USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 837 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 25 TYR OH : rot -127:sc= 0.195 USER MOD Set 1.2: A 29 THR OG1 : rot -14:sc= 1.06 USER MOD Set 1.3: A 57 THR OG1 : rot 180:sc= 0 USER MOD Set 1.4: A 64 SER OG : rot 77:sc= -0.0742 USER MOD Single : A 1 MET CE :methyl 172:sc= -9.03! (180deg=-9.1!) USER MOD Single : A 1 MET N :NH3+ 159:sc= -0.271 (180deg=-1.36!) USER MOD Single : A 4 LYS NZ :NH3+ -129:sc= -0.106 (180deg=-0.822) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= -1.5! C(o=-1.5!,f=-9.9!) USER MOD Single : A 15 ASN : amide:sc= -1.59 X(o=-1.6,f=-2) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0.00666 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -3.44! C(o=-3.4!,f=-9.8!) USER MOD Single : A 37 ASN : amide:sc= -0.144 K(o=-0.14,f=-0.85) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl 139:sc= -0.769 (180deg=-1.39) USER MOD Single : A 44 ASN : amide:sc= -4.8! C(o=-4.8!,f=-4!) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 MET CE :methyl -120:sc= -2.81! (180deg=-6.03!) USER MOD Single : A 62 GLN : amide:sc= -1.01 X(o=-1,f=-0.62) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 112:sc= 0.689 USER MOD Single : A 69 LYS NZ :NH3+ -174:sc= -0.559 (180deg=-0.653) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 MET CE :methyl -174:sc= -1.53 (180deg=-1.55) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= -0.0508 X(o=-0.051,f=0) USER MOD Single : A 82 GLN : amide:sc=-0.00298 X(o=-0.003,f=0) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -2.16! C(o=-2.2!,f=-2.5!) USER MOD Single : A 94 SER OG : rot 180:sc= 0.163 USER MOD Single : A 96 THR OG1 : rot -139:sc= 0.151! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.405 -10.377 8.564 1.00 0.00 N ATOM 2 CA MET A 1 -10.996 -10.683 8.749 1.00 0.00 C ATOM 3 C MET A 1 -10.478 -10.107 10.069 1.00 0.00 C ATOM 4 O MET A 1 -11.239 -9.513 10.832 1.00 0.00 O ATOM 5 CB MET A 1 -10.190 -10.101 7.586 1.00 0.00 C ATOM 6 CG MET A 1 -10.692 -8.704 7.217 1.00 0.00 C ATOM 7 SD MET A 1 -10.188 -7.526 8.459 1.00 0.00 S ATOM 8 CE MET A 1 -10.879 -6.032 7.768 1.00 0.00 C ATOM 0 H1 MET A 1 -12.646 -10.449 7.555 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.981 -11.052 9.106 1.00 0.00 H new ATOM 0 H3 MET A 1 -12.597 -9.411 8.898 1.00 0.00 H new ATOM 0 HA MET A 1 -10.879 -11.766 8.777 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.136 -10.053 7.858 1.00 0.00 H new ATOM 0 HB3 MET A 1 -10.266 -10.759 6.721 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.296 -8.411 6.245 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.778 -8.710 7.130 1.00 0.00 H new ATOM 0 HE1 MET A 1 -10.780 -5.219 8.487 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.346 -5.774 6.853 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.933 -6.190 7.541 1.00 0.00 H new ATOM 18 N ASP A 2 -9.188 -10.302 10.297 1.00 0.00 N ATOM 19 CA ASP A 2 -8.560 -9.808 11.511 1.00 0.00 C ATOM 20 C ASP A 2 -7.494 -8.774 11.144 1.00 0.00 C ATOM 21 O ASP A 2 -6.705 -8.989 10.225 1.00 0.00 O ATOM 22 CB ASP A 2 -7.874 -10.942 12.276 1.00 0.00 C ATOM 23 CG ASP A 2 -8.551 -11.337 13.590 1.00 0.00 C ATOM 24 OD1 ASP A 2 -8.691 -10.438 14.448 1.00 0.00 O ATOM 25 OD2 ASP A 2 -8.912 -12.527 13.708 1.00 0.00 O ATOM 0 H ASP A 2 -8.560 -10.795 9.662 1.00 0.00 H new ATOM 0 HA ASP A 2 -9.336 -9.367 12.137 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -7.827 -11.819 11.631 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -6.846 -10.647 12.488 1.00 0.00 H new ATOM 30 N ILE A 3 -7.505 -7.673 11.882 1.00 0.00 N ATOM 31 CA ILE A 3 -6.549 -6.605 11.646 1.00 0.00 C ATOM 32 C ILE A 3 -5.632 -6.468 12.863 1.00 0.00 C ATOM 33 O ILE A 3 -6.081 -6.603 14.001 1.00 0.00 O ATOM 34 CB ILE A 3 -7.274 -5.310 11.274 1.00 0.00 C ATOM 35 CG1 ILE A 3 -8.222 -5.532 10.094 1.00 0.00 C ATOM 36 CG2 ILE A 3 -6.277 -4.181 11.003 1.00 0.00 C ATOM 37 CD1 ILE A 3 -8.720 -4.199 9.532 1.00 0.00 C ATOM 0 H ILE A 3 -8.161 -7.498 12.643 1.00 0.00 H new ATOM 0 HA ILE A 3 -5.914 -6.844 10.793 1.00 0.00 H new ATOM 0 HB ILE A 3 -7.884 -5.004 12.124 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -7.710 -6.092 9.312 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -9.071 -6.136 10.414 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -6.819 -3.272 10.741 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -5.679 -4.002 11.896 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -5.622 -4.464 10.179 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -9.392 -4.386 8.694 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -9.253 -3.653 10.310 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -7.870 -3.608 9.191 1.00 0.00 H new ATOM 49 N LYS A 4 -4.365 -6.203 12.583 1.00 0.00 N ATOM 50 CA LYS A 4 -3.381 -6.047 13.641 1.00 0.00 C ATOM 51 C LYS A 4 -2.570 -4.773 13.394 1.00 0.00 C ATOM 52 O LYS A 4 -1.718 -4.737 12.507 1.00 0.00 O ATOM 53 CB LYS A 4 -2.523 -7.308 13.764 1.00 0.00 C ATOM 54 CG LYS A 4 -1.600 -7.464 12.553 1.00 0.00 C ATOM 55 CD LYS A 4 -1.120 -8.910 12.413 1.00 0.00 C ATOM 56 CE LYS A 4 0.404 -8.994 12.517 1.00 0.00 C ATOM 57 NZ LYS A 4 0.940 -9.941 11.513 1.00 0.00 N ATOM 0 H LYS A 4 -3.997 -6.092 11.638 1.00 0.00 H new ATOM 0 HA LYS A 4 -3.874 -5.929 14.606 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -1.928 -7.259 14.676 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -3.167 -8.183 13.850 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -2.127 -7.163 11.648 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -0.742 -6.800 12.657 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -1.576 -9.525 13.189 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -1.446 -9.314 11.454 1.00 0.00 H new ATOM 0 HE2 LYS A 4 0.840 -8.007 12.364 1.00 0.00 H new ATOM 0 HE3 LYS A 4 0.689 -9.316 13.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 1.573 -10.621 11.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 0.154 -10.452 11.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 1.471 -9.416 10.789 1.00 0.00 H new ATOM 71 N ILE A 5 -2.865 -3.759 14.193 1.00 0.00 N ATOM 72 CA ILE A 5 -2.174 -2.486 14.072 1.00 0.00 C ATOM 73 C ILE A 5 -0.672 -2.706 14.259 1.00 0.00 C ATOM 74 O ILE A 5 -0.230 -3.122 15.329 1.00 0.00 O ATOM 75 CB ILE A 5 -2.770 -1.459 15.038 1.00 0.00 C ATOM 76 CG1 ILE A 5 -4.238 -1.184 14.707 1.00 0.00 C ATOM 77 CG2 ILE A 5 -1.936 -0.176 15.057 1.00 0.00 C ATOM 78 CD1 ILE A 5 -5.025 -0.821 15.968 1.00 0.00 C ATOM 0 H ILE A 5 -3.573 -3.792 14.927 1.00 0.00 H new ATOM 0 HA ILE A 5 -2.314 -2.070 13.074 1.00 0.00 H new ATOM 0 HB ILE A 5 -2.740 -1.877 16.044 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -4.306 -0.370 13.985 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -4.680 -2.063 14.239 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -2.381 0.537 15.751 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -0.920 -0.407 15.376 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -1.912 0.257 14.057 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.066 -0.630 15.705 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -4.976 -1.647 16.678 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -4.595 0.073 16.420 1.00 0.00 H new ATOM 90 N ILE A 6 0.073 -2.417 13.202 1.00 0.00 N ATOM 91 CA ILE A 6 1.516 -2.579 13.236 1.00 0.00 C ATOM 92 C ILE A 6 2.142 -1.378 13.949 1.00 0.00 C ATOM 93 O ILE A 6 2.669 -1.513 15.053 1.00 0.00 O ATOM 94 CB ILE A 6 2.063 -2.811 11.826 1.00 0.00 C ATOM 95 CG1 ILE A 6 1.573 -4.145 11.261 1.00 0.00 C ATOM 96 CG2 ILE A 6 3.589 -2.705 11.806 1.00 0.00 C ATOM 97 CD1 ILE A 6 2.514 -5.286 11.654 1.00 0.00 C ATOM 0 H ILE A 6 -0.296 -2.071 12.316 1.00 0.00 H new ATOM 0 HA ILE A 6 1.787 -3.467 13.807 1.00 0.00 H new ATOM 0 HB ILE A 6 1.678 -2.025 11.176 1.00 0.00 H new ATOM 0 HG12 ILE A 6 0.569 -4.353 11.630 1.00 0.00 H new ATOM 0 HG13 ILE A 6 1.506 -4.082 10.175 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.952 -2.874 10.792 1.00 0.00 H new ATOM 0 HG22 ILE A 6 3.889 -1.711 12.138 1.00 0.00 H new ATOM 0 HG23 ILE A 6 4.015 -3.454 12.473 1.00 0.00 H new ATOM 0 HD11 ILE A 6 2.142 -6.223 11.240 1.00 0.00 H new ATOM 0 HD12 ILE A 6 3.511 -5.086 11.262 1.00 0.00 H new ATOM 0 HD13 ILE A 6 2.559 -5.362 12.740 1.00 0.00 H new ATOM 109 N LYS A 7 2.065 -0.232 13.289 1.00 0.00 N ATOM 110 CA LYS A 7 2.617 0.991 13.846 1.00 0.00 C ATOM 111 C LYS A 7 1.766 2.180 13.398 1.00 0.00 C ATOM 112 O LYS A 7 1.085 2.111 12.376 1.00 0.00 O ATOM 113 CB LYS A 7 4.098 1.123 13.483 1.00 0.00 C ATOM 114 CG LYS A 7 4.987 0.547 14.587 1.00 0.00 C ATOM 115 CD LYS A 7 6.436 0.421 14.113 1.00 0.00 C ATOM 116 CE LYS A 7 7.278 1.599 14.607 1.00 0.00 C ATOM 117 NZ LYS A 7 7.835 1.313 15.948 1.00 0.00 N ATOM 0 H LYS A 7 1.629 -0.125 12.373 1.00 0.00 H new ATOM 0 HA LYS A 7 2.580 0.965 14.935 1.00 0.00 H new ATOM 0 HB2 LYS A 7 4.294 0.603 12.545 1.00 0.00 H new ATOM 0 HB3 LYS A 7 4.345 2.173 13.323 1.00 0.00 H new ATOM 0 HG2 LYS A 7 4.943 1.189 15.467 1.00 0.00 H new ATOM 0 HG3 LYS A 7 4.612 -0.432 14.887 1.00 0.00 H new ATOM 0 HD2 LYS A 7 6.862 -0.514 14.478 1.00 0.00 H new ATOM 0 HD3 LYS A 7 6.464 0.380 13.024 1.00 0.00 H new ATOM 0 HE2 LYS A 7 8.088 1.794 13.904 1.00 0.00 H new ATOM 0 HE3 LYS A 7 6.666 2.500 14.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 8.404 2.123 16.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 7.058 1.149 16.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 8.436 0.465 15.901 1.00 0.00 H new ATOM 131 N ASP A 8 1.831 3.244 14.185 1.00 0.00 N ATOM 132 CA ASP A 8 1.074 4.447 13.883 1.00 0.00 C ATOM 133 C ASP A 8 2.027 5.643 13.829 1.00 0.00 C ATOM 134 O ASP A 8 2.619 6.016 14.840 1.00 0.00 O ATOM 135 CB ASP A 8 0.027 4.724 14.963 1.00 0.00 C ATOM 136 CG ASP A 8 -0.355 6.197 15.130 1.00 0.00 C ATOM 137 OD1 ASP A 8 0.533 6.969 15.551 1.00 0.00 O ATOM 138 OD2 ASP A 8 -1.526 6.516 14.833 1.00 0.00 O ATOM 0 H ASP A 8 2.397 3.298 15.032 1.00 0.00 H new ATOM 0 HA ASP A 8 0.574 4.300 12.926 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -0.873 4.155 14.730 1.00 0.00 H new ATOM 0 HB3 ASP A 8 0.402 4.351 15.916 1.00 0.00 H new ATOM 143 N LYS A 9 2.144 6.212 12.638 1.00 0.00 N ATOM 144 CA LYS A 9 3.014 7.358 12.439 1.00 0.00 C ATOM 145 C LYS A 9 2.164 8.627 12.339 1.00 0.00 C ATOM 146 O LYS A 9 1.083 8.609 11.752 1.00 0.00 O ATOM 147 CB LYS A 9 3.929 7.134 11.233 1.00 0.00 C ATOM 148 CG LYS A 9 4.432 8.465 10.672 1.00 0.00 C ATOM 149 CD LYS A 9 5.860 8.330 10.138 1.00 0.00 C ATOM 150 CE LYS A 9 6.012 9.041 8.792 1.00 0.00 C ATOM 151 NZ LYS A 9 7.442 9.268 8.484 1.00 0.00 N ATOM 0 H LYS A 9 1.651 5.900 11.801 1.00 0.00 H new ATOM 0 HA LYS A 9 3.678 7.485 13.294 1.00 0.00 H new ATOM 0 HB2 LYS A 9 4.777 6.515 11.525 1.00 0.00 H new ATOM 0 HB3 LYS A 9 3.389 6.590 10.458 1.00 0.00 H new ATOM 0 HG2 LYS A 9 3.771 8.800 9.873 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.402 9.227 11.451 1.00 0.00 H new ATOM 0 HD2 LYS A 9 6.562 8.752 10.857 1.00 0.00 H new ATOM 0 HD3 LYS A 9 6.112 7.275 10.027 1.00 0.00 H new ATOM 0 HE2 LYS A 9 5.555 8.442 8.004 1.00 0.00 H new ATOM 0 HE3 LYS A 9 5.483 9.994 8.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 7.527 9.751 7.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 7.868 9.858 9.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 7.937 8.354 8.441 1.00 0.00 H new ATOM 165 N LYS A 10 2.685 9.697 12.920 1.00 0.00 N ATOM 166 CA LYS A 10 1.988 10.972 12.904 1.00 0.00 C ATOM 167 C LYS A 10 2.674 11.911 11.910 1.00 0.00 C ATOM 168 O LYS A 10 3.901 11.988 11.869 1.00 0.00 O ATOM 169 CB LYS A 10 1.883 11.544 14.319 1.00 0.00 C ATOM 170 CG LYS A 10 0.935 12.744 14.357 1.00 0.00 C ATOM 171 CD LYS A 10 -0.038 12.636 15.533 1.00 0.00 C ATOM 172 CE LYS A 10 -1.296 13.470 15.282 1.00 0.00 C ATOM 173 NZ LYS A 10 -2.233 13.352 16.422 1.00 0.00 N ATOM 0 H LYS A 10 3.582 9.708 13.405 1.00 0.00 H new ATOM 0 HA LYS A 10 0.961 10.840 12.562 1.00 0.00 H new ATOM 0 HB2 LYS A 10 1.526 10.772 15.001 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.871 11.845 14.667 1.00 0.00 H new ATOM 0 HG2 LYS A 10 1.512 13.665 14.441 1.00 0.00 H new ATOM 0 HG3 LYS A 10 0.377 12.801 13.422 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -0.314 11.593 15.687 1.00 0.00 H new ATOM 0 HD3 LYS A 10 0.451 12.975 16.446 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -1.023 14.515 15.135 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -1.784 13.136 14.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -3.081 13.924 16.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -2.507 12.356 16.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -1.770 13.693 17.289 1.00 0.00 H new ATOM 187 N ASN A 11 1.853 12.602 11.134 1.00 0.00 N ATOM 188 CA ASN A 11 2.365 13.533 10.143 1.00 0.00 C ATOM 189 C ASN A 11 1.485 14.784 10.121 1.00 0.00 C ATOM 190 O ASN A 11 0.555 14.880 9.322 1.00 0.00 O ATOM 191 CB ASN A 11 2.343 12.915 8.743 1.00 0.00 C ATOM 192 CG ASN A 11 2.838 13.915 7.695 1.00 0.00 C ATOM 193 OD1 ASN A 11 2.394 15.049 7.623 1.00 0.00 O ATOM 194 ND2 ASN A 11 3.779 13.432 6.890 1.00 0.00 N ATOM 0 H ASN A 11 0.836 12.536 11.171 1.00 0.00 H new ATOM 0 HA ASN A 11 3.392 13.780 10.412 1.00 0.00 H new ATOM 0 HB2 ASN A 11 2.970 12.024 8.725 1.00 0.00 H new ATOM 0 HB3 ASN A 11 1.330 12.597 8.498 1.00 0.00 H new ATOM 0 HD21 ASN A 11 4.174 14.021 6.157 1.00 0.00 H new ATOM 0 HD22 ASN A 11 4.106 12.473 7.005 1.00 0.00 H new ATOM 201 N PRO A 12 1.818 15.737 11.033 1.00 0.00 N ATOM 202 CA PRO A 12 1.068 16.978 11.126 1.00 0.00 C ATOM 203 C PRO A 12 1.415 17.916 9.968 1.00 0.00 C ATOM 204 O PRO A 12 0.697 18.882 9.710 1.00 0.00 O ATOM 205 CB PRO A 12 1.429 17.555 12.486 1.00 0.00 C ATOM 206 CG PRO A 12 2.714 16.860 12.905 1.00 0.00 C ATOM 207 CD PRO A 12 2.913 15.658 11.996 1.00 0.00 C ATOM 0 HA PRO A 12 -0.008 16.826 11.045 1.00 0.00 H new ATOM 0 HB2 PRO A 12 1.570 18.634 12.428 1.00 0.00 H new ATOM 0 HB3 PRO A 12 0.634 17.376 13.210 1.00 0.00 H new ATOM 0 HG2 PRO A 12 3.560 17.542 12.826 1.00 0.00 H new ATOM 0 HG3 PRO A 12 2.655 16.545 13.947 1.00 0.00 H new ATOM 0 HD2 PRO A 12 3.882 15.694 11.498 1.00 0.00 H new ATOM 0 HD3 PRO A 12 2.879 14.725 12.559 1.00 0.00 H new ATOM 215 N LEU A 13 2.514 17.599 9.301 1.00 0.00 N ATOM 216 CA LEU A 13 2.964 18.401 8.176 1.00 0.00 C ATOM 217 C LEU A 13 1.903 18.369 7.075 1.00 0.00 C ATOM 218 O LEU A 13 1.302 19.394 6.756 1.00 0.00 O ATOM 219 CB LEU A 13 4.348 17.943 7.710 1.00 0.00 C ATOM 220 CG LEU A 13 5.439 17.910 8.782 1.00 0.00 C ATOM 221 CD1 LEU A 13 6.763 17.408 8.201 1.00 0.00 C ATOM 222 CD2 LEU A 13 5.590 19.276 9.454 1.00 0.00 C ATOM 0 H LEU A 13 3.107 16.798 9.518 1.00 0.00 H new ATOM 0 HA LEU A 13 3.082 19.443 8.475 1.00 0.00 H new ATOM 0 HB2 LEU A 13 4.254 16.944 7.284 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.676 18.602 6.906 1.00 0.00 H new ATOM 0 HG LEU A 13 5.137 17.203 9.555 1.00 0.00 H new ATOM 0 HD11 LEU A 13 7.522 17.394 8.983 1.00 0.00 H new ATOM 0 HD12 LEU A 13 6.629 16.400 7.808 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.083 18.072 7.397 1.00 0.00 H new ATOM 0 HD21 LEU A 13 6.372 19.224 10.212 1.00 0.00 H new ATOM 0 HD22 LEU A 13 5.858 20.022 8.706 1.00 0.00 H new ATOM 0 HD23 LEU A 13 4.647 19.556 9.924 1.00 0.00 H new ATOM 234 N LEU A 14 1.704 17.181 6.523 1.00 0.00 N ATOM 235 CA LEU A 14 0.725 17.002 5.464 1.00 0.00 C ATOM 236 C LEU A 14 -0.680 17.007 6.068 1.00 0.00 C ATOM 237 O LEU A 14 -1.667 17.176 5.353 1.00 0.00 O ATOM 238 CB LEU A 14 1.041 15.745 4.650 1.00 0.00 C ATOM 239 CG LEU A 14 2.496 15.580 4.208 1.00 0.00 C ATOM 240 CD1 LEU A 14 2.759 14.158 3.708 1.00 0.00 C ATOM 241 CD2 LEU A 14 2.875 16.634 3.166 1.00 0.00 C ATOM 0 H LEU A 14 2.204 16.333 6.789 1.00 0.00 H new ATOM 0 HA LEU A 14 0.771 17.831 4.758 1.00 0.00 H new ATOM 0 HB2 LEU A 14 0.761 14.873 5.241 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.410 15.744 3.761 1.00 0.00 H new ATOM 0 HG LEU A 14 3.137 15.740 5.075 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.801 14.067 3.400 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.554 13.447 4.509 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.110 13.945 2.859 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.914 16.494 2.869 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.231 16.531 2.293 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.750 17.629 3.593 1.00 0.00 H new ATOM 253 N ASN A 15 -0.727 16.819 7.379 1.00 0.00 N ATOM 254 CA ASN A 15 -1.995 16.799 8.088 1.00 0.00 C ATOM 255 C ASN A 15 -2.657 15.432 7.903 1.00 0.00 C ATOM 256 O ASN A 15 -3.875 15.343 7.753 1.00 0.00 O ATOM 257 CB ASN A 15 -2.948 17.864 7.541 1.00 0.00 C ATOM 258 CG ASN A 15 -3.786 18.479 8.663 1.00 0.00 C ATOM 259 OD1 ASN A 15 -4.930 18.121 8.887 1.00 0.00 O ATOM 260 ND2 ASN A 15 -3.153 19.423 9.355 1.00 0.00 N ATOM 0 H ASN A 15 0.093 16.679 7.969 1.00 0.00 H new ATOM 0 HA ASN A 15 -1.796 16.999 9.141 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -2.377 18.645 7.039 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -3.605 17.420 6.793 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -3.627 19.895 10.126 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -2.194 19.675 9.115 1.00 0.00 H new ATOM 267 N ARG A 16 -1.825 14.401 7.919 1.00 0.00 N ATOM 268 CA ARG A 16 -2.315 13.043 7.755 1.00 0.00 C ATOM 269 C ARG A 16 -1.731 12.134 8.839 1.00 0.00 C ATOM 270 O ARG A 16 -1.110 12.612 9.787 1.00 0.00 O ATOM 271 CB ARG A 16 -1.945 12.486 6.379 1.00 0.00 C ATOM 272 CG ARG A 16 -0.456 12.139 6.310 1.00 0.00 C ATOM 273 CD ARG A 16 -0.055 11.722 4.894 1.00 0.00 C ATOM 274 NE ARG A 16 1.321 11.177 4.897 1.00 0.00 N ATOM 275 CZ ARG A 16 2.051 10.974 3.791 1.00 0.00 C ATOM 276 NH1 ARG A 16 1.540 11.268 2.588 1.00 0.00 N ATOM 277 NH2 ARG A 16 3.291 10.475 3.890 1.00 0.00 N ATOM 0 H ARG A 16 -0.816 14.479 8.043 1.00 0.00 H new ATOM 0 HA ARG A 16 -3.401 13.069 7.843 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -2.539 11.596 6.171 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -2.187 13.218 5.609 1.00 0.00 H new ATOM 0 HG2 ARG A 16 0.136 13.000 6.621 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -0.235 11.331 7.007 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -0.751 10.973 4.516 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -0.114 12.579 4.223 1.00 0.00 H new ATOM 0 HE ARG A 16 1.740 10.941 5.797 1.00 0.00 H new ATOM 0 HH11 ARG A 16 0.596 11.646 2.514 1.00 0.00 H new ATOM 0 HH12 ARG A 16 2.095 11.114 1.746 1.00 0.00 H new ATOM 0 HH21 ARG A 16 3.679 10.250 4.806 1.00 0.00 H new ATOM 0 HH22 ARG A 16 3.847 10.320 3.049 1.00 0.00 H new ATOM 291 N ARG A 17 -1.951 10.839 8.662 1.00 0.00 N ATOM 292 CA ARG A 17 -1.455 9.859 9.613 1.00 0.00 C ATOM 293 C ARG A 17 -1.179 8.529 8.909 1.00 0.00 C ATOM 294 O ARG A 17 -2.076 7.944 8.305 1.00 0.00 O ATOM 295 CB ARG A 17 -2.460 9.631 10.744 1.00 0.00 C ATOM 296 CG ARG A 17 -1.781 9.738 12.111 1.00 0.00 C ATOM 297 CD ARG A 17 -2.052 8.492 12.957 1.00 0.00 C ATOM 298 NE ARG A 17 -2.675 8.878 14.242 1.00 0.00 N ATOM 299 CZ ARG A 17 -1.987 9.272 15.322 1.00 0.00 C ATOM 300 NH1 ARG A 17 -0.649 9.334 15.278 1.00 0.00 N ATOM 301 NH2 ARG A 17 -2.636 9.604 16.446 1.00 0.00 N ATOM 0 H ARG A 17 -2.466 10.446 7.874 1.00 0.00 H new ATOM 0 HA ARG A 17 -0.530 10.248 10.038 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -3.263 10.364 10.675 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -2.916 8.647 10.637 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -0.707 9.865 11.978 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -2.145 10.623 12.633 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -2.708 7.811 12.416 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -1.120 7.958 13.141 1.00 0.00 H new ATOM 0 HE ARG A 17 -3.692 8.842 14.310 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -0.155 9.081 14.422 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -0.125 9.634 16.100 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -3.654 9.557 16.480 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -2.112 9.904 17.268 1.00 0.00 H new ATOM 315 N GLU A 18 0.067 8.090 9.011 1.00 0.00 N ATOM 316 CA GLU A 18 0.473 6.839 8.391 1.00 0.00 C ATOM 317 C GLU A 18 0.349 5.687 9.391 1.00 0.00 C ATOM 318 O GLU A 18 1.115 5.608 10.350 1.00 0.00 O ATOM 319 CB GLU A 18 1.897 6.937 7.841 1.00 0.00 C ATOM 320 CG GLU A 18 2.048 8.153 6.924 1.00 0.00 C ATOM 321 CD GLU A 18 1.637 7.812 5.490 1.00 0.00 C ATOM 322 OE1 GLU A 18 0.602 7.127 5.344 1.00 0.00 O ATOM 323 OE2 GLU A 18 2.368 8.245 4.572 1.00 0.00 O ATOM 0 H GLU A 18 0.809 8.578 9.513 1.00 0.00 H new ATOM 0 HA GLU A 18 -0.192 6.639 7.551 1.00 0.00 H new ATOM 0 HB2 GLU A 18 2.605 7.009 8.666 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.141 6.029 7.290 1.00 0.00 H new ATOM 0 HG2 GLU A 18 1.434 8.973 7.297 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.082 8.497 6.938 1.00 0.00 H new ATOM 330 N LEU A 19 -0.622 4.823 9.132 1.00 0.00 N ATOM 331 CA LEU A 19 -0.855 3.679 9.996 1.00 0.00 C ATOM 332 C LEU A 19 -0.591 2.392 9.214 1.00 0.00 C ATOM 333 O LEU A 19 -1.028 2.254 8.073 1.00 0.00 O ATOM 334 CB LEU A 19 -2.255 3.749 10.611 1.00 0.00 C ATOM 335 CG LEU A 19 -2.707 5.129 11.095 1.00 0.00 C ATOM 336 CD1 LEU A 19 -3.923 5.615 10.304 1.00 0.00 C ATOM 337 CD2 LEU A 19 -2.968 5.122 12.602 1.00 0.00 C ATOM 0 H LEU A 19 -1.256 4.893 8.336 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.161 3.689 10.837 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.973 3.392 9.873 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.295 3.059 11.454 1.00 0.00 H new ATOM 0 HG LEU A 19 -1.900 5.838 10.912 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.224 6.598 10.667 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.666 5.682 9.247 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -4.746 4.912 10.434 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.288 6.114 12.920 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.749 4.398 12.833 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.053 4.849 13.128 1.00 0.00 H new ATOM 349 N ASP A 20 0.124 1.481 9.859 1.00 0.00 N ATOM 350 CA ASP A 20 0.452 0.209 9.237 1.00 0.00 C ATOM 351 C ASP A 20 -0.220 -0.922 10.017 1.00 0.00 C ATOM 352 O ASP A 20 -0.240 -0.907 11.247 1.00 0.00 O ATOM 353 CB ASP A 20 1.962 -0.038 9.252 1.00 0.00 C ATOM 354 CG ASP A 20 2.708 0.442 8.006 1.00 0.00 C ATOM 355 OD1 ASP A 20 2.047 0.532 6.948 1.00 0.00 O ATOM 356 OD2 ASP A 20 3.922 0.709 8.138 1.00 0.00 O ATOM 0 H ASP A 20 0.485 1.599 10.806 1.00 0.00 H new ATOM 0 HA ASP A 20 0.102 0.237 8.205 1.00 0.00 H new ATOM 0 HB2 ASP A 20 2.387 0.457 10.125 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.139 -1.107 9.374 1.00 0.00 H new ATOM 361 N PHE A 21 -0.753 -1.878 9.270 1.00 0.00 N ATOM 362 CA PHE A 21 -1.424 -3.015 9.875 1.00 0.00 C ATOM 363 C PHE A 21 -1.425 -4.219 8.931 1.00 0.00 C ATOM 364 O PHE A 21 -1.166 -4.075 7.737 1.00 0.00 O ATOM 365 CB PHE A 21 -2.870 -2.591 10.143 1.00 0.00 C ATOM 366 CG PHE A 21 -3.657 -2.233 8.880 1.00 0.00 C ATOM 367 CD1 PHE A 21 -3.604 -0.968 8.382 1.00 0.00 C ATOM 368 CD2 PHE A 21 -4.409 -3.178 8.256 1.00 0.00 C ATOM 369 CE1 PHE A 21 -4.334 -0.635 7.211 1.00 0.00 C ATOM 370 CE2 PHE A 21 -5.139 -2.845 7.084 1.00 0.00 C ATOM 371 CZ PHE A 21 -5.086 -1.581 6.587 1.00 0.00 C ATOM 0 H PHE A 21 -0.733 -1.888 8.250 1.00 0.00 H new ATOM 0 HA PHE A 21 -0.909 -3.306 10.790 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -3.385 -3.399 10.663 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -2.868 -1.732 10.813 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -3.007 -0.217 8.878 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -4.451 -4.182 8.651 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -4.292 0.369 6.816 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -5.736 -3.596 6.588 1.00 0.00 H new ATOM 0 HZ PHE A 21 -5.641 -1.328 5.696 1.00 0.00 H new ATOM 381 N ILE A 22 -1.717 -5.378 9.501 1.00 0.00 N ATOM 382 CA ILE A 22 -1.754 -6.606 8.725 1.00 0.00 C ATOM 383 C ILE A 22 -3.167 -7.191 8.770 1.00 0.00 C ATOM 384 O ILE A 22 -3.779 -7.264 9.835 1.00 0.00 O ATOM 385 CB ILE A 22 -0.672 -7.575 9.203 1.00 0.00 C ATOM 386 CG1 ILE A 22 0.707 -6.913 9.180 1.00 0.00 C ATOM 387 CG2 ILE A 22 -0.699 -8.872 8.391 1.00 0.00 C ATOM 388 CD1 ILE A 22 1.145 -6.608 7.746 1.00 0.00 C ATOM 0 H ILE A 22 -1.930 -5.493 10.492 1.00 0.00 H new ATOM 0 HA ILE A 22 -1.527 -6.402 7.679 1.00 0.00 H new ATOM 0 HB ILE A 22 -0.885 -7.839 10.239 1.00 0.00 H new ATOM 0 HG12 ILE A 22 0.681 -5.991 9.760 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.437 -7.568 9.655 1.00 0.00 H new ATOM 0 HG21 ILE A 22 0.080 -9.543 8.752 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -1.671 -9.351 8.503 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -0.525 -8.646 7.339 1.00 0.00 H new ATOM 0 HD11 ILE A 22 2.128 -6.138 7.758 1.00 0.00 H new ATOM 0 HD12 ILE A 22 1.193 -7.535 7.175 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.426 -5.933 7.282 1.00 0.00 H new ATOM 400 N VAL A 23 -3.645 -7.592 7.602 1.00 0.00 N ATOM 401 CA VAL A 23 -4.975 -8.168 7.495 1.00 0.00 C ATOM 402 C VAL A 23 -4.859 -9.688 7.363 1.00 0.00 C ATOM 403 O VAL A 23 -4.183 -10.186 6.464 1.00 0.00 O ATOM 404 CB VAL A 23 -5.733 -7.523 6.333 1.00 0.00 C ATOM 405 CG1 VAL A 23 -7.229 -7.836 6.413 1.00 0.00 C ATOM 406 CG2 VAL A 23 -5.490 -6.013 6.290 1.00 0.00 C ATOM 0 H VAL A 23 -3.135 -7.530 6.721 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.553 -7.963 8.396 1.00 0.00 H new ATOM 0 HB VAL A 23 -5.351 -7.950 5.406 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -7.744 -7.366 5.576 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -7.378 -8.915 6.371 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -7.632 -7.450 7.350 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -6.040 -5.580 5.455 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -5.831 -5.563 7.222 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.425 -5.819 6.162 1.00 0.00 H new ATOM 416 N LYS A 24 -5.528 -10.382 8.272 1.00 0.00 N ATOM 417 CA LYS A 24 -5.508 -11.834 8.268 1.00 0.00 C ATOM 418 C LYS A 24 -6.934 -12.359 8.089 1.00 0.00 C ATOM 419 O LYS A 24 -7.890 -11.746 8.563 1.00 0.00 O ATOM 420 CB LYS A 24 -4.811 -12.364 9.523 1.00 0.00 C ATOM 421 CG LYS A 24 -3.301 -12.479 9.303 1.00 0.00 C ATOM 422 CD LYS A 24 -2.572 -12.716 10.627 1.00 0.00 C ATOM 423 CE LYS A 24 -1.109 -13.095 10.387 1.00 0.00 C ATOM 424 NZ LYS A 24 -0.866 -14.500 10.781 1.00 0.00 N ATOM 0 H LYS A 24 -6.087 -9.965 9.016 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.923 -12.204 7.426 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.010 -11.698 10.363 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.219 -13.340 9.786 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -3.091 -13.299 8.616 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.927 -11.568 8.836 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -2.622 -11.816 11.240 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -3.070 -13.510 11.184 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -0.860 -12.958 9.335 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.457 -12.433 10.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 0.132 -14.740 10.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -1.084 -14.620 11.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -1.474 -15.129 10.218 1.00 0.00 H new ATOM 438 N TYR A 25 -7.034 -13.489 7.404 1.00 0.00 N ATOM 439 CA TYR A 25 -8.327 -14.103 7.157 1.00 0.00 C ATOM 440 C TYR A 25 -8.175 -15.592 6.837 1.00 0.00 C ATOM 441 O TYR A 25 -7.061 -16.082 6.662 1.00 0.00 O ATOM 442 CB TYR A 25 -8.907 -13.388 5.935 1.00 0.00 C ATOM 443 CG TYR A 25 -7.941 -13.296 4.752 1.00 0.00 C ATOM 444 CD1 TYR A 25 -6.871 -12.427 4.800 1.00 0.00 C ATOM 445 CD2 TYR A 25 -8.141 -14.083 3.635 1.00 0.00 C ATOM 446 CE1 TYR A 25 -5.962 -12.340 3.687 1.00 0.00 C ATOM 447 CE2 TYR A 25 -7.232 -13.996 2.521 1.00 0.00 C ATOM 448 CZ TYR A 25 -6.188 -13.129 2.602 1.00 0.00 C ATOM 449 OH TYR A 25 -5.329 -13.047 1.550 1.00 0.00 O ATOM 0 H TYR A 25 -6.240 -13.995 7.012 1.00 0.00 H new ATOM 0 HA TYR A 25 -8.967 -14.016 8.035 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -9.809 -13.910 5.615 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -9.208 -12.381 6.225 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -6.715 -11.811 5.673 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -8.979 -14.764 3.597 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -5.120 -11.664 3.713 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -7.377 -14.606 1.641 1.00 0.00 H new ATOM 0 HH TYR A 25 -5.834 -12.877 0.728 1.00 0.00 H new ATOM 459 N GLU A 26 -9.312 -16.269 6.771 1.00 0.00 N ATOM 460 CA GLU A 26 -9.319 -17.692 6.476 1.00 0.00 C ATOM 461 C GLU A 26 -10.330 -17.999 5.370 1.00 0.00 C ATOM 462 O GLU A 26 -11.253 -18.788 5.569 1.00 0.00 O ATOM 463 CB GLU A 26 -9.616 -18.511 7.733 1.00 0.00 C ATOM 464 CG GLU A 26 -8.326 -19.059 8.348 1.00 0.00 C ATOM 465 CD GLU A 26 -8.371 -20.585 8.448 1.00 0.00 C ATOM 466 OE1 GLU A 26 -8.942 -21.071 9.449 1.00 0.00 O ATOM 467 OE2 GLU A 26 -7.834 -21.231 7.523 1.00 0.00 O ATOM 0 H GLU A 26 -10.234 -15.859 6.917 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.327 -17.975 6.124 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.135 -17.889 8.462 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.284 -19.336 7.485 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.473 -18.756 7.742 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.181 -18.630 9.340 1.00 0.00 H new ATOM 474 N GLY A 27 -10.123 -17.360 4.228 1.00 0.00 N ATOM 475 CA GLY A 27 -11.005 -17.555 3.090 1.00 0.00 C ATOM 476 C GLY A 27 -10.894 -16.390 2.104 1.00 0.00 C ATOM 477 O GLY A 27 -9.804 -15.868 1.876 1.00 0.00 O ATOM 0 H GLY A 27 -9.357 -16.706 4.066 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -10.753 -18.488 2.586 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.035 -17.647 3.435 1.00 0.00 H new ATOM 481 N SER A 28 -12.036 -16.018 1.545 1.00 0.00 N ATOM 482 CA SER A 28 -12.080 -14.925 0.589 1.00 0.00 C ATOM 483 C SER A 28 -11.287 -13.731 1.122 1.00 0.00 C ATOM 484 O SER A 28 -11.349 -13.421 2.311 1.00 0.00 O ATOM 485 CB SER A 28 -13.523 -14.514 0.290 1.00 0.00 C ATOM 486 OG SER A 28 -14.364 -15.642 0.063 1.00 0.00 O ATOM 0 H SER A 28 -12.938 -16.454 1.736 1.00 0.00 H new ATOM 0 HA SER A 28 -11.627 -15.266 -0.342 1.00 0.00 H new ATOM 0 HB2 SER A 28 -13.914 -13.932 1.125 1.00 0.00 H new ATOM 0 HB3 SER A 28 -13.541 -13.866 -0.586 1.00 0.00 H new ATOM 0 HG SER A 28 -15.277 -15.337 -0.123 1.00 0.00 H new ATOM 492 N THR A 29 -10.561 -13.092 0.217 1.00 0.00 N ATOM 493 CA THR A 29 -9.757 -11.938 0.582 1.00 0.00 C ATOM 494 C THR A 29 -10.654 -10.737 0.887 1.00 0.00 C ATOM 495 O THR A 29 -11.687 -10.550 0.245 1.00 0.00 O ATOM 496 CB THR A 29 -8.760 -11.679 -0.551 1.00 0.00 C ATOM 497 OG1 THR A 29 -7.704 -12.603 -0.301 1.00 0.00 O ATOM 498 CG2 THR A 29 -8.091 -10.308 -0.439 1.00 0.00 C ATOM 0 H THR A 29 -10.513 -13.351 -0.768 1.00 0.00 H new ATOM 0 HA THR A 29 -9.193 -12.123 1.496 1.00 0.00 H new ATOM 0 HB THR A 29 -9.272 -11.756 -1.510 1.00 0.00 H new ATOM 0 HG1 THR A 29 -7.794 -12.965 0.605 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.394 -10.175 -1.266 1.00 0.00 H new ATOM 0 HG22 THR A 29 -8.851 -9.528 -0.476 1.00 0.00 H new ATOM 0 HG23 THR A 29 -7.550 -10.243 0.505 1.00 0.00 H new ATOM 506 N PRO A 30 -10.217 -9.934 1.894 1.00 0.00 N ATOM 507 CA PRO A 30 -10.969 -8.757 2.293 1.00 0.00 C ATOM 508 C PRO A 30 -10.802 -7.628 1.274 1.00 0.00 C ATOM 509 O PRO A 30 -9.822 -7.597 0.531 1.00 0.00 O ATOM 510 CB PRO A 30 -10.436 -8.397 3.670 1.00 0.00 C ATOM 511 CG PRO A 30 -9.093 -9.099 3.793 1.00 0.00 C ATOM 512 CD PRO A 30 -8.999 -10.125 2.676 1.00 0.00 C ATOM 0 HA PRO A 30 -12.043 -8.938 2.331 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -10.324 -7.318 3.776 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -11.121 -8.724 4.452 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -8.278 -8.379 3.720 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -9.003 -9.584 4.765 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -8.109 -9.967 2.067 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -8.938 -11.138 3.073 1.00 0.00 H new ATOM 520 N SER A 31 -11.775 -6.729 1.270 1.00 0.00 N ATOM 521 CA SER A 31 -11.748 -5.601 0.354 1.00 0.00 C ATOM 522 C SER A 31 -11.156 -4.375 1.051 1.00 0.00 C ATOM 523 O SER A 31 -10.994 -4.367 2.271 1.00 0.00 O ATOM 524 CB SER A 31 -13.149 -5.287 -0.174 1.00 0.00 C ATOM 525 OG SER A 31 -13.823 -6.457 -0.629 1.00 0.00 O ATOM 0 H SER A 31 -12.587 -6.759 1.886 1.00 0.00 H new ATOM 0 HA SER A 31 -11.120 -5.866 -0.496 1.00 0.00 H new ATOM 0 HB2 SER A 31 -13.736 -4.814 0.614 1.00 0.00 H new ATOM 0 HB3 SER A 31 -13.076 -4.570 -0.992 1.00 0.00 H new ATOM 0 HG SER A 31 -14.714 -6.215 -0.956 1.00 0.00 H new ATOM 531 N ARG A 32 -10.850 -3.367 0.247 1.00 0.00 N ATOM 532 CA ARG A 32 -10.280 -2.138 0.772 1.00 0.00 C ATOM 533 C ARG A 32 -11.302 -1.410 1.647 1.00 0.00 C ATOM 534 O ARG A 32 -10.936 -0.755 2.622 1.00 0.00 O ATOM 535 CB ARG A 32 -9.835 -1.210 -0.360 1.00 0.00 C ATOM 536 CG ARG A 32 -8.522 -1.692 -0.981 1.00 0.00 C ATOM 537 CD ARG A 32 -8.394 -1.217 -2.430 1.00 0.00 C ATOM 538 NE ARG A 32 -8.961 -2.230 -3.347 1.00 0.00 N ATOM 539 CZ ARG A 32 -8.294 -3.308 -3.780 1.00 0.00 C ATOM 540 NH1 ARG A 32 -7.032 -3.521 -3.382 1.00 0.00 N ATOM 541 NH2 ARG A 32 -8.889 -4.175 -4.612 1.00 0.00 N ATOM 0 H ARG A 32 -10.986 -3.376 -0.764 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.409 -2.406 1.371 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -10.609 -1.168 -1.126 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -9.710 -0.197 0.023 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -7.681 -1.319 -0.397 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -8.477 -2.781 -0.946 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -8.914 -0.268 -2.557 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -7.346 -1.041 -2.672 1.00 0.00 H new ATOM 0 HE ARG A 32 -9.920 -2.099 -3.670 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -6.579 -2.862 -2.749 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -6.525 -4.342 -3.712 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -9.849 -4.014 -4.915 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -8.381 -4.996 -4.942 1.00 0.00 H new ATOM 555 N ASN A 33 -12.564 -1.548 1.267 1.00 0.00 N ATOM 556 CA ASN A 33 -13.641 -0.911 2.005 1.00 0.00 C ATOM 557 C ASN A 33 -13.851 -1.647 3.330 1.00 0.00 C ATOM 558 O ASN A 33 -14.145 -1.026 4.350 1.00 0.00 O ATOM 559 CB ASN A 33 -14.954 -0.967 1.221 1.00 0.00 C ATOM 560 CG ASN A 33 -15.199 -2.369 0.661 1.00 0.00 C ATOM 561 OD1 ASN A 33 -15.302 -3.345 1.385 1.00 0.00 O ATOM 562 ND2 ASN A 33 -15.286 -2.414 -0.666 1.00 0.00 N ATOM 0 H ASN A 33 -12.864 -2.092 0.458 1.00 0.00 H new ATOM 0 HA ASN A 33 -13.365 0.130 2.173 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -15.782 -0.681 1.870 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -14.925 -0.245 0.405 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -15.448 -3.304 -1.137 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -15.190 -1.558 -1.213 1.00 0.00 H new ATOM 569 N ASP A 34 -13.691 -2.961 3.272 1.00 0.00 N ATOM 570 CA ASP A 34 -13.858 -3.789 4.454 1.00 0.00 C ATOM 571 C ASP A 34 -12.775 -3.437 5.475 1.00 0.00 C ATOM 572 O ASP A 34 -13.059 -3.293 6.663 1.00 0.00 O ATOM 573 CB ASP A 34 -13.722 -5.273 4.112 1.00 0.00 C ATOM 574 CG ASP A 34 -14.943 -5.895 3.432 1.00 0.00 C ATOM 575 OD1 ASP A 34 -15.868 -5.120 3.107 1.00 0.00 O ATOM 576 OD2 ASP A 34 -14.924 -7.132 3.252 1.00 0.00 O ATOM 0 H ASP A 34 -13.447 -3.473 2.424 1.00 0.00 H new ATOM 0 HA ASP A 34 -14.853 -3.603 4.858 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -12.857 -5.402 3.461 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -13.516 -5.824 5.029 1.00 0.00 H new ATOM 581 N VAL A 35 -11.554 -3.309 4.975 1.00 0.00 N ATOM 582 CA VAL A 35 -10.427 -2.978 5.829 1.00 0.00 C ATOM 583 C VAL A 35 -10.562 -1.531 6.307 1.00 0.00 C ATOM 584 O VAL A 35 -10.235 -1.218 7.451 1.00 0.00 O ATOM 585 CB VAL A 35 -9.114 -3.242 5.088 1.00 0.00 C ATOM 586 CG1 VAL A 35 -7.916 -2.756 5.906 1.00 0.00 C ATOM 587 CG2 VAL A 35 -8.973 -4.723 4.734 1.00 0.00 C ATOM 0 H VAL A 35 -11.321 -3.429 3.989 1.00 0.00 H new ATOM 0 HA VAL A 35 -10.419 -3.614 6.714 1.00 0.00 H new ATOM 0 HB VAL A 35 -9.135 -2.676 4.157 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.996 -2.955 5.357 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -8.007 -1.685 6.084 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.890 -3.281 6.861 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -8.032 -4.883 4.208 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -8.985 -5.318 5.647 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -9.802 -5.025 4.094 1.00 0.00 H new ATOM 597 N ARG A 36 -11.046 -0.687 5.407 1.00 0.00 N ATOM 598 CA ARG A 36 -11.229 0.720 5.723 1.00 0.00 C ATOM 599 C ARG A 36 -12.248 0.882 6.853 1.00 0.00 C ATOM 600 O ARG A 36 -11.992 1.587 7.828 1.00 0.00 O ATOM 601 CB ARG A 36 -11.708 1.501 4.498 1.00 0.00 C ATOM 602 CG ARG A 36 -10.584 2.370 3.929 1.00 0.00 C ATOM 603 CD ARG A 36 -11.138 3.677 3.356 1.00 0.00 C ATOM 604 NE ARG A 36 -10.467 3.993 2.076 1.00 0.00 N ATOM 605 CZ ARG A 36 -10.980 4.802 1.139 1.00 0.00 C ATOM 606 NH1 ARG A 36 -12.173 5.381 1.333 1.00 0.00 N ATOM 607 NH2 ARG A 36 -10.301 5.032 0.007 1.00 0.00 N ATOM 0 H ARG A 36 -11.317 -0.950 4.460 1.00 0.00 H new ATOM 0 HA ARG A 36 -10.265 1.117 6.039 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -12.059 0.807 3.734 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -12.556 2.129 4.771 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -9.858 2.591 4.712 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -10.055 1.822 3.149 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -12.213 3.588 3.200 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -10.985 4.489 4.067 1.00 0.00 H new ATOM 0 HE ARG A 36 -9.557 3.569 1.895 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -12.691 5.206 2.194 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -12.563 5.997 0.620 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -9.393 4.591 -0.142 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -10.692 5.648 -0.706 1.00 0.00 H new ATOM 621 N ASN A 37 -13.382 0.217 6.684 1.00 0.00 N ATOM 622 CA ASN A 37 -14.440 0.279 7.677 1.00 0.00 C ATOM 623 C ASN A 37 -13.934 -0.314 8.994 1.00 0.00 C ATOM 624 O ASN A 37 -14.193 0.232 10.065 1.00 0.00 O ATOM 625 CB ASN A 37 -15.660 -0.531 7.233 1.00 0.00 C ATOM 626 CG ASN A 37 -16.755 0.385 6.681 1.00 0.00 C ATOM 627 OD1 ASN A 37 -17.143 1.368 7.291 1.00 0.00 O ATOM 628 ND2 ASN A 37 -17.229 0.009 5.497 1.00 0.00 N ATOM 0 H ASN A 37 -13.591 -0.367 5.874 1.00 0.00 H new ATOM 0 HA ASN A 37 -14.725 1.324 7.800 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -15.365 -1.251 6.470 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -16.049 -1.101 8.077 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -17.962 0.555 5.045 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -16.859 -0.825 5.041 1.00 0.00 H new ATOM 635 N LYS A 38 -13.219 -1.423 8.870 1.00 0.00 N ATOM 636 CA LYS A 38 -12.674 -2.096 10.037 1.00 0.00 C ATOM 637 C LYS A 38 -11.735 -1.141 10.778 1.00 0.00 C ATOM 638 O LYS A 38 -11.851 -0.967 11.990 1.00 0.00 O ATOM 639 CB LYS A 38 -12.016 -3.417 9.635 1.00 0.00 C ATOM 640 CG LYS A 38 -12.110 -4.443 10.766 1.00 0.00 C ATOM 641 CD LYS A 38 -12.766 -5.737 10.280 1.00 0.00 C ATOM 642 CE LYS A 38 -13.664 -6.337 11.363 1.00 0.00 C ATOM 643 NZ LYS A 38 -15.089 -6.220 10.978 1.00 0.00 N ATOM 0 H LYS A 38 -13.005 -1.872 7.980 1.00 0.00 H new ATOM 0 HA LYS A 38 -13.471 -2.362 10.731 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -12.499 -3.811 8.741 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -10.970 -3.244 9.382 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -11.113 -4.659 11.150 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -12.687 -4.027 11.592 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -13.354 -5.537 9.385 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -11.996 -6.457 10.001 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -13.408 -7.385 11.517 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -13.494 -5.825 12.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -15.685 -6.632 11.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -15.334 -5.217 10.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -15.250 -6.729 10.085 1.00 0.00 H new ATOM 657 N LEU A 39 -10.825 -0.549 10.018 1.00 0.00 N ATOM 658 CA LEU A 39 -9.867 0.383 10.587 1.00 0.00 C ATOM 659 C LEU A 39 -10.613 1.590 11.159 1.00 0.00 C ATOM 660 O LEU A 39 -10.434 1.940 12.324 1.00 0.00 O ATOM 661 CB LEU A 39 -8.800 0.752 9.554 1.00 0.00 C ATOM 662 CG LEU A 39 -7.350 0.707 10.041 1.00 0.00 C ATOM 663 CD1 LEU A 39 -6.710 -0.647 9.731 1.00 0.00 C ATOM 664 CD2 LEU A 39 -6.542 1.870 9.463 1.00 0.00 C ATOM 0 H LEU A 39 -10.731 -0.697 9.013 1.00 0.00 H new ATOM 0 HA LEU A 39 -9.330 -0.081 11.414 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.898 0.077 8.703 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.009 1.758 9.189 1.00 0.00 H new ATOM 0 HG LEU A 39 -7.349 0.822 11.125 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.680 -0.653 10.087 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -7.271 -1.437 10.230 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.722 -0.817 8.654 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -5.515 1.815 9.825 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -6.547 1.811 8.375 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.987 2.814 9.777 1.00 0.00 H new ATOM 676 N ALA A 40 -11.434 2.193 10.312 1.00 0.00 N ATOM 677 CA ALA A 40 -12.209 3.353 10.718 1.00 0.00 C ATOM 678 C ALA A 40 -12.904 3.057 12.049 1.00 0.00 C ATOM 679 O ALA A 40 -13.013 3.933 12.905 1.00 0.00 O ATOM 680 CB ALA A 40 -13.200 3.719 9.612 1.00 0.00 C ATOM 0 H ALA A 40 -11.579 1.900 9.346 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.558 4.214 10.870 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -13.781 4.589 9.917 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -12.655 3.950 8.697 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -13.871 2.879 9.433 1.00 0.00 H new ATOM 686 N ALA A 41 -13.356 1.818 12.181 1.00 0.00 N ATOM 687 CA ALA A 41 -14.037 1.395 13.392 1.00 0.00 C ATOM 688 C ALA A 41 -13.009 1.198 14.508 1.00 0.00 C ATOM 689 O ALA A 41 -13.276 1.515 15.666 1.00 0.00 O ATOM 690 CB ALA A 41 -14.841 0.125 13.109 1.00 0.00 C ATOM 0 H ALA A 41 -13.264 1.094 11.469 1.00 0.00 H new ATOM 0 HA ALA A 41 -14.741 2.159 13.723 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -15.352 -0.192 14.018 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -15.577 0.326 12.330 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -14.168 -0.665 12.777 1.00 0.00 H new ATOM 696 N MET A 42 -11.854 0.676 14.120 1.00 0.00 N ATOM 697 CA MET A 42 -10.785 0.433 15.073 1.00 0.00 C ATOM 698 C MET A 42 -10.211 1.750 15.601 1.00 0.00 C ATOM 699 O MET A 42 -10.034 1.914 16.807 1.00 0.00 O ATOM 700 CB MET A 42 -9.673 -0.374 14.399 1.00 0.00 C ATOM 701 CG MET A 42 -10.036 -1.859 14.334 1.00 0.00 C ATOM 702 SD MET A 42 -8.880 -2.725 13.285 1.00 0.00 S ATOM 703 CE MET A 42 -7.492 -2.860 14.400 1.00 0.00 C ATOM 0 H MET A 42 -11.636 0.415 13.158 1.00 0.00 H new ATOM 0 HA MET A 42 -11.194 -0.127 15.914 1.00 0.00 H new ATOM 0 HB2 MET A 42 -9.502 0.007 13.392 1.00 0.00 H new ATOM 0 HB3 MET A 42 -8.741 -0.247 14.950 1.00 0.00 H new ATOM 0 HG2 MET A 42 -10.023 -2.289 15.336 1.00 0.00 H new ATOM 0 HG3 MET A 42 -11.049 -1.978 13.949 1.00 0.00 H new ATOM 0 HE1 MET A 42 -7.043 -3.849 14.304 1.00 0.00 H new ATOM 0 HE2 MET A 42 -6.751 -2.099 14.153 1.00 0.00 H new ATOM 0 HE3 MET A 42 -7.833 -2.714 15.425 1.00 0.00 H new ATOM 713 N LEU A 43 -9.937 2.654 14.672 1.00 0.00 N ATOM 714 CA LEU A 43 -9.387 3.951 15.029 1.00 0.00 C ATOM 715 C LEU A 43 -10.533 4.931 15.291 1.00 0.00 C ATOM 716 O LEU A 43 -10.303 6.126 15.467 1.00 0.00 O ATOM 717 CB LEU A 43 -8.403 4.428 13.960 1.00 0.00 C ATOM 718 CG LEU A 43 -7.779 3.336 13.088 1.00 0.00 C ATOM 719 CD1 LEU A 43 -6.588 3.881 12.297 1.00 0.00 C ATOM 720 CD2 LEU A 43 -7.399 2.114 13.927 1.00 0.00 C ATOM 0 H LEU A 43 -10.086 2.514 13.673 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.810 3.880 15.951 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.918 5.135 13.309 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.599 4.976 14.452 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.525 3.009 12.364 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.163 3.085 11.686 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -6.921 4.695 11.653 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.831 4.251 12.988 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.958 1.353 13.283 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -6.677 2.406 14.690 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -8.291 1.711 14.407 1.00 0.00 H new ATOM 732 N ASN A 44 -11.741 4.387 15.311 1.00 0.00 N ATOM 733 CA ASN A 44 -12.923 5.199 15.549 1.00 0.00 C ATOM 734 C ASN A 44 -12.801 6.510 14.770 1.00 0.00 C ATOM 735 O ASN A 44 -13.180 7.569 15.268 1.00 0.00 O ATOM 736 CB ASN A 44 -13.066 5.541 17.033 1.00 0.00 C ATOM 737 CG ASN A 44 -11.721 5.961 17.631 1.00 0.00 C ATOM 738 OD1 ASN A 44 -11.384 7.132 17.706 1.00 0.00 O ATOM 739 ND2 ASN A 44 -10.974 4.944 18.050 1.00 0.00 N ATOM 0 H ASN A 44 -11.927 3.395 15.166 1.00 0.00 H new ATOM 0 HA ASN A 44 -13.794 4.630 15.225 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -13.790 6.346 17.156 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -13.454 4.678 17.573 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -10.059 5.120 18.464 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -11.316 3.988 17.957 1.00 0.00 H new ATOM 746 N ALA A 45 -12.269 6.397 13.562 1.00 0.00 N ATOM 747 CA ALA A 45 -12.092 7.561 12.710 1.00 0.00 C ATOM 748 C ALA A 45 -13.032 7.455 11.508 1.00 0.00 C ATOM 749 O ALA A 45 -13.593 6.392 11.245 1.00 0.00 O ATOM 750 CB ALA A 45 -10.624 7.671 12.294 1.00 0.00 C ATOM 0 H ALA A 45 -11.955 5.517 13.153 1.00 0.00 H new ATOM 0 HA ALA A 45 -12.347 8.473 13.249 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.491 8.544 11.655 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -10.001 7.773 13.182 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -10.332 6.774 11.748 1.00 0.00 H new ATOM 756 N PRO A 46 -13.180 8.601 10.791 1.00 0.00 N ATOM 757 CA PRO A 46 -14.043 8.648 9.623 1.00 0.00 C ATOM 758 C PRO A 46 -13.390 7.945 8.431 1.00 0.00 C ATOM 759 O PRO A 46 -12.167 7.946 8.299 1.00 0.00 O ATOM 760 CB PRO A 46 -14.293 10.127 9.377 1.00 0.00 C ATOM 761 CG PRO A 46 -13.195 10.865 10.124 1.00 0.00 C ATOM 762 CD PRO A 46 -12.532 9.879 11.072 1.00 0.00 C ATOM 0 HA PRO A 46 -14.984 8.119 9.774 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -14.263 10.356 8.312 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -15.278 10.422 9.739 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -12.465 11.272 9.425 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -13.610 11.707 10.678 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -11.457 9.825 10.899 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -12.672 10.174 12.112 1.00 0.00 H new ATOM 770 N LEU A 47 -14.235 7.362 7.593 1.00 0.00 N ATOM 771 CA LEU A 47 -13.755 6.657 6.416 1.00 0.00 C ATOM 772 C LEU A 47 -13.263 7.674 5.384 1.00 0.00 C ATOM 773 O LEU A 47 -12.160 7.543 4.855 1.00 0.00 O ATOM 774 CB LEU A 47 -14.832 5.711 5.882 1.00 0.00 C ATOM 775 CG LEU A 47 -14.339 4.361 5.359 1.00 0.00 C ATOM 776 CD1 LEU A 47 -14.572 3.254 6.390 1.00 0.00 C ATOM 777 CD2 LEU A 47 -14.977 4.030 4.008 1.00 0.00 C ATOM 0 H LEU A 47 -15.249 7.363 7.706 1.00 0.00 H new ATOM 0 HA LEU A 47 -12.905 6.024 6.671 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -15.554 5.528 6.678 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -15.366 6.217 5.077 1.00 0.00 H new ATOM 0 HG LEU A 47 -13.263 4.430 5.199 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -14.212 2.305 5.992 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -14.032 3.491 7.307 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -15.638 3.176 6.606 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -14.609 3.065 3.659 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -16.061 3.987 4.118 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -14.716 4.802 3.284 1.00 0.00 H new ATOM 789 N GLU A 48 -14.105 8.664 5.128 1.00 0.00 N ATOM 790 CA GLU A 48 -13.769 9.702 4.168 1.00 0.00 C ATOM 791 C GLU A 48 -12.344 10.205 4.406 1.00 0.00 C ATOM 792 O GLU A 48 -11.617 10.491 3.456 1.00 0.00 O ATOM 793 CB GLU A 48 -14.774 10.854 4.232 1.00 0.00 C ATOM 794 CG GLU A 48 -15.198 11.132 5.676 1.00 0.00 C ATOM 795 CD GLU A 48 -16.576 10.535 5.967 1.00 0.00 C ATOM 796 OE1 GLU A 48 -17.522 10.907 5.239 1.00 0.00 O ATOM 797 OE2 GLU A 48 -16.654 9.720 6.912 1.00 0.00 O ATOM 0 H GLU A 48 -15.019 8.770 5.568 1.00 0.00 H new ATOM 0 HA GLU A 48 -13.820 9.273 3.167 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -14.332 11.752 3.800 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -15.651 10.610 3.632 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -14.463 10.711 6.362 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -15.219 12.207 5.852 1.00 0.00 H new ATOM 804 N LEU A 49 -11.987 10.296 5.679 1.00 0.00 N ATOM 805 CA LEU A 49 -10.662 10.758 6.053 1.00 0.00 C ATOM 806 C LEU A 49 -9.673 9.596 5.949 1.00 0.00 C ATOM 807 O LEU A 49 -8.484 9.807 5.713 1.00 0.00 O ATOM 808 CB LEU A 49 -10.695 11.416 7.434 1.00 0.00 C ATOM 809 CG LEU A 49 -11.645 12.606 7.588 1.00 0.00 C ATOM 810 CD1 LEU A 49 -11.405 13.331 8.914 1.00 0.00 C ATOM 811 CD2 LEU A 49 -11.538 13.551 6.390 1.00 0.00 C ATOM 0 H LEU A 49 -12.593 10.057 6.464 1.00 0.00 H new ATOM 0 HA LEU A 49 -10.319 11.531 5.365 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -10.970 10.659 8.169 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -9.686 11.747 7.681 1.00 0.00 H new ATOM 0 HG LEU A 49 -12.667 12.227 7.609 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -12.093 14.172 8.998 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -11.572 12.641 9.741 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -10.379 13.697 8.948 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -12.223 14.388 6.524 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.518 13.926 6.313 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -11.797 13.013 5.478 1.00 0.00 H new ATOM 823 N LEU A 50 -10.200 8.394 6.131 1.00 0.00 N ATOM 824 CA LEU A 50 -9.378 7.198 6.060 1.00 0.00 C ATOM 825 C LEU A 50 -9.202 6.790 4.596 1.00 0.00 C ATOM 826 O LEU A 50 -10.167 6.771 3.833 1.00 0.00 O ATOM 827 CB LEU A 50 -9.964 6.092 6.940 1.00 0.00 C ATOM 828 CG LEU A 50 -8.953 5.141 7.585 1.00 0.00 C ATOM 829 CD1 LEU A 50 -8.493 5.670 8.944 1.00 0.00 C ATOM 830 CD2 LEU A 50 -9.520 3.723 7.683 1.00 0.00 C ATOM 0 H LEU A 50 -11.186 8.223 6.328 1.00 0.00 H new ATOM 0 HA LEU A 50 -8.383 7.397 6.457 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -10.551 6.558 7.732 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -10.654 5.502 6.337 1.00 0.00 H new ATOM 0 HG LEU A 50 -8.073 5.092 6.944 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -7.775 4.976 9.381 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -8.023 6.645 8.815 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -9.353 5.767 9.607 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -8.782 3.067 8.145 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -10.425 3.734 8.290 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -9.757 3.356 6.684 1.00 0.00 H new ATOM 842 N VAL A 51 -7.963 6.475 4.247 1.00 0.00 N ATOM 843 CA VAL A 51 -7.649 6.069 2.887 1.00 0.00 C ATOM 844 C VAL A 51 -6.664 4.899 2.924 1.00 0.00 C ATOM 845 O VAL A 51 -5.979 4.691 3.924 1.00 0.00 O ATOM 846 CB VAL A 51 -7.126 7.267 2.092 1.00 0.00 C ATOM 847 CG1 VAL A 51 -7.350 7.068 0.591 1.00 0.00 C ATOM 848 CG2 VAL A 51 -7.767 8.569 2.575 1.00 0.00 C ATOM 0 H VAL A 51 -7.165 6.493 4.882 1.00 0.00 H new ATOM 0 HA VAL A 51 -8.546 5.722 2.374 1.00 0.00 H new ATOM 0 HB VAL A 51 -6.052 7.340 2.264 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -6.970 7.933 0.048 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.824 6.172 0.260 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.416 6.956 0.394 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.377 9.404 1.993 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -8.848 8.511 2.448 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -7.533 8.721 3.629 1.00 0.00 H new ATOM 858 N ILE A 52 -6.625 4.166 1.821 1.00 0.00 N ATOM 859 CA ILE A 52 -5.735 3.022 1.715 1.00 0.00 C ATOM 860 C ILE A 52 -4.752 3.251 0.564 1.00 0.00 C ATOM 861 O ILE A 52 -5.163 3.527 -0.562 1.00 0.00 O ATOM 862 CB ILE A 52 -6.540 1.727 1.587 1.00 0.00 C ATOM 863 CG1 ILE A 52 -7.589 1.622 2.696 1.00 0.00 C ATOM 864 CG2 ILE A 52 -5.616 0.508 1.555 1.00 0.00 C ATOM 865 CD1 ILE A 52 -6.931 1.344 4.049 1.00 0.00 C ATOM 0 H ILE A 52 -7.195 4.342 0.993 1.00 0.00 H new ATOM 0 HA ILE A 52 -5.143 2.914 2.624 1.00 0.00 H new ATOM 0 HB ILE A 52 -7.076 1.750 0.638 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -8.161 2.548 2.749 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.294 0.825 2.460 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.213 -0.399 1.464 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -4.941 0.585 0.703 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -5.034 0.468 2.476 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -7.699 1.274 4.819 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.380 0.405 4.000 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.245 2.155 4.293 1.00 0.00 H new ATOM 877 N GLN A 53 -3.473 3.128 0.888 1.00 0.00 N ATOM 878 CA GLN A 53 -2.429 3.319 -0.105 1.00 0.00 C ATOM 879 C GLN A 53 -2.467 2.191 -1.138 1.00 0.00 C ATOM 880 O GLN A 53 -2.704 2.435 -2.320 1.00 0.00 O ATOM 881 CB GLN A 53 -1.053 3.409 0.558 1.00 0.00 C ATOM 882 CG GLN A 53 0.061 3.415 -0.490 1.00 0.00 C ATOM 883 CD GLN A 53 1.432 3.233 0.165 1.00 0.00 C ATOM 884 OE1 GLN A 53 2.060 2.192 0.070 1.00 0.00 O ATOM 885 NE2 GLN A 53 1.858 4.301 0.833 1.00 0.00 N ATOM 0 H GLN A 53 -3.136 2.899 1.823 1.00 0.00 H new ATOM 0 HA GLN A 53 -2.611 4.263 -0.619 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -0.995 4.315 1.161 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -0.916 2.566 1.235 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -0.110 2.616 -1.212 1.00 0.00 H new ATOM 0 HG3 GLN A 53 0.040 4.354 -1.043 1.00 0.00 H new ATOM 0 HE21 GLN A 53 1.281 5.141 0.872 1.00 0.00 H new ATOM 0 HE22 GLN A 53 2.762 4.280 1.306 1.00 0.00 H new ATOM 894 N ARG A 54 -2.230 0.980 -0.655 1.00 0.00 N ATOM 895 CA ARG A 54 -2.234 -0.186 -1.522 1.00 0.00 C ATOM 896 C ARG A 54 -2.013 -1.458 -0.702 1.00 0.00 C ATOM 897 O ARG A 54 -1.026 -1.569 0.025 1.00 0.00 O ATOM 898 CB ARG A 54 -1.144 -0.081 -2.591 1.00 0.00 C ATOM 899 CG ARG A 54 -1.676 -0.512 -3.959 1.00 0.00 C ATOM 900 CD ARG A 54 -0.741 -0.053 -5.080 1.00 0.00 C ATOM 901 NE ARG A 54 -1.237 -0.542 -6.386 1.00 0.00 N ATOM 902 CZ ARG A 54 -0.638 -0.294 -7.558 1.00 0.00 C ATOM 903 NH1 ARG A 54 0.484 0.439 -7.596 1.00 0.00 N ATOM 904 NH2 ARG A 54 -1.160 -0.778 -8.693 1.00 0.00 N ATOM 0 H ARG A 54 -2.034 0.781 0.326 1.00 0.00 H new ATOM 0 HA ARG A 54 -3.206 -0.231 -2.013 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -0.780 0.945 -2.645 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -0.295 -0.706 -2.313 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -1.779 -1.597 -3.988 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -2.670 -0.093 -4.115 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -0.679 1.035 -5.090 1.00 0.00 H new ATOM 0 HD3 ARG A 54 0.267 -0.428 -4.901 1.00 0.00 H new ATOM 0 HE ARG A 54 -2.089 -1.103 -6.394 1.00 0.00 H new ATOM 0 HH11 ARG A 54 0.882 0.808 -6.732 1.00 0.00 H new ATOM 0 HH12 ARG A 54 0.940 0.628 -8.489 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -2.014 -1.335 -8.665 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -0.704 -0.589 -9.585 1.00 0.00 H new ATOM 918 N ILE A 55 -2.947 -2.386 -0.845 1.00 0.00 N ATOM 919 CA ILE A 55 -2.867 -3.647 -0.126 1.00 0.00 C ATOM 920 C ILE A 55 -2.050 -4.646 -0.948 1.00 0.00 C ATOM 921 O ILE A 55 -2.181 -4.705 -2.170 1.00 0.00 O ATOM 922 CB ILE A 55 -4.267 -4.147 0.236 1.00 0.00 C ATOM 923 CG1 ILE A 55 -4.866 -3.321 1.376 1.00 0.00 C ATOM 924 CG2 ILE A 55 -4.248 -5.642 0.560 1.00 0.00 C ATOM 925 CD1 ILE A 55 -6.313 -3.735 1.651 1.00 0.00 C ATOM 0 H ILE A 55 -3.764 -2.290 -1.448 1.00 0.00 H new ATOM 0 HA ILE A 55 -2.347 -3.513 0.822 1.00 0.00 H new ATOM 0 HB ILE A 55 -4.913 -4.014 -0.632 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -4.269 -3.453 2.278 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -4.829 -2.262 1.121 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.255 -5.972 0.814 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -3.892 -6.198 -0.307 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -3.583 -5.823 1.405 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -6.715 -3.133 2.466 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -6.913 -3.579 0.754 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.343 -4.788 1.929 1.00 0.00 H new ATOM 937 N LYS A 56 -1.225 -5.407 -0.244 1.00 0.00 N ATOM 938 CA LYS A 56 -0.387 -6.401 -0.893 1.00 0.00 C ATOM 939 C LYS A 56 -0.695 -7.782 -0.309 1.00 0.00 C ATOM 940 O LYS A 56 -0.428 -8.037 0.864 1.00 0.00 O ATOM 941 CB LYS A 56 1.088 -6.007 -0.793 1.00 0.00 C ATOM 942 CG LYS A 56 1.493 -5.101 -1.958 1.00 0.00 C ATOM 943 CD LYS A 56 2.432 -3.989 -1.487 1.00 0.00 C ATOM 944 CE LYS A 56 1.831 -2.610 -1.764 1.00 0.00 C ATOM 945 NZ LYS A 56 2.000 -2.248 -3.189 1.00 0.00 N ATOM 0 H LYS A 56 -1.119 -5.355 0.769 1.00 0.00 H new ATOM 0 HA LYS A 56 -0.609 -6.448 -1.959 1.00 0.00 H new ATOM 0 HB2 LYS A 56 1.268 -5.493 0.151 1.00 0.00 H new ATOM 0 HB3 LYS A 56 1.708 -6.903 -0.792 1.00 0.00 H new ATOM 0 HG2 LYS A 56 1.984 -5.693 -2.730 1.00 0.00 H new ATOM 0 HG3 LYS A 56 0.603 -4.663 -2.409 1.00 0.00 H new ATOM 0 HD2 LYS A 56 2.624 -4.098 -0.420 1.00 0.00 H new ATOM 0 HD3 LYS A 56 3.392 -4.080 -1.995 1.00 0.00 H new ATOM 0 HE2 LYS A 56 0.772 -2.610 -1.506 1.00 0.00 H new ATOM 0 HE3 LYS A 56 2.313 -1.863 -1.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 1.587 -1.309 -3.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 3.013 -2.228 -3.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 1.519 -2.952 -3.785 1.00 0.00 H new ATOM 959 N THR A 57 -1.254 -8.635 -1.155 1.00 0.00 N ATOM 960 CA THR A 57 -1.601 -9.983 -0.737 1.00 0.00 C ATOM 961 C THR A 57 -0.438 -10.940 -1.003 1.00 0.00 C ATOM 962 O THR A 57 0.196 -10.876 -2.055 1.00 0.00 O ATOM 963 CB THR A 57 -2.892 -10.382 -1.454 1.00 0.00 C ATOM 964 OG1 THR A 57 -3.756 -9.265 -1.262 1.00 0.00 O ATOM 965 CG2 THR A 57 -3.616 -11.536 -0.758 1.00 0.00 C ATOM 0 H THR A 57 -1.475 -8.419 -2.127 1.00 0.00 H new ATOM 0 HA THR A 57 -1.780 -10.030 0.337 1.00 0.00 H new ATOM 0 HB THR A 57 -2.663 -10.664 -2.482 1.00 0.00 H new ATOM 0 HG1 THR A 57 -4.617 -9.439 -1.697 1.00 0.00 H new ATOM 0 HG21 THR A 57 -4.525 -11.779 -1.308 1.00 0.00 H new ATOM 0 HG22 THR A 57 -2.965 -12.410 -0.729 1.00 0.00 H new ATOM 0 HG23 THR A 57 -3.875 -11.243 0.259 1.00 0.00 H new ATOM 973 N GLU A 58 -0.192 -11.806 -0.030 1.00 0.00 N ATOM 974 CA GLU A 58 0.884 -12.775 -0.146 1.00 0.00 C ATOM 975 C GLU A 58 0.426 -13.981 -0.969 1.00 0.00 C ATOM 976 O GLU A 58 -0.693 -14.000 -1.479 1.00 0.00 O ATOM 977 CB GLU A 58 1.381 -13.210 1.234 1.00 0.00 C ATOM 978 CG GLU A 58 2.553 -12.340 1.694 1.00 0.00 C ATOM 979 CD GLU A 58 3.851 -12.755 0.999 1.00 0.00 C ATOM 980 OE1 GLU A 58 3.885 -12.654 -0.246 1.00 0.00 O ATOM 981 OE2 GLU A 58 4.779 -13.164 1.728 1.00 0.00 O ATOM 0 H GLU A 58 -0.719 -11.856 0.842 1.00 0.00 H new ATOM 0 HA GLU A 58 1.718 -12.302 -0.664 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.567 -13.141 1.956 1.00 0.00 H new ATOM 0 HB3 GLU A 58 1.690 -14.255 1.201 1.00 0.00 H new ATOM 0 HG2 GLU A 58 2.340 -11.293 1.478 1.00 0.00 H new ATOM 0 HG3 GLU A 58 2.672 -12.425 2.774 1.00 0.00 H new ATOM 988 N TYR A 59 1.315 -14.958 -1.073 1.00 0.00 N ATOM 989 CA TYR A 59 1.016 -16.165 -1.825 1.00 0.00 C ATOM 990 C TYR A 59 0.626 -17.311 -0.890 1.00 0.00 C ATOM 991 O TYR A 59 1.465 -17.834 -0.158 1.00 0.00 O ATOM 992 CB TYR A 59 2.307 -16.537 -2.556 1.00 0.00 C ATOM 993 CG TYR A 59 2.471 -15.855 -3.916 1.00 0.00 C ATOM 994 CD1 TYR A 59 1.826 -16.364 -5.025 1.00 0.00 C ATOM 995 CD2 TYR A 59 3.263 -14.731 -4.033 1.00 0.00 C ATOM 996 CE1 TYR A 59 1.980 -15.722 -6.305 1.00 0.00 C ATOM 997 CE2 TYR A 59 3.416 -14.089 -5.313 1.00 0.00 C ATOM 998 CZ TYR A 59 2.767 -14.616 -6.386 1.00 0.00 C ATOM 999 OH TYR A 59 2.913 -14.010 -7.595 1.00 0.00 O ATOM 0 H TYR A 59 2.243 -14.938 -0.649 1.00 0.00 H new ATOM 0 HA TYR A 59 0.183 -15.995 -2.507 1.00 0.00 H new ATOM 0 HB2 TYR A 59 3.157 -16.277 -1.926 1.00 0.00 H new ATOM 0 HB3 TYR A 59 2.334 -17.617 -2.697 1.00 0.00 H new ATOM 0 HD1 TYR A 59 1.206 -17.243 -4.933 1.00 0.00 H new ATOM 0 HD2 TYR A 59 3.768 -14.333 -3.165 1.00 0.00 H new ATOM 0 HE1 TYR A 59 1.482 -16.110 -7.181 1.00 0.00 H new ATOM 0 HE2 TYR A 59 4.032 -13.209 -5.419 1.00 0.00 H new ATOM 0 HH TYR A 59 3.502 -13.232 -7.502 1.00 0.00 H new ATOM 1009 N GLY A 60 -0.649 -17.669 -0.944 1.00 0.00 N ATOM 1010 CA GLY A 60 -1.161 -18.744 -0.111 1.00 0.00 C ATOM 1011 C GLY A 60 -0.727 -18.564 1.345 1.00 0.00 C ATOM 1012 O GLY A 60 -0.364 -19.531 2.013 1.00 0.00 O ATOM 0 H GLY A 60 -1.343 -17.233 -1.552 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -2.249 -18.767 -0.170 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.801 -19.702 -0.486 1.00 0.00 H new ATOM 1016 N MET A 61 -0.778 -17.318 1.794 1.00 0.00 N ATOM 1017 CA MET A 61 -0.394 -16.999 3.159 1.00 0.00 C ATOM 1018 C MET A 61 -1.569 -16.397 3.932 1.00 0.00 C ATOM 1019 O MET A 61 -1.420 -16.002 5.087 1.00 0.00 O ATOM 1020 CB MET A 61 0.769 -16.005 3.143 1.00 0.00 C ATOM 1021 CG MET A 61 2.021 -16.636 2.531 1.00 0.00 C ATOM 1022 SD MET A 61 3.399 -16.470 3.653 1.00 0.00 S ATOM 1023 CE MET A 61 3.244 -14.744 4.081 1.00 0.00 C ATOM 0 H MET A 61 -1.079 -16.518 1.237 1.00 0.00 H new ATOM 0 HA MET A 61 -0.090 -17.920 3.656 1.00 0.00 H new ATOM 0 HB2 MET A 61 0.488 -15.120 2.573 1.00 0.00 H new ATOM 0 HB3 MET A 61 0.984 -15.674 4.159 1.00 0.00 H new ATOM 0 HG2 MET A 61 1.840 -17.689 2.318 1.00 0.00 H new ATOM 0 HG3 MET A 61 2.254 -16.154 1.582 1.00 0.00 H new ATOM 0 HE1 MET A 61 4.152 -14.215 3.793 1.00 0.00 H new ATOM 0 HE2 MET A 61 2.391 -14.314 3.556 1.00 0.00 H new ATOM 0 HE3 MET A 61 3.094 -14.648 5.156 1.00 0.00 H new ATOM 1033 N GLN A 62 -2.712 -16.346 3.264 1.00 0.00 N ATOM 1034 CA GLN A 62 -3.912 -15.799 3.874 1.00 0.00 C ATOM 1035 C GLN A 62 -3.562 -14.591 4.745 1.00 0.00 C ATOM 1036 O GLN A 62 -3.813 -14.595 5.949 1.00 0.00 O ATOM 1037 CB GLN A 62 -4.649 -16.866 4.687 1.00 0.00 C ATOM 1038 CG GLN A 62 -4.947 -18.098 3.831 1.00 0.00 C ATOM 1039 CD GLN A 62 -5.335 -17.696 2.407 1.00 0.00 C ATOM 1040 OE1 GLN A 62 -4.654 -17.999 1.441 1.00 0.00 O ATOM 1041 NE2 GLN A 62 -6.466 -17.000 2.330 1.00 0.00 N ATOM 0 H GLN A 62 -2.833 -16.675 2.306 1.00 0.00 H new ATOM 0 HA GLN A 62 -4.581 -15.468 3.080 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -4.045 -17.154 5.548 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -5.581 -16.454 5.075 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -4.071 -18.747 3.804 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -5.755 -18.673 4.283 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -6.988 -16.780 3.178 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -6.811 -16.686 1.423 1.00 0.00 H new ATOM 1050 N GLU A 63 -2.987 -13.585 4.102 1.00 0.00 N ATOM 1051 CA GLU A 63 -2.599 -12.373 4.802 1.00 0.00 C ATOM 1052 C GLU A 63 -2.412 -11.223 3.810 1.00 0.00 C ATOM 1053 O GLU A 63 -1.685 -11.359 2.828 1.00 0.00 O ATOM 1054 CB GLU A 63 -1.330 -12.598 5.627 1.00 0.00 C ATOM 1055 CG GLU A 63 -0.903 -11.312 6.338 1.00 0.00 C ATOM 1056 CD GLU A 63 0.616 -11.135 6.285 1.00 0.00 C ATOM 1057 OE1 GLU A 63 1.081 -10.513 5.305 1.00 0.00 O ATOM 1058 OE2 GLU A 63 1.277 -11.626 7.225 1.00 0.00 O ATOM 0 H GLU A 63 -2.781 -13.585 3.103 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.398 -12.104 5.493 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.504 -13.384 6.362 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -0.526 -12.943 4.977 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -1.389 -10.455 5.871 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -1.234 -11.339 7.376 1.00 0.00 H new ATOM 1065 N SER A 64 -3.081 -10.117 4.102 1.00 0.00 N ATOM 1066 CA SER A 64 -2.997 -8.945 3.248 1.00 0.00 C ATOM 1067 C SER A 64 -2.611 -7.719 4.078 1.00 0.00 C ATOM 1068 O SER A 64 -3.234 -7.436 5.101 1.00 0.00 O ATOM 1069 CB SER A 64 -4.320 -8.698 2.520 1.00 0.00 C ATOM 1070 OG SER A 64 -4.861 -9.897 1.974 1.00 0.00 O ATOM 0 H SER A 64 -3.683 -10.008 4.918 1.00 0.00 H new ATOM 0 HA SER A 64 -2.228 -9.124 2.497 1.00 0.00 H new ATOM 0 HB2 SER A 64 -5.038 -8.259 3.212 1.00 0.00 H new ATOM 0 HB3 SER A 64 -4.164 -7.974 1.720 1.00 0.00 H new ATOM 0 HG SER A 64 -5.273 -10.425 2.689 1.00 0.00 H new ATOM 1076 N LYS A 65 -1.585 -7.024 3.608 1.00 0.00 N ATOM 1077 CA LYS A 65 -1.108 -5.836 4.294 1.00 0.00 C ATOM 1078 C LYS A 65 -1.288 -4.620 3.383 1.00 0.00 C ATOM 1079 O LYS A 65 -1.171 -4.731 2.164 1.00 0.00 O ATOM 1080 CB LYS A 65 0.330 -6.036 4.777 1.00 0.00 C ATOM 1081 CG LYS A 65 1.332 -5.527 3.739 1.00 0.00 C ATOM 1082 CD LYS A 65 2.766 -5.644 4.258 1.00 0.00 C ATOM 1083 CE LYS A 65 3.224 -7.104 4.281 1.00 0.00 C ATOM 1084 NZ LYS A 65 3.746 -7.504 2.956 1.00 0.00 N ATOM 0 H LYS A 65 -1.071 -7.262 2.760 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.698 -5.652 5.192 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.478 -5.509 5.719 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.508 -7.093 4.972 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.228 -6.098 2.817 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.113 -4.487 3.496 1.00 0.00 H new ATOM 0 HD2 LYS A 65 3.434 -5.060 3.625 1.00 0.00 H new ATOM 0 HD3 LYS A 65 2.829 -5.224 5.262 1.00 0.00 H new ATOM 0 HE2 LYS A 65 3.997 -7.237 5.038 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.390 -7.749 4.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.052 -8.497 2.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.998 -7.396 2.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 4.555 -6.900 2.705 1.00 0.00 H new ATOM 1098 N GLY A 66 -1.569 -3.487 4.010 1.00 0.00 N ATOM 1099 CA GLY A 66 -1.766 -2.251 3.271 1.00 0.00 C ATOM 1100 C GLY A 66 -1.655 -1.037 4.195 1.00 0.00 C ATOM 1101 O GLY A 66 -2.106 -1.078 5.338 1.00 0.00 O ATOM 0 H GLY A 66 -1.665 -3.399 5.022 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.024 -2.176 2.476 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -2.746 -2.261 2.793 1.00 0.00 H new ATOM 1105 N TYR A 67 -1.051 0.017 3.664 1.00 0.00 N ATOM 1106 CA TYR A 67 -0.875 1.241 4.426 1.00 0.00 C ATOM 1107 C TYR A 67 -2.076 2.173 4.253 1.00 0.00 C ATOM 1108 O TYR A 67 -2.451 2.506 3.130 1.00 0.00 O ATOM 1109 CB TYR A 67 0.369 1.921 3.851 1.00 0.00 C ATOM 1110 CG TYR A 67 1.412 2.304 4.903 1.00 0.00 C ATOM 1111 CD1 TYR A 67 1.052 3.093 5.976 1.00 0.00 C ATOM 1112 CD2 TYR A 67 2.713 1.860 4.778 1.00 0.00 C ATOM 1113 CE1 TYR A 67 2.033 3.453 6.966 1.00 0.00 C ATOM 1114 CE2 TYR A 67 3.694 2.220 5.769 1.00 0.00 C ATOM 1115 CZ TYR A 67 3.306 2.999 6.814 1.00 0.00 C ATOM 1116 OH TYR A 67 4.233 3.339 7.749 1.00 0.00 O ATOM 0 H TYR A 67 -0.678 0.048 2.715 1.00 0.00 H new ATOM 0 HA TYR A 67 -0.777 1.020 5.489 1.00 0.00 H new ATOM 0 HB2 TYR A 67 0.831 1.254 3.123 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.064 2.819 3.313 1.00 0.00 H new ATOM 0 HD1 TYR A 67 0.034 3.441 6.073 1.00 0.00 H new ATOM 0 HD2 TYR A 67 2.995 1.243 3.938 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.764 4.070 7.811 1.00 0.00 H new ATOM 0 HE2 TYR A 67 4.715 1.879 5.684 1.00 0.00 H new ATOM 0 HH TYR A 67 4.502 2.540 8.248 1.00 0.00 H new ATOM 1126 N ALA A 68 -2.648 2.566 5.382 1.00 0.00 N ATOM 1127 CA ALA A 68 -3.799 3.452 5.369 1.00 0.00 C ATOM 1128 C ALA A 68 -3.355 4.864 5.755 1.00 0.00 C ATOM 1129 O ALA A 68 -2.349 5.036 6.442 1.00 0.00 O ATOM 1130 CB ALA A 68 -4.876 2.903 6.307 1.00 0.00 C ATOM 0 H ALA A 68 -2.335 2.287 6.312 1.00 0.00 H new ATOM 0 HA ALA A 68 -4.232 3.504 4.370 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.740 3.568 6.298 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.178 1.910 5.973 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -4.478 2.839 7.320 1.00 0.00 H new ATOM 1136 N LYS A 69 -4.126 5.839 5.296 1.00 0.00 N ATOM 1137 CA LYS A 69 -3.824 7.230 5.584 1.00 0.00 C ATOM 1138 C LYS A 69 -4.999 7.857 6.338 1.00 0.00 C ATOM 1139 O LYS A 69 -6.084 8.015 5.782 1.00 0.00 O ATOM 1140 CB LYS A 69 -3.450 7.975 4.301 1.00 0.00 C ATOM 1141 CG LYS A 69 -2.119 7.467 3.741 1.00 0.00 C ATOM 1142 CD LYS A 69 -1.908 7.953 2.306 1.00 0.00 C ATOM 1143 CE LYS A 69 -2.587 7.016 1.304 1.00 0.00 C ATOM 1144 NZ LYS A 69 -1.686 6.734 0.165 1.00 0.00 N ATOM 0 H LYS A 69 -4.959 5.693 4.727 1.00 0.00 H new ATOM 0 HA LYS A 69 -2.952 7.303 6.233 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.236 7.843 3.557 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -3.379 9.044 4.504 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -1.299 7.813 4.370 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.102 6.377 3.766 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.309 8.961 2.197 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -0.841 8.010 2.091 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.862 6.084 1.797 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -3.510 7.469 0.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -2.197 6.181 -0.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -1.364 7.630 -0.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -0.864 6.192 0.499 1.00 0.00 H new ATOM 1158 N LEU A 70 -4.742 8.196 7.593 1.00 0.00 N ATOM 1159 CA LEU A 70 -5.765 8.802 8.429 1.00 0.00 C ATOM 1160 C LEU A 70 -5.539 10.314 8.488 1.00 0.00 C ATOM 1161 O LEU A 70 -4.466 10.770 8.879 1.00 0.00 O ATOM 1162 CB LEU A 70 -5.800 8.131 9.803 1.00 0.00 C ATOM 1163 CG LEU A 70 -6.597 8.862 10.886 1.00 0.00 C ATOM 1164 CD1 LEU A 70 -8.000 9.215 10.390 1.00 0.00 C ATOM 1165 CD2 LEU A 70 -6.635 8.049 12.181 1.00 0.00 C ATOM 0 H LEU A 70 -3.840 8.063 8.051 1.00 0.00 H new ATOM 0 HA LEU A 70 -6.753 8.644 7.998 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -6.216 7.130 9.686 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -4.775 8.011 10.153 1.00 0.00 H new ATOM 0 HG LEU A 70 -6.089 9.800 11.109 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -8.545 9.734 11.179 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -7.925 9.861 9.516 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -8.531 8.302 10.122 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -7.207 8.591 12.934 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.106 7.085 11.991 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.619 7.891 12.542 1.00 0.00 H new ATOM 1177 N TYR A 71 -6.569 11.050 8.095 1.00 0.00 N ATOM 1178 CA TYR A 71 -6.496 12.501 8.099 1.00 0.00 C ATOM 1179 C TYR A 71 -7.410 13.093 9.174 1.00 0.00 C ATOM 1180 O TYR A 71 -8.269 12.398 9.714 1.00 0.00 O ATOM 1181 CB TYR A 71 -6.991 12.951 6.723 1.00 0.00 C ATOM 1182 CG TYR A 71 -5.988 12.712 5.592 1.00 0.00 C ATOM 1183 CD1 TYR A 71 -5.858 11.454 5.040 1.00 0.00 C ATOM 1184 CD2 TYR A 71 -5.213 13.754 5.125 1.00 0.00 C ATOM 1185 CE1 TYR A 71 -4.914 11.228 3.976 1.00 0.00 C ATOM 1186 CE2 TYR A 71 -4.270 13.529 4.061 1.00 0.00 C ATOM 1187 CZ TYR A 71 -4.166 12.277 3.539 1.00 0.00 C ATOM 1188 OH TYR A 71 -3.275 12.064 2.534 1.00 0.00 O ATOM 0 H TYR A 71 -7.458 10.668 7.772 1.00 0.00 H new ATOM 0 HA TYR A 71 -5.479 12.834 8.308 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -7.917 12.424 6.491 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -7.230 14.014 6.764 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -6.464 10.639 5.406 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -5.314 14.738 5.558 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -4.802 10.248 3.535 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -3.659 14.336 3.685 1.00 0.00 H new ATOM 0 HH TYR A 71 -2.812 12.902 2.324 1.00 0.00 H new ATOM 1198 N GLU A 72 -7.192 14.369 9.453 1.00 0.00 N ATOM 1199 CA GLU A 72 -7.984 15.062 10.455 1.00 0.00 C ATOM 1200 C GLU A 72 -9.175 15.764 9.797 1.00 0.00 C ATOM 1201 O GLU A 72 -10.201 15.984 10.438 1.00 0.00 O ATOM 1202 CB GLU A 72 -7.127 16.057 11.240 1.00 0.00 C ATOM 1203 CG GLU A 72 -6.497 15.391 12.465 1.00 0.00 C ATOM 1204 CD GLU A 72 -6.927 16.095 13.754 1.00 0.00 C ATOM 1205 OE1 GLU A 72 -8.090 15.878 14.157 1.00 0.00 O ATOM 1206 OE2 GLU A 72 -6.083 16.833 14.306 1.00 0.00 O ATOM 0 H GLU A 72 -6.478 14.942 9.003 1.00 0.00 H new ATOM 0 HA GLU A 72 -8.366 14.325 11.162 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.344 16.456 10.595 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.740 16.901 11.556 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.790 14.342 12.504 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.411 15.415 12.378 1.00 0.00 H new ATOM 1213 N ASP A 73 -8.998 16.094 8.526 1.00 0.00 N ATOM 1214 CA ASP A 73 -10.045 16.766 7.775 1.00 0.00 C ATOM 1215 C ASP A 73 -9.998 16.303 6.318 1.00 0.00 C ATOM 1216 O ASP A 73 -8.978 15.792 5.858 1.00 0.00 O ATOM 1217 CB ASP A 73 -9.850 18.283 7.796 1.00 0.00 C ATOM 1218 CG ASP A 73 -10.632 19.021 8.884 1.00 0.00 C ATOM 1219 OD1 ASP A 73 -10.217 18.907 10.058 1.00 0.00 O ATOM 1220 OD2 ASP A 73 -11.628 19.682 8.518 1.00 0.00 O ATOM 0 H ASP A 73 -8.146 15.909 7.997 1.00 0.00 H new ATOM 0 HA ASP A 73 -11.002 16.519 8.235 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -8.789 18.496 7.925 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -10.140 18.685 6.825 1.00 0.00 H new ATOM 1225 N ALA A 74 -11.115 16.498 5.632 1.00 0.00 N ATOM 1226 CA ALA A 74 -11.214 16.107 4.236 1.00 0.00 C ATOM 1227 C ALA A 74 -10.606 17.204 3.359 1.00 0.00 C ATOM 1228 O ALA A 74 -9.915 16.912 2.385 1.00 0.00 O ATOM 1229 CB ALA A 74 -12.677 15.825 3.888 1.00 0.00 C ATOM 0 H ALA A 74 -11.959 16.922 6.017 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.653 15.191 4.053 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -12.752 15.532 2.841 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -13.052 15.019 4.518 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -13.271 16.723 4.056 1.00 0.00 H new ATOM 1235 N ASP A 75 -10.886 18.442 3.737 1.00 0.00 N ATOM 1236 CA ASP A 75 -10.376 19.584 2.997 1.00 0.00 C ATOM 1237 C ASP A 75 -8.857 19.460 2.861 1.00 0.00 C ATOM 1238 O ASP A 75 -8.315 19.595 1.765 1.00 0.00 O ATOM 1239 CB ASP A 75 -10.679 20.894 3.727 1.00 0.00 C ATOM 1240 CG ASP A 75 -11.368 21.963 2.877 1.00 0.00 C ATOM 1241 OD1 ASP A 75 -10.689 22.492 1.971 1.00 0.00 O ATOM 1242 OD2 ASP A 75 -12.559 22.227 3.152 1.00 0.00 O ATOM 0 H ASP A 75 -11.460 18.680 4.546 1.00 0.00 H new ATOM 0 HA ASP A 75 -10.859 19.596 2.020 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -11.309 20.675 4.589 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -9.744 21.303 4.111 1.00 0.00 H new ATOM 1247 N ARG A 76 -8.212 19.203 3.990 1.00 0.00 N ATOM 1248 CA ARG A 76 -6.767 19.060 4.010 1.00 0.00 C ATOM 1249 C ARG A 76 -6.325 17.995 3.003 1.00 0.00 C ATOM 1250 O ARG A 76 -5.447 18.242 2.178 1.00 0.00 O ATOM 1251 CB ARG A 76 -6.271 18.671 5.404 1.00 0.00 C ATOM 1252 CG ARG A 76 -5.657 19.873 6.123 1.00 0.00 C ATOM 1253 CD ARG A 76 -6.628 21.056 6.142 1.00 0.00 C ATOM 1254 NE ARG A 76 -7.227 21.197 7.487 1.00 0.00 N ATOM 1255 CZ ARG A 76 -6.626 21.808 8.517 1.00 0.00 C ATOM 1256 NH1 ARG A 76 -5.405 22.338 8.362 1.00 0.00 N ATOM 1257 NH2 ARG A 76 -7.246 21.889 9.703 1.00 0.00 N ATOM 0 H ARG A 76 -8.664 19.090 4.897 1.00 0.00 H new ATOM 0 HA ARG A 76 -6.335 20.023 3.739 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -7.100 18.276 5.991 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.531 17.875 5.321 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -5.396 19.596 7.144 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -4.732 20.165 5.626 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -6.103 21.972 5.871 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -7.412 20.906 5.400 1.00 0.00 H new ATOM 0 HE ARG A 76 -8.156 20.804 7.640 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -4.933 22.276 7.460 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -4.948 22.803 9.146 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -8.175 21.485 9.821 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -6.788 22.354 10.487 1.00 0.00 H new ATOM 1271 N MET A 77 -6.954 16.833 3.105 1.00 0.00 N ATOM 1272 CA MET A 77 -6.637 15.730 2.214 1.00 0.00 C ATOM 1273 C MET A 77 -6.667 16.180 0.752 1.00 0.00 C ATOM 1274 O MET A 77 -5.821 15.774 -0.043 1.00 0.00 O ATOM 1275 CB MET A 77 -7.647 14.600 2.422 1.00 0.00 C ATOM 1276 CG MET A 77 -7.413 13.465 1.422 1.00 0.00 C ATOM 1277 SD MET A 77 -7.510 11.889 2.254 1.00 0.00 S ATOM 1278 CE MET A 77 -9.262 11.824 2.591 1.00 0.00 C ATOM 0 H MET A 77 -7.681 16.632 3.791 1.00 0.00 H new ATOM 0 HA MET A 77 -5.632 15.378 2.445 1.00 0.00 H new ATOM 0 HB2 MET A 77 -7.565 14.216 3.439 1.00 0.00 H new ATOM 0 HB3 MET A 77 -8.660 14.987 2.308 1.00 0.00 H new ATOM 0 HG2 MET A 77 -8.156 13.512 0.626 1.00 0.00 H new ATOM 0 HG3 MET A 77 -6.436 13.578 0.953 1.00 0.00 H new ATOM 0 HE1 MET A 77 -9.482 10.950 3.204 1.00 0.00 H new ATOM 0 HE2 MET A 77 -9.564 12.726 3.123 1.00 0.00 H new ATOM 0 HE3 MET A 77 -9.811 11.756 1.652 1.00 0.00 H new ATOM 1288 N LYS A 78 -7.650 17.013 0.443 1.00 0.00 N ATOM 1289 CA LYS A 78 -7.801 17.522 -0.909 1.00 0.00 C ATOM 1290 C LYS A 78 -6.603 18.410 -1.252 1.00 0.00 C ATOM 1291 O LYS A 78 -5.890 18.150 -2.221 1.00 0.00 O ATOM 1292 CB LYS A 78 -9.151 18.223 -1.070 1.00 0.00 C ATOM 1293 CG LYS A 78 -10.303 17.286 -0.700 1.00 0.00 C ATOM 1294 CD LYS A 78 -11.524 17.542 -1.585 1.00 0.00 C ATOM 1295 CE LYS A 78 -12.184 16.226 -2.003 1.00 0.00 C ATOM 1296 NZ LYS A 78 -12.543 16.260 -3.439 1.00 0.00 N ATOM 0 H LYS A 78 -8.349 17.348 1.106 1.00 0.00 H new ATOM 0 HA LYS A 78 -7.806 16.701 -1.626 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.182 19.110 -0.438 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -9.269 18.561 -2.100 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -9.982 16.250 -0.807 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -10.571 17.430 0.347 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -12.244 18.159 -1.048 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -11.224 18.100 -2.472 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -11.505 15.395 -1.811 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -13.077 16.053 -1.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -12.990 15.360 -3.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -13.207 17.041 -3.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -11.684 16.403 -4.008 1.00 0.00 H new ATOM 1310 N GLN A 79 -6.418 19.439 -0.439 1.00 0.00 N ATOM 1311 CA GLN A 79 -5.318 20.367 -0.645 1.00 0.00 C ATOM 1312 C GLN A 79 -3.984 19.619 -0.633 1.00 0.00 C ATOM 1313 O GLN A 79 -3.026 20.041 -1.279 1.00 0.00 O ATOM 1314 CB GLN A 79 -5.334 21.477 0.408 1.00 0.00 C ATOM 1315 CG GLN A 79 -6.345 22.565 0.042 1.00 0.00 C ATOM 1316 CD GLN A 79 -6.663 23.447 1.252 1.00 0.00 C ATOM 1317 OE1 GLN A 79 -6.352 24.626 1.292 1.00 0.00 O ATOM 1318 NE2 GLN A 79 -7.300 22.812 2.232 1.00 0.00 N ATOM 0 H GLN A 79 -7.011 19.651 0.364 1.00 0.00 H new ATOM 0 HA GLN A 79 -5.441 20.836 -1.622 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -5.584 21.056 1.382 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -4.339 21.914 0.496 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -5.947 23.179 -0.766 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -7.261 22.105 -0.328 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -7.531 21.823 2.134 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -7.558 23.314 3.082 1.00 0.00 H new ATOM 1327 N VAL A 80 -3.964 18.521 0.108 1.00 0.00 N ATOM 1328 CA VAL A 80 -2.762 17.710 0.212 1.00 0.00 C ATOM 1329 C VAL A 80 -2.564 16.931 -1.089 1.00 0.00 C ATOM 1330 O VAL A 80 -1.497 16.994 -1.698 1.00 0.00 O ATOM 1331 CB VAL A 80 -2.846 16.806 1.444 1.00 0.00 C ATOM 1332 CG1 VAL A 80 -1.635 15.875 1.524 1.00 0.00 C ATOM 1333 CG2 VAL A 80 -2.988 17.633 2.723 1.00 0.00 C ATOM 0 H VAL A 80 -4.761 18.174 0.642 1.00 0.00 H new ATOM 0 HA VAL A 80 -1.885 18.342 0.349 1.00 0.00 H new ATOM 0 HB VAL A 80 -3.738 16.187 1.345 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -1.719 15.243 2.408 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -1.598 15.248 0.633 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.723 16.469 1.588 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -3.046 16.966 3.583 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -2.124 18.289 2.830 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -3.896 18.234 2.669 1.00 0.00 H new ATOM 1343 N GLU A 81 -3.608 16.214 -1.478 1.00 0.00 N ATOM 1344 CA GLU A 81 -3.562 15.423 -2.696 1.00 0.00 C ATOM 1345 C GLU A 81 -3.544 16.338 -3.922 1.00 0.00 C ATOM 1346 O GLU A 81 -3.381 15.870 -5.048 1.00 0.00 O ATOM 1347 CB GLU A 81 -4.736 14.444 -2.759 1.00 0.00 C ATOM 1348 CG GLU A 81 -4.264 13.048 -3.170 1.00 0.00 C ATOM 1349 CD GLU A 81 -4.290 12.886 -4.691 1.00 0.00 C ATOM 1350 OE1 GLU A 81 -3.375 13.442 -5.337 1.00 0.00 O ATOM 1351 OE2 GLU A 81 -5.224 12.210 -5.174 1.00 0.00 O ATOM 0 H GLU A 81 -4.492 16.164 -0.971 1.00 0.00 H new ATOM 0 HA GLU A 81 -2.643 14.837 -2.691 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -5.226 14.395 -1.786 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -5.478 14.805 -3.471 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -3.253 12.879 -2.800 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -4.902 12.294 -2.709 1.00 0.00 H new ATOM 1358 N GLN A 82 -3.714 17.626 -3.662 1.00 0.00 N ATOM 1359 CA GLN A 82 -3.719 18.611 -4.731 1.00 0.00 C ATOM 1360 C GLN A 82 -2.289 18.914 -5.180 1.00 0.00 C ATOM 1361 O GLN A 82 -2.077 19.714 -6.091 1.00 0.00 O ATOM 1362 CB GLN A 82 -4.440 19.889 -4.295 1.00 0.00 C ATOM 1363 CG GLN A 82 -5.761 20.056 -5.047 1.00 0.00 C ATOM 1364 CD GLN A 82 -6.530 21.278 -4.540 1.00 0.00 C ATOM 1365 OE1 GLN A 82 -6.368 22.389 -5.019 1.00 0.00 O ATOM 1366 NE2 GLN A 82 -7.372 21.013 -3.546 1.00 0.00 N ATOM 0 H GLN A 82 -3.849 18.010 -2.727 1.00 0.00 H new ATOM 0 HA GLN A 82 -4.265 18.196 -5.579 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -4.630 19.856 -3.222 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -3.801 20.752 -4.479 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -5.565 20.162 -6.114 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -6.370 19.161 -4.922 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -7.459 20.060 -3.192 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -7.931 21.762 -3.138 1.00 0.00 H new ATOM 1375 N GLU A 83 -1.344 18.260 -4.521 1.00 0.00 N ATOM 1376 CA GLU A 83 0.061 18.450 -4.842 1.00 0.00 C ATOM 1377 C GLU A 83 0.504 17.441 -5.903 1.00 0.00 C ATOM 1378 O GLU A 83 1.389 17.729 -6.707 1.00 0.00 O ATOM 1379 CB GLU A 83 0.929 18.342 -3.587 1.00 0.00 C ATOM 1380 CG GLU A 83 1.140 16.879 -3.190 1.00 0.00 C ATOM 1381 CD GLU A 83 2.023 16.770 -1.945 1.00 0.00 C ATOM 1382 OE1 GLU A 83 1.533 17.169 -0.866 1.00 0.00 O ATOM 1383 OE2 GLU A 83 3.167 16.292 -2.100 1.00 0.00 O ATOM 0 H GLU A 83 -1.523 17.598 -3.766 1.00 0.00 H new ATOM 0 HA GLU A 83 0.189 19.454 -5.247 1.00 0.00 H new ATOM 0 HB2 GLU A 83 1.894 18.817 -3.766 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.456 18.881 -2.766 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.176 16.408 -2.999 1.00 0.00 H new ATOM 0 HG3 GLU A 83 1.601 16.337 -4.016 1.00 0.00 H new ATOM 1390 N TYR A 84 -0.133 16.279 -5.872 1.00 0.00 N ATOM 1391 CA TYR A 84 0.185 15.226 -6.822 1.00 0.00 C ATOM 1392 C TYR A 84 -0.699 15.326 -8.067 1.00 0.00 C ATOM 1393 O TYR A 84 -0.947 14.326 -8.739 1.00 0.00 O ATOM 1394 CB TYR A 84 -0.113 13.908 -6.105 1.00 0.00 C ATOM 1395 CG TYR A 84 0.972 12.843 -6.285 1.00 0.00 C ATOM 1396 CD1 TYR A 84 1.002 12.076 -7.431 1.00 0.00 C ATOM 1397 CD2 TYR A 84 1.919 12.650 -5.300 1.00 0.00 C ATOM 1398 CE1 TYR A 84 2.022 11.075 -7.601 1.00 0.00 C ATOM 1399 CE2 TYR A 84 2.940 11.649 -5.469 1.00 0.00 C ATOM 1400 CZ TYR A 84 2.941 10.910 -6.611 1.00 0.00 C ATOM 1401 OH TYR A 84 3.905 9.964 -6.771 1.00 0.00 O ATOM 0 H TYR A 84 -0.867 16.044 -5.204 1.00 0.00 H new ATOM 0 HA TYR A 84 1.223 15.301 -7.145 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -0.241 14.106 -5.041 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -1.060 13.513 -6.472 1.00 0.00 H new ATOM 0 HD1 TYR A 84 0.260 12.227 -8.201 1.00 0.00 H new ATOM 0 HD2 TYR A 84 1.894 13.250 -4.402 1.00 0.00 H new ATOM 0 HE1 TYR A 84 2.057 10.469 -8.494 1.00 0.00 H new ATOM 0 HE2 TYR A 84 3.688 11.489 -4.707 1.00 0.00 H new ATOM 0 HH TYR A 84 4.492 9.959 -5.986 1.00 0.00 H new ATOM 1411 N VAL A 85 -1.150 16.542 -8.337 1.00 0.00 N ATOM 1412 CA VAL A 85 -2.001 16.786 -9.490 1.00 0.00 C ATOM 1413 C VAL A 85 -1.194 17.511 -10.569 1.00 0.00 C ATOM 1414 O VAL A 85 -0.048 17.155 -10.836 1.00 0.00 O ATOM 1415 CB VAL A 85 -3.253 17.553 -9.063 1.00 0.00 C ATOM 1416 CG1 VAL A 85 -4.380 17.375 -10.082 1.00 0.00 C ATOM 1417 CG2 VAL A 85 -3.707 17.129 -7.664 1.00 0.00 C ATOM 0 H VAL A 85 -0.942 17.369 -7.777 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.344 15.844 -9.918 1.00 0.00 H new ATOM 0 HB VAL A 85 -2.999 18.612 -9.026 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.258 17.931 -9.754 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -4.055 17.750 -11.053 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -4.630 16.318 -10.167 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -4.599 17.690 -7.385 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -3.934 16.063 -7.663 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -2.912 17.332 -6.946 1.00 0.00 H new ATOM 1427 N LEU A 86 -1.826 18.515 -11.160 1.00 0.00 N ATOM 1428 CA LEU A 86 -1.181 19.293 -12.205 1.00 0.00 C ATOM 1429 C LEU A 86 0.283 19.530 -11.828 1.00 0.00 C ATOM 1430 O LEU A 86 0.584 20.394 -11.007 1.00 0.00 O ATOM 1431 CB LEU A 86 -1.963 20.580 -12.473 1.00 0.00 C ATOM 1432 CG LEU A 86 -2.776 20.613 -13.769 1.00 0.00 C ATOM 1433 CD1 LEU A 86 -3.294 22.024 -14.056 1.00 0.00 C ATOM 1434 CD2 LEU A 86 -1.966 20.051 -14.939 1.00 0.00 C ATOM 0 H LEU A 86 -2.777 18.807 -10.935 1.00 0.00 H new ATOM 0 HA LEU A 86 -1.183 18.744 -13.146 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -2.642 20.750 -11.637 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.260 21.413 -12.487 1.00 0.00 H new ATOM 0 HG LEU A 86 -3.647 19.970 -13.642 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.868 22.019 -14.982 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.932 22.351 -13.235 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -2.451 22.708 -14.155 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.567 20.086 -15.848 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -1.064 20.648 -15.077 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -1.689 19.018 -14.727 1.00 0.00 H new ATOM 1446 N LYS A 87 1.154 18.746 -12.447 1.00 0.00 N ATOM 1447 CA LYS A 87 2.579 18.859 -12.188 1.00 0.00 C ATOM 1448 C LYS A 87 3.334 18.888 -13.518 1.00 0.00 C ATOM 1449 O LYS A 87 2.901 18.279 -14.495 1.00 0.00 O ATOM 1450 CB LYS A 87 3.041 17.750 -11.241 1.00 0.00 C ATOM 1451 CG LYS A 87 2.790 16.369 -11.850 1.00 0.00 C ATOM 1452 CD LYS A 87 3.827 15.357 -11.361 1.00 0.00 C ATOM 1453 CE LYS A 87 5.178 15.583 -12.042 1.00 0.00 C ATOM 1454 NZ LYS A 87 5.671 14.324 -12.645 1.00 0.00 N ATOM 0 H LYS A 87 0.900 18.030 -13.127 1.00 0.00 H new ATOM 0 HA LYS A 87 2.800 19.795 -11.676 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.103 17.869 -11.026 1.00 0.00 H new ATOM 0 HB3 LYS A 87 2.513 17.834 -10.291 1.00 0.00 H new ATOM 0 HG2 LYS A 87 1.790 16.027 -11.584 1.00 0.00 H new ATOM 0 HG3 LYS A 87 2.826 16.435 -12.937 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.942 15.442 -10.280 1.00 0.00 H new ATOM 0 HD3 LYS A 87 3.477 14.345 -11.566 1.00 0.00 H new ATOM 0 HE2 LYS A 87 5.080 16.348 -12.812 1.00 0.00 H new ATOM 0 HE3 LYS A 87 5.901 15.953 -11.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 6.589 14.495 -13.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 5.783 13.604 -11.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 4.988 13.988 -13.353 1.00 0.00 H new ATOM 1468 N ARG A 88 4.451 19.601 -13.512 1.00 0.00 N ATOM 1469 CA ARG A 88 5.271 19.716 -14.706 1.00 0.00 C ATOM 1470 C ARG A 88 6.736 19.939 -14.325 1.00 0.00 C ATOM 1471 O ARG A 88 7.058 20.093 -13.148 1.00 0.00 O ATOM 1472 CB ARG A 88 4.799 20.874 -15.589 1.00 0.00 C ATOM 1473 CG ARG A 88 4.447 20.384 -16.994 1.00 0.00 C ATOM 1474 CD ARG A 88 4.702 21.475 -18.036 1.00 0.00 C ATOM 1475 NE ARG A 88 3.533 21.599 -18.936 1.00 0.00 N ATOM 1476 CZ ARG A 88 3.491 22.405 -20.005 1.00 0.00 C ATOM 1477 NH1 ARG A 88 4.552 23.163 -20.315 1.00 0.00 N ATOM 1478 NH2 ARG A 88 2.388 22.453 -20.765 1.00 0.00 N ATOM 0 H ARG A 88 4.807 20.105 -12.700 1.00 0.00 H new ATOM 0 HA ARG A 88 5.175 18.785 -15.265 1.00 0.00 H new ATOM 0 HB2 ARG A 88 3.928 21.349 -15.137 1.00 0.00 H new ATOM 0 HB3 ARG A 88 5.580 21.632 -15.649 1.00 0.00 H new ATOM 0 HG2 ARG A 88 5.040 19.501 -17.234 1.00 0.00 H new ATOM 0 HG3 ARG A 88 3.400 20.083 -17.026 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.891 22.427 -17.539 1.00 0.00 H new ATOM 0 HD3 ARG A 88 5.593 21.235 -18.615 1.00 0.00 H new ATOM 0 HE ARG A 88 2.708 21.036 -18.729 1.00 0.00 H new ATOM 0 HH11 ARG A 88 5.392 23.126 -19.737 1.00 0.00 H new ATOM 0 HH12 ARG A 88 4.520 23.777 -21.129 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.581 21.876 -20.529 1.00 0.00 H new ATOM 0 HH22 ARG A 88 2.356 23.067 -21.579 1.00 0.00 H new ATOM 1492 N ASN A 89 7.584 19.947 -15.342 1.00 0.00 N ATOM 1493 CA ASN A 89 9.007 20.148 -15.128 1.00 0.00 C ATOM 1494 C ASN A 89 9.645 20.665 -16.420 1.00 0.00 C ATOM 1495 O ASN A 89 10.691 20.172 -16.840 1.00 0.00 O ATOM 1496 CB ASN A 89 9.698 18.836 -14.752 1.00 0.00 C ATOM 1497 CG ASN A 89 8.900 18.082 -13.687 1.00 0.00 C ATOM 1498 OD1 ASN A 89 8.984 18.356 -12.501 1.00 0.00 O ATOM 1499 ND2 ASN A 89 8.123 17.119 -14.174 1.00 0.00 N ATOM 0 H ASN A 89 7.313 19.818 -16.317 1.00 0.00 H new ATOM 0 HA ASN A 89 9.128 20.865 -14.316 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.808 18.212 -15.639 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.702 19.043 -14.381 1.00 0.00 H new ATOM 0 HD21 ASN A 89 7.550 16.558 -13.543 1.00 0.00 H new ATOM 0 HD22 ASN A 89 8.099 16.942 -15.178 1.00 0.00 H new ATOM 1506 N ALA A 90 8.988 21.651 -17.013 1.00 0.00 N ATOM 1507 CA ALA A 90 9.478 22.240 -18.248 1.00 0.00 C ATOM 1508 C ALA A 90 8.726 23.545 -18.519 1.00 0.00 C ATOM 1509 O ALA A 90 7.497 23.559 -18.563 1.00 0.00 O ATOM 1510 CB ALA A 90 9.327 21.232 -19.389 1.00 0.00 C ATOM 0 H ALA A 90 8.121 22.057 -16.661 1.00 0.00 H new ATOM 0 HA ALA A 90 10.538 22.482 -18.164 1.00 0.00 H new ATOM 0 HB1 ALA A 90 9.694 21.673 -20.315 1.00 0.00 H new ATOM 0 HB2 ALA A 90 9.903 20.335 -19.161 1.00 0.00 H new ATOM 0 HB3 ALA A 90 8.276 20.968 -19.505 1.00 0.00 H new ATOM 1516 N VAL A 91 9.497 24.609 -18.693 1.00 0.00 N ATOM 1517 CA VAL A 91 8.919 25.915 -18.958 1.00 0.00 C ATOM 1518 C VAL A 91 7.897 25.796 -20.091 1.00 0.00 C ATOM 1519 O VAL A 91 8.175 25.182 -21.120 1.00 0.00 O ATOM 1520 CB VAL A 91 10.027 26.927 -19.257 1.00 0.00 C ATOM 1521 CG1 VAL A 91 10.283 27.031 -20.761 1.00 0.00 C ATOM 1522 CG2 VAL A 91 9.695 28.296 -18.660 1.00 0.00 C ATOM 0 H VAL A 91 10.516 24.593 -18.656 1.00 0.00 H new ATOM 0 HA VAL A 91 8.389 26.283 -18.079 1.00 0.00 H new ATOM 0 HB VAL A 91 10.943 26.570 -18.786 1.00 0.00 H new ATOM 0 HG11 VAL A 91 11.075 27.757 -20.946 1.00 0.00 H new ATOM 0 HG12 VAL A 91 10.586 26.058 -21.147 1.00 0.00 H new ATOM 0 HG13 VAL A 91 9.371 27.353 -21.264 1.00 0.00 H new ATOM 0 HG21 VAL A 91 10.499 28.997 -18.887 1.00 0.00 H new ATOM 0 HG22 VAL A 91 8.762 28.663 -19.088 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.587 28.205 -17.579 1.00 0.00 H new ATOM 1532 N PRO A 92 6.706 26.409 -19.857 1.00 0.00 N ATOM 1533 CA PRO A 92 5.642 26.377 -20.846 1.00 0.00 C ATOM 1534 C PRO A 92 5.943 27.328 -22.007 1.00 0.00 C ATOM 1535 O PRO A 92 7.069 27.801 -22.150 1.00 0.00 O ATOM 1536 CB PRO A 92 4.383 26.753 -20.082 1.00 0.00 C ATOM 1537 CG PRO A 92 4.857 27.431 -18.806 1.00 0.00 C ATOM 1538 CD PRO A 92 6.342 27.145 -18.651 1.00 0.00 C ATOM 0 HA PRO A 92 5.531 25.398 -21.313 1.00 0.00 H new ATOM 0 HB2 PRO A 92 3.755 27.422 -20.670 1.00 0.00 H new ATOM 0 HB3 PRO A 92 3.785 25.870 -19.856 1.00 0.00 H new ATOM 0 HG2 PRO A 92 4.678 28.505 -18.855 1.00 0.00 H new ATOM 0 HG3 PRO A 92 4.304 27.055 -17.945 1.00 0.00 H new ATOM 0 HD2 PRO A 92 6.916 28.068 -18.562 1.00 0.00 H new ATOM 0 HD3 PRO A 92 6.541 26.558 -17.754 1.00 0.00 H new ATOM 1546 N GLY A 93 4.916 27.579 -22.805 1.00 0.00 N ATOM 1547 CA GLY A 93 5.057 28.465 -23.948 1.00 0.00 C ATOM 1548 C GLY A 93 5.341 29.900 -23.499 1.00 0.00 C ATOM 1549 O GLY A 93 6.280 30.142 -22.742 1.00 0.00 O ATOM 0 H GLY A 93 3.983 27.185 -22.683 1.00 0.00 H new ATOM 0 HA2 GLY A 93 5.867 28.113 -24.587 1.00 0.00 H new ATOM 0 HA3 GLY A 93 4.146 28.441 -24.546 1.00 0.00 H new ATOM 1553 N SER A 94 4.512 30.813 -23.984 1.00 0.00 N ATOM 1554 CA SER A 94 4.663 32.217 -23.641 1.00 0.00 C ATOM 1555 C SER A 94 3.292 32.896 -23.603 1.00 0.00 C ATOM 1556 O SER A 94 2.333 32.337 -23.074 1.00 0.00 O ATOM 1557 CB SER A 94 5.582 32.931 -24.635 1.00 0.00 C ATOM 1558 OG SER A 94 5.981 34.215 -24.164 1.00 0.00 O ATOM 0 H SER A 94 3.734 30.608 -24.611 1.00 0.00 H new ATOM 0 HA SER A 94 5.121 32.281 -22.654 1.00 0.00 H new ATOM 0 HB2 SER A 94 6.466 32.320 -24.815 1.00 0.00 H new ATOM 0 HB3 SER A 94 5.069 33.038 -25.591 1.00 0.00 H new ATOM 0 HG SER A 94 6.568 34.638 -24.825 1.00 0.00 H new ATOM 1564 N GLU A 95 3.244 34.092 -24.172 1.00 0.00 N ATOM 1565 CA GLU A 95 2.007 34.853 -24.210 1.00 0.00 C ATOM 1566 C GLU A 95 1.667 35.383 -22.816 1.00 0.00 C ATOM 1567 O GLU A 95 1.865 34.690 -21.819 1.00 0.00 O ATOM 1568 CB GLU A 95 0.861 34.009 -24.771 1.00 0.00 C ATOM 1569 CG GLU A 95 -0.355 34.880 -25.093 1.00 0.00 C ATOM 1570 CD GLU A 95 -0.538 35.027 -26.605 1.00 0.00 C ATOM 1571 OE1 GLU A 95 -1.163 34.118 -27.193 1.00 0.00 O ATOM 1572 OE2 GLU A 95 -0.049 36.046 -27.140 1.00 0.00 O ATOM 0 H GLU A 95 4.042 34.552 -24.610 1.00 0.00 H new ATOM 0 HA GLU A 95 2.147 35.704 -24.876 1.00 0.00 H new ATOM 0 HB2 GLU A 95 1.192 33.493 -25.672 1.00 0.00 H new ATOM 0 HB3 GLU A 95 0.582 33.242 -24.049 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -1.250 34.437 -24.656 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -0.232 35.864 -24.640 1.00 0.00 H new ATOM 1579 N THR A 96 1.159 36.606 -22.790 1.00 0.00 N ATOM 1580 CA THR A 96 0.790 37.237 -21.534 1.00 0.00 C ATOM 1581 C THR A 96 -0.686 37.639 -21.553 1.00 0.00 C ATOM 1582 O THR A 96 -1.513 36.952 -22.152 1.00 0.00 O ATOM 1583 CB THR A 96 1.737 38.416 -21.300 1.00 0.00 C ATOM 1584 OG1 THR A 96 1.328 38.945 -20.042 1.00 0.00 O ATOM 1585 CG2 THR A 96 1.498 39.564 -22.283 1.00 0.00 C ATOM 0 H THR A 96 0.994 37.177 -23.619 1.00 0.00 H new ATOM 0 HA THR A 96 0.896 36.545 -20.698 1.00 0.00 H new ATOM 0 HB THR A 96 2.769 38.075 -21.385 1.00 0.00 H new ATOM 0 HG1 THR A 96 1.341 39.924 -20.079 1.00 0.00 H new ATOM 0 HG21 THR A 96 2.196 40.374 -22.073 1.00 0.00 H new ATOM 0 HG22 THR A 96 1.651 39.208 -23.302 1.00 0.00 H new ATOM 0 HG23 THR A 96 0.476 39.928 -22.175 1.00 0.00 H new ATOM 1593 N GLU A 97 -0.973 38.750 -20.891 1.00 0.00 N ATOM 1594 CA GLU A 97 -2.335 39.251 -20.824 1.00 0.00 C ATOM 1595 C GLU A 97 -2.335 40.779 -20.741 1.00 0.00 C ATOM 1596 O GLU A 97 -1.454 41.370 -20.118 1.00 0.00 O ATOM 1597 CB GLU A 97 -3.088 38.637 -19.642 1.00 0.00 C ATOM 1598 CG GLU A 97 -4.601 38.689 -19.869 1.00 0.00 C ATOM 1599 CD GLU A 97 -5.247 39.775 -19.005 1.00 0.00 C ATOM 1600 OE1 GLU A 97 -5.322 39.553 -17.777 1.00 0.00 O ATOM 1601 OE2 GLU A 97 -5.651 40.801 -19.593 1.00 0.00 O ATOM 0 H GLU A 97 -0.285 39.318 -20.396 1.00 0.00 H new ATOM 0 HA GLU A 97 -2.855 38.956 -21.735 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -2.773 37.603 -19.503 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -2.835 39.173 -18.727 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -4.808 38.885 -20.921 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -5.042 37.721 -19.632 1.00 0.00 H new ATOM 1608 N GLY A 98 -3.334 41.374 -21.376 1.00 0.00 N ATOM 1609 CA GLY A 98 -3.460 42.822 -21.381 1.00 0.00 C ATOM 1610 C GLY A 98 -3.505 43.363 -22.812 1.00 0.00 C ATOM 1611 O GLY A 98 -2.560 43.180 -23.578 1.00 0.00 O ATOM 0 H GLY A 98 -4.063 40.880 -21.890 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -4.366 43.114 -20.849 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -2.620 43.266 -20.847 1.00 0.00 H new ATOM 1615 N GLU A 99 -4.612 44.018 -23.128 1.00 0.00 N ATOM 1616 CA GLU A 99 -4.792 44.587 -24.453 1.00 0.00 C ATOM 1617 C GLU A 99 -6.087 45.400 -24.510 1.00 0.00 C ATOM 1618 O GLU A 99 -7.104 44.995 -23.950 1.00 0.00 O ATOM 1619 CB GLU A 99 -4.783 43.495 -25.525 1.00 0.00 C ATOM 1620 CG GLU A 99 -4.411 44.072 -26.892 1.00 0.00 C ATOM 1621 CD GLU A 99 -3.427 43.157 -27.624 1.00 0.00 C ATOM 1622 OE1 GLU A 99 -2.567 42.576 -26.927 1.00 0.00 O ATOM 1623 OE2 GLU A 99 -3.557 43.059 -28.863 1.00 0.00 O ATOM 0 H GLU A 99 -5.393 44.168 -22.490 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.956 45.256 -24.656 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -4.072 42.716 -25.250 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -5.765 43.026 -25.579 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -5.311 44.200 -27.494 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -3.969 45.060 -26.766 1.00 0.00 H new ATOM 1630 N GLU A 100 -6.006 46.534 -25.191 1.00 0.00 N ATOM 1631 CA GLU A 100 -7.159 47.408 -25.328 1.00 0.00 C ATOM 1632 C GLU A 100 -6.809 48.615 -26.201 1.00 0.00 C ATOM 1633 O GLU A 100 -5.911 49.387 -25.868 1.00 0.00 O ATOM 1634 CB GLU A 100 -7.676 47.853 -23.958 1.00 0.00 C ATOM 1635 CG GLU A 100 -9.021 48.571 -24.086 1.00 0.00 C ATOM 1636 CD GLU A 100 -10.182 47.614 -23.810 1.00 0.00 C ATOM 1637 OE1 GLU A 100 -10.316 47.209 -22.635 1.00 0.00 O ATOM 1638 OE2 GLU A 100 -10.909 47.309 -24.780 1.00 0.00 O ATOM 0 H GLU A 100 -5.160 46.868 -25.654 1.00 0.00 H new ATOM 0 HA GLU A 100 -7.958 46.850 -25.817 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -7.783 46.986 -23.307 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -6.949 48.516 -23.489 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -9.059 49.406 -23.387 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -9.120 48.989 -25.088 1.00 0.00 H new ATOM 1645 N ALA A 101 -7.537 48.741 -27.301 1.00 0.00 N ATOM 1646 CA ALA A 101 -7.315 49.841 -28.224 1.00 0.00 C ATOM 1647 C ALA A 101 -8.299 49.729 -29.390 1.00 0.00 C ATOM 1648 O ALA A 101 -8.081 48.952 -30.318 1.00 0.00 O ATOM 1649 CB ALA A 101 -5.857 49.831 -28.688 1.00 0.00 C ATOM 0 H ALA A 101 -8.281 48.099 -27.574 1.00 0.00 H new ATOM 0 HA ALA A 101 -7.494 50.797 -27.732 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -5.690 50.656 -29.380 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -5.200 49.942 -27.825 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -5.641 48.887 -29.189 1.00 0.00 H new TER 1655 ALA A 101