 10.00 H new ATOM 0 HD13 LEU A 472 -2.105 -0.278 -13.586 1.00 10.00 H new ATOM 0 HD21 LEU A 472 0.143 -0.733 -11.532 1.00 10.00 H new ATOM 0 HD22 LEU A 472 -0.852 0.741 -11.599 1.00 10.00 H new ATOM 0 HD23 LEU A 472 -0.745 -0.192 -10.087 1.00 10.00 H new ATOM 1014 N THR A 473 -4.877 2.074 -10.069 1.00 10.00 N ATOM 1015 CA THR A 473 -6.060 2.628 -9.431 1.00 10.00 C ATOM 1016 C THR A 473 -6.566 3.846 -10.194 1.00 10.00 C ATOM 1017 O THR A 473 -7.757 4.156 -10.164 1.00 10.00 O ATOM 1018 CB THR A 473 -5.748 2.998 -7.977 1.00 10.00 C ATOM 1019 OG1 THR A 473 -4.536 3.722 -7.895 1.00 10.00 O ATOM 1020 CG2 THR A 473 -5.625 1.795 -7.065 1.00 10.00 C ATOM 0 H THR A 473 -4.009 2.247 -9.562 1.00 10.00 H new ATOM 0 HA THR A 473 -6.845 1.872 -9.442 1.00 10.00 H new ATOM 0 HB THR A 473 -6.593 3.601 -7.645 1.00 10.00 H new ATOM 0 HG1 THR A 473 -4.719 4.632 -7.582 1.00 10.00 H new ATOM 0 HG21 THR A 473 -5.404 2.128 -6.051 1.00 10.00 H new ATOM 0 HG22 THR A 473 -6.563 1.239 -7.068 1.00 10.00 H new ATOM 0 HG23 THR A 473 -4.820 1.151 -7.419 1.00 10.00 H new ATOM 1028 N LYS A 474 -5.657 4.538 -10.878 1.00 10.00 N ATOM 1029 CA LYS A 474 -6.025 5.722 -11.645 1.00 10.00 C ATOM 1030 C LYS A 474 -6.330 5.364 -13.096 1.00 10.00 C ATOM 1031 O LYS A 474 -7.085 6.065 -13.771 1.00 10.00 O ATOM 1032 CB LYS A 474 -4.905 6.764 -11.586 1.00 10.00 C ATOM 1033 CG LYS A 474 -3.621 6.314 -12.261 1.00 10.00 C ATOM 1034 CD LYS A 474 -2.443 7.185 -11.854 1.00 10.00 C ATOM 1035 CE LYS A 474 -1.517 7.454 -13.029 1.00 10.00 C ATOM 1036 NZ LYS A 474 -1.013 8.856 -13.029 1.00 10.00 N ATOM 0 H LYS A 474 -4.666 4.300 -10.916 1.00 10.00 H new ATOM 0 HA LYS A 474 -6.927 6.143 -11.200 1.00 10.00 H new ATOM 0 HB2 LYS A 474 -5.251 7.684 -12.058 1.00 10.00 H new ATOM 0 HB3 LYS A 474 -4.694 7.000 -10.543 1.00 10.00 H new ATOM 0 HG2 LYS A 474 -3.415 5.276 -11.999 1.00 10.00 H new ATOM 0 HG3 LYS A 474 -3.745 6.351 -13.343 1.00 10.00 H new ATOM 0 HD2 LYS A 474 -2.809 8.131 -11.454 1.00 10.00 H new ATOM 0 HD3 LYS A 474 -1.886 6.695 -11.055 1.00 10.00 H new ATOM 0 HE2 LYS A 474 -0.673 6.765 -12.992 1.00 10.00 H new ATOM 0 HE3 LYS A 474 -2.047 7.259 -13.961 1.00 10.00 H new ATOM 0 HZ1 LYS A 474 -0.886 9.179 -14.009 1.00 10.00 H new ATOM 0 HZ2 LYS A 474 -1.699 9.472 -12.547 1.00 10.00 H new ATOM 0 HZ3 LYS A 474 -0.101 8.897 -12.530 1.00 10.00 H new ATOM 1050 N LYS A 475 -5.746 4.271 -13.572 1.00 10.00 N ATOM 1051 CA LYS A 475 -5.968 3.828 -14.942 1.00 10.00 C ATOM 1052 C LYS A 475 -7.441 3.500 -15.179 1.00 10.00 C ATOM 1053 O LYS A 475 -7.905 3.480 -16.320 1.00 10.00 O ATOM 1054 CB LYS A 475 -5.104 2.603 -15.251 1.00 10.00 C ATOM 1055 CG LYS A 475 -5.276 2.077 -16.667 1.00 10.00 C ATOM 1056 CD LYS A 475 -4.992 3.156 -17.699 1.00 10.00 C ATOM 1057 CE LYS A 475 -4.777 2.562 -19.082 1.00 10.00 C ATOM 1058 NZ LYS A 475 -3.749 3.310 -19.856 1.00 10.00 N ATOM 0 H LYS A 475 -5.117 3.677 -13.031 1.00 10.00 H new ATOM 0 HA LYS A 475 -5.685 4.642 -15.610 1.00 10.00 H new ATOM 0 HB2 LYS A 475 -4.056 2.859 -15.092 1.00 10.00 H new ATOM 0 HB3 LYS A 475 -5.349 1.809 -14.545 1.00 10.00 H new ATOM 0 HG2 LYS A 475 -4.605 1.233 -16.827 1.00 10.00 H new ATOM 0 HG3 LYS A 475 -6.292 1.705 -16.798 1.00 10.00 H new ATOM 0 HD2 LYS A 475 -5.824 3.860 -17.729 1.00 10.00 H new ATOM 0 HD3 LYS A 475 -4.108 3.720 -17.403 1.00 10.00 H new ATOM 0 HE2 LYS A 475 -4.471 1.520 -18.986 1.00 10.00 H new ATOM 0 HE3 LYS A 475 -5.719 2.568 -19.630 1.00 10.00 H new ATOM 0 HZ1 LYS A 475 -3.633 2.873 -20.792 1.00 10.00 H new ATOM 0 HZ2 LYS A 475 -4.052 4.298 -19.971 1.00 10.00 H new ATOM 0 HZ3 LYS A 475 -2.843 3.283 -19.347 1.00 10.00 H new ATOM 1072 N ASN A 476 -8.171 3.237 -14.098 1.00 10.00 N ATOM 1073 CA ASN A 476 -9.589 2.903 -14.196 1.00 10.00 C ATOM 1074 C ASN A 476 -10.461 3.911 -13.448 1.00 10.00 C ATOM 1075 O ASN A 476 -11.650 4.042 -13.736 1.00 10.00 O ATOM 1076 CB ASN A 476 -9.838 1.497 -13.650 1.00 10.00 C ATOM 1077 CG ASN A 476 -9.626 0.422 -14.698 1.00 10.00 C ATOM 1078 OD1 ASN A 476 -10.539 -0.341 -15.015 1.00 10.00 O ATOM 1079 ND2 ASN A 476 -8.417 0.357 -15.243 1.00 10.00 N ATOM 0 H ASN A 476 -7.805 3.249 -13.146 1.00 10.00 H new ATOM 0 HA ASN A 476 -9.863 2.939 -15.250 1.00 10.00 H new ATOM 0 HB2 ASN A 476 -9.172 1.315 -12.807 1.00 10.00 H new ATOM 0 HB3 ASN A 476 -10.858 1.433 -13.270 1.00 10.00 H new ATOM 0 HD21 ASN A 476 -8.215 -0.346 -15.954 1.00 10.00 H new ATOM 0 HD22 ASN A 476 -7.690 1.010 -14.950 1.00 10.00 H new ATOM 1086 N GLU A 477 -9.872 4.619 -12.486 1.00 10.00 N ATOM 1087 CA GLU A 477 -10.617 5.604 -11.706 1.00 10.00 C ATOM 1088 C GLU A 477 -10.273 7.024 -12.144 1.00 10.00 C ATOM 1089 O GLU A 477 -11.130 7.906 -12.153 1.00 10.00 O ATOM 1090 CB GLU A 477 -10.323 5.433 -10.216 1.00 10.00 C ATOM 1091 CG GLU A 477 -10.461 3.999 -9.729 1.00 10.00 C ATOM 1092 CD GLU A 477 -11.903 3.606 -9.478 1.00 10.00 C ATOM 1093 OE1 GLU A 477 -12.789 4.097 -10.208 1.00 10.00 O ATOM 1094 OE2 GLU A 477 -12.147 2.806 -8.550 1.00 10.00 O ATOM 0 H GLU A 477 -8.889 4.530 -12.230 1.00 10.00 H new ATOM 0 HA GLU A 477 -11.680 5.438 -11.882 1.00 10.00 H new ATOM 0 HB2 GLU A 477 -9.311 5.781 -10.012 1.00 10.00 H new ATOM 0 HB3 GLU A 477 -11.000 6.068 -9.645 1.00 10.00 H new ATOM 0 HG2 GLU A 477 -10.028 3.325 -10.468 1.00 10.00 H new ATOM 0 HG3 GLU A 477 -9.889 3.875 -8.810 1.00 10.00 H new ATOM 1101 N ASN A 478 -9.012 7.236 -12.503 1.00 10.00 N ATOM 1102 CA ASN A 478 -8.550 8.548 -12.939 1.00 10.00 C ATOM 1103 C ASN A 478 -8.721 9.578 -11.827 1.00 10.00 C ATOM 1104 O ASN A 478 -9.525 10.502 -11.939 1.00 10.00 O ATOM 1105 CB ASN A 478 -9.315 8.992 -14.188 1.00 10.00 C ATOM 1106 CG ASN A 478 -8.616 8.582 -15.469 1.00 10.00 C ATOM 1107 OD1 ASN A 478 -7.622 7.857 -15.443 1.00 10.00 O ATOM 1108 ND2 ASN A 478 -9.136 9.046 -16.601 1.00 10.00 N ATOM 0 H ASN A 478 -8.291 6.515 -12.501 1.00 10.00 H new ATOM 0 HA ASN A 478 -7.490 8.473 -13.181 1.00 10.00 H new ATOM 0 HB2 ASN A 478 -10.316 8.562 -14.170 1.00 10.00 H new ATOM 0 HB3 ASN A 478 -9.433 10.075 -14.172 1.00 10.00 H new ATOM 0 HD21 ASN A 478 -8.709 8.803 -17.495 1.00 10.00 H new ATOM 0 HD22 ASN A 478 -9.962 9.645 -16.575 1.00 10.00 H new ATOM 1115 N TYR A 479 -7.959 9.410 -10.749 1.00 10.00 N ATOM 1116 CA TYR A 479 -8.029 10.326 -9.617 1.00 10.00 C ATOM 1117 C TYR A 479 -6.918 11.366 -9.687 1.00 10.00 C ATOM 1118 O TYR A 479 -6.365 11.771 -8.664 1.00 10.00 O ATOM 1119 CB TYR A 479 -7.946 9.552 -8.298 1.00 10.00 C ATOM 1120 CG TYR A 479 -6.778 8.592 -8.221 1.00 10.00 C ATOM 1121 CD1 TYR A 479 -5.499 9.046 -7.920 1.00 10.00 C ATOM 1122 CD2 TYR A 479 -6.954 7.230 -8.441 1.00 10.00 C ATOM 1123 CE1 TYR A 479 -4.431 8.173 -7.842 1.00 10.00 C ATOM 1124 CE2 TYR A 479 -5.890 6.350 -8.364 1.00 10.00 C ATOM 1125 CZ TYR A 479 -4.632 6.828 -8.065 1.00 10.00 C ATOM 1126 OH TYR A 479 -3.568 5.958 -7.988 1.00 10.00 O ATOM 0 H TYR A 479 -7.288 8.650 -10.637 1.00 10.00 H new ATOM 0 HA TYR A 479 -8.986 10.845 -9.662 1.00 10.00 H new ATOM 0 HB2 TYR A 479 -7.874 10.263 -7.475 1.00 10.00 H new ATOM 0 HB3 TYR A 479 -8.872 8.994 -8.157 1.00 10.00 H new ATOM 0 HD1 TYR A 479 -5.337 10.099 -7.744 1.00 10.00 H new ATOM 0 HD2 TYR A 479 -7.938 6.853 -8.676 1.00 10.00 H new ATOM 0 HE1 TYR A 479 -3.444 8.543 -7.607 1.00 10.00 H new ATOM 0 HE2 TYR A 479 -6.044 5.295 -8.537 1.00 10.00 H new ATOM 0 HH TYR A 479 -3.718 5.203 -8.594 1.00 10.00 H new ATOM 1136 N LYS A 480 -6.600 11.798 -10.900 1.00 10.00 N ATOM 1137 CA LYS A 480 -5.556 12.795 -11.109 1.00 10.00 C ATOM 1138 C LYS A 480 -5.928 14.118 -10.447 1.00 10.00 C ATOM 1139 O LYS A 480 -5.136 15.078 -10.559 1.00 10.00 O ATOM 1140 CB LYS A 480 -5.317 13.009 -12.604 1.00 10.00 C ATOM 1141 CG LYS A 480 -6.597 13.177 -13.407 1.00 10.00 C ATOM 1142 CD LYS A 480 -6.410 14.155 -14.555 1.00 10.00 C ATOM 1143 CE LYS A 480 -7.649 15.010 -14.766 1.00 10.00 C ATOM 1144 NZ LYS A 480 -7.874 15.319 -16.204 1.00 10.00 N ATOM 1145 OXT LYS A 480 -7.007 14.185 -9.824 1.00 10.00 O ATOM 0 H LYS A 480 -7.050 11.474 -11.756 1.00 10.00 H new ATOM 0 HA LYS A 480 -4.638 12.425 -10.652 1.00 10.00 H new ATOM 0 HB2 LYS A 480 -4.693 13.892 -12.741 1.00 10.00 H new ATOM 0 HB3 LYS A 480 -4.759 12.160 -12.999 1.00 10.00 H new ATOM 0 HG2 LYS A 480 -6.911 12.210 -13.799 1.00 10.00 H new ATOM 0 HG3 LYS A 480 -7.394 13.530 -12.753 1.00 10.00 H new ATOM 0 HD2 LYS A 480 -5.554 14.798 -14.351 1.00 10.00 H new ATOM 0 HD3 LYS A 480 -6.186 13.606 -15.469 1.00 10.00 H new ATOM 0 HE2 LYS A 480 -8.520 14.491 -14.366 1.00 10.00 H new ATOM 0 HE3 LYS A 480 -7.547 15.940 -14.207 1.00 10.00 H new ATOM 0 HZ1 LYS A 480 -8.728 15.904 -16.304 1.00 10.00 H new ATOM 0 HZ2 LYS A 480 -7.054 15.837 -16.580 1.00 10.00 H new ATOM 0 HZ3 LYS A 480 -7.997 14.433 -16.734 1.00 10.00 H new TER 1159 LYS A 480