USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 992 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 125 ASN : amide:sc= 0.756 K(o=1.5,f=-2.7) USER MOD Set 1.2: A 129 LYS NZ :NH3+ 143:sc= 0.716 (180deg=0) USER MOD Set 2.1: A 33 THR OG1 : rot 164:sc= 0.813 USER MOD Set 2.2: A 73 TYR OH : rot -167:sc= 1.8 USER MOD Set 3.1: A 16 GLN : amide:sc= 2.14 K(o=1.3,f=-2) USER MOD Set 3.2: A 60 GLN : amide:sc= -0.814 K(o=1.3,f=0.37) USER MOD Set 4.1: A 12 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 13 CYS SG : rot -130:sc= -0.761 USER MOD Set 5.1: A 11 ASN : amide:sc= 0.884 K(o=2.1,f=-4.5!) USER MOD Set 5.2: A 15 SER OG : rot 117:sc= 1.18 USER MOD Set 6.1: A 5 MET CE :methyl -172:sc= -2.31 (180deg=-1.97) USER MOD Set 6.2: A 35 CYS SG : rot 29:sc= 0.357 USER MOD Single : A 1 MET CE :methyl -136:sc= 0 (180deg=-0.014) USER MOD Single : A 1 MET N :NH3+ -108:sc= 0.0146 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 179:sc= 2.17 (180deg=2.11) USER MOD Single : A 3 LYS NZ :NH3+ 174:sc= 1.18 (180deg=1) USER MOD Single : A 8 CYS SG : rot -120:sc= 0.0145 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 MET CE :methyl 179:sc= 0 (180deg=-0.000973) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 85:sc= 1.19 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot -75:sc= 1.27 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0678 USER MOD Single : A 40 SER OG : rot 5:sc= 1.04 USER MOD Single : A 43 HIS : no HD1:sc= -1.41 X(o=-1.4,f=-1.5) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 135:sc= -0.684 (180deg=-1.19) USER MOD Single : A 50 MET CE :methyl -124:sc= -3.31 (180deg=-12.9!) USER MOD Single : A 58 SER OG : rot 99:sc= 1.34 USER MOD Single : A 61 THR OG1 : rot -44:sc= 1.24 USER MOD Single : A 62 SER OG : rot 103:sc= 0.6 USER MOD Single : A 67 ASN : amide:sc= 0.968 K(o=0.97,f=-0.67) USER MOD Single : A 69 ASN : amide:sc= 1.04 K(o=1,f=-0.023) USER MOD Single : A 78 SER OG : rot -120:sc= 0 USER MOD Single : A 80 CYS SG : rot 180:sc= -0.0171 USER MOD Single : A 82 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.0977 X(o=-0.098,f=-0.11) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0172 USER MOD Single : A 93 GLN : amide:sc= 0.993 K(o=0.99,f=-0.052) USER MOD Single : A 100 GLN : amide:sc= 0.553 K(o=0.55,f=-6.6!) USER MOD Single : A 107 GLN : amide:sc= 1.05 K(o=1,f=-1.2) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 90:sc= 1.24 USER MOD Single : A 118 GLN : amide:sc= 0.914 K(o=0.91,f=-5!) USER MOD Single : A 120 LYS NZ :NH3+ -172:sc= 1.23 (180deg=1.19) USER MOD Single : A 131 SER OG : rot 60:sc= 0.492 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.413 -0.568 -2.488 1.00 0.00 N ATOM 2 CA MET A 1 2.389 0.529 -2.706 1.00 0.00 C ATOM 3 C MET A 1 3.695 0.236 -1.968 1.00 0.00 C ATOM 4 O MET A 1 3.686 -0.286 -0.852 1.00 0.00 O ATOM 5 CB MET A 1 1.803 1.899 -2.298 1.00 0.00 C ATOM 6 CG MET A 1 2.805 3.065 -2.345 1.00 0.00 C ATOM 7 SD MET A 1 2.049 4.714 -2.319 1.00 0.00 S ATOM 8 CE MET A 1 1.433 4.840 -4.025 1.00 0.00 C ATOM 0 H1 MET A 1 1.310 -1.120 -3.363 1.00 0.00 H new ATOM 0 H2 MET A 1 1.753 -1.188 -1.726 1.00 0.00 H new ATOM 0 H3 MET A 1 0.492 -0.165 -2.222 1.00 0.00 H new ATOM 0 HA MET A 1 2.607 0.581 -3.773 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.965 2.131 -2.955 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.403 1.822 -1.287 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.484 2.978 -1.497 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.409 2.971 -3.247 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.666 5.827 -4.424 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.910 4.078 -4.641 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.353 4.690 -4.034 1.00 0.00 H new ATOM 18 N LYS A 2 4.826 0.604 -2.580 1.00 0.00 N ATOM 19 CA LYS A 2 6.149 0.521 -1.959 1.00 0.00 C ATOM 20 C LYS A 2 6.607 1.914 -1.535 1.00 0.00 C ATOM 21 O LYS A 2 6.403 2.883 -2.263 1.00 0.00 O ATOM 22 CB LYS A 2 7.160 -0.094 -2.948 1.00 0.00 C ATOM 23 CG LYS A 2 7.450 -1.569 -2.666 1.00 0.00 C ATOM 24 CD LYS A 2 6.487 -2.569 -3.317 1.00 0.00 C ATOM 25 CE LYS A 2 6.693 -3.997 -2.764 1.00 0.00 C ATOM 26 NZ LYS A 2 8.112 -4.435 -2.761 1.00 0.00 N ATOM 0 H LYS A 2 4.847 0.972 -3.531 1.00 0.00 H new ATOM 0 HA LYS A 2 6.091 -0.117 -1.077 1.00 0.00 H new ATOM 0 HB2 LYS A 2 6.775 0.007 -3.963 1.00 0.00 H new ATOM 0 HB3 LYS A 2 8.092 0.469 -2.903 1.00 0.00 H new ATOM 0 HG2 LYS A 2 8.462 -1.793 -3.004 1.00 0.00 H new ATOM 0 HG3 LYS A 2 7.433 -1.725 -1.587 1.00 0.00 H new ATOM 0 HD2 LYS A 2 5.459 -2.254 -3.139 1.00 0.00 H new ATOM 0 HD3 LYS A 2 6.638 -2.571 -4.397 1.00 0.00 H new ATOM 0 HE2 LYS A 2 6.305 -4.043 -1.746 1.00 0.00 H new ATOM 0 HE3 LYS A 2 6.107 -4.696 -3.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 8.179 -5.393 -2.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 8.476 -4.439 -3.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 8.676 -3.780 -2.183 1.00 0.00 H new ATOM 40 N LYS A 3 7.273 2.016 -0.387 1.00 0.00 N ATOM 41 CA LYS A 3 7.939 3.246 0.031 1.00 0.00 C ATOM 42 C LYS A 3 9.395 3.168 -0.352 1.00 0.00 C ATOM 43 O LYS A 3 10.097 2.292 0.150 1.00 0.00 O ATOM 44 CB LYS A 3 7.765 3.476 1.536 1.00 0.00 C ATOM 45 CG LYS A 3 6.539 4.383 1.697 1.00 0.00 C ATOM 46 CD LYS A 3 6.195 4.637 3.161 1.00 0.00 C ATOM 47 CE LYS A 3 5.174 5.771 3.269 1.00 0.00 C ATOM 48 NZ LYS A 3 4.803 6.032 4.678 1.00 0.00 N ATOM 0 H LYS A 3 7.366 1.249 0.279 1.00 0.00 H new ATOM 0 HA LYS A 3 7.485 4.098 -0.475 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.620 2.531 2.059 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.653 3.943 1.963 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.726 5.335 1.200 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.684 3.926 1.199 1.00 0.00 H new ATOM 0 HD2 LYS A 3 5.792 3.730 3.611 1.00 0.00 H new ATOM 0 HD3 LYS A 3 7.097 4.895 3.716 1.00 0.00 H new ATOM 0 HE2 LYS A 3 5.587 6.677 2.826 1.00 0.00 H new ATOM 0 HE3 LYS A 3 4.282 5.515 2.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 4.189 6.870 4.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 4.296 5.209 5.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 5.663 6.200 5.238 1.00 0.00 H new ATOM 62 N VAL A 4 9.829 4.075 -1.216 1.00 0.00 N ATOM 63 CA VAL A 4 11.180 4.166 -1.732 1.00 0.00 C ATOM 64 C VAL A 4 11.887 5.285 -0.981 1.00 0.00 C ATOM 65 O VAL A 4 11.330 6.375 -0.825 1.00 0.00 O ATOM 66 CB VAL A 4 11.115 4.498 -3.240 1.00 0.00 C ATOM 67 CG1 VAL A 4 12.504 4.705 -3.862 1.00 0.00 C ATOM 68 CG2 VAL A 4 10.403 3.413 -4.061 1.00 0.00 C ATOM 0 H VAL A 4 9.217 4.799 -1.591 1.00 0.00 H new ATOM 0 HA VAL A 4 11.719 3.228 -1.599 1.00 0.00 H new ATOM 0 HB VAL A 4 10.545 5.426 -3.283 1.00 0.00 H new ATOM 0 HG11 VAL A 4 12.397 4.935 -4.922 1.00 0.00 H new ATOM 0 HG12 VAL A 4 13.008 5.531 -3.360 1.00 0.00 H new ATOM 0 HG13 VAL A 4 13.094 3.796 -3.746 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.389 3.702 -5.112 1.00 0.00 H new ATOM 0 HG22 VAL A 4 10.934 2.467 -3.952 1.00 0.00 H new ATOM 0 HG23 VAL A 4 9.380 3.298 -3.702 1.00 0.00 H new ATOM 78 N MET A 5 13.126 5.037 -0.564 1.00 0.00 N ATOM 79 CA MET A 5 13.984 6.106 -0.056 1.00 0.00 C ATOM 80 C MET A 5 15.217 6.208 -0.948 1.00 0.00 C ATOM 81 O MET A 5 15.782 5.175 -1.295 1.00 0.00 O ATOM 82 CB MET A 5 14.346 5.942 1.432 1.00 0.00 C ATOM 83 CG MET A 5 15.211 7.147 1.846 1.00 0.00 C ATOM 84 SD MET A 5 15.571 7.390 3.598 1.00 0.00 S ATOM 85 CE MET A 5 13.989 8.089 4.115 1.00 0.00 C ATOM 0 H MET A 5 13.557 4.112 -0.567 1.00 0.00 H new ATOM 0 HA MET A 5 13.429 7.043 -0.097 1.00 0.00 H new ATOM 0 HB2 MET A 5 13.443 5.894 2.041 1.00 0.00 H new ATOM 0 HB3 MET A 5 14.889 5.010 1.592 1.00 0.00 H new ATOM 0 HG2 MET A 5 16.163 7.068 1.320 1.00 0.00 H new ATOM 0 HG3 MET A 5 14.719 8.049 1.481 1.00 0.00 H new ATOM 0 HE1 MET A 5 14.065 8.438 5.145 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.732 8.926 3.466 1.00 0.00 H new ATOM 0 HE3 MET A 5 13.214 7.325 4.047 1.00 0.00 H new ATOM 95 N PHE A 6 15.662 7.424 -1.280 1.00 0.00 N ATOM 96 CA PHE A 6 16.948 7.654 -1.935 1.00 0.00 C ATOM 97 C PHE A 6 17.861 8.301 -0.888 1.00 0.00 C ATOM 98 O PHE A 6 17.430 9.268 -0.265 1.00 0.00 O ATOM 99 CB PHE A 6 16.793 8.527 -3.181 1.00 0.00 C ATOM 100 CG PHE A 6 15.936 7.888 -4.255 1.00 0.00 C ATOM 101 CD1 PHE A 6 16.505 6.979 -5.173 1.00 0.00 C ATOM 102 CD2 PHE A 6 14.564 8.192 -4.327 1.00 0.00 C ATOM 103 CE1 PHE A 6 15.710 6.383 -6.171 1.00 0.00 C ATOM 104 CE2 PHE A 6 13.777 7.564 -5.309 1.00 0.00 C ATOM 105 CZ PHE A 6 14.342 6.673 -6.227 1.00 0.00 C ATOM 0 H PHE A 6 15.136 8.279 -1.100 1.00 0.00 H new ATOM 0 HA PHE A 6 17.380 6.718 -2.290 1.00 0.00 H new ATOM 0 HB2 PHE A 6 16.353 9.482 -2.895 1.00 0.00 H new ATOM 0 HB3 PHE A 6 17.780 8.741 -3.592 1.00 0.00 H new ATOM 0 HD1 PHE A 6 17.556 6.739 -5.110 1.00 0.00 H new ATOM 0 HD2 PHE A 6 14.122 8.897 -3.639 1.00 0.00 H new ATOM 0 HE1 PHE A 6 16.153 5.707 -6.888 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.718 7.773 -5.355 1.00 0.00 H new ATOM 0 HZ PHE A 6 13.722 6.208 -6.980 1.00 0.00 H new ATOM 115 N VAL A 7 19.088 7.817 -0.671 1.00 0.00 N ATOM 116 CA VAL A 7 19.947 8.251 0.438 1.00 0.00 C ATOM 117 C VAL A 7 21.325 8.629 -0.108 1.00 0.00 C ATOM 118 O VAL A 7 22.052 7.749 -0.562 1.00 0.00 O ATOM 119 CB VAL A 7 20.096 7.127 1.494 1.00 0.00 C ATOM 120 CG1 VAL A 7 20.892 7.625 2.710 1.00 0.00 C ATOM 121 CG2 VAL A 7 18.754 6.578 1.986 1.00 0.00 C ATOM 0 H VAL A 7 19.517 7.107 -1.264 1.00 0.00 H new ATOM 0 HA VAL A 7 19.487 9.115 0.919 1.00 0.00 H new ATOM 0 HB VAL A 7 20.627 6.320 0.990 1.00 0.00 H new ATOM 0 HG11 VAL A 7 20.985 6.820 3.439 1.00 0.00 H new ATOM 0 HG12 VAL A 7 21.885 7.941 2.390 1.00 0.00 H new ATOM 0 HG13 VAL A 7 20.372 8.468 3.165 1.00 0.00 H new ATOM 0 HG21 VAL A 7 18.930 5.795 2.723 1.00 0.00 H new ATOM 0 HG22 VAL A 7 18.177 7.382 2.442 1.00 0.00 H new ATOM 0 HG23 VAL A 7 18.199 6.166 1.144 1.00 0.00 H new ATOM 131 N CYS A 8 21.716 9.906 -0.051 1.00 0.00 N ATOM 132 CA CYS A 8 23.011 10.360 -0.566 1.00 0.00 C ATOM 133 C CYS A 8 23.938 10.802 0.560 1.00 0.00 C ATOM 134 O CYS A 8 23.499 11.100 1.664 1.00 0.00 O ATOM 135 CB CYS A 8 22.761 11.458 -1.618 1.00 0.00 C ATOM 136 SG CYS A 8 24.275 12.004 -2.462 1.00 0.00 S ATOM 0 H CYS A 8 21.147 10.651 0.351 1.00 0.00 H new ATOM 0 HA CYS A 8 23.532 9.535 -1.051 1.00 0.00 H new ATOM 0 HB2 CYS A 8 22.054 11.086 -2.360 1.00 0.00 H new ATOM 0 HB3 CYS A 8 22.294 12.316 -1.134 1.00 0.00 H new ATOM 0 HG CYS A 8 24.458 13.273 -2.248 1.00 0.00 H new ATOM 142 N LYS A 9 25.242 10.901 0.293 1.00 0.00 N ATOM 143 CA LYS A 9 26.194 11.486 1.242 1.00 0.00 C ATOM 144 C LYS A 9 25.939 12.985 1.479 1.00 0.00 C ATOM 145 O LYS A 9 26.467 13.542 2.441 1.00 0.00 O ATOM 146 CB LYS A 9 27.640 11.178 0.798 1.00 0.00 C ATOM 147 CG LYS A 9 28.245 10.085 1.694 1.00 0.00 C ATOM 148 CD LYS A 9 29.641 9.666 1.212 1.00 0.00 C ATOM 149 CE LYS A 9 30.350 8.719 2.194 1.00 0.00 C ATOM 150 NZ LYS A 9 30.806 9.400 3.434 1.00 0.00 N ATOM 0 H LYS A 9 25.666 10.582 -0.578 1.00 0.00 H new ATOM 0 HA LYS A 9 26.042 11.018 2.215 1.00 0.00 H new ATOM 0 HB2 LYS A 9 27.648 10.852 -0.242 1.00 0.00 H new ATOM 0 HB3 LYS A 9 28.246 12.082 0.854 1.00 0.00 H new ATOM 0 HG2 LYS A 9 28.308 10.448 2.720 1.00 0.00 H new ATOM 0 HG3 LYS A 9 27.587 9.216 1.703 1.00 0.00 H new ATOM 0 HD2 LYS A 9 29.554 9.177 0.242 1.00 0.00 H new ATOM 0 HD3 LYS A 9 30.253 10.556 1.067 1.00 0.00 H new ATOM 0 HE2 LYS A 9 29.673 7.908 2.460 1.00 0.00 H new ATOM 0 HE3 LYS A 9 31.209 8.267 1.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 31.276 8.711 4.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 31.475 10.157 3.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 29.987 9.809 3.927 1.00 0.00 H new ATOM 164 N ARG A 10 25.114 13.632 0.649 1.00 0.00 N ATOM 165 CA ARG A 10 24.586 14.971 0.819 1.00 0.00 C ATOM 166 C ARG A 10 23.283 14.957 0.043 1.00 0.00 C ATOM 167 O ARG A 10 23.280 14.710 -1.163 1.00 0.00 O ATOM 168 CB ARG A 10 25.561 16.064 0.347 1.00 0.00 C ATOM 169 CG ARG A 10 26.258 15.893 -1.022 1.00 0.00 C ATOM 170 CD ARG A 10 27.207 17.091 -1.195 1.00 0.00 C ATOM 171 NE ARG A 10 28.249 16.847 -2.201 1.00 0.00 N ATOM 172 CZ ARG A 10 29.459 17.416 -2.241 1.00 0.00 C ATOM 173 NH1 ARG A 10 29.813 18.366 -1.378 1.00 0.00 N ATOM 174 NH2 ARG A 10 30.306 17.003 -3.172 1.00 0.00 N ATOM 0 H ARG A 10 24.782 13.198 -0.212 1.00 0.00 H new ATOM 0 HA ARG A 10 24.430 15.221 1.868 1.00 0.00 H new ATOM 0 HB2 ARG A 10 25.015 17.007 0.325 1.00 0.00 H new ATOM 0 HB3 ARG A 10 26.339 16.163 1.104 1.00 0.00 H new ATOM 0 HG2 ARG A 10 26.811 14.954 -1.059 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.524 15.863 -1.827 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.629 17.969 -1.482 1.00 0.00 H new ATOM 0 HD3 ARG A 10 27.677 17.318 -0.238 1.00 0.00 H new ATOM 0 HE ARG A 10 28.029 16.180 -2.940 1.00 0.00 H new ATOM 0 HH11 ARG A 10 29.155 18.677 -0.664 1.00 0.00 H new ATOM 0 HH12 ARG A 10 30.742 18.783 -1.431 1.00 0.00 H new ATOM 0 HH21 ARG A 10 30.027 16.274 -3.828 1.00 0.00 H new ATOM 0 HH22 ARG A 10 31.237 17.414 -3.233 1.00 0.00 H new ATOM 188 N ASN A 11 22.172 15.099 0.758 1.00 0.00 N ATOM 189 CA ASN A 11 20.811 15.087 0.204 1.00 0.00 C ATOM 190 C ASN A 11 20.511 16.339 -0.647 1.00 0.00 C ATOM 191 O ASN A 11 19.539 17.050 -0.383 1.00 0.00 O ATOM 192 CB ASN A 11 19.752 14.915 1.305 1.00 0.00 C ATOM 193 CG ASN A 11 18.371 14.651 0.694 1.00 0.00 C ATOM 194 OD1 ASN A 11 18.249 14.212 -0.448 1.00 0.00 O ATOM 195 ND2 ASN A 11 17.306 14.880 1.439 1.00 0.00 N ATOM 0 H ASN A 11 22.188 15.230 1.769 1.00 0.00 H new ATOM 0 HA ASN A 11 20.759 14.223 -0.458 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.030 14.088 1.958 1.00 0.00 H new ATOM 0 HB3 ASN A 11 19.716 15.811 1.924 1.00 0.00 H new ATOM 0 HD21 ASN A 11 16.374 14.693 1.068 1.00 0.00 H new ATOM 0 HD22 ASN A 11 17.414 15.244 2.386 1.00 0.00 H new ATOM 202 N SER A 12 21.352 16.655 -1.631 1.00 0.00 N ATOM 203 CA SER A 12 21.315 17.900 -2.392 1.00 0.00 C ATOM 204 C SER A 12 21.267 17.666 -3.904 1.00 0.00 C ATOM 205 O SER A 12 20.764 18.537 -4.619 1.00 0.00 O ATOM 206 CB SER A 12 22.540 18.741 -2.022 1.00 0.00 C ATOM 207 OG SER A 12 23.709 17.948 -1.894 1.00 0.00 O ATOM 0 H SER A 12 22.101 16.030 -1.929 1.00 0.00 H new ATOM 0 HA SER A 12 20.397 18.428 -2.132 1.00 0.00 H new ATOM 0 HB2 SER A 12 22.700 19.503 -2.785 1.00 0.00 H new ATOM 0 HB3 SER A 12 22.352 19.263 -1.084 1.00 0.00 H new ATOM 0 HG SER A 12 24.469 18.521 -1.659 1.00 0.00 H new ATOM 213 N CYS A 13 21.730 16.500 -4.383 1.00 0.00 N ATOM 214 CA CYS A 13 21.897 16.225 -5.807 1.00 0.00 C ATOM 215 C CYS A 13 21.336 14.850 -6.174 1.00 0.00 C ATOM 216 O CYS A 13 20.157 14.772 -6.517 1.00 0.00 O ATOM 217 CB CYS A 13 23.373 16.371 -6.218 1.00 0.00 C ATOM 218 SG CYS A 13 23.975 18.049 -5.917 1.00 0.00 S ATOM 0 H CYS A 13 21.999 15.720 -3.783 1.00 0.00 H new ATOM 0 HA CYS A 13 21.324 16.963 -6.369 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.980 15.659 -5.660 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.485 16.126 -7.274 1.00 0.00 H new ATOM 0 HG CYS A 13 24.564 18.497 -6.986 1.00 0.00 H new ATOM 224 N ARG A 14 22.135 13.769 -6.071 1.00 0.00 N ATOM 225 CA ARG A 14 21.769 12.449 -6.613 1.00 0.00 C ATOM 226 C ARG A 14 20.356 12.038 -6.154 1.00 0.00 C ATOM 227 O ARG A 14 19.514 11.664 -6.969 1.00 0.00 O ATOM 228 CB ARG A 14 22.759 11.341 -6.184 1.00 0.00 C ATOM 229 CG ARG A 14 24.250 11.507 -6.536 1.00 0.00 C ATOM 230 CD ARG A 14 24.966 10.307 -5.895 1.00 0.00 C ATOM 231 NE ARG A 14 26.425 10.245 -6.102 1.00 0.00 N ATOM 232 CZ ARG A 14 27.359 10.141 -5.142 1.00 0.00 C ATOM 233 NH1 ARG A 14 27.049 10.272 -3.859 1.00 0.00 N ATOM 234 NH2 ARG A 14 28.624 9.928 -5.486 1.00 0.00 N ATOM 0 H ARG A 14 23.046 13.788 -5.613 1.00 0.00 H new ATOM 0 HA ARG A 14 21.801 12.549 -7.698 1.00 0.00 H new ATOM 0 HB2 ARG A 14 22.685 11.231 -5.102 1.00 0.00 H new ATOM 0 HB3 ARG A 14 22.418 10.404 -6.623 1.00 0.00 H new ATOM 0 HG2 ARG A 14 24.398 11.520 -7.616 1.00 0.00 H new ATOM 0 HG3 ARG A 14 24.641 12.448 -6.149 1.00 0.00 H new ATOM 0 HD2 ARG A 14 24.770 10.322 -4.823 1.00 0.00 H new ATOM 0 HD3 ARG A 14 24.523 9.392 -6.287 1.00 0.00 H new ATOM 0 HE ARG A 14 26.756 10.285 -7.066 1.00 0.00 H new ATOM 0 HH11 ARG A 14 26.084 10.456 -3.584 1.00 0.00 H new ATOM 0 HH12 ARG A 14 27.775 10.189 -3.148 1.00 0.00 H new ATOM 0 HH21 ARG A 14 28.878 9.845 -6.470 1.00 0.00 H new ATOM 0 HH22 ARG A 14 29.342 9.847 -4.766 1.00 0.00 H new ATOM 248 N SER A 15 20.103 12.122 -4.843 1.00 0.00 N ATOM 249 CA SER A 15 18.871 11.680 -4.191 1.00 0.00 C ATOM 250 C SER A 15 17.701 12.594 -4.555 1.00 0.00 C ATOM 251 O SER A 15 16.613 12.120 -4.867 1.00 0.00 O ATOM 252 CB SER A 15 19.103 11.699 -2.671 1.00 0.00 C ATOM 253 OG SER A 15 19.750 12.903 -2.294 1.00 0.00 O ATOM 0 H SER A 15 20.777 12.514 -4.185 1.00 0.00 H new ATOM 0 HA SER A 15 18.620 10.674 -4.527 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.151 11.609 -2.148 1.00 0.00 H new ATOM 0 HB3 SER A 15 19.710 10.843 -2.377 1.00 0.00 H new ATOM 0 HG SER A 15 19.162 13.419 -1.703 1.00 0.00 H new ATOM 259 N GLN A 16 17.930 13.908 -4.521 1.00 0.00 N ATOM 260 CA GLN A 16 16.928 14.931 -4.792 1.00 0.00 C ATOM 261 C GLN A 16 16.356 14.758 -6.197 1.00 0.00 C ATOM 262 O GLN A 16 15.138 14.773 -6.392 1.00 0.00 O ATOM 263 CB GLN A 16 17.605 16.304 -4.656 1.00 0.00 C ATOM 264 CG GLN A 16 17.888 16.674 -3.198 1.00 0.00 C ATOM 265 CD GLN A 16 16.632 17.039 -2.412 1.00 0.00 C ATOM 266 OE1 GLN A 16 15.546 17.233 -2.960 1.00 0.00 O ATOM 267 NE2 GLN A 16 16.781 17.200 -1.115 1.00 0.00 N ATOM 0 H GLN A 16 18.846 14.297 -4.297 1.00 0.00 H new ATOM 0 HA GLN A 16 16.103 14.845 -4.085 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.541 16.302 -5.215 1.00 0.00 H new ATOM 0 HB3 GLN A 16 16.968 17.066 -5.104 1.00 0.00 H new ATOM 0 HG2 GLN A 16 18.384 15.836 -2.708 1.00 0.00 H new ATOM 0 HG3 GLN A 16 18.581 17.515 -3.172 1.00 0.00 H new ATOM 0 HE21 GLN A 16 17.689 17.034 -0.681 1.00 0.00 H new ATOM 0 HE22 GLN A 16 15.988 17.491 -0.543 1.00 0.00 H new ATOM 276 N MET A 17 17.253 14.560 -7.160 1.00 0.00 N ATOM 277 CA MET A 17 16.926 14.318 -8.554 1.00 0.00 C ATOM 278 C MET A 17 16.157 13.006 -8.679 1.00 0.00 C ATOM 279 O MET A 17 15.102 12.972 -9.314 1.00 0.00 O ATOM 280 CB MET A 17 18.241 14.313 -9.344 1.00 0.00 C ATOM 281 CG MET A 17 18.862 15.724 -9.388 1.00 0.00 C ATOM 282 SD MET A 17 20.662 15.838 -9.606 1.00 0.00 S ATOM 283 CE MET A 17 20.855 14.998 -11.191 1.00 0.00 C ATOM 0 H MET A 17 18.257 14.565 -6.981 1.00 0.00 H new ATOM 0 HA MET A 17 16.280 15.096 -8.960 1.00 0.00 H new ATOM 0 HB2 MET A 17 18.943 13.617 -8.885 1.00 0.00 H new ATOM 0 HB3 MET A 17 18.059 13.960 -10.359 1.00 0.00 H new ATOM 0 HG2 MET A 17 18.389 16.275 -10.200 1.00 0.00 H new ATOM 0 HG3 MET A 17 18.602 16.236 -8.461 1.00 0.00 H new ATOM 0 HE1 MET A 17 21.907 14.998 -11.477 1.00 0.00 H new ATOM 0 HE2 MET A 17 20.503 13.970 -11.103 1.00 0.00 H new ATOM 0 HE3 MET A 17 20.272 15.517 -11.951 1.00 0.00 H new ATOM 293 N ALA A 18 16.635 11.943 -8.025 1.00 0.00 N ATOM 294 CA ALA A 18 15.961 10.656 -8.040 1.00 0.00 C ATOM 295 C ALA A 18 14.529 10.769 -7.514 1.00 0.00 C ATOM 296 O ALA A 18 13.634 10.135 -8.073 1.00 0.00 O ATOM 297 CB ALA A 18 16.760 9.634 -7.234 1.00 0.00 C ATOM 0 H ALA A 18 17.495 11.957 -7.476 1.00 0.00 H new ATOM 0 HA ALA A 18 15.901 10.315 -9.074 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.245 8.673 -7.252 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.753 9.522 -7.670 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.853 9.976 -6.203 1.00 0.00 H new ATOM 303 N GLU A 19 14.297 11.600 -6.490 1.00 0.00 N ATOM 304 CA GLU A 19 12.953 11.813 -5.971 1.00 0.00 C ATOM 305 C GLU A 19 12.072 12.421 -7.052 1.00 0.00 C ATOM 306 O GLU A 19 11.024 11.850 -7.343 1.00 0.00 O ATOM 307 CB GLU A 19 12.935 12.641 -4.673 1.00 0.00 C ATOM 308 CG GLU A 19 11.500 13.015 -4.242 1.00 0.00 C ATOM 309 CD GLU A 19 11.411 13.732 -2.882 1.00 0.00 C ATOM 310 OE1 GLU A 19 12.147 13.354 -1.944 1.00 0.00 O ATOM 311 OE2 GLU A 19 10.563 14.641 -2.728 1.00 0.00 O ATOM 0 H GLU A 19 15.024 12.131 -6.010 1.00 0.00 H new ATOM 0 HA GLU A 19 12.545 10.840 -5.696 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.416 12.075 -3.876 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.519 13.550 -4.816 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.059 13.655 -5.006 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.898 12.107 -4.201 1.00 0.00 H new ATOM 318 N GLY A 20 12.495 13.530 -7.663 1.00 0.00 N ATOM 319 CA GLY A 20 11.687 14.234 -8.650 1.00 0.00 C ATOM 320 C GLY A 20 11.255 13.301 -9.782 1.00 0.00 C ATOM 321 O GLY A 20 10.090 13.334 -10.187 1.00 0.00 O ATOM 0 H GLY A 20 13.403 13.960 -7.486 1.00 0.00 H new ATOM 0 HA2 GLY A 20 10.806 14.656 -8.167 1.00 0.00 H new ATOM 0 HA3 GLY A 20 12.256 15.068 -9.061 1.00 0.00 H new ATOM 325 N PHE A 21 12.149 12.425 -10.258 1.00 0.00 N ATOM 326 CA PHE A 21 11.766 11.428 -11.248 1.00 0.00 C ATOM 327 C PHE A 21 10.782 10.438 -10.627 1.00 0.00 C ATOM 328 O PHE A 21 9.720 10.227 -11.192 1.00 0.00 O ATOM 329 CB PHE A 21 12.993 10.729 -11.864 1.00 0.00 C ATOM 330 CG PHE A 21 13.911 11.666 -12.629 1.00 0.00 C ATOM 331 CD1 PHE A 21 13.442 12.357 -13.767 1.00 0.00 C ATOM 332 CD2 PHE A 21 15.207 11.926 -12.145 1.00 0.00 C ATOM 333 CE1 PHE A 21 14.230 13.367 -14.349 1.00 0.00 C ATOM 334 CE2 PHE A 21 15.986 12.943 -12.719 1.00 0.00 C ATOM 335 CZ PHE A 21 15.478 13.677 -13.802 1.00 0.00 C ATOM 0 H PHE A 21 13.128 12.391 -9.974 1.00 0.00 H new ATOM 0 HA PHE A 21 11.265 11.931 -12.075 1.00 0.00 H new ATOM 0 HB2 PHE A 21 13.562 10.246 -11.069 1.00 0.00 H new ATOM 0 HB3 PHE A 21 12.652 9.941 -12.535 1.00 0.00 H new ATOM 0 HD1 PHE A 21 12.479 12.111 -14.190 1.00 0.00 H new ATOM 0 HD2 PHE A 21 15.604 11.341 -11.329 1.00 0.00 H new ATOM 0 HE1 PHE A 21 13.871 13.901 -15.216 1.00 0.00 H new ATOM 0 HE2 PHE A 21 16.970 13.159 -12.330 1.00 0.00 H new ATOM 0 HZ PHE A 21 16.057 14.489 -14.217 1.00 0.00 H new ATOM 345 N ALA A 22 11.060 9.865 -9.458 1.00 0.00 N ATOM 346 CA ALA A 22 10.232 8.831 -8.846 1.00 0.00 C ATOM 347 C ALA A 22 8.795 9.288 -8.588 1.00 0.00 C ATOM 348 O ALA A 22 7.866 8.568 -8.951 1.00 0.00 O ATOM 349 CB ALA A 22 10.899 8.364 -7.554 1.00 0.00 C ATOM 0 H ALA A 22 11.879 10.110 -8.902 1.00 0.00 H new ATOM 0 HA ALA A 22 10.155 8.002 -9.549 1.00 0.00 H new ATOM 0 HB1 ALA A 22 10.288 7.591 -7.088 1.00 0.00 H new ATOM 0 HB2 ALA A 22 11.886 7.960 -7.779 1.00 0.00 H new ATOM 0 HB3 ALA A 22 11.000 9.207 -6.871 1.00 0.00 H new ATOM 355 N LYS A 23 8.570 10.477 -8.020 1.00 0.00 N ATOM 356 CA LYS A 23 7.220 10.995 -7.825 1.00 0.00 C ATOM 357 C LYS A 23 6.541 11.414 -9.130 1.00 0.00 C ATOM 358 O LYS A 23 5.346 11.694 -9.109 1.00 0.00 O ATOM 359 CB LYS A 23 7.166 12.109 -6.771 1.00 0.00 C ATOM 360 CG LYS A 23 8.317 13.115 -6.832 1.00 0.00 C ATOM 361 CD LYS A 23 7.934 14.472 -6.244 1.00 0.00 C ATOM 362 CE LYS A 23 7.235 15.295 -7.332 1.00 0.00 C ATOM 363 NZ LYS A 23 6.796 16.625 -6.839 1.00 0.00 N ATOM 0 H LYS A 23 9.309 11.097 -7.688 1.00 0.00 H new ATOM 0 HA LYS A 23 6.641 10.158 -7.436 1.00 0.00 H new ATOM 0 HB2 LYS A 23 6.226 12.649 -6.883 1.00 0.00 H new ATOM 0 HB3 LYS A 23 7.155 11.652 -5.782 1.00 0.00 H new ATOM 0 HG2 LYS A 23 9.174 12.716 -6.290 1.00 0.00 H new ATOM 0 HG3 LYS A 23 8.628 13.246 -7.869 1.00 0.00 H new ATOM 0 HD2 LYS A 23 7.274 14.340 -5.386 1.00 0.00 H new ATOM 0 HD3 LYS A 23 8.822 14.994 -5.886 1.00 0.00 H new ATOM 0 HE2 LYS A 23 7.913 15.428 -8.175 1.00 0.00 H new ATOM 0 HE3 LYS A 23 6.370 14.744 -7.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 6.329 17.144 -7.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 6.128 16.500 -6.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 7.623 17.163 -6.510 1.00 0.00 H new ATOM 377 N THR A 24 7.241 11.452 -10.261 1.00 0.00 N ATOM 378 CA THR A 24 6.612 11.629 -11.553 1.00 0.00 C ATOM 379 C THR A 24 6.307 10.268 -12.195 1.00 0.00 C ATOM 380 O THR A 24 5.194 10.023 -12.660 1.00 0.00 O ATOM 381 CB THR A 24 7.556 12.485 -12.417 1.00 0.00 C ATOM 382 OG1 THR A 24 7.887 13.690 -11.750 1.00 0.00 O ATOM 383 CG2 THR A 24 6.894 12.846 -13.740 1.00 0.00 C ATOM 0 H THR A 24 8.256 11.361 -10.301 1.00 0.00 H new ATOM 0 HA THR A 24 5.654 12.140 -11.455 1.00 0.00 H new ATOM 0 HB THR A 24 8.456 11.897 -12.597 1.00 0.00 H new ATOM 0 HG1 THR A 24 8.639 13.532 -11.142 1.00 0.00 H new ATOM 0 HG21 THR A 24 7.578 13.451 -14.336 1.00 0.00 H new ATOM 0 HG22 THR A 24 6.648 11.934 -14.284 1.00 0.00 H new ATOM 0 HG23 THR A 24 5.982 13.412 -13.548 1.00 0.00 H new ATOM 391 N LEU A 25 7.299 9.379 -12.210 1.00 0.00 N ATOM 392 CA LEU A 25 7.308 8.120 -12.939 1.00 0.00 C ATOM 393 C LEU A 25 6.509 7.040 -12.227 1.00 0.00 C ATOM 394 O LEU A 25 5.796 6.268 -12.868 1.00 0.00 O ATOM 395 CB LEU A 25 8.758 7.620 -13.054 1.00 0.00 C ATOM 396 CG LEU A 25 9.716 8.491 -13.882 1.00 0.00 C ATOM 397 CD1 LEU A 25 11.114 7.894 -13.725 1.00 0.00 C ATOM 398 CD2 LEU A 25 9.318 8.538 -15.360 1.00 0.00 C ATOM 0 H LEU A 25 8.161 9.529 -11.686 1.00 0.00 H new ATOM 0 HA LEU A 25 6.860 8.305 -13.915 1.00 0.00 H new ATOM 0 HB2 LEU A 25 9.167 7.523 -12.048 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.742 6.621 -13.489 1.00 0.00 H new ATOM 0 HG LEU A 25 9.681 9.520 -13.523 1.00 0.00 H new ATOM 0 HD11 LEU A 25 11.828 8.484 -14.299 1.00 0.00 H new ATOM 0 HD12 LEU A 25 11.398 7.904 -12.673 1.00 0.00 H new ATOM 0 HD13 LEU A 25 11.114 6.867 -14.091 1.00 0.00 H new ATOM 0 HD21 LEU A 25 10.023 9.165 -15.907 1.00 0.00 H new ATOM 0 HD22 LEU A 25 9.333 7.529 -15.773 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.315 8.953 -15.454 1.00 0.00 H new ATOM 410 N GLY A 26 6.657 6.980 -10.905 1.00 0.00 N ATOM 411 CA GLY A 26 6.165 5.889 -10.086 1.00 0.00 C ATOM 412 C GLY A 26 5.078 6.279 -9.100 1.00 0.00 C ATOM 413 O GLY A 26 4.510 5.377 -8.481 1.00 0.00 O ATOM 0 H GLY A 26 7.132 7.706 -10.369 1.00 0.00 H new ATOM 0 HA2 GLY A 26 5.780 5.106 -10.740 1.00 0.00 H new ATOM 0 HA3 GLY A 26 7.002 5.461 -9.534 1.00 0.00 H new ATOM 417 N ALA A 27 4.760 7.569 -8.942 1.00 0.00 N ATOM 418 CA ALA A 27 3.584 7.983 -8.184 1.00 0.00 C ATOM 419 C ALA A 27 2.349 7.268 -8.752 1.00 0.00 C ATOM 420 O ALA A 27 1.939 7.532 -9.885 1.00 0.00 O ATOM 421 CB ALA A 27 3.436 9.508 -8.213 1.00 0.00 C ATOM 0 H ALA A 27 5.303 8.340 -9.330 1.00 0.00 H new ATOM 0 HA ALA A 27 3.693 7.700 -7.137 1.00 0.00 H new ATOM 0 HB1 ALA A 27 2.554 9.799 -7.643 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.321 9.968 -7.773 1.00 0.00 H new ATOM 0 HB3 ALA A 27 3.328 9.844 -9.244 1.00 0.00 H new ATOM 427 N GLY A 28 1.809 6.320 -7.981 1.00 0.00 N ATOM 428 CA GLY A 28 0.773 5.382 -8.410 1.00 0.00 C ATOM 429 C GLY A 28 1.072 3.954 -7.936 1.00 0.00 C ATOM 430 O GLY A 28 0.139 3.197 -7.664 1.00 0.00 O ATOM 0 H GLY A 28 2.091 6.182 -7.011 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -0.193 5.701 -8.018 1.00 0.00 H new ATOM 0 HA3 GLY A 28 0.696 5.396 -9.497 1.00 0.00 H new ATOM 434 N LYS A 29 2.356 3.599 -7.769 1.00 0.00 N ATOM 435 CA LYS A 29 2.801 2.329 -7.179 1.00 0.00 C ATOM 436 C LYS A 29 3.849 2.545 -6.095 1.00 0.00 C ATOM 437 O LYS A 29 3.995 1.685 -5.226 1.00 0.00 O ATOM 438 CB LYS A 29 3.321 1.344 -8.245 1.00 0.00 C ATOM 439 CG LYS A 29 4.622 1.760 -8.962 1.00 0.00 C ATOM 440 CD LYS A 29 4.423 2.616 -10.214 1.00 0.00 C ATOM 441 CE LYS A 29 3.877 1.783 -11.384 1.00 0.00 C ATOM 442 NZ LYS A 29 3.726 2.578 -12.631 1.00 0.00 N ATOM 0 H LYS A 29 3.130 4.202 -8.047 1.00 0.00 H new ATOM 0 HA LYS A 29 1.922 1.882 -6.715 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.483 0.376 -7.771 1.00 0.00 H new ATOM 0 HB3 LYS A 29 2.543 1.205 -8.995 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.247 2.311 -8.259 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.171 0.860 -9.239 1.00 0.00 H new ATOM 0 HD2 LYS A 29 3.734 3.431 -9.993 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.372 3.070 -10.500 1.00 0.00 H new ATOM 0 HE2 LYS A 29 4.547 0.944 -11.571 1.00 0.00 H new ATOM 0 HE3 LYS A 29 2.910 1.363 -11.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 3.355 1.969 -13.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.066 3.364 -12.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 4.652 2.958 -12.915 1.00 0.00 H new ATOM 456 N ILE A 30 4.536 3.689 -6.105 1.00 0.00 N ATOM 457 CA ILE A 30 5.479 4.052 -5.060 1.00 0.00 C ATOM 458 C ILE A 30 5.183 5.426 -4.472 1.00 0.00 C ATOM 459 O ILE A 30 4.562 6.279 -5.110 1.00 0.00 O ATOM 460 CB ILE A 30 6.939 3.996 -5.558 1.00 0.00 C ATOM 461 CG1 ILE A 30 7.209 4.856 -6.809 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.356 2.546 -5.802 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.689 5.200 -7.015 1.00 0.00 C ATOM 0 H ILE A 30 4.450 4.388 -6.843 1.00 0.00 H new ATOM 0 HA ILE A 30 5.355 3.311 -4.271 1.00 0.00 H new ATOM 0 HB ILE A 30 7.548 4.430 -4.765 1.00 0.00 H new ATOM 0 HG12 ILE A 30 6.843 4.327 -7.689 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.638 5.781 -6.733 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.388 2.518 -6.153 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.274 1.982 -4.873 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.705 2.102 -6.555 1.00 0.00 H new ATOM 0 HD11 ILE A 30 8.800 5.806 -7.914 1.00 0.00 H new ATOM 0 HD12 ILE A 30 9.056 5.758 -6.154 1.00 0.00 H new ATOM 0 HD13 ILE A 30 9.264 4.281 -7.124 1.00 0.00 H new ATOM 475 N ALA A 31 5.699 5.622 -3.262 1.00 0.00 N ATOM 476 CA ALA A 31 5.782 6.881 -2.547 1.00 0.00 C ATOM 477 C ALA A 31 7.264 7.052 -2.229 1.00 0.00 C ATOM 478 O ALA A 31 7.906 6.093 -1.796 1.00 0.00 O ATOM 479 CB ALA A 31 4.954 6.801 -1.260 1.00 0.00 C ATOM 0 H ALA A 31 6.095 4.851 -2.724 1.00 0.00 H new ATOM 0 HA ALA A 31 5.394 7.720 -3.124 1.00 0.00 H new ATOM 0 HB1 ALA A 31 5.019 7.749 -0.726 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.913 6.596 -1.509 1.00 0.00 H new ATOM 0 HB3 ALA A 31 5.340 6.001 -0.628 1.00 0.00 H new ATOM 485 N VAL A 32 7.819 8.239 -2.457 1.00 0.00 N ATOM 486 CA VAL A 32 9.246 8.474 -2.383 1.00 0.00 C ATOM 487 C VAL A 32 9.637 9.514 -1.330 1.00 0.00 C ATOM 488 O VAL A 32 8.887 10.454 -1.052 1.00 0.00 O ATOM 489 CB VAL A 32 9.705 8.870 -3.795 1.00 0.00 C ATOM 490 CG1 VAL A 32 8.908 10.007 -4.452 1.00 0.00 C ATOM 491 CG2 VAL A 32 11.197 9.193 -3.809 1.00 0.00 C ATOM 0 H VAL A 32 7.279 9.070 -2.700 1.00 0.00 H new ATOM 0 HA VAL A 32 9.751 7.566 -2.053 1.00 0.00 H new ATOM 0 HB VAL A 32 9.502 7.990 -4.406 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.312 10.208 -5.444 1.00 0.00 H new ATOM 0 HG12 VAL A 32 7.861 9.715 -4.539 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.984 10.906 -3.840 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.500 9.471 -4.819 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.396 10.022 -3.130 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.762 8.317 -3.489 1.00 0.00 H new ATOM 501 N THR A 33 10.851 9.361 -0.796 1.00 0.00 N ATOM 502 CA THR A 33 11.529 10.341 0.027 1.00 0.00 C ATOM 503 C THR A 33 13.022 10.332 -0.330 1.00 0.00 C ATOM 504 O THR A 33 13.637 9.271 -0.396 1.00 0.00 O ATOM 505 CB THR A 33 11.349 10.017 1.522 1.00 0.00 C ATOM 506 OG1 THR A 33 10.012 9.678 1.857 1.00 0.00 O ATOM 507 CG2 THR A 33 11.775 11.194 2.403 1.00 0.00 C ATOM 0 H THR A 33 11.403 8.515 -0.936 1.00 0.00 H new ATOM 0 HA THR A 33 11.101 11.326 -0.160 1.00 0.00 H new ATOM 0 HB THR A 33 11.987 9.153 1.708 1.00 0.00 H new ATOM 0 HG1 THR A 33 9.994 9.247 2.737 1.00 0.00 H new ATOM 0 HG21 THR A 33 11.635 10.933 3.452 1.00 0.00 H new ATOM 0 HG22 THR A 33 12.825 11.422 2.223 1.00 0.00 H new ATOM 0 HG23 THR A 33 11.168 12.067 2.163 1.00 0.00 H new ATOM 515 N SER A 34 13.629 11.490 -0.559 1.00 0.00 N ATOM 516 CA SER A 34 15.069 11.648 -0.680 1.00 0.00 C ATOM 517 C SER A 34 15.618 12.134 0.660 1.00 0.00 C ATOM 518 O SER A 34 14.978 12.927 1.358 1.00 0.00 O ATOM 519 CB SER A 34 15.401 12.581 -1.842 1.00 0.00 C ATOM 520 OG SER A 34 14.675 13.794 -1.828 1.00 0.00 O ATOM 0 H SER A 34 13.118 12.366 -0.668 1.00 0.00 H new ATOM 0 HA SER A 34 15.549 10.697 -0.911 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.467 12.807 -1.821 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.204 12.062 -2.780 1.00 0.00 H new ATOM 0 HG SER A 34 13.752 13.626 -2.111 1.00 0.00 H new ATOM 526 N CYS A 35 16.785 11.630 1.046 1.00 0.00 N ATOM 527 CA CYS A 35 17.395 11.778 2.348 1.00 0.00 C ATOM 528 C CYS A 35 18.894 11.635 2.130 1.00 0.00 C ATOM 529 O CYS A 35 19.375 11.476 1.002 1.00 0.00 O ATOM 530 CB CYS A 35 16.849 10.700 3.296 1.00 0.00 C ATOM 531 SG CYS A 35 15.320 11.307 4.053 1.00 0.00 S ATOM 0 H CYS A 35 17.360 11.074 0.413 1.00 0.00 H new ATOM 0 HA CYS A 35 17.172 12.742 2.806 1.00 0.00 H new ATOM 0 HB2 CYS A 35 16.658 9.777 2.748 1.00 0.00 H new ATOM 0 HB3 CYS A 35 17.585 10.467 4.066 1.00 0.00 H new ATOM 0 HG CYS A 35 14.735 12.139 3.243 1.00 0.00 H new ATOM 537 N GLY A 36 19.662 11.681 3.206 1.00 0.00 N ATOM 538 CA GLY A 36 21.081 11.462 3.105 1.00 0.00 C ATOM 539 C GLY A 36 21.717 11.333 4.461 1.00 0.00 C ATOM 540 O GLY A 36 21.074 11.605 5.478 1.00 0.00 O ATOM 0 H GLY A 36 19.323 11.867 4.150 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.270 10.558 2.526 1.00 0.00 H new ATOM 0 HA3 GLY A 36 21.540 12.289 2.564 1.00 0.00 H new ATOM 544 N LEU A 37 22.990 10.938 4.440 1.00 0.00 N ATOM 545 CA LEU A 37 23.828 10.864 5.634 1.00 0.00 C ATOM 546 C LEU A 37 23.813 12.207 6.370 1.00 0.00 C ATOM 547 O LEU A 37 23.840 12.240 7.600 1.00 0.00 O ATOM 548 CB LEU A 37 25.262 10.447 5.287 1.00 0.00 C ATOM 549 CG LEU A 37 25.467 8.941 5.034 1.00 0.00 C ATOM 550 CD1 LEU A 37 25.153 8.070 6.258 1.00 0.00 C ATOM 551 CD2 LEU A 37 24.710 8.397 3.818 1.00 0.00 C ATOM 0 H LEU A 37 23.472 10.658 3.585 1.00 0.00 H new ATOM 0 HA LEU A 37 23.417 10.098 6.292 1.00 0.00 H new ATOM 0 HB2 LEU A 37 25.577 10.994 4.398 1.00 0.00 H new ATOM 0 HB3 LEU A 37 25.919 10.755 6.100 1.00 0.00 H new ATOM 0 HG LEU A 37 26.533 8.871 4.819 1.00 0.00 H new ATOM 0 HD11 LEU A 37 25.318 7.021 6.010 1.00 0.00 H new ATOM 0 HD12 LEU A 37 25.805 8.355 7.084 1.00 0.00 H new ATOM 0 HD13 LEU A 37 24.113 8.214 6.550 1.00 0.00 H new ATOM 0 HD21 LEU A 37 24.910 7.331 3.712 1.00 0.00 H new ATOM 0 HD22 LEU A 37 23.640 8.554 3.955 1.00 0.00 H new ATOM 0 HD23 LEU A 37 25.041 8.919 2.920 1.00 0.00 H new ATOM 563 N GLU A 38 23.717 13.300 5.609 1.00 0.00 N ATOM 564 CA GLU A 38 23.470 14.649 6.082 1.00 0.00 C ATOM 565 C GLU A 38 22.578 15.325 5.036 1.00 0.00 C ATOM 566 O GLU A 38 22.685 15.045 3.833 1.00 0.00 O ATOM 567 CB GLU A 38 24.785 15.439 6.226 1.00 0.00 C ATOM 568 CG GLU A 38 25.707 14.915 7.336 1.00 0.00 C ATOM 569 CD GLU A 38 26.932 15.826 7.526 1.00 0.00 C ATOM 570 OE1 GLU A 38 26.873 16.774 8.342 1.00 0.00 O ATOM 571 OE2 GLU A 38 27.980 15.594 6.880 1.00 0.00 O ATOM 0 H GLU A 38 23.816 13.257 4.595 1.00 0.00 H new ATOM 0 HA GLU A 38 22.997 14.623 7.064 1.00 0.00 H new ATOM 0 HB2 GLU A 38 25.321 15.409 5.277 1.00 0.00 H new ATOM 0 HB3 GLU A 38 24.549 16.484 6.426 1.00 0.00 H new ATOM 0 HG2 GLU A 38 25.152 14.850 8.272 1.00 0.00 H new ATOM 0 HG3 GLU A 38 26.037 13.906 7.090 1.00 0.00 H new ATOM 578 N SER A 39 21.689 16.207 5.490 1.00 0.00 N ATOM 579 CA SER A 39 20.932 17.093 4.617 1.00 0.00 C ATOM 580 C SER A 39 21.869 18.157 4.024 1.00 0.00 C ATOM 581 O SER A 39 22.931 18.458 4.579 1.00 0.00 O ATOM 582 CB SER A 39 19.777 17.729 5.408 1.00 0.00 C ATOM 583 OG SER A 39 20.121 17.951 6.771 1.00 0.00 O ATOM 0 H SER A 39 21.475 16.325 6.480 1.00 0.00 H new ATOM 0 HA SER A 39 20.502 16.528 3.790 1.00 0.00 H new ATOM 0 HB2 SER A 39 19.500 18.676 4.946 1.00 0.00 H new ATOM 0 HB3 SER A 39 18.902 17.081 5.356 1.00 0.00 H new ATOM 0 HG SER A 39 19.361 18.358 7.238 1.00 0.00 H new ATOM 589 N SER A 40 21.480 18.743 2.893 1.00 0.00 N ATOM 590 CA SER A 40 22.110 19.899 2.259 1.00 0.00 C ATOM 591 C SER A 40 21.088 20.476 1.276 1.00 0.00 C ATOM 592 O SER A 40 20.280 19.720 0.736 1.00 0.00 O ATOM 593 CB SER A 40 23.378 19.466 1.509 1.00 0.00 C ATOM 594 OG SER A 40 24.404 19.094 2.409 1.00 0.00 O ATOM 0 H SER A 40 20.674 18.406 2.367 1.00 0.00 H new ATOM 0 HA SER A 40 22.401 20.642 3.002 1.00 0.00 H new ATOM 0 HB2 SER A 40 23.146 18.628 0.851 1.00 0.00 H new ATOM 0 HB3 SER A 40 23.725 20.282 0.875 1.00 0.00 H new ATOM 0 HG SER A 40 24.057 19.111 3.325 1.00 0.00 H new ATOM 600 N ARG A 41 21.094 21.796 1.047 1.00 0.00 N ATOM 601 CA ARG A 41 20.100 22.456 0.198 1.00 0.00 C ATOM 602 C ARG A 41 20.045 21.806 -1.183 1.00 0.00 C ATOM 603 O ARG A 41 21.059 21.310 -1.674 1.00 0.00 O ATOM 604 CB ARG A 41 20.362 23.972 0.087 1.00 0.00 C ATOM 605 CG ARG A 41 21.752 24.354 -0.471 1.00 0.00 C ATOM 606 CD ARG A 41 21.732 25.697 -1.214 1.00 0.00 C ATOM 607 NE ARG A 41 20.992 25.590 -2.485 1.00 0.00 N ATOM 608 CZ ARG A 41 20.641 26.592 -3.298 1.00 0.00 C ATOM 609 NH1 ARG A 41 20.996 27.846 -3.035 1.00 0.00 N ATOM 610 NH2 ARG A 41 19.924 26.302 -4.378 1.00 0.00 N ATOM 0 H ARG A 41 21.786 22.432 1.444 1.00 0.00 H new ATOM 0 HA ARG A 41 19.127 22.328 0.673 1.00 0.00 H new ATOM 0 HB2 ARG A 41 19.597 24.412 -0.552 1.00 0.00 H new ATOM 0 HB3 ARG A 41 20.248 24.419 1.075 1.00 0.00 H new ATOM 0 HG2 ARG A 41 22.469 24.405 0.349 1.00 0.00 H new ATOM 0 HG3 ARG A 41 22.097 23.572 -1.147 1.00 0.00 H new ATOM 0 HD2 ARG A 41 21.271 26.458 -0.584 1.00 0.00 H new ATOM 0 HD3 ARG A 41 22.754 26.022 -1.411 1.00 0.00 H new ATOM 0 HE ARG A 41 20.719 24.651 -2.775 1.00 0.00 H new ATOM 0 HH11 ARG A 41 21.545 28.056 -2.202 1.00 0.00 H new ATOM 0 HH12 ARG A 41 20.719 28.598 -3.667 1.00 0.00 H new ATOM 0 HH21 ARG A 41 19.656 25.336 -4.568 1.00 0.00 H new ATOM 0 HH22 ARG A 41 19.641 27.045 -5.017 1.00 0.00 H new ATOM 624 N VAL A 42 18.885 21.871 -1.835 1.00 0.00 N ATOM 625 CA VAL A 42 18.770 21.427 -3.223 1.00 0.00 C ATOM 626 C VAL A 42 19.775 22.230 -4.049 1.00 0.00 C ATOM 627 O VAL A 42 19.788 23.465 -3.989 1.00 0.00 O ATOM 628 CB VAL A 42 17.339 21.600 -3.764 1.00 0.00 C ATOM 629 CG1 VAL A 42 17.241 21.022 -5.181 1.00 0.00 C ATOM 630 CG2 VAL A 42 16.301 20.902 -2.876 1.00 0.00 C ATOM 0 H VAL A 42 18.018 22.224 -1.429 1.00 0.00 H new ATOM 0 HA VAL A 42 18.989 20.361 -3.288 1.00 0.00 H new ATOM 0 HB VAL A 42 17.125 22.669 -3.771 1.00 0.00 H new ATOM 0 HG11 VAL A 42 16.225 21.149 -5.556 1.00 0.00 H new ATOM 0 HG12 VAL A 42 17.938 21.545 -5.836 1.00 0.00 H new ATOM 0 HG13 VAL A 42 17.490 19.961 -5.159 1.00 0.00 H new ATOM 0 HG21 VAL A 42 15.306 21.050 -3.295 1.00 0.00 H new ATOM 0 HG22 VAL A 42 16.520 19.835 -2.829 1.00 0.00 H new ATOM 0 HG23 VAL A 42 16.338 21.324 -1.872 1.00 0.00 H new ATOM 640 N HIS A 43 20.634 21.540 -4.794 1.00 0.00 N ATOM 641 CA HIS A 43 21.618 22.184 -5.644 1.00 0.00 C ATOM 642 C HIS A 43 20.893 22.843 -6.830 1.00 0.00 C ATOM 643 O HIS A 43 19.949 22.252 -7.356 1.00 0.00 O ATOM 644 CB HIS A 43 22.634 21.121 -6.058 1.00 0.00 C ATOM 645 CG HIS A 43 23.955 21.688 -6.495 1.00 0.00 C ATOM 646 ND1 HIS A 43 24.364 21.899 -7.789 1.00 0.00 N ATOM 647 CD2 HIS A 43 24.969 22.110 -5.676 1.00 0.00 C ATOM 648 CE1 HIS A 43 25.593 22.441 -7.751 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.011 22.585 -6.482 1.00 0.00 N ATOM 0 H HIS A 43 20.664 20.521 -4.822 1.00 0.00 H new ATOM 0 HA HIS A 43 22.160 22.980 -5.133 1.00 0.00 H new ATOM 0 HB2 HIS A 43 22.799 20.442 -5.221 1.00 0.00 H new ATOM 0 HB3 HIS A 43 22.216 20.528 -6.871 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.965 22.081 -4.596 1.00 0.00 H new ATOM 0 HE1 HIS A 43 26.167 22.723 -8.622 1.00 0.00 H new ATOM 0 HE2 HIS A 43 26.905 22.963 -6.169 1.00 0.00 H new ATOM 657 N PRO A 44 21.293 24.043 -7.286 1.00 0.00 N ATOM 658 CA PRO A 44 20.491 24.794 -8.241 1.00 0.00 C ATOM 659 C PRO A 44 20.521 24.204 -9.644 1.00 0.00 C ATOM 660 O PRO A 44 19.478 24.099 -10.279 1.00 0.00 O ATOM 661 CB PRO A 44 21.037 26.224 -8.190 1.00 0.00 C ATOM 662 CG PRO A 44 22.499 26.043 -7.780 1.00 0.00 C ATOM 663 CD PRO A 44 22.493 24.780 -6.916 1.00 0.00 C ATOM 0 HA PRO A 44 19.434 24.760 -7.976 1.00 0.00 H new ATOM 0 HB2 PRO A 44 20.951 26.719 -9.157 1.00 0.00 H new ATOM 0 HB3 PRO A 44 20.492 26.835 -7.470 1.00 0.00 H new ATOM 0 HG2 PRO A 44 23.145 25.927 -8.650 1.00 0.00 H new ATOM 0 HG3 PRO A 44 22.866 26.905 -7.223 1.00 0.00 H new ATOM 0 HD2 PRO A 44 23.387 24.183 -7.093 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.483 25.033 -5.856 1.00 0.00 H new ATOM 671 N THR A 45 21.667 23.757 -10.145 1.00 0.00 N ATOM 672 CA THR A 45 21.729 23.237 -11.505 1.00 0.00 C ATOM 673 C THR A 45 20.891 21.957 -11.652 1.00 0.00 C ATOM 674 O THR A 45 20.357 21.707 -12.728 1.00 0.00 O ATOM 675 CB THR A 45 23.209 23.038 -11.860 1.00 0.00 C ATOM 676 OG1 THR A 45 23.917 24.243 -11.612 1.00 0.00 O ATOM 677 CG2 THR A 45 23.447 22.578 -13.296 1.00 0.00 C ATOM 0 H THR A 45 22.553 23.744 -9.639 1.00 0.00 H new ATOM 0 HA THR A 45 21.291 23.942 -12.211 1.00 0.00 H new ATOM 0 HB THR A 45 23.577 22.233 -11.224 1.00 0.00 H new ATOM 0 HG1 THR A 45 24.863 24.119 -11.836 1.00 0.00 H new ATOM 0 HG21 THR A 45 24.517 22.460 -13.468 1.00 0.00 H new ATOM 0 HG22 THR A 45 22.946 21.624 -13.460 1.00 0.00 H new ATOM 0 HG23 THR A 45 23.048 23.321 -13.987 1.00 0.00 H new ATOM 685 N ALA A 46 20.664 21.207 -10.565 1.00 0.00 N ATOM 686 CA ALA A 46 19.767 20.054 -10.548 1.00 0.00 C ATOM 687 C ALA A 46 18.398 20.408 -11.117 1.00 0.00 C ATOM 688 O ALA A 46 17.816 19.623 -11.870 1.00 0.00 O ATOM 689 CB ALA A 46 19.560 19.622 -9.097 1.00 0.00 C ATOM 0 H ALA A 46 21.106 21.390 -9.664 1.00 0.00 H new ATOM 0 HA ALA A 46 20.215 19.265 -11.151 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.892 18.761 -9.065 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.520 19.353 -8.657 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.120 20.444 -8.532 1.00 0.00 H new ATOM 695 N ILE A 47 17.903 21.599 -10.762 1.00 0.00 N ATOM 696 CA ILE A 47 16.618 22.090 -11.180 1.00 0.00 C ATOM 697 C ILE A 47 16.582 22.077 -12.709 1.00 0.00 C ATOM 698 O ILE A 47 15.622 21.592 -13.300 1.00 0.00 O ATOM 699 CB ILE A 47 16.438 23.518 -10.620 1.00 0.00 C ATOM 700 CG1 ILE A 47 16.584 23.614 -9.080 1.00 0.00 C ATOM 701 CG2 ILE A 47 15.089 24.076 -11.061 1.00 0.00 C ATOM 702 CD1 ILE A 47 16.852 25.053 -8.617 1.00 0.00 C ATOM 0 H ILE A 47 18.409 22.251 -10.162 1.00 0.00 H new ATOM 0 HA ILE A 47 15.804 21.469 -10.806 1.00 0.00 H new ATOM 0 HB ILE A 47 17.250 24.117 -11.032 1.00 0.00 H new ATOM 0 HG12 ILE A 47 15.675 23.244 -8.606 1.00 0.00 H new ATOM 0 HG13 ILE A 47 17.400 22.970 -8.752 1.00 0.00 H new ATOM 0 HG21 ILE A 47 14.965 25.084 -10.664 1.00 0.00 H new ATOM 0 HG22 ILE A 47 15.046 24.107 -12.150 1.00 0.00 H new ATOM 0 HG23 ILE A 47 14.290 23.437 -10.685 1.00 0.00 H new ATOM 0 HD11 ILE A 47 16.947 25.074 -7.531 1.00 0.00 H new ATOM 0 HD12 ILE A 47 17.775 25.415 -9.070 1.00 0.00 H new ATOM 0 HD13 ILE A 47 16.024 25.693 -8.921 1.00 0.00 H new ATOM 714 N ALA A 48 17.650 22.569 -13.342 1.00 0.00 N ATOM 715 CA ALA A 48 17.728 22.786 -14.767 1.00 0.00 C ATOM 716 C ALA A 48 17.681 21.461 -15.513 1.00 0.00 C ATOM 717 O ALA A 48 17.041 21.356 -16.554 1.00 0.00 O ATOM 718 CB ALA A 48 18.998 23.575 -15.104 1.00 0.00 C ATOM 0 H ALA A 48 18.505 22.832 -12.851 1.00 0.00 H new ATOM 0 HA ALA A 48 16.867 23.372 -15.088 1.00 0.00 H new ATOM 0 HB1 ALA A 48 19.052 23.736 -16.181 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.974 24.538 -14.594 1.00 0.00 H new ATOM 0 HB3 ALA A 48 19.873 23.013 -14.777 1.00 0.00 H new ATOM 724 N MET A 49 18.331 20.437 -14.968 1.00 0.00 N ATOM 725 CA MET A 49 18.396 19.124 -15.583 1.00 0.00 C ATOM 726 C MET A 49 17.010 18.452 -15.564 1.00 0.00 C ATOM 727 O MET A 49 16.528 17.872 -16.550 1.00 0.00 O ATOM 728 CB MET A 49 19.448 18.286 -14.848 1.00 0.00 C ATOM 729 CG MET A 49 20.729 18.995 -14.394 1.00 0.00 C ATOM 730 SD MET A 49 21.434 20.342 -15.404 1.00 0.00 S ATOM 731 CE MET A 49 21.703 19.522 -16.981 1.00 0.00 C ATOM 0 H MET A 49 18.830 20.500 -14.080 1.00 0.00 H new ATOM 0 HA MET A 49 18.691 19.213 -16.629 1.00 0.00 H new ATOM 0 HB2 MET A 49 18.975 17.850 -13.968 1.00 0.00 H new ATOM 0 HB3 MET A 49 19.734 17.460 -15.499 1.00 0.00 H new ATOM 0 HG2 MET A 49 20.540 19.400 -13.400 1.00 0.00 H new ATOM 0 HG3 MET A 49 21.501 18.233 -14.286 1.00 0.00 H new ATOM 0 HE1 MET A 49 21.353 20.164 -17.789 1.00 0.00 H new ATOM 0 HE2 MET A 49 22.767 19.322 -17.111 1.00 0.00 H new ATOM 0 HE3 MET A 49 21.152 18.581 -17.001 1.00 0.00 H new ATOM 741 N MET A 50 16.331 18.551 -14.425 1.00 0.00 N ATOM 742 CA MET A 50 14.979 18.050 -14.293 1.00 0.00 C ATOM 743 C MET A 50 14.035 18.866 -15.161 1.00 0.00 C ATOM 744 O MET A 50 13.155 18.277 -15.779 1.00 0.00 O ATOM 745 CB MET A 50 14.576 18.031 -12.819 1.00 0.00 C ATOM 746 CG MET A 50 15.454 16.996 -12.100 1.00 0.00 C ATOM 747 SD MET A 50 14.642 16.101 -10.761 1.00 0.00 S ATOM 748 CE MET A 50 13.450 15.156 -11.708 1.00 0.00 C ATOM 0 H MET A 50 16.704 18.978 -13.577 1.00 0.00 H new ATOM 0 HA MET A 50 14.921 17.022 -14.650 1.00 0.00 H new ATOM 0 HB2 MET A 50 14.709 19.018 -12.375 1.00 0.00 H new ATOM 0 HB3 MET A 50 13.522 17.774 -12.715 1.00 0.00 H new ATOM 0 HG2 MET A 50 15.812 16.274 -12.834 1.00 0.00 H new ATOM 0 HG3 MET A 50 16.331 17.503 -11.698 1.00 0.00 H new ATOM 0 HE1 MET A 50 12.446 15.359 -11.336 1.00 0.00 H new ATOM 0 HE2 MET A 50 13.512 15.441 -12.758 1.00 0.00 H new ATOM 0 HE3 MET A 50 13.666 14.092 -11.607 1.00 0.00 H new ATOM 758 N GLU A 51 14.269 20.167 -15.323 1.00 0.00 N ATOM 759 CA GLU A 51 13.521 20.996 -16.258 1.00 0.00 C ATOM 760 C GLU A 51 13.717 20.527 -17.701 1.00 0.00 C ATOM 761 O GLU A 51 12.813 20.718 -18.515 1.00 0.00 O ATOM 762 CB GLU A 51 13.935 22.464 -16.119 1.00 0.00 C ATOM 763 CG GLU A 51 13.176 23.194 -15.002 1.00 0.00 C ATOM 764 CD GLU A 51 13.483 24.704 -15.003 1.00 0.00 C ATOM 765 OE1 GLU A 51 14.643 25.107 -14.764 1.00 0.00 O ATOM 766 OE2 GLU A 51 12.554 25.510 -15.245 1.00 0.00 O ATOM 0 H GLU A 51 14.986 20.675 -14.806 1.00 0.00 H new ATOM 0 HA GLU A 51 12.463 20.900 -16.014 1.00 0.00 H new ATOM 0 HB2 GLU A 51 15.005 22.517 -15.919 1.00 0.00 H new ATOM 0 HB3 GLU A 51 13.761 22.977 -17.065 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.104 23.040 -15.128 1.00 0.00 H new ATOM 0 HG3 GLU A 51 13.448 22.767 -14.037 1.00 0.00 H new ATOM 773 N GLU A 52 14.842 19.878 -18.023 1.00 0.00 N ATOM 774 CA GLU A 52 15.024 19.283 -19.343 1.00 0.00 C ATOM 775 C GLU A 52 14.031 18.149 -19.537 1.00 0.00 C ATOM 776 O GLU A 52 13.465 17.998 -20.622 1.00 0.00 O ATOM 777 CB GLU A 52 16.432 18.728 -19.592 1.00 0.00 C ATOM 778 CG GLU A 52 17.530 19.768 -19.347 1.00 0.00 C ATOM 779 CD GLU A 52 18.827 19.459 -20.106 1.00 0.00 C ATOM 780 OE1 GLU A 52 19.592 18.564 -19.678 1.00 0.00 O ATOM 781 OE2 GLU A 52 19.110 20.134 -21.119 1.00 0.00 O ATOM 0 H GLU A 52 15.632 19.754 -17.390 1.00 0.00 H new ATOM 0 HA GLU A 52 14.862 20.093 -20.054 1.00 0.00 H new ATOM 0 HB2 GLU A 52 16.600 17.869 -18.942 1.00 0.00 H new ATOM 0 HB3 GLU A 52 16.500 18.369 -20.619 1.00 0.00 H new ATOM 0 HG2 GLU A 52 17.166 20.751 -19.646 1.00 0.00 H new ATOM 0 HG3 GLU A 52 17.743 19.819 -18.279 1.00 0.00 H new ATOM 788 N VAL A 53 13.812 17.362 -18.479 1.00 0.00 N ATOM 789 CA VAL A 53 12.827 16.275 -18.559 1.00 0.00 C ATOM 790 C VAL A 53 11.391 16.823 -18.415 1.00 0.00 C ATOM 791 O VAL A 53 10.445 16.201 -18.903 1.00 0.00 O ATOM 792 CB VAL A 53 13.195 15.160 -17.561 1.00 0.00 C ATOM 793 CG1 VAL A 53 12.209 13.981 -17.579 1.00 0.00 C ATOM 794 CG2 VAL A 53 14.587 14.600 -17.912 1.00 0.00 C ATOM 0 H VAL A 53 14.287 17.451 -17.581 1.00 0.00 H new ATOM 0 HA VAL A 53 12.853 15.814 -19.546 1.00 0.00 H new ATOM 0 HB VAL A 53 13.169 15.614 -16.571 1.00 0.00 H new ATOM 0 HG11 VAL A 53 12.525 13.231 -16.854 1.00 0.00 H new ATOM 0 HG12 VAL A 53 11.212 14.337 -17.321 1.00 0.00 H new ATOM 0 HG13 VAL A 53 12.190 13.538 -18.575 1.00 0.00 H new ATOM 0 HG21 VAL A 53 14.850 13.811 -17.207 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.571 14.193 -18.923 1.00 0.00 H new ATOM 0 HG23 VAL A 53 15.326 15.399 -17.854 1.00 0.00 H new ATOM 804 N GLY A 54 11.218 18.003 -17.812 1.00 0.00 N ATOM 805 CA GLY A 54 9.930 18.662 -17.612 1.00 0.00 C ATOM 806 C GLY A 54 9.467 18.583 -16.155 1.00 0.00 C ATOM 807 O GLY A 54 8.263 18.618 -15.898 1.00 0.00 O ATOM 0 H GLY A 54 11.999 18.542 -17.438 1.00 0.00 H new ATOM 0 HA2 GLY A 54 10.007 19.707 -17.912 1.00 0.00 H new ATOM 0 HA3 GLY A 54 9.182 18.200 -18.256 1.00 0.00 H new ATOM 811 N ILE A 55 10.403 18.439 -15.211 1.00 0.00 N ATOM 812 CA ILE A 55 10.143 18.325 -13.773 1.00 0.00 C ATOM 813 C ILE A 55 10.921 19.463 -13.069 1.00 0.00 C ATOM 814 O ILE A 55 11.592 20.260 -13.724 1.00 0.00 O ATOM 815 CB ILE A 55 10.495 16.884 -13.309 1.00 0.00 C ATOM 816 CG1 ILE A 55 9.806 15.778 -14.155 1.00 0.00 C ATOM 817 CG2 ILE A 55 10.122 16.617 -11.834 1.00 0.00 C ATOM 818 CD1 ILE A 55 10.666 14.515 -14.213 1.00 0.00 C ATOM 0 H ILE A 55 11.397 18.397 -15.436 1.00 0.00 H new ATOM 0 HA ILE A 55 9.094 18.457 -13.509 1.00 0.00 H new ATOM 0 HB ILE A 55 11.576 16.834 -13.442 1.00 0.00 H new ATOM 0 HG12 ILE A 55 8.833 15.540 -13.725 1.00 0.00 H new ATOM 0 HG13 ILE A 55 9.627 16.147 -15.165 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.392 15.595 -11.570 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.661 17.313 -11.191 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.049 16.755 -11.699 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.160 13.757 -14.811 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.629 14.751 -14.666 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.823 14.135 -13.204 1.00 0.00 H new ATOM 830 N ASP A 56 10.825 19.580 -11.745 1.00 0.00 N ATOM 831 CA ASP A 56 11.426 20.640 -10.931 1.00 0.00 C ATOM 832 C ASP A 56 11.874 20.043 -9.596 1.00 0.00 C ATOM 833 O ASP A 56 11.311 19.036 -9.157 1.00 0.00 O ATOM 834 CB ASP A 56 10.375 21.730 -10.672 1.00 0.00 C ATOM 835 CG ASP A 56 10.828 22.774 -9.638 1.00 0.00 C ATOM 836 OD1 ASP A 56 11.987 23.238 -9.716 1.00 0.00 O ATOM 837 OD2 ASP A 56 10.032 23.110 -8.734 1.00 0.00 O ATOM 0 H ASP A 56 10.302 18.908 -11.183 1.00 0.00 H new ATOM 0 HA ASP A 56 12.282 21.072 -11.450 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.145 22.234 -11.611 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.453 21.262 -10.327 1.00 0.00 H new ATOM 842 N ILE A 57 12.849 20.677 -8.937 1.00 0.00 N ATOM 843 CA ILE A 57 13.306 20.306 -7.600 1.00 0.00 C ATOM 844 C ILE A 57 13.394 21.497 -6.634 1.00 0.00 C ATOM 845 O ILE A 57 13.517 21.286 -5.429 1.00 0.00 O ATOM 846 CB ILE A 57 14.652 19.560 -7.623 1.00 0.00 C ATOM 847 CG1 ILE A 57 15.068 18.915 -8.954 1.00 0.00 C ATOM 848 CG2 ILE A 57 14.621 18.496 -6.525 1.00 0.00 C ATOM 849 CD1 ILE A 57 16.385 18.161 -8.775 1.00 0.00 C ATOM 0 H ILE A 57 13.349 21.476 -9.327 1.00 0.00 H new ATOM 0 HA ILE A 57 12.537 19.630 -7.226 1.00 0.00 H new ATOM 0 HB ILE A 57 15.410 20.326 -7.461 1.00 0.00 H new ATOM 0 HG12 ILE A 57 14.291 18.232 -9.296 1.00 0.00 H new ATOM 0 HG13 ILE A 57 15.179 19.681 -9.721 1.00 0.00 H new ATOM 0 HG21 ILE A 57 15.565 17.951 -6.519 1.00 0.00 H new ATOM 0 HG22 ILE A 57 14.473 18.976 -5.558 1.00 0.00 H new ATOM 0 HG23 ILE A 57 13.803 17.801 -6.714 1.00 0.00 H new ATOM 0 HD11 ILE A 57 16.675 17.706 -9.722 1.00 0.00 H new ATOM 0 HD12 ILE A 57 17.161 18.856 -8.453 1.00 0.00 H new ATOM 0 HD13 ILE A 57 16.259 17.383 -8.022 1.00 0.00 H new ATOM 861 N SER A 58 13.320 22.728 -7.137 1.00 0.00 N ATOM 862 CA SER A 58 13.461 23.976 -6.383 1.00 0.00 C ATOM 863 C SER A 58 12.722 23.997 -5.033 1.00 0.00 C ATOM 864 O SER A 58 13.216 24.601 -4.078 1.00 0.00 O ATOM 865 CB SER A 58 12.962 25.141 -7.253 1.00 0.00 C ATOM 866 OG SER A 58 13.409 25.047 -8.585 1.00 0.00 O ATOM 0 H SER A 58 13.152 22.892 -8.130 1.00 0.00 H new ATOM 0 HA SER A 58 14.520 24.071 -6.144 1.00 0.00 H new ATOM 0 HB2 SER A 58 11.872 25.160 -7.239 1.00 0.00 H new ATOM 0 HB3 SER A 58 13.303 26.083 -6.824 1.00 0.00 H new ATOM 0 HG SER A 58 12.699 24.665 -9.142 1.00 0.00 H new ATOM 872 N GLY A 59 11.559 23.339 -4.939 1.00 0.00 N ATOM 873 CA GLY A 59 10.701 23.360 -3.761 1.00 0.00 C ATOM 874 C GLY A 59 10.778 22.099 -2.894 1.00 0.00 C ATOM 875 O GLY A 59 10.036 22.029 -1.912 1.00 0.00 O ATOM 0 H GLY A 59 11.187 22.768 -5.698 1.00 0.00 H new ATOM 0 HA2 GLY A 59 10.967 24.222 -3.150 1.00 0.00 H new ATOM 0 HA3 GLY A 59 9.669 23.502 -4.082 1.00 0.00 H new ATOM 879 N GLN A 60 11.617 21.099 -3.216 1.00 0.00 N ATOM 880 CA GLN A 60 11.668 19.867 -2.420 1.00 0.00 C ATOM 881 C GLN A 60 12.322 20.063 -1.056 1.00 0.00 C ATOM 882 O GLN A 60 11.983 19.338 -0.117 1.00 0.00 O ATOM 883 CB GLN A 60 12.399 18.717 -3.138 1.00 0.00 C ATOM 884 CG GLN A 60 11.780 18.289 -4.478 1.00 0.00 C ATOM 885 CD GLN A 60 12.192 16.888 -4.957 1.00 0.00 C ATOM 886 OE1 GLN A 60 11.448 16.243 -5.690 1.00 0.00 O ATOM 887 NE2 GLN A 60 13.383 16.405 -4.635 1.00 0.00 N ATOM 0 H GLN A 60 12.258 21.121 -4.009 1.00 0.00 H new ATOM 0 HA GLN A 60 10.620 19.600 -2.282 1.00 0.00 H new ATOM 0 HB2 GLN A 60 13.433 19.016 -3.312 1.00 0.00 H new ATOM 0 HB3 GLN A 60 12.425 17.853 -2.474 1.00 0.00 H new ATOM 0 HG2 GLN A 60 10.694 18.323 -4.388 1.00 0.00 H new ATOM 0 HG3 GLN A 60 12.060 19.016 -5.241 1.00 0.00 H new ATOM 0 HE21 GLN A 60 14.003 16.940 -4.026 1.00 0.00 H new ATOM 0 HE22 GLN A 60 13.680 15.499 -4.996 1.00 0.00 H new ATOM 896 N THR A 61 13.216 21.047 -0.932 1.00 0.00 N ATOM 897 CA THR A 61 14.018 21.284 0.264 1.00 0.00 C ATOM 898 C THR A 61 14.891 20.066 0.566 1.00 0.00 C ATOM 899 O THR A 61 15.136 19.236 -0.307 1.00 0.00 O ATOM 900 CB THR A 61 13.153 21.771 1.448 1.00 0.00 C ATOM 901 OG1 THR A 61 12.453 20.737 2.108 1.00 0.00 O ATOM 902 CG2 THR A 61 12.116 22.795 1.014 1.00 0.00 C ATOM 0 H THR A 61 13.404 21.715 -1.680 1.00 0.00 H new ATOM 0 HA THR A 61 14.707 22.108 0.079 1.00 0.00 H new ATOM 0 HB THR A 61 13.878 22.210 2.134 1.00 0.00 H new ATOM 0 HG1 THR A 61 12.055 20.136 1.444 1.00 0.00 H new ATOM 0 HG21 THR A 61 11.531 23.109 1.878 1.00 0.00 H new ATOM 0 HG22 THR A 61 12.618 23.660 0.582 1.00 0.00 H new ATOM 0 HG23 THR A 61 11.455 22.350 0.270 1.00 0.00 H new ATOM 910 N SER A 62 15.369 19.970 1.798 1.00 0.00 N ATOM 911 CA SER A 62 16.202 18.860 2.254 1.00 0.00 C ATOM 912 C SER A 62 15.740 18.338 3.611 1.00 0.00 C ATOM 913 O SER A 62 14.977 18.987 4.332 1.00 0.00 O ATOM 914 CB SER A 62 17.674 19.278 2.266 1.00 0.00 C ATOM 915 OG SER A 62 18.511 18.136 2.191 1.00 0.00 O ATOM 0 H SER A 62 15.189 20.668 2.520 1.00 0.00 H new ATOM 0 HA SER A 62 16.096 18.032 1.553 1.00 0.00 H new ATOM 0 HB2 SER A 62 17.877 19.942 1.426 1.00 0.00 H new ATOM 0 HB3 SER A 62 17.892 19.838 3.175 1.00 0.00 H new ATOM 0 HG SER A 62 18.859 18.045 1.279 1.00 0.00 H new ATOM 921 N ASP A 63 16.199 17.130 3.933 1.00 0.00 N ATOM 922 CA ASP A 63 15.789 16.328 5.080 1.00 0.00 C ATOM 923 C ASP A 63 16.895 15.282 5.295 1.00 0.00 C ATOM 924 O ASP A 63 17.364 14.721 4.296 1.00 0.00 O ATOM 925 CB ASP A 63 14.453 15.621 4.762 1.00 0.00 C ATOM 926 CG ASP A 63 13.429 15.794 5.890 1.00 0.00 C ATOM 927 OD1 ASP A 63 13.731 15.423 7.042 1.00 0.00 O ATOM 928 OD2 ASP A 63 12.313 16.295 5.624 1.00 0.00 O ATOM 0 H ASP A 63 16.906 16.660 3.368 1.00 0.00 H new ATOM 0 HA ASP A 63 15.648 16.942 5.970 1.00 0.00 H new ATOM 0 HB2 ASP A 63 14.042 16.022 3.835 1.00 0.00 H new ATOM 0 HB3 ASP A 63 14.635 14.559 4.597 1.00 0.00 H new ATOM 933 N PRO A 64 17.384 15.039 6.522 1.00 0.00 N ATOM 934 CA PRO A 64 18.377 14.004 6.788 1.00 0.00 C ATOM 935 C PRO A 64 17.704 12.638 6.997 1.00 0.00 C ATOM 936 O PRO A 64 16.543 12.555 7.404 1.00 0.00 O ATOM 937 CB PRO A 64 19.083 14.475 8.062 1.00 0.00 C ATOM 938 CG PRO A 64 17.968 15.179 8.836 1.00 0.00 C ATOM 939 CD PRO A 64 17.116 15.808 7.731 1.00 0.00 C ATOM 0 HA PRO A 64 19.071 13.868 5.958 1.00 0.00 H new ATOM 0 HB2 PRO A 64 19.499 13.639 8.625 1.00 0.00 H new ATOM 0 HB3 PRO A 64 19.908 15.151 7.839 1.00 0.00 H new ATOM 0 HG2 PRO A 64 17.391 14.477 9.438 1.00 0.00 H new ATOM 0 HG3 PRO A 64 18.364 15.932 9.517 1.00 0.00 H new ATOM 0 HD2 PRO A 64 16.057 15.772 7.988 1.00 0.00 H new ATOM 0 HD3 PRO A 64 17.375 16.857 7.590 1.00 0.00 H new ATOM 947 N ILE A 65 18.475 11.559 6.807 1.00 0.00 N ATOM 948 CA ILE A 65 18.041 10.190 7.111 1.00 0.00 C ATOM 949 C ILE A 65 17.554 10.076 8.564 1.00 0.00 C ATOM 950 O ILE A 65 16.589 9.370 8.855 1.00 0.00 O ATOM 951 CB ILE A 65 19.170 9.202 6.765 1.00 0.00 C ATOM 952 CG1 ILE A 65 18.580 7.781 6.743 1.00 0.00 C ATOM 953 CG2 ILE A 65 20.411 9.309 7.676 1.00 0.00 C ATOM 954 CD1 ILE A 65 19.572 6.762 6.200 1.00 0.00 C ATOM 0 H ILE A 65 19.423 11.612 6.436 1.00 0.00 H new ATOM 0 HA ILE A 65 17.183 9.929 6.492 1.00 0.00 H new ATOM 0 HB ILE A 65 19.555 9.463 5.779 1.00 0.00 H new ATOM 0 HG12 ILE A 65 18.283 7.496 7.752 1.00 0.00 H new ATOM 0 HG13 ILE A 65 17.678 7.772 6.130 1.00 0.00 H new ATOM 0 HG21 ILE A 65 21.156 8.578 7.363 1.00 0.00 H new ATOM 0 HG22 ILE A 65 20.832 10.312 7.601 1.00 0.00 H new ATOM 0 HG23 ILE A 65 20.122 9.113 8.709 1.00 0.00 H new ATOM 0 HD11 ILE A 65 19.115 5.772 6.202 1.00 0.00 H new ATOM 0 HD12 ILE A 65 19.849 7.032 5.181 1.00 0.00 H new ATOM 0 HD13 ILE A 65 20.463 6.751 6.828 1.00 0.00 H new ATOM 966 N GLU A 66 18.202 10.828 9.462 1.00 0.00 N ATOM 967 CA GLU A 66 17.982 10.826 10.903 1.00 0.00 C ATOM 968 C GLU A 66 16.528 11.146 11.280 1.00 0.00 C ATOM 969 O GLU A 66 16.079 10.773 12.366 1.00 0.00 O ATOM 970 CB GLU A 66 18.926 11.852 11.563 1.00 0.00 C ATOM 971 CG GLU A 66 20.400 11.739 11.131 1.00 0.00 C ATOM 972 CD GLU A 66 21.316 12.583 12.037 1.00 0.00 C ATOM 973 OE1 GLU A 66 21.464 13.803 11.800 1.00 0.00 O ATOM 974 OE2 GLU A 66 21.911 12.031 12.991 1.00 0.00 O ATOM 0 H GLU A 66 18.930 11.486 9.183 1.00 0.00 H new ATOM 0 HA GLU A 66 18.193 9.820 11.265 1.00 0.00 H new ATOM 0 HB2 GLU A 66 18.569 12.856 11.331 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.868 11.735 12.645 1.00 0.00 H new ATOM 0 HG2 GLU A 66 20.712 10.695 11.166 1.00 0.00 H new ATOM 0 HG3 GLU A 66 20.504 12.068 10.097 1.00 0.00 H new ATOM 981 N ASN A 67 15.791 11.843 10.406 1.00 0.00 N ATOM 982 CA ASN A 67 14.424 12.278 10.670 1.00 0.00 C ATOM 983 C ASN A 67 13.387 11.177 10.378 1.00 0.00 C ATOM 984 O ASN A 67 12.196 11.390 10.611 1.00 0.00 O ATOM 985 CB ASN A 67 14.148 13.549 9.855 1.00 0.00 C ATOM 986 CG ASN A 67 12.850 14.252 10.250 1.00 0.00 C ATOM 987 OD1 ASN A 67 12.427 14.249 11.404 1.00 0.00 O ATOM 988 ND2 ASN A 67 12.218 14.918 9.303 1.00 0.00 N ATOM 0 H ASN A 67 16.136 12.121 9.487 1.00 0.00 H new ATOM 0 HA ASN A 67 14.325 12.496 11.733 1.00 0.00 H new ATOM 0 HB2 ASN A 67 14.981 14.241 9.982 1.00 0.00 H new ATOM 0 HB3 ASN A 67 14.106 13.291 8.797 1.00 0.00 H new ATOM 0 HD21 ASN A 67 11.369 15.438 9.525 1.00 0.00 H new ATOM 0 HD22 ASN A 67 12.578 14.913 8.349 1.00 0.00 H new ATOM 995 N PHE A 68 13.799 10.000 9.888 1.00 0.00 N ATOM 996 CA PHE A 68 12.909 8.908 9.523 1.00 0.00 C ATOM 997 C PHE A 68 13.354 7.595 10.176 1.00 0.00 C ATOM 998 O PHE A 68 14.316 7.549 10.947 1.00 0.00 O ATOM 999 CB PHE A 68 12.875 8.783 7.994 1.00 0.00 C ATOM 1000 CG PHE A 68 12.359 10.011 7.274 1.00 0.00 C ATOM 1001 CD1 PHE A 68 13.240 11.050 6.920 1.00 0.00 C ATOM 1002 CD2 PHE A 68 10.990 10.120 6.969 1.00 0.00 C ATOM 1003 CE1 PHE A 68 12.748 12.202 6.288 1.00 0.00 C ATOM 1004 CE2 PHE A 68 10.498 11.278 6.338 1.00 0.00 C ATOM 1005 CZ PHE A 68 11.377 12.323 6.002 1.00 0.00 C ATOM 0 H PHE A 68 14.784 9.783 9.734 1.00 0.00 H new ATOM 0 HA PHE A 68 11.905 9.123 9.888 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.882 8.565 7.638 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.250 7.931 7.726 1.00 0.00 H new ATOM 0 HD1 PHE A 68 14.295 10.961 7.135 1.00 0.00 H new ATOM 0 HD2 PHE A 68 10.316 9.314 7.219 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.426 12.999 6.020 1.00 0.00 H new ATOM 0 HE2 PHE A 68 9.445 11.364 6.112 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.000 13.216 5.526 1.00 0.00 H new ATOM 1015 N ASN A 69 12.636 6.519 9.848 1.00 0.00 N ATOM 1016 CA ASN A 69 12.834 5.161 10.336 1.00 0.00 C ATOM 1017 C ASN A 69 12.717 4.206 9.153 1.00 0.00 C ATOM 1018 O ASN A 69 11.738 4.245 8.404 1.00 0.00 O ATOM 1019 CB ASN A 69 11.814 4.789 11.436 1.00 0.00 C ATOM 1020 CG ASN A 69 10.397 5.345 11.266 1.00 0.00 C ATOM 1021 OD1 ASN A 69 9.795 5.821 12.225 1.00 0.00 O ATOM 1022 ND2 ASN A 69 9.834 5.332 10.068 1.00 0.00 N ATOM 0 H ASN A 69 11.855 6.581 9.195 1.00 0.00 H new ATOM 0 HA ASN A 69 13.823 5.087 10.788 1.00 0.00 H new ATOM 0 HB2 ASN A 69 11.751 3.702 11.490 1.00 0.00 H new ATOM 0 HB3 ASN A 69 12.204 5.133 12.394 1.00 0.00 H new ATOM 0 HD21 ASN A 69 8.898 5.718 9.940 1.00 0.00 H new ATOM 0 HD22 ASN A 69 10.336 4.936 9.273 1.00 0.00 H new ATOM 1029 N ALA A 70 13.709 3.332 9.009 1.00 0.00 N ATOM 1030 CA ALA A 70 13.838 2.406 7.893 1.00 0.00 C ATOM 1031 C ALA A 70 12.638 1.479 7.749 1.00 0.00 C ATOM 1032 O ALA A 70 12.319 1.077 6.635 1.00 0.00 O ATOM 1033 CB ALA A 70 15.107 1.560 8.075 1.00 0.00 C ATOM 0 H ALA A 70 14.467 3.248 9.687 1.00 0.00 H new ATOM 0 HA ALA A 70 13.896 3.007 6.985 1.00 0.00 H new ATOM 0 HB1 ALA A 70 15.205 0.866 7.240 1.00 0.00 H new ATOM 0 HB2 ALA A 70 15.979 2.214 8.107 1.00 0.00 H new ATOM 0 HB3 ALA A 70 15.040 0.999 9.007 1.00 0.00 H new ATOM 1039 N ASP A 71 11.968 1.155 8.858 1.00 0.00 N ATOM 1040 CA ASP A 71 10.846 0.218 8.892 1.00 0.00 C ATOM 1041 C ASP A 71 9.672 0.678 8.021 1.00 0.00 C ATOM 1042 O ASP A 71 8.862 -0.144 7.592 1.00 0.00 O ATOM 1043 CB ASP A 71 10.386 0.035 10.343 1.00 0.00 C ATOM 1044 CG ASP A 71 9.210 -0.951 10.453 1.00 0.00 C ATOM 1045 OD1 ASP A 71 9.415 -2.170 10.252 1.00 0.00 O ATOM 1046 OD2 ASP A 71 8.085 -0.522 10.796 1.00 0.00 O ATOM 0 H ASP A 71 12.195 1.544 9.773 1.00 0.00 H new ATOM 0 HA ASP A 71 11.191 -0.731 8.482 1.00 0.00 H new ATOM 0 HB2 ASP A 71 11.220 -0.326 10.945 1.00 0.00 H new ATOM 0 HB3 ASP A 71 10.090 1.000 10.754 1.00 0.00 H new ATOM 1051 N ASP A 72 9.577 1.982 7.738 1.00 0.00 N ATOM 1052 CA ASP A 72 8.491 2.551 6.963 1.00 0.00 C ATOM 1053 C ASP A 72 8.776 2.428 5.467 1.00 0.00 C ATOM 1054 O ASP A 72 7.850 2.504 4.665 1.00 0.00 O ATOM 1055 CB ASP A 72 8.273 4.011 7.371 1.00 0.00 C ATOM 1056 CG ASP A 72 7.025 4.629 6.727 1.00 0.00 C ATOM 1057 OD1 ASP A 72 5.925 4.038 6.816 1.00 0.00 O ATOM 1058 OD2 ASP A 72 7.111 5.764 6.207 1.00 0.00 O ATOM 0 H ASP A 72 10.263 2.671 8.048 1.00 0.00 H new ATOM 0 HA ASP A 72 7.576 1.996 7.169 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.184 4.071 8.456 1.00 0.00 H new ATOM 0 HB3 ASP A 72 9.149 4.596 7.090 1.00 0.00 H new ATOM 1063 N TYR A 73 10.035 2.198 5.080 1.00 0.00 N ATOM 1064 CA TYR A 73 10.486 2.147 3.715 1.00 0.00 C ATOM 1065 C TYR A 73 10.653 0.696 3.305 1.00 0.00 C ATOM 1066 O TYR A 73 11.377 -0.070 3.940 1.00 0.00 O ATOM 1067 CB TYR A 73 11.756 2.983 3.560 1.00 0.00 C ATOM 1068 CG TYR A 73 11.451 4.449 3.787 1.00 0.00 C ATOM 1069 CD1 TYR A 73 10.966 5.226 2.723 1.00 0.00 C ATOM 1070 CD2 TYR A 73 11.556 5.007 5.075 1.00 0.00 C ATOM 1071 CE1 TYR A 73 10.582 6.557 2.941 1.00 0.00 C ATOM 1072 CE2 TYR A 73 11.201 6.347 5.306 1.00 0.00 C ATOM 1073 CZ TYR A 73 10.690 7.124 4.232 1.00 0.00 C ATOM 1074 OH TYR A 73 10.347 8.426 4.417 1.00 0.00 O ATOM 0 H TYR A 73 10.787 2.037 5.750 1.00 0.00 H new ATOM 0 HA TYR A 73 9.751 2.585 3.039 1.00 0.00 H new ATOM 0 HB2 TYR A 73 12.510 2.647 4.272 1.00 0.00 H new ATOM 0 HB3 TYR A 73 12.173 2.841 2.563 1.00 0.00 H new ATOM 0 HD1 TYR A 73 10.888 4.798 1.735 1.00 0.00 H new ATOM 0 HD2 TYR A 73 11.913 4.400 5.894 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.203 7.150 2.122 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.315 6.781 6.288 1.00 0.00 H new ATOM 0 HH TYR A 73 10.661 8.725 5.296 1.00 0.00 H new ATOM 1084 N ASP A 74 9.951 0.309 2.244 1.00 0.00 N ATOM 1085 CA ASP A 74 10.063 -1.036 1.703 1.00 0.00 C ATOM 1086 C ASP A 74 11.364 -1.171 0.915 1.00 0.00 C ATOM 1087 O ASP A 74 11.991 -2.230 0.911 1.00 0.00 O ATOM 1088 CB ASP A 74 8.879 -1.348 0.791 1.00 0.00 C ATOM 1089 CG ASP A 74 8.967 -2.806 0.319 1.00 0.00 C ATOM 1090 OD1 ASP A 74 8.485 -3.694 1.057 1.00 0.00 O ATOM 1091 OD2 ASP A 74 9.458 -3.048 -0.806 1.00 0.00 O ATOM 0 H ASP A 74 9.298 0.911 1.743 1.00 0.00 H new ATOM 0 HA ASP A 74 10.064 -1.743 2.532 1.00 0.00 H new ATOM 0 HB2 ASP A 74 7.942 -1.183 1.324 1.00 0.00 H new ATOM 0 HB3 ASP A 74 8.880 -0.676 -0.067 1.00 0.00 H new ATOM 1096 N VAL A 75 11.795 -0.073 0.289 1.00 0.00 N ATOM 1097 CA VAL A 75 12.914 -0.065 -0.639 1.00 0.00 C ATOM 1098 C VAL A 75 13.809 1.123 -0.327 1.00 0.00 C ATOM 1099 O VAL A 75 13.327 2.227 -0.071 1.00 0.00 O ATOM 1100 CB VAL A 75 12.411 -0.134 -2.105 1.00 0.00 C ATOM 1101 CG1 VAL A 75 10.982 0.349 -2.390 1.00 0.00 C ATOM 1102 CG2 VAL A 75 13.388 0.444 -3.139 1.00 0.00 C ATOM 0 H VAL A 75 11.367 0.844 0.418 1.00 0.00 H new ATOM 0 HA VAL A 75 13.529 -0.956 -0.516 1.00 0.00 H new ATOM 0 HB VAL A 75 12.367 -1.216 -2.231 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.767 0.243 -3.453 1.00 0.00 H new ATOM 0 HG12 VAL A 75 10.274 -0.249 -1.816 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.888 1.397 -2.104 1.00 0.00 H new ATOM 0 HG21 VAL A 75 12.957 0.355 -4.136 1.00 0.00 H new ATOM 0 HG22 VAL A 75 13.574 1.495 -2.916 1.00 0.00 H new ATOM 0 HG23 VAL A 75 14.328 -0.107 -3.100 1.00 0.00 H new ATOM 1112 N VAL A 76 15.120 0.896 -0.363 1.00 0.00 N ATOM 1113 CA VAL A 76 16.100 1.932 -0.068 1.00 0.00 C ATOM 1114 C VAL A 76 17.233 1.883 -1.094 1.00 0.00 C ATOM 1115 O VAL A 76 17.845 0.851 -1.367 1.00 0.00 O ATOM 1116 CB VAL A 76 16.525 1.881 1.418 1.00 0.00 C ATOM 1117 CG1 VAL A 76 16.574 0.468 2.020 1.00 0.00 C ATOM 1118 CG2 VAL A 76 17.817 2.663 1.686 1.00 0.00 C ATOM 0 H VAL A 76 15.529 -0.009 -0.597 1.00 0.00 H new ATOM 0 HA VAL A 76 15.662 2.924 -0.180 1.00 0.00 H new ATOM 0 HB VAL A 76 15.719 2.388 1.949 1.00 0.00 H new ATOM 0 HG11 VAL A 76 16.881 0.528 3.064 1.00 0.00 H new ATOM 0 HG12 VAL A 76 15.586 0.012 1.958 1.00 0.00 H new ATOM 0 HG13 VAL A 76 17.290 -0.139 1.466 1.00 0.00 H new ATOM 0 HG21 VAL A 76 18.071 2.595 2.744 1.00 0.00 H new ATOM 0 HG22 VAL A 76 18.627 2.242 1.091 1.00 0.00 H new ATOM 0 HG23 VAL A 76 17.672 3.709 1.414 1.00 0.00 H new ATOM 1128 N ILE A 77 17.500 3.041 -1.679 1.00 0.00 N ATOM 1129 CA ILE A 77 18.444 3.243 -2.743 1.00 0.00 C ATOM 1130 C ILE A 77 19.453 4.234 -2.212 1.00 0.00 C ATOM 1131 O ILE A 77 19.223 5.444 -2.188 1.00 0.00 O ATOM 1132 CB ILE A 77 17.707 3.729 -4.004 1.00 0.00 C ATOM 1133 CG1 ILE A 77 16.705 2.684 -4.543 1.00 0.00 C ATOM 1134 CG2 ILE A 77 18.711 4.124 -5.091 1.00 0.00 C ATOM 1135 CD1 ILE A 77 17.313 1.315 -4.872 1.00 0.00 C ATOM 0 H ILE A 77 17.034 3.905 -1.402 1.00 0.00 H new ATOM 0 HA ILE A 77 18.958 2.330 -3.043 1.00 0.00 H new ATOM 0 HB ILE A 77 17.127 4.606 -3.718 1.00 0.00 H new ATOM 0 HG12 ILE A 77 15.914 2.546 -3.805 1.00 0.00 H new ATOM 0 HG13 ILE A 77 16.236 3.082 -5.443 1.00 0.00 H new ATOM 0 HG21 ILE A 77 18.174 4.465 -5.976 1.00 0.00 H new ATOM 0 HG22 ILE A 77 19.350 4.927 -4.722 1.00 0.00 H new ATOM 0 HG23 ILE A 77 19.325 3.262 -5.350 1.00 0.00 H new ATOM 0 HD11 ILE A 77 16.533 0.650 -5.243 1.00 0.00 H new ATOM 0 HD12 ILE A 77 18.083 1.433 -5.635 1.00 0.00 H new ATOM 0 HD13 ILE A 77 17.756 0.888 -3.972 1.00 0.00 H new ATOM 1147 N SER A 78 20.555 3.710 -1.708 1.00 0.00 N ATOM 1148 CA SER A 78 21.665 4.579 -1.413 1.00 0.00 C ATOM 1149 C SER A 78 22.237 5.049 -2.745 1.00 0.00 C ATOM 1150 O SER A 78 22.059 4.435 -3.800 1.00 0.00 O ATOM 1151 CB SER A 78 22.721 3.875 -0.582 1.00 0.00 C ATOM 1152 OG SER A 78 22.288 3.831 0.755 1.00 0.00 O ATOM 0 H SER A 78 20.699 2.721 -1.502 1.00 0.00 H new ATOM 0 HA SER A 78 21.328 5.428 -0.819 1.00 0.00 H new ATOM 0 HB2 SER A 78 22.887 2.866 -0.959 1.00 0.00 H new ATOM 0 HB3 SER A 78 23.672 4.403 -0.654 1.00 0.00 H new ATOM 0 HG SER A 78 22.934 4.299 1.324 1.00 0.00 H new ATOM 1158 N LEU A 79 22.899 6.189 -2.691 1.00 0.00 N ATOM 1159 CA LEU A 79 23.652 6.791 -3.765 1.00 0.00 C ATOM 1160 C LEU A 79 24.735 7.570 -3.022 1.00 0.00 C ATOM 1161 O LEU A 79 24.819 8.795 -3.076 1.00 0.00 O ATOM 1162 CB LEU A 79 22.772 7.592 -4.768 1.00 0.00 C ATOM 1163 CG LEU A 79 21.249 7.693 -4.515 1.00 0.00 C ATOM 1164 CD1 LEU A 79 20.990 8.848 -3.560 1.00 0.00 C ATOM 1165 CD2 LEU A 79 20.469 7.938 -5.810 1.00 0.00 C ATOM 0 H LEU A 79 22.924 6.752 -1.841 1.00 0.00 H new ATOM 0 HA LEU A 79 24.097 6.075 -4.456 1.00 0.00 H new ATOM 0 HB2 LEU A 79 23.166 8.607 -4.813 1.00 0.00 H new ATOM 0 HB3 LEU A 79 22.913 7.151 -5.755 1.00 0.00 H new ATOM 0 HG LEU A 79 20.911 6.747 -4.093 1.00 0.00 H new ATOM 0 HD11 LEU A 79 19.920 8.932 -3.372 1.00 0.00 H new ATOM 0 HD12 LEU A 79 21.510 8.666 -2.620 1.00 0.00 H new ATOM 0 HD13 LEU A 79 21.354 9.775 -4.003 1.00 0.00 H new ATOM 0 HD21 LEU A 79 19.404 8.002 -5.587 1.00 0.00 H new ATOM 0 HD22 LEU A 79 20.802 8.871 -6.264 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.645 7.115 -6.502 1.00 0.00 H new ATOM 1177 N CYS A 80 25.488 6.854 -2.186 1.00 0.00 N ATOM 1178 CA CYS A 80 26.540 7.419 -1.360 1.00 0.00 C ATOM 1179 C CYS A 80 27.779 7.704 -2.208 1.00 0.00 C ATOM 1180 O CYS A 80 28.449 8.712 -1.982 1.00 0.00 O ATOM 1181 CB CYS A 80 26.866 6.442 -0.228 1.00 0.00 C ATOM 1182 SG CYS A 80 25.411 6.231 0.837 1.00 0.00 S ATOM 0 H CYS A 80 25.377 5.847 -2.066 1.00 0.00 H new ATOM 0 HA CYS A 80 26.204 8.362 -0.929 1.00 0.00 H new ATOM 0 HB2 CYS A 80 27.169 5.480 -0.641 1.00 0.00 H new ATOM 0 HB3 CYS A 80 27.706 6.816 0.357 1.00 0.00 H new ATOM 0 HG CYS A 80 25.692 5.399 1.795 1.00 0.00 H new ATOM 1188 N GLY A 81 28.050 6.875 -3.217 1.00 0.00 N ATOM 1189 CA GLY A 81 29.298 6.920 -3.963 1.00 0.00 C ATOM 1190 C GLY A 81 30.334 6.030 -3.279 1.00 0.00 C ATOM 1191 O GLY A 81 30.067 5.468 -2.214 1.00 0.00 O ATOM 0 H GLY A 81 27.405 6.153 -3.537 1.00 0.00 H new ATOM 0 HA2 GLY A 81 29.134 6.584 -4.987 1.00 0.00 H new ATOM 0 HA3 GLY A 81 29.664 7.945 -4.019 1.00 0.00 H new ATOM 1195 N CYS A 82 31.515 5.902 -3.891 1.00 0.00 N ATOM 1196 CA CYS A 82 32.608 5.003 -3.537 1.00 0.00 C ATOM 1197 C CYS A 82 32.166 3.613 -3.039 1.00 0.00 C ATOM 1198 O CYS A 82 32.835 3.004 -2.201 1.00 0.00 O ATOM 1199 CB CYS A 82 33.508 5.761 -2.563 1.00 0.00 C ATOM 1200 SG CYS A 82 34.317 7.165 -3.392 1.00 0.00 S ATOM 0 H CYS A 82 31.745 6.468 -4.708 1.00 0.00 H new ATOM 0 HA CYS A 82 33.167 4.740 -4.435 1.00 0.00 H new ATOM 0 HB2 CYS A 82 32.918 6.121 -1.720 1.00 0.00 H new ATOM 0 HB3 CYS A 82 34.263 5.087 -2.159 1.00 0.00 H new ATOM 0 HG CYS A 82 35.074 7.793 -2.542 1.00 0.00 H new ATOM 1206 N GLY A 83 31.041 3.112 -3.556 1.00 0.00 N ATOM 1207 CA GLY A 83 30.408 1.861 -3.154 1.00 0.00 C ATOM 1208 C GLY A 83 30.137 1.740 -1.649 1.00 0.00 C ATOM 1209 O GLY A 83 30.111 0.627 -1.119 1.00 0.00 O ATOM 0 H GLY A 83 30.528 3.590 -4.297 1.00 0.00 H new ATOM 0 HA2 GLY A 83 29.464 1.757 -3.690 1.00 0.00 H new ATOM 0 HA3 GLY A 83 31.043 1.031 -3.464 1.00 0.00 H new ATOM 1213 N VAL A 84 29.972 2.863 -0.949 1.00 0.00 N ATOM 1214 CA VAL A 84 29.601 2.928 0.452 1.00 0.00 C ATOM 1215 C VAL A 84 28.190 2.339 0.616 1.00 0.00 C ATOM 1216 O VAL A 84 27.386 2.306 -0.319 1.00 0.00 O ATOM 1217 CB VAL A 84 29.767 4.380 0.944 1.00 0.00 C ATOM 1218 CG1 VAL A 84 29.271 4.639 2.375 1.00 0.00 C ATOM 1219 CG2 VAL A 84 31.240 4.826 0.876 1.00 0.00 C ATOM 0 H VAL A 84 30.100 3.785 -1.366 1.00 0.00 H new ATOM 0 HA VAL A 84 30.251 2.325 1.086 1.00 0.00 H new ATOM 0 HB VAL A 84 29.139 4.957 0.265 1.00 0.00 H new ATOM 0 HG11 VAL A 84 29.430 5.687 2.631 1.00 0.00 H new ATOM 0 HG12 VAL A 84 28.208 4.407 2.439 1.00 0.00 H new ATOM 0 HG13 VAL A 84 29.823 4.008 3.071 1.00 0.00 H new ATOM 0 HG21 VAL A 84 31.326 5.854 1.229 1.00 0.00 H new ATOM 0 HG22 VAL A 84 31.847 4.174 1.505 1.00 0.00 H new ATOM 0 HG23 VAL A 84 31.591 4.766 -0.154 1.00 0.00 H new ATOM 1229 N ASN A 85 27.895 1.874 1.828 1.00 0.00 N ATOM 1230 CA ASN A 85 26.585 1.373 2.247 1.00 0.00 C ATOM 1231 C ASN A 85 26.301 1.824 3.680 1.00 0.00 C ATOM 1232 O ASN A 85 27.159 2.426 4.328 1.00 0.00 O ATOM 1233 CB ASN A 85 26.449 -0.154 2.096 1.00 0.00 C ATOM 1234 CG ASN A 85 27.214 -0.903 3.177 1.00 0.00 C ATOM 1235 OD1 ASN A 85 26.645 -1.531 4.063 1.00 0.00 O ATOM 1236 ND2 ASN A 85 28.527 -0.810 3.117 1.00 0.00 N ATOM 0 H ASN A 85 28.588 1.834 2.575 1.00 0.00 H new ATOM 0 HA ASN A 85 25.836 1.800 1.580 1.00 0.00 H new ATOM 0 HB2 ASN A 85 25.396 -0.430 2.140 1.00 0.00 H new ATOM 0 HB3 ASN A 85 26.817 -0.456 1.116 1.00 0.00 H new ATOM 0 HD21 ASN A 85 29.104 -1.269 3.822 1.00 0.00 H new ATOM 0 HD22 ASN A 85 28.967 -0.279 2.365 1.00 0.00 H new ATOM 1243 N LEU A 86 25.089 1.549 4.157 1.00 0.00 N ATOM 1244 CA LEU A 86 24.547 2.077 5.404 1.00 0.00 C ATOM 1245 C LEU A 86 24.653 1.000 6.488 1.00 0.00 C ATOM 1246 O LEU A 86 24.038 -0.051 6.333 1.00 0.00 O ATOM 1247 CB LEU A 86 23.079 2.495 5.169 1.00 0.00 C ATOM 1248 CG LEU A 86 22.867 3.497 4.014 1.00 0.00 C ATOM 1249 CD1 LEU A 86 21.383 3.848 3.906 1.00 0.00 C ATOM 1250 CD2 LEU A 86 23.694 4.778 4.167 1.00 0.00 C ATOM 0 H LEU A 86 24.438 0.933 3.670 1.00 0.00 H new ATOM 0 HA LEU A 86 25.108 2.951 5.734 1.00 0.00 H new ATOM 0 HB2 LEU A 86 22.489 1.601 4.968 1.00 0.00 H new ATOM 0 HB3 LEU A 86 22.690 2.934 6.088 1.00 0.00 H new ATOM 0 HG LEU A 86 23.211 3.009 3.102 1.00 0.00 H new ATOM 0 HD11 LEU A 86 21.235 4.556 3.090 1.00 0.00 H new ATOM 0 HD12 LEU A 86 20.808 2.943 3.710 1.00 0.00 H new ATOM 0 HD13 LEU A 86 21.046 4.296 4.841 1.00 0.00 H new ATOM 0 HD21 LEU A 86 23.499 5.440 3.323 1.00 0.00 H new ATOM 0 HD22 LEU A 86 23.418 5.281 5.094 1.00 0.00 H new ATOM 0 HD23 LEU A 86 24.754 4.526 4.193 1.00 0.00 H new ATOM 1262 N PRO A 87 25.410 1.219 7.579 1.00 0.00 N ATOM 1263 CA PRO A 87 25.373 0.342 8.744 1.00 0.00 C ATOM 1264 C PRO A 87 23.958 0.074 9.313 1.00 0.00 C ATOM 1265 O PRO A 87 23.721 -1.069 9.715 1.00 0.00 O ATOM 1266 CB PRO A 87 26.281 0.997 9.792 1.00 0.00 C ATOM 1267 CG PRO A 87 27.241 1.843 8.959 1.00 0.00 C ATOM 1268 CD PRO A 87 26.380 2.286 7.779 1.00 0.00 C ATOM 0 HA PRO A 87 25.717 -0.650 8.451 1.00 0.00 H new ATOM 0 HB2 PRO A 87 25.710 1.609 10.490 1.00 0.00 H new ATOM 0 HB3 PRO A 87 26.813 0.252 10.383 1.00 0.00 H new ATOM 0 HG2 PRO A 87 27.620 2.695 9.523 1.00 0.00 H new ATOM 0 HG3 PRO A 87 28.106 1.266 8.632 1.00 0.00 H new ATOM 0 HD2 PRO A 87 25.883 3.233 7.990 1.00 0.00 H new ATOM 0 HD3 PRO A 87 26.987 2.437 6.886 1.00 0.00 H new ATOM 1276 N PRO A 88 23.027 1.056 9.403 1.00 0.00 N ATOM 1277 CA PRO A 88 21.718 0.829 10.030 1.00 0.00 C ATOM 1278 C PRO A 88 20.753 -0.016 9.180 1.00 0.00 C ATOM 1279 O PRO A 88 21.062 -0.419 8.061 1.00 0.00 O ATOM 1280 CB PRO A 88 21.162 2.232 10.316 1.00 0.00 C ATOM 1281 CG PRO A 88 21.812 3.083 9.232 1.00 0.00 C ATOM 1282 CD PRO A 88 23.193 2.490 9.138 1.00 0.00 C ATOM 0 HA PRO A 88 21.830 0.235 10.937 1.00 0.00 H new ATOM 0 HB2 PRO A 88 20.074 2.257 10.251 1.00 0.00 H new ATOM 0 HB3 PRO A 88 21.429 2.577 11.315 1.00 0.00 H new ATOM 0 HG2 PRO A 88 21.275 3.014 8.286 1.00 0.00 H new ATOM 0 HG3 PRO A 88 21.841 4.138 9.506 1.00 0.00 H new ATOM 0 HD2 PRO A 88 23.625 2.659 8.152 1.00 0.00 H new ATOM 0 HD3 PRO A 88 23.866 2.947 9.864 1.00 0.00 H new ATOM 1290 N GLU A 89 19.540 -0.229 9.706 1.00 0.00 N ATOM 1291 CA GLU A 89 18.427 -1.012 9.149 1.00 0.00 C ATOM 1292 C GLU A 89 18.038 -0.616 7.717 1.00 0.00 C ATOM 1293 O GLU A 89 17.337 -1.353 7.023 1.00 0.00 O ATOM 1294 CB GLU A 89 17.189 -0.836 10.047 1.00 0.00 C ATOM 1295 CG GLU A 89 17.240 -1.550 11.404 1.00 0.00 C ATOM 1296 CD GLU A 89 18.323 -1.051 12.383 1.00 0.00 C ATOM 1297 OE1 GLU A 89 18.668 0.152 12.375 1.00 0.00 O ATOM 1298 OE2 GLU A 89 18.831 -1.867 13.185 1.00 0.00 O ATOM 0 H GLU A 89 19.290 0.176 10.608 1.00 0.00 H new ATOM 0 HA GLU A 89 18.770 -2.046 9.115 1.00 0.00 H new ATOM 0 HB2 GLU A 89 17.041 0.229 10.224 1.00 0.00 H new ATOM 0 HB3 GLU A 89 16.315 -1.194 9.502 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.267 -1.447 11.885 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.398 -2.614 11.228 1.00 0.00 H new ATOM 1305 N TRP A 90 18.507 0.535 7.249 1.00 0.00 N ATOM 1306 CA TRP A 90 18.418 1.000 5.879 1.00 0.00 C ATOM 1307 C TRP A 90 19.208 0.121 4.892 1.00 0.00 C ATOM 1308 O TRP A 90 19.342 0.493 3.731 1.00 0.00 O ATOM 1309 CB TRP A 90 18.907 2.447 5.847 1.00 0.00 C ATOM 1310 CG TRP A 90 18.173 3.401 6.735 1.00 0.00 C ATOM 1311 CD1 TRP A 90 18.569 3.815 7.953 1.00 0.00 C ATOM 1312 CD2 TRP A 90 16.920 4.099 6.487 1.00 0.00 C ATOM 1313 NE1 TRP A 90 17.713 4.759 8.450 1.00 0.00 N ATOM 1314 CE2 TRP A 90 16.650 4.966 7.593 1.00 0.00 C ATOM 1315 CE3 TRP A 90 15.991 4.083 5.429 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 15.516 5.789 7.633 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 14.843 4.889 5.472 1.00 0.00 C ATOM 1318 CH2 TRP A 90 14.606 5.740 6.566 1.00 0.00 C ATOM 0 H TRP A 90 18.986 1.203 7.853 1.00 0.00 H new ATOM 0 HA TRP A 90 17.381 0.936 5.551 1.00 0.00 H new ATOM 0 HB2 TRP A 90 19.961 2.461 6.123 1.00 0.00 H new ATOM 0 HB3 TRP A 90 18.841 2.810 4.821 1.00 0.00 H new ATOM 0 HD1 TRP A 90 19.445 3.451 8.469 1.00 0.00 H new ATOM 0 HE1 TRP A 90 17.843 5.246 9.337 1.00 0.00 H new ATOM 0 HE3 TRP A 90 16.164 3.444 4.576 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 15.346 6.449 8.470 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 14.135 4.855 4.657 1.00 0.00 H new ATOM 0 HH2 TRP A 90 13.721 6.358 6.585 1.00 0.00 H new ATOM 1329 N VAL A 91 19.727 -1.032 5.320 1.00 0.00 N ATOM 1330 CA VAL A 91 20.367 -2.024 4.467 1.00 0.00 C ATOM 1331 C VAL A 91 19.674 -3.396 4.572 1.00 0.00 C ATOM 1332 O VAL A 91 20.107 -4.348 3.921 1.00 0.00 O ATOM 1333 CB VAL A 91 21.887 -2.010 4.751 1.00 0.00 C ATOM 1334 CG1 VAL A 91 22.284 -2.813 6.002 1.00 0.00 C ATOM 1335 CG2 VAL A 91 22.723 -2.469 3.549 1.00 0.00 C ATOM 0 H VAL A 91 19.711 -1.305 6.303 1.00 0.00 H new ATOM 0 HA VAL A 91 20.249 -1.772 3.413 1.00 0.00 H new ATOM 0 HB VAL A 91 22.114 -0.962 4.945 1.00 0.00 H new ATOM 0 HG11 VAL A 91 23.364 -2.760 6.141 1.00 0.00 H new ATOM 0 HG12 VAL A 91 21.785 -2.395 6.876 1.00 0.00 H new ATOM 0 HG13 VAL A 91 21.985 -3.854 5.876 1.00 0.00 H new ATOM 0 HG21 VAL A 91 23.781 -2.438 3.809 1.00 0.00 H new ATOM 0 HG22 VAL A 91 22.445 -3.488 3.280 1.00 0.00 H new ATOM 0 HG23 VAL A 91 22.537 -1.807 2.703 1.00 0.00 H new ATOM 1345 N THR A 92 18.583 -3.515 5.342 1.00 0.00 N ATOM 1346 CA THR A 92 17.918 -4.786 5.637 1.00 0.00 C ATOM 1347 C THR A 92 16.410 -4.734 5.340 1.00 0.00 C ATOM 1348 O THR A 92 15.624 -5.507 5.893 1.00 0.00 O ATOM 1349 CB THR A 92 18.264 -5.223 7.078 1.00 0.00 C ATOM 1350 OG1 THR A 92 18.016 -4.184 8.008 1.00 0.00 O ATOM 1351 CG2 THR A 92 19.744 -5.594 7.225 1.00 0.00 C ATOM 0 H THR A 92 18.132 -2.714 5.784 1.00 0.00 H new ATOM 0 HA THR A 92 18.295 -5.558 4.966 1.00 0.00 H new ATOM 0 HB THR A 92 17.632 -6.088 7.279 1.00 0.00 H new ATOM 0 HG1 THR A 92 18.243 -4.492 8.910 1.00 0.00 H new ATOM 0 HG21 THR A 92 19.943 -5.895 8.253 1.00 0.00 H new ATOM 0 HG22 THR A 92 19.981 -6.419 6.553 1.00 0.00 H new ATOM 0 HG23 THR A 92 20.362 -4.732 6.973 1.00 0.00 H new ATOM 1359 N GLN A 93 16.004 -3.819 4.455 1.00 0.00 N ATOM 1360 CA GLN A 93 14.647 -3.763 3.913 1.00 0.00 C ATOM 1361 C GLN A 93 14.564 -4.647 2.657 1.00 0.00 C ATOM 1362 O GLN A 93 15.550 -5.283 2.273 1.00 0.00 O ATOM 1363 CB GLN A 93 14.240 -2.303 3.639 1.00 0.00 C ATOM 1364 CG GLN A 93 14.433 -1.365 4.845 1.00 0.00 C ATOM 1365 CD GLN A 93 13.799 -1.904 6.135 1.00 0.00 C ATOM 1366 OE1 GLN A 93 12.638 -2.304 6.179 1.00 0.00 O ATOM 1367 NE2 GLN A 93 14.567 -1.979 7.210 1.00 0.00 N ATOM 0 H GLN A 93 16.617 -3.089 4.092 1.00 0.00 H new ATOM 0 HA GLN A 93 13.936 -4.154 4.641 1.00 0.00 H new ATOM 0 HB2 GLN A 93 14.824 -1.925 2.800 1.00 0.00 H new ATOM 0 HB3 GLN A 93 13.193 -2.279 3.336 1.00 0.00 H new ATOM 0 HG2 GLN A 93 15.499 -1.209 5.009 1.00 0.00 H new ATOM 0 HG3 GLN A 93 14.000 -0.392 4.614 1.00 0.00 H new ATOM 0 HE21 GLN A 93 15.531 -1.647 7.173 1.00 0.00 H new ATOM 0 HE22 GLN A 93 14.195 -2.369 8.076 1.00 0.00 H new ATOM 1376 N GLU A 94 13.388 -4.719 2.026 1.00 0.00 N ATOM 1377 CA GLU A 94 13.099 -5.638 0.938 1.00 0.00 C ATOM 1378 C GLU A 94 14.016 -5.450 -0.270 1.00 0.00 C ATOM 1379 O GLU A 94 14.376 -6.435 -0.919 1.00 0.00 O ATOM 1380 CB GLU A 94 11.617 -5.506 0.546 1.00 0.00 C ATOM 1381 CG GLU A 94 11.086 -6.867 0.100 1.00 0.00 C ATOM 1382 CD GLU A 94 9.583 -6.868 -0.241 1.00 0.00 C ATOM 1383 OE1 GLU A 94 9.212 -6.566 -1.399 1.00 0.00 O ATOM 1384 OE2 GLU A 94 8.764 -7.256 0.625 1.00 0.00 O ATOM 0 H GLU A 94 12.597 -4.123 2.269 1.00 0.00 H new ATOM 0 HA GLU A 94 13.296 -6.649 1.294 1.00 0.00 H new ATOM 0 HB2 GLU A 94 11.037 -5.137 1.392 1.00 0.00 H new ATOM 0 HB3 GLU A 94 11.506 -4.779 -0.258 1.00 0.00 H new ATOM 0 HG2 GLU A 94 11.647 -7.197 -0.774 1.00 0.00 H new ATOM 0 HG3 GLU A 94 11.270 -7.595 0.890 1.00 0.00 H new ATOM 1391 N ILE A 95 14.435 -4.213 -0.547 1.00 0.00 N ATOM 1392 CA ILE A 95 15.354 -3.893 -1.631 1.00 0.00 C ATOM 1393 C ILE A 95 16.386 -2.929 -1.052 1.00 0.00 C ATOM 1394 O ILE A 95 16.015 -1.970 -0.367 1.00 0.00 O ATOM 1395 CB ILE A 95 14.572 -3.305 -2.819 1.00 0.00 C ATOM 1396 CG1 ILE A 95 13.675 -4.416 -3.417 1.00 0.00 C ATOM 1397 CG2 ILE A 95 15.504 -2.676 -3.879 1.00 0.00 C ATOM 1398 CD1 ILE A 95 13.018 -4.059 -4.745 1.00 0.00 C ATOM 0 H ILE A 95 14.138 -3.396 -0.013 1.00 0.00 H new ATOM 0 HA ILE A 95 15.867 -4.773 -2.020 1.00 0.00 H new ATOM 0 HB ILE A 95 13.944 -2.487 -2.465 1.00 0.00 H new ATOM 0 HG12 ILE A 95 14.276 -5.315 -3.555 1.00 0.00 H new ATOM 0 HG13 ILE A 95 12.895 -4.662 -2.696 1.00 0.00 H new ATOM 0 HG21 ILE A 95 14.906 -2.275 -4.697 1.00 0.00 H new ATOM 0 HG22 ILE A 95 16.082 -1.872 -3.424 1.00 0.00 H new ATOM 0 HG23 ILE A 95 16.182 -3.437 -4.265 1.00 0.00 H new ATOM 0 HD11 ILE A 95 12.410 -4.896 -5.087 1.00 0.00 H new ATOM 0 HD12 ILE A 95 12.386 -3.181 -4.614 1.00 0.00 H new ATOM 0 HD13 ILE A 95 13.788 -3.844 -5.486 1.00 0.00 H new ATOM 1410 N PHE A 96 17.660 -3.164 -1.368 1.00 0.00 N ATOM 1411 CA PHE A 96 18.747 -2.252 -1.103 1.00 0.00 C ATOM 1412 C PHE A 96 19.677 -2.291 -2.307 1.00 0.00 C ATOM 1413 O PHE A 96 20.041 -3.372 -2.778 1.00 0.00 O ATOM 1414 CB PHE A 96 19.532 -2.579 0.176 1.00 0.00 C ATOM 1415 CG PHE A 96 20.706 -1.622 0.326 1.00 0.00 C ATOM 1416 CD1 PHE A 96 20.495 -0.340 0.868 1.00 0.00 C ATOM 1417 CD2 PHE A 96 21.956 -1.933 -0.253 1.00 0.00 C ATOM 1418 CE1 PHE A 96 21.534 0.605 0.862 1.00 0.00 C ATOM 1419 CE2 PHE A 96 22.974 -0.962 -0.316 1.00 0.00 C ATOM 1420 CZ PHE A 96 22.771 0.298 0.271 1.00 0.00 C ATOM 0 H PHE A 96 17.961 -4.023 -1.829 1.00 0.00 H new ATOM 0 HA PHE A 96 18.326 -1.260 -0.941 1.00 0.00 H new ATOM 0 HB2 PHE A 96 18.877 -2.503 1.044 1.00 0.00 H new ATOM 0 HB3 PHE A 96 19.893 -3.607 0.138 1.00 0.00 H new ATOM 0 HD1 PHE A 96 19.534 -0.083 1.289 1.00 0.00 H new ATOM 0 HD2 PHE A 96 22.132 -2.922 -0.650 1.00 0.00 H new ATOM 0 HE1 PHE A 96 21.381 1.574 1.314 1.00 0.00 H new ATOM 0 HE2 PHE A 96 23.906 -1.185 -0.813 1.00 0.00 H new ATOM 0 HZ PHE A 96 23.565 1.030 0.268 1.00 0.00 H new ATOM 1430 N GLU A 97 20.079 -1.115 -2.773 1.00 0.00 N ATOM 1431 CA GLU A 97 21.139 -0.923 -3.750 1.00 0.00 C ATOM 1432 C GLU A 97 21.869 0.367 -3.390 1.00 0.00 C ATOM 1433 O GLU A 97 21.295 1.248 -2.752 1.00 0.00 O ATOM 1434 CB GLU A 97 20.586 -0.780 -5.178 1.00 0.00 C ATOM 1435 CG GLU A 97 20.234 -2.119 -5.827 1.00 0.00 C ATOM 1436 CD GLU A 97 19.869 -1.971 -7.317 1.00 0.00 C ATOM 1437 OE1 GLU A 97 19.262 -0.950 -7.715 1.00 0.00 O ATOM 1438 OE2 GLU A 97 20.185 -2.893 -8.105 1.00 0.00 O ATOM 0 H GLU A 97 19.659 -0.237 -2.468 1.00 0.00 H new ATOM 0 HA GLU A 97 21.796 -1.792 -3.728 1.00 0.00 H new ATOM 0 HB2 GLU A 97 19.696 -0.151 -5.154 1.00 0.00 H new ATOM 0 HB3 GLU A 97 21.323 -0.267 -5.796 1.00 0.00 H new ATOM 0 HG2 GLU A 97 21.079 -2.801 -5.729 1.00 0.00 H new ATOM 0 HG3 GLU A 97 19.397 -2.569 -5.294 1.00 0.00 H new ATOM 1445 N ASP A 98 23.111 0.489 -3.853 1.00 0.00 N ATOM 1446 CA ASP A 98 23.891 1.721 -3.823 1.00 0.00 C ATOM 1447 C ASP A 98 24.242 2.108 -5.260 1.00 0.00 C ATOM 1448 O ASP A 98 24.888 1.338 -5.974 1.00 0.00 O ATOM 1449 CB ASP A 98 25.151 1.644 -2.959 1.00 0.00 C ATOM 1450 CG ASP A 98 25.905 2.985 -3.075 1.00 0.00 C ATOM 1451 OD1 ASP A 98 25.366 4.020 -2.619 1.00 0.00 O ATOM 1452 OD2 ASP A 98 26.999 3.009 -3.683 1.00 0.00 O ATOM 0 H ASP A 98 23.617 -0.292 -4.272 1.00 0.00 H new ATOM 0 HA ASP A 98 23.273 2.486 -3.352 1.00 0.00 H new ATOM 0 HB2 ASP A 98 24.887 1.446 -1.920 1.00 0.00 H new ATOM 0 HB3 ASP A 98 25.787 0.822 -3.288 1.00 0.00 H new ATOM 1457 N TRP A 99 23.760 3.267 -5.706 1.00 0.00 N ATOM 1458 CA TRP A 99 23.868 3.750 -7.075 1.00 0.00 C ATOM 1459 C TRP A 99 25.100 4.643 -7.206 1.00 0.00 C ATOM 1460 O TRP A 99 25.148 5.757 -6.682 1.00 0.00 O ATOM 1461 CB TRP A 99 22.556 4.425 -7.490 1.00 0.00 C ATOM 1462 CG TRP A 99 21.335 3.557 -7.650 1.00 0.00 C ATOM 1463 CD1 TRP A 99 21.216 2.222 -7.441 1.00 0.00 C ATOM 1464 CD2 TRP A 99 20.011 3.992 -8.076 1.00 0.00 C ATOM 1465 NE1 TRP A 99 19.932 1.808 -7.742 1.00 0.00 N ATOM 1466 CE2 TRP A 99 19.125 2.869 -8.094 1.00 0.00 C ATOM 1467 CE3 TRP A 99 19.477 5.250 -8.426 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 17.759 3.001 -8.409 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 18.113 5.399 -8.718 1.00 0.00 C ATOM 1470 CH2 TRP A 99 17.263 4.280 -8.697 1.00 0.00 C ATOM 0 H TRP A 99 23.265 3.918 -5.097 1.00 0.00 H new ATOM 0 HA TRP A 99 24.015 2.924 -7.771 1.00 0.00 H new ATOM 0 HB2 TRP A 99 22.326 5.192 -6.750 1.00 0.00 H new ATOM 0 HB3 TRP A 99 22.728 4.937 -8.437 1.00 0.00 H new ATOM 0 HD1 TRP A 99 22.008 1.577 -7.091 1.00 0.00 H new ATOM 0 HE1 TRP A 99 19.620 0.837 -7.708 1.00 0.00 H new ATOM 0 HE3 TRP A 99 20.128 6.111 -8.470 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 17.110 2.138 -8.428 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 17.716 6.374 -8.959 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.211 4.408 -8.906 1.00 0.00 H new ATOM 1481 N GLN A 100 26.110 4.116 -7.901 1.00 0.00 N ATOM 1482 CA GLN A 100 27.362 4.795 -8.185 1.00 0.00 C ATOM 1483 C GLN A 100 27.099 5.883 -9.236 1.00 0.00 C ATOM 1484 O GLN A 100 26.892 5.573 -10.412 1.00 0.00 O ATOM 1485 CB GLN A 100 28.391 3.754 -8.671 1.00 0.00 C ATOM 1486 CG GLN A 100 29.838 4.189 -8.403 1.00 0.00 C ATOM 1487 CD GLN A 100 30.286 3.738 -7.013 1.00 0.00 C ATOM 1488 OE1 GLN A 100 30.069 4.422 -6.020 1.00 0.00 O ATOM 1489 NE2 GLN A 100 30.885 2.563 -6.898 1.00 0.00 N ATOM 0 H GLN A 100 26.071 3.174 -8.291 1.00 0.00 H new ATOM 0 HA GLN A 100 27.768 5.275 -7.295 1.00 0.00 H new ATOM 0 HB2 GLN A 100 28.203 2.802 -8.174 1.00 0.00 H new ATOM 0 HB3 GLN A 100 28.257 3.587 -9.740 1.00 0.00 H new ATOM 0 HG2 GLN A 100 30.497 3.764 -9.159 1.00 0.00 H new ATOM 0 HG3 GLN A 100 29.918 5.273 -8.483 1.00 0.00 H new ATOM 0 HE21 GLN A 100 31.063 1.998 -7.728 1.00 0.00 H new ATOM 0 HE22 GLN A 100 31.168 2.223 -5.979 1.00 0.00 H new ATOM 1498 N LEU A 101 27.082 7.151 -8.821 1.00 0.00 N ATOM 1499 CA LEU A 101 26.810 8.306 -9.669 1.00 0.00 C ATOM 1500 C LEU A 101 27.819 9.402 -9.347 1.00 0.00 C ATOM 1501 O LEU A 101 28.256 9.522 -8.201 1.00 0.00 O ATOM 1502 CB LEU A 101 25.400 8.840 -9.360 1.00 0.00 C ATOM 1503 CG LEU A 101 24.207 8.256 -10.124 1.00 0.00 C ATOM 1504 CD1 LEU A 101 24.422 8.076 -11.628 1.00 0.00 C ATOM 1505 CD2 LEU A 101 23.696 6.949 -9.538 1.00 0.00 C ATOM 0 H LEU A 101 27.264 7.408 -7.851 1.00 0.00 H new ATOM 0 HA LEU A 101 26.881 8.017 -10.717 1.00 0.00 H new ATOM 0 HB2 LEU A 101 25.216 8.691 -8.296 1.00 0.00 H new ATOM 0 HB3 LEU A 101 25.409 9.916 -9.534 1.00 0.00 H new ATOM 0 HG LEU A 101 23.450 9.030 -9.995 1.00 0.00 H new ATOM 0 HD11 LEU A 101 23.521 7.657 -12.077 1.00 0.00 H new ATOM 0 HD12 LEU A 101 24.638 9.043 -12.083 1.00 0.00 H new ATOM 0 HD13 LEU A 101 25.260 7.400 -11.797 1.00 0.00 H new ATOM 0 HD21 LEU A 101 22.851 6.592 -10.127 1.00 0.00 H new ATOM 0 HD22 LEU A 101 24.493 6.205 -9.558 1.00 0.00 H new ATOM 0 HD23 LEU A 101 23.377 7.112 -8.509 1.00 0.00 H new ATOM 1517 N GLU A 102 28.128 10.256 -10.318 1.00 0.00 N ATOM 1518 CA GLU A 102 29.068 11.356 -10.185 1.00 0.00 C ATOM 1519 C GLU A 102 28.391 12.569 -9.557 1.00 0.00 C ATOM 1520 O GLU A 102 28.047 13.514 -10.260 1.00 0.00 O ATOM 1521 CB GLU A 102 29.755 11.659 -11.530 1.00 0.00 C ATOM 1522 CG GLU A 102 30.649 10.499 -11.990 1.00 0.00 C ATOM 1523 CD GLU A 102 31.415 10.848 -13.278 1.00 0.00 C ATOM 1524 OE1 GLU A 102 30.900 10.591 -14.389 1.00 0.00 O ATOM 1525 OE2 GLU A 102 32.557 11.356 -13.193 1.00 0.00 O ATOM 0 H GLU A 102 27.715 10.196 -11.249 1.00 0.00 H new ATOM 0 HA GLU A 102 29.866 11.065 -9.501 1.00 0.00 H new ATOM 0 HB2 GLU A 102 28.997 11.856 -12.288 1.00 0.00 H new ATOM 0 HB3 GLU A 102 30.355 12.564 -11.436 1.00 0.00 H new ATOM 0 HG2 GLU A 102 31.358 10.251 -11.200 1.00 0.00 H new ATOM 0 HG3 GLU A 102 30.037 9.613 -12.159 1.00 0.00 H new ATOM 1532 N ASP A 103 28.185 12.485 -8.234 1.00 0.00 N ATOM 1533 CA ASP A 103 27.573 13.483 -7.347 1.00 0.00 C ATOM 1534 C ASP A 103 27.632 14.904 -7.932 1.00 0.00 C ATOM 1535 O ASP A 103 28.690 15.541 -7.880 1.00 0.00 O ATOM 1536 CB ASP A 103 28.225 13.449 -5.970 1.00 0.00 C ATOM 1537 CG ASP A 103 27.841 14.665 -5.118 1.00 0.00 C ATOM 1538 OD1 ASP A 103 26.688 15.143 -5.205 1.00 0.00 O ATOM 1539 OD2 ASP A 103 28.708 15.125 -4.345 1.00 0.00 O ATOM 0 H ASP A 103 28.464 11.651 -7.717 1.00 0.00 H new ATOM 0 HA ASP A 103 26.520 13.218 -7.251 1.00 0.00 H new ATOM 0 HB2 ASP A 103 27.929 12.537 -5.452 1.00 0.00 H new ATOM 0 HB3 ASP A 103 29.309 13.414 -6.083 1.00 0.00 H new ATOM 1544 N PRO A 104 26.530 15.370 -8.543 1.00 0.00 N ATOM 1545 CA PRO A 104 26.480 16.592 -9.328 1.00 0.00 C ATOM 1546 C PRO A 104 26.822 17.897 -8.598 1.00 0.00 C ATOM 1547 O PRO A 104 26.882 18.939 -9.247 1.00 0.00 O ATOM 1548 CB PRO A 104 25.086 16.647 -9.943 1.00 0.00 C ATOM 1549 CG PRO A 104 24.626 15.196 -9.965 1.00 0.00 C ATOM 1550 CD PRO A 104 25.368 14.542 -8.807 1.00 0.00 C ATOM 0 HA PRO A 104 27.276 16.536 -10.070 1.00 0.00 H new ATOM 0 HB2 PRO A 104 24.414 17.268 -9.351 1.00 0.00 H new ATOM 0 HB3 PRO A 104 25.111 17.072 -10.947 1.00 0.00 H new ATOM 0 HG2 PRO A 104 23.546 15.120 -9.838 1.00 0.00 H new ATOM 0 HG3 PRO A 104 24.869 14.717 -10.913 1.00 0.00 H new ATOM 0 HD2 PRO A 104 24.730 14.476 -7.925 1.00 0.00 H new ATOM 0 HD3 PRO A 104 25.666 13.525 -9.062 1.00 0.00 H new ATOM 1558 N ASP A 105 27.058 17.889 -7.286 1.00 0.00 N ATOM 1559 CA ASP A 105 27.431 19.083 -6.530 1.00 0.00 C ATOM 1560 C ASP A 105 28.693 19.746 -7.110 1.00 0.00 C ATOM 1561 O ASP A 105 29.819 19.285 -6.908 1.00 0.00 O ATOM 1562 CB ASP A 105 27.596 18.741 -5.048 1.00 0.00 C ATOM 1563 CG ASP A 105 27.845 19.998 -4.193 1.00 0.00 C ATOM 1564 OD1 ASP A 105 28.976 20.533 -4.182 1.00 0.00 O ATOM 1565 OD2 ASP A 105 26.908 20.441 -3.494 1.00 0.00 O ATOM 0 H ASP A 105 26.995 17.047 -6.714 1.00 0.00 H new ATOM 0 HA ASP A 105 26.626 19.813 -6.619 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.701 18.231 -4.691 1.00 0.00 H new ATOM 0 HB3 ASP A 105 28.428 18.048 -4.926 1.00 0.00 H new ATOM 1570 N GLY A 106 28.481 20.818 -7.875 1.00 0.00 N ATOM 1571 CA GLY A 106 29.502 21.732 -8.376 1.00 0.00 C ATOM 1572 C GLY A 106 30.100 21.299 -9.716 1.00 0.00 C ATOM 1573 O GLY A 106 31.196 21.751 -10.057 1.00 0.00 O ATOM 0 H GLY A 106 27.543 21.083 -8.176 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.068 22.726 -8.484 1.00 0.00 H new ATOM 0 HA3 GLY A 106 30.301 21.812 -7.639 1.00 0.00 H new ATOM 1577 N GLN A 107 29.430 20.411 -10.461 1.00 0.00 N ATOM 1578 CA GLN A 107 30.011 19.769 -11.638 1.00 0.00 C ATOM 1579 C GLN A 107 29.669 20.499 -12.941 1.00 0.00 C ATOM 1580 O GLN A 107 28.941 21.496 -12.959 1.00 0.00 O ATOM 1581 CB GLN A 107 29.552 18.306 -11.715 1.00 0.00 C ATOM 1582 CG GLN A 107 29.691 17.518 -10.410 1.00 0.00 C ATOM 1583 CD GLN A 107 31.110 17.205 -9.942 1.00 0.00 C ATOM 1584 OE1 GLN A 107 32.113 17.645 -10.499 1.00 0.00 O ATOM 1585 NE2 GLN A 107 31.205 16.401 -8.898 1.00 0.00 N ATOM 0 H GLN A 107 28.473 20.121 -10.262 1.00 0.00 H new ATOM 0 HA GLN A 107 31.094 19.813 -11.526 1.00 0.00 H new ATOM 0 HB2 GLN A 107 28.508 18.284 -12.026 1.00 0.00 H new ATOM 0 HB3 GLN A 107 30.127 17.800 -12.491 1.00 0.00 H new ATOM 0 HG2 GLN A 107 29.189 18.077 -9.621 1.00 0.00 H new ATOM 0 HG3 GLN A 107 29.155 16.576 -10.524 1.00 0.00 H new ATOM 0 HE21 GLN A 107 30.361 16.046 -8.449 1.00 0.00 H new ATOM 0 HE22 GLN A 107 32.123 16.135 -8.541 1.00 0.00 H new ATOM 1594 N SER A 108 30.204 19.973 -14.042 1.00 0.00 N ATOM 1595 CA SER A 108 29.952 20.424 -15.401 1.00 0.00 C ATOM 1596 C SER A 108 28.566 19.960 -15.857 1.00 0.00 C ATOM 1597 O SER A 108 28.082 18.922 -15.397 1.00 0.00 O ATOM 1598 CB SER A 108 31.031 19.797 -16.291 1.00 0.00 C ATOM 1599 OG SER A 108 32.329 20.159 -15.843 1.00 0.00 O ATOM 0 H SER A 108 30.853 19.187 -14.004 1.00 0.00 H new ATOM 0 HA SER A 108 29.982 21.512 -15.461 1.00 0.00 H new ATOM 0 HB2 SER A 108 30.929 18.712 -16.284 1.00 0.00 H new ATOM 0 HB3 SER A 108 30.893 20.124 -17.322 1.00 0.00 H new ATOM 0 HG SER A 108 33.002 19.747 -16.424 1.00 0.00 H new ATOM 1605 N LEU A 109 27.951 20.667 -16.814 1.00 0.00 N ATOM 1606 CA LEU A 109 26.634 20.301 -17.348 1.00 0.00 C ATOM 1607 C LEU A 109 26.636 18.889 -17.917 1.00 0.00 C ATOM 1608 O LEU A 109 25.622 18.205 -17.846 1.00 0.00 O ATOM 1609 CB LEU A 109 26.174 21.258 -18.459 1.00 0.00 C ATOM 1610 CG LEU A 109 25.892 22.695 -17.986 1.00 0.00 C ATOM 1611 CD1 LEU A 109 25.528 23.567 -19.193 1.00 0.00 C ATOM 1612 CD2 LEU A 109 24.758 22.767 -16.953 1.00 0.00 C ATOM 0 H LEU A 109 28.350 21.504 -17.238 1.00 0.00 H new ATOM 0 HA LEU A 109 25.945 20.365 -16.506 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.939 21.288 -19.235 1.00 0.00 H new ATOM 0 HB3 LEU A 109 25.270 20.856 -18.917 1.00 0.00 H new ATOM 0 HG LEU A 109 26.799 23.059 -17.503 1.00 0.00 H new ATOM 0 HD11 LEU A 109 25.328 24.585 -18.859 1.00 0.00 H new ATOM 0 HD12 LEU A 109 26.357 23.573 -19.901 1.00 0.00 H new ATOM 0 HD13 LEU A 109 24.640 23.163 -19.679 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.603 23.804 -16.655 1.00 0.00 H new ATOM 0 HD22 LEU A 109 23.841 22.374 -17.392 1.00 0.00 H new ATOM 0 HD23 LEU A 109 25.025 22.174 -16.078 1.00 0.00 H new ATOM 1624 N GLU A 110 27.762 18.449 -18.474 1.00 0.00 N ATOM 1625 CA GLU A 110 27.901 17.107 -19.020 1.00 0.00 C ATOM 1626 C GLU A 110 27.785 16.051 -17.912 1.00 0.00 C ATOM 1627 O GLU A 110 27.113 15.038 -18.108 1.00 0.00 O ATOM 1628 CB GLU A 110 29.234 17.033 -19.775 1.00 0.00 C ATOM 1629 CG GLU A 110 29.414 15.702 -20.519 1.00 0.00 C ATOM 1630 CD GLU A 110 30.711 15.691 -21.347 1.00 0.00 C ATOM 1631 OE1 GLU A 110 31.778 15.309 -20.815 1.00 0.00 O ATOM 1632 OE2 GLU A 110 30.677 16.047 -22.547 1.00 0.00 O ATOM 0 H GLU A 110 28.605 19.017 -18.558 1.00 0.00 H new ATOM 0 HA GLU A 110 27.093 16.892 -19.720 1.00 0.00 H new ATOM 0 HB2 GLU A 110 29.290 17.855 -20.489 1.00 0.00 H new ATOM 0 HB3 GLU A 110 30.055 17.166 -19.070 1.00 0.00 H new ATOM 0 HG2 GLU A 110 29.432 14.882 -19.801 1.00 0.00 H new ATOM 0 HG3 GLU A 110 28.560 15.532 -21.175 1.00 0.00 H new ATOM 1639 N VAL A 111 28.370 16.292 -16.733 1.00 0.00 N ATOM 1640 CA VAL A 111 28.231 15.400 -15.580 1.00 0.00 C ATOM 1641 C VAL A 111 26.771 15.411 -15.142 1.00 0.00 C ATOM 1642 O VAL A 111 26.174 14.347 -14.984 1.00 0.00 O ATOM 1643 CB VAL A 111 29.165 15.835 -14.437 1.00 0.00 C ATOM 1644 CG1 VAL A 111 28.958 14.991 -13.170 1.00 0.00 C ATOM 1645 CG2 VAL A 111 30.640 15.748 -14.862 1.00 0.00 C ATOM 0 H VAL A 111 28.952 17.110 -16.553 1.00 0.00 H new ATOM 0 HA VAL A 111 28.520 14.385 -15.854 1.00 0.00 H new ATOM 0 HB VAL A 111 28.911 16.871 -14.210 1.00 0.00 H new ATOM 0 HG11 VAL A 111 29.638 15.333 -12.390 1.00 0.00 H new ATOM 0 HG12 VAL A 111 27.929 15.097 -12.827 1.00 0.00 H new ATOM 0 HG13 VAL A 111 29.160 13.943 -13.394 1.00 0.00 H new ATOM 0 HG21 VAL A 111 31.276 16.061 -14.034 1.00 0.00 H new ATOM 0 HG22 VAL A 111 30.880 14.720 -15.135 1.00 0.00 H new ATOM 0 HG23 VAL A 111 30.811 16.400 -15.718 1.00 0.00 H new ATOM 1655 N PHE A 112 26.184 16.603 -15.001 1.00 0.00 N ATOM 1656 CA PHE A 112 24.791 16.766 -14.618 1.00 0.00 C ATOM 1657 C PHE A 112 23.873 15.973 -15.546 1.00 0.00 C ATOM 1658 O PHE A 112 23.078 15.175 -15.063 1.00 0.00 O ATOM 1659 CB PHE A 112 24.427 18.253 -14.633 1.00 0.00 C ATOM 1660 CG PHE A 112 24.584 18.960 -13.309 1.00 0.00 C ATOM 1661 CD1 PHE A 112 23.598 18.815 -12.312 1.00 0.00 C ATOM 1662 CD2 PHE A 112 25.703 19.779 -13.077 1.00 0.00 C ATOM 1663 CE1 PHE A 112 23.744 19.471 -11.080 1.00 0.00 C ATOM 1664 CE2 PHE A 112 25.854 20.421 -11.842 1.00 0.00 C ATOM 1665 CZ PHE A 112 24.889 20.245 -10.842 1.00 0.00 C ATOM 0 H PHE A 112 26.672 17.486 -15.152 1.00 0.00 H new ATOM 0 HA PHE A 112 24.654 16.377 -13.609 1.00 0.00 H new ATOM 0 HB2 PHE A 112 25.049 18.757 -15.373 1.00 0.00 H new ATOM 0 HB3 PHE A 112 23.393 18.356 -14.963 1.00 0.00 H new ATOM 0 HD1 PHE A 112 22.730 18.199 -12.496 1.00 0.00 H new ATOM 0 HD2 PHE A 112 26.445 19.913 -13.850 1.00 0.00 H new ATOM 0 HE1 PHE A 112 22.981 19.381 -10.321 1.00 0.00 H new ATOM 0 HE2 PHE A 112 26.713 21.051 -11.661 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.028 20.710 -9.877 1.00 0.00 H new ATOM 1675 N ARG A 113 23.986 16.147 -16.865 1.00 0.00 N ATOM 1676 CA ARG A 113 23.189 15.421 -17.851 1.00 0.00 C ATOM 1677 C ARG A 113 23.422 13.920 -17.769 1.00 0.00 C ATOM 1678 O ARG A 113 22.442 13.175 -17.801 1.00 0.00 O ATOM 1679 CB ARG A 113 23.488 15.958 -19.265 1.00 0.00 C ATOM 1680 CG ARG A 113 22.569 17.142 -19.605 1.00 0.00 C ATOM 1681 CD ARG A 113 23.237 18.233 -20.437 1.00 0.00 C ATOM 1682 NE ARG A 113 22.253 19.259 -20.820 1.00 0.00 N ATOM 1683 CZ ARG A 113 22.527 20.393 -21.477 1.00 0.00 C ATOM 1684 NH1 ARG A 113 23.777 20.705 -21.815 1.00 0.00 N ATOM 1685 NH2 ARG A 113 21.532 21.209 -21.793 1.00 0.00 N ATOM 0 H ARG A 113 24.644 16.806 -17.282 1.00 0.00 H new ATOM 0 HA ARG A 113 22.135 15.588 -17.629 1.00 0.00 H new ATOM 0 HB2 ARG A 113 24.530 16.271 -19.327 1.00 0.00 H new ATOM 0 HB3 ARG A 113 23.350 15.163 -19.998 1.00 0.00 H new ATOM 0 HG2 ARG A 113 21.700 16.769 -20.146 1.00 0.00 H new ATOM 0 HG3 ARG A 113 22.203 17.581 -18.677 1.00 0.00 H new ATOM 0 HD2 ARG A 113 24.046 18.690 -19.867 1.00 0.00 H new ATOM 0 HD3 ARG A 113 23.684 17.796 -21.330 1.00 0.00 H new ATOM 0 HE ARG A 113 21.280 19.092 -20.563 1.00 0.00 H new ATOM 0 HH11 ARG A 113 24.543 20.076 -21.573 1.00 0.00 H new ATOM 0 HH12 ARG A 113 23.968 21.573 -22.315 1.00 0.00 H new ATOM 0 HH21 ARG A 113 20.575 20.969 -21.536 1.00 0.00 H new ATOM 0 HH22 ARG A 113 21.724 22.077 -22.293 1.00 0.00 H new ATOM 1699 N THR A 114 24.671 13.468 -17.638 1.00 0.00 N ATOM 1700 CA THR A 114 24.980 12.055 -17.573 1.00 0.00 C ATOM 1701 C THR A 114 24.295 11.446 -16.346 1.00 0.00 C ATOM 1702 O THR A 114 23.569 10.458 -16.466 1.00 0.00 O ATOM 1703 CB THR A 114 26.510 11.911 -17.551 1.00 0.00 C ATOM 1704 OG1 THR A 114 27.072 12.455 -18.729 1.00 0.00 O ATOM 1705 CG2 THR A 114 26.937 10.454 -17.456 1.00 0.00 C ATOM 0 H THR A 114 25.488 14.076 -17.575 1.00 0.00 H new ATOM 0 HA THR A 114 24.604 11.510 -18.439 1.00 0.00 H new ATOM 0 HB THR A 114 26.866 12.448 -16.672 1.00 0.00 H new ATOM 0 HG1 THR A 114 27.279 13.402 -18.586 1.00 0.00 H new ATOM 0 HG21 THR A 114 28.025 10.394 -17.443 1.00 0.00 H new ATOM 0 HG22 THR A 114 26.538 10.017 -16.540 1.00 0.00 H new ATOM 0 HG23 THR A 114 26.554 9.906 -18.316 1.00 0.00 H new ATOM 1713 N VAL A 115 24.473 12.053 -15.172 1.00 0.00 N ATOM 1714 CA VAL A 115 23.899 11.554 -13.937 1.00 0.00 C ATOM 1715 C VAL A 115 22.381 11.664 -13.982 1.00 0.00 C ATOM 1716 O VAL A 115 21.718 10.699 -13.628 1.00 0.00 O ATOM 1717 CB VAL A 115 24.531 12.280 -12.743 1.00 0.00 C ATOM 1718 CG1 VAL A 115 23.836 11.964 -11.410 1.00 0.00 C ATOM 1719 CG2 VAL A 115 26.018 11.913 -12.632 1.00 0.00 C ATOM 0 H VAL A 115 25.021 12.905 -15.058 1.00 0.00 H new ATOM 0 HA VAL A 115 24.124 10.495 -13.815 1.00 0.00 H new ATOM 0 HB VAL A 115 24.410 13.347 -12.931 1.00 0.00 H new ATOM 0 HG11 VAL A 115 24.330 12.508 -10.604 1.00 0.00 H new ATOM 0 HG12 VAL A 115 22.790 12.266 -11.464 1.00 0.00 H new ATOM 0 HG13 VAL A 115 23.894 10.893 -11.214 1.00 0.00 H new ATOM 0 HG21 VAL A 115 26.459 12.433 -11.781 1.00 0.00 H new ATOM 0 HG22 VAL A 115 26.118 10.837 -12.491 1.00 0.00 H new ATOM 0 HG23 VAL A 115 26.535 12.208 -13.545 1.00 0.00 H new ATOM 1729 N ARG A 116 21.807 12.772 -14.453 1.00 0.00 N ATOM 1730 CA ARG A 116 20.359 12.950 -14.517 1.00 0.00 C ATOM 1731 C ARG A 116 19.730 11.854 -15.370 1.00 0.00 C ATOM 1732 O ARG A 116 18.723 11.273 -14.967 1.00 0.00 O ATOM 1733 CB ARG A 116 20.068 14.372 -15.028 1.00 0.00 C ATOM 1734 CG ARG A 116 18.579 14.749 -15.047 1.00 0.00 C ATOM 1735 CD ARG A 116 17.727 14.440 -16.296 1.00 0.00 C ATOM 1736 NE ARG A 116 18.503 14.298 -17.545 1.00 0.00 N ATOM 1737 CZ ARG A 116 18.952 15.288 -18.326 1.00 0.00 C ATOM 1738 NH1 ARG A 116 18.644 16.552 -18.069 1.00 0.00 N ATOM 1739 NH2 ARG A 116 19.725 15.015 -19.369 1.00 0.00 N ATOM 0 H ARG A 116 22.336 13.572 -14.801 1.00 0.00 H new ATOM 0 HA ARG A 116 19.905 12.853 -13.531 1.00 0.00 H new ATOM 0 HB2 ARG A 116 20.603 15.086 -14.402 1.00 0.00 H new ATOM 0 HB3 ARG A 116 20.468 14.471 -16.037 1.00 0.00 H new ATOM 0 HG2 ARG A 116 18.107 14.252 -14.200 1.00 0.00 H new ATOM 0 HG3 ARG A 116 18.513 15.822 -14.865 1.00 0.00 H new ATOM 0 HD2 ARG A 116 17.170 13.519 -16.122 1.00 0.00 H new ATOM 0 HD3 ARG A 116 16.994 15.236 -16.427 1.00 0.00 H new ATOM 0 HE ARG A 116 18.719 13.347 -17.843 1.00 0.00 H new ATOM 0 HH11 ARG A 116 18.057 16.781 -17.267 1.00 0.00 H new ATOM 0 HH12 ARG A 116 18.994 17.295 -18.674 1.00 0.00 H new ATOM 0 HH21 ARG A 116 19.978 14.049 -19.577 1.00 0.00 H new ATOM 0 HH22 ARG A 116 20.066 15.771 -19.963 1.00 0.00 H new ATOM 1753 N GLY A 117 20.343 11.539 -16.512 1.00 0.00 N ATOM 1754 CA GLY A 117 19.886 10.457 -17.365 1.00 0.00 C ATOM 1755 C GLY A 117 19.996 9.113 -16.658 1.00 0.00 C ATOM 1756 O GLY A 117 19.005 8.384 -16.621 1.00 0.00 O ATOM 0 H GLY A 117 21.166 12.028 -16.865 1.00 0.00 H new ATOM 0 HA2 GLY A 117 18.851 10.633 -17.657 1.00 0.00 H new ATOM 0 HA3 GLY A 117 20.477 10.438 -18.281 1.00 0.00 H new ATOM 1760 N GLN A 118 21.148 8.798 -16.050 1.00 0.00 N ATOM 1761 CA GLN A 118 21.336 7.536 -15.345 1.00 0.00 C ATOM 1762 C GLN A 118 20.333 7.395 -14.207 1.00 0.00 C ATOM 1763 O GLN A 118 19.643 6.389 -14.122 1.00 0.00 O ATOM 1764 CB GLN A 118 22.758 7.401 -14.784 1.00 0.00 C ATOM 1765 CG GLN A 118 23.825 7.038 -15.825 1.00 0.00 C ATOM 1766 CD GLN A 118 25.092 6.482 -15.165 1.00 0.00 C ATOM 1767 OE1 GLN A 118 25.029 5.632 -14.276 1.00 0.00 O ATOM 1768 NE2 GLN A 118 26.265 6.934 -15.575 1.00 0.00 N ATOM 0 H GLN A 118 21.965 9.409 -16.036 1.00 0.00 H new ATOM 0 HA GLN A 118 21.175 6.742 -16.074 1.00 0.00 H new ATOM 0 HB2 GLN A 118 23.038 8.342 -14.309 1.00 0.00 H new ATOM 0 HB3 GLN A 118 22.756 6.639 -14.005 1.00 0.00 H new ATOM 0 HG2 GLN A 118 23.421 6.300 -16.518 1.00 0.00 H new ATOM 0 HG3 GLN A 118 24.077 7.922 -16.411 1.00 0.00 H new ATOM 0 HE21 GLN A 118 26.311 7.638 -16.312 1.00 0.00 H new ATOM 0 HE22 GLN A 118 27.124 6.579 -15.155 1.00 0.00 H new ATOM 1777 N VAL A 119 20.237 8.393 -13.337 1.00 0.00 N ATOM 1778 CA VAL A 119 19.303 8.435 -12.219 1.00 0.00 C ATOM 1779 C VAL A 119 17.882 8.180 -12.717 1.00 0.00 C ATOM 1780 O VAL A 119 17.218 7.314 -12.151 1.00 0.00 O ATOM 1781 CB VAL A 119 19.444 9.768 -11.448 1.00 0.00 C ATOM 1782 CG1 VAL A 119 18.345 9.951 -10.399 1.00 0.00 C ATOM 1783 CG2 VAL A 119 20.785 9.818 -10.698 1.00 0.00 C ATOM 0 H VAL A 119 20.827 9.223 -13.392 1.00 0.00 H new ATOM 0 HA VAL A 119 19.539 7.641 -11.510 1.00 0.00 H new ATOM 0 HB VAL A 119 19.374 10.556 -12.197 1.00 0.00 H new ATOM 0 HG11 VAL A 119 18.488 10.901 -9.885 1.00 0.00 H new ATOM 0 HG12 VAL A 119 17.371 9.946 -10.888 1.00 0.00 H new ATOM 0 HG13 VAL A 119 18.393 9.137 -9.676 1.00 0.00 H new ATOM 0 HG21 VAL A 119 20.867 10.763 -10.161 1.00 0.00 H new ATOM 0 HG22 VAL A 119 20.836 8.992 -9.988 1.00 0.00 H new ATOM 0 HG23 VAL A 119 21.604 9.734 -11.412 1.00 0.00 H new ATOM 1793 N LYS A 120 17.416 8.853 -13.778 1.00 0.00 N ATOM 1794 CA LYS A 120 16.064 8.612 -14.273 1.00 0.00 C ATOM 1795 C LYS A 120 15.903 7.156 -14.690 1.00 0.00 C ATOM 1796 O LYS A 120 14.937 6.507 -14.296 1.00 0.00 O ATOM 1797 CB LYS A 120 15.751 9.568 -15.435 1.00 0.00 C ATOM 1798 CG LYS A 120 14.325 9.355 -15.969 1.00 0.00 C ATOM 1799 CD LYS A 120 14.013 10.244 -17.183 1.00 0.00 C ATOM 1800 CE LYS A 120 14.701 9.759 -18.471 1.00 0.00 C ATOM 1801 NZ LYS A 120 14.040 8.569 -19.068 1.00 0.00 N ATOM 0 H LYS A 120 17.946 9.553 -14.297 1.00 0.00 H new ATOM 0 HA LYS A 120 15.350 8.808 -13.473 1.00 0.00 H new ATOM 0 HB2 LYS A 120 15.866 10.599 -15.101 1.00 0.00 H new ATOM 0 HB3 LYS A 120 16.469 9.412 -16.240 1.00 0.00 H new ATOM 0 HG2 LYS A 120 14.197 8.309 -16.246 1.00 0.00 H new ATOM 0 HG3 LYS A 120 13.608 9.565 -15.175 1.00 0.00 H new ATOM 0 HD2 LYS A 120 12.935 10.270 -17.341 1.00 0.00 H new ATOM 0 HD3 LYS A 120 14.329 11.265 -16.970 1.00 0.00 H new ATOM 0 HE2 LYS A 120 14.707 10.569 -19.200 1.00 0.00 H new ATOM 0 HE3 LYS A 120 15.742 9.519 -18.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 14.620 8.206 -19.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 13.935 7.830 -18.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 13.102 8.837 -19.428 1.00 0.00 H new ATOM 1815 N GLU A 121 16.859 6.639 -15.453 1.00 0.00 N ATOM 1816 CA GLU A 121 16.871 5.265 -15.916 1.00 0.00 C ATOM 1817 C GLU A 121 16.812 4.303 -14.728 1.00 0.00 C ATOM 1818 O GLU A 121 16.087 3.314 -14.763 1.00 0.00 O ATOM 1819 CB GLU A 121 18.129 5.069 -16.789 1.00 0.00 C ATOM 1820 CG GLU A 121 18.960 3.807 -16.532 1.00 0.00 C ATOM 1821 CD GLU A 121 20.017 3.591 -17.629 1.00 0.00 C ATOM 1822 OE1 GLU A 121 19.709 2.941 -18.654 1.00 0.00 O ATOM 1823 OE2 GLU A 121 21.172 4.046 -17.471 1.00 0.00 O ATOM 0 H GLU A 121 17.663 7.179 -15.772 1.00 0.00 H new ATOM 0 HA GLU A 121 15.992 5.046 -16.523 1.00 0.00 H new ATOM 0 HB2 GLU A 121 17.820 5.065 -17.834 1.00 0.00 H new ATOM 0 HB3 GLU A 121 18.776 5.935 -16.652 1.00 0.00 H new ATOM 0 HG2 GLU A 121 19.452 3.886 -15.563 1.00 0.00 H new ATOM 0 HG3 GLU A 121 18.301 2.940 -16.485 1.00 0.00 H new ATOM 1830 N ARG A 122 17.569 4.586 -13.671 1.00 0.00 N ATOM 1831 CA ARG A 122 17.661 3.725 -12.504 1.00 0.00 C ATOM 1832 C ARG A 122 16.348 3.768 -11.718 1.00 0.00 C ATOM 1833 O ARG A 122 15.861 2.706 -11.345 1.00 0.00 O ATOM 1834 CB ARG A 122 18.881 4.122 -11.662 1.00 0.00 C ATOM 1835 CG ARG A 122 20.245 3.814 -12.306 1.00 0.00 C ATOM 1836 CD ARG A 122 21.346 4.586 -11.564 1.00 0.00 C ATOM 1837 NE ARG A 122 22.681 4.399 -12.164 1.00 0.00 N ATOM 1838 CZ ARG A 122 23.602 3.493 -11.812 1.00 0.00 C ATOM 1839 NH1 ARG A 122 23.339 2.570 -10.887 1.00 0.00 N ATOM 1840 NH2 ARG A 122 24.791 3.529 -12.402 1.00 0.00 N ATOM 0 H ARG A 122 18.140 5.429 -13.604 1.00 0.00 H new ATOM 0 HA ARG A 122 17.809 2.689 -12.809 1.00 0.00 H new ATOM 0 HB2 ARG A 122 18.828 5.191 -11.454 1.00 0.00 H new ATOM 0 HB3 ARG A 122 18.825 3.607 -10.703 1.00 0.00 H new ATOM 0 HG2 ARG A 122 20.445 2.743 -12.265 1.00 0.00 H new ATOM 0 HG3 ARG A 122 20.234 4.096 -13.359 1.00 0.00 H new ATOM 0 HD2 ARG A 122 21.100 5.648 -11.561 1.00 0.00 H new ATOM 0 HD3 ARG A 122 21.372 4.262 -10.524 1.00 0.00 H new ATOM 0 HE ARG A 122 22.929 5.027 -12.929 1.00 0.00 H new ATOM 0 HH11 ARG A 122 22.425 2.546 -10.436 1.00 0.00 H new ATOM 0 HH12 ARG A 122 24.052 1.887 -10.631 1.00 0.00 H new ATOM 0 HH21 ARG A 122 24.988 4.238 -13.109 1.00 0.00 H new ATOM 0 HH22 ARG A 122 25.507 2.848 -12.149 1.00 0.00 H new ATOM 1854 N VAL A 123 15.727 4.935 -11.504 1.00 0.00 N ATOM 1855 CA VAL A 123 14.380 5.056 -10.965 1.00 0.00 C ATOM 1856 C VAL A 123 13.409 4.215 -11.807 1.00 0.00 C ATOM 1857 O VAL A 123 12.657 3.428 -11.235 1.00 0.00 O ATOM 1858 CB VAL A 123 13.987 6.546 -10.896 1.00 0.00 C ATOM 1859 CG1 VAL A 123 12.527 6.729 -10.475 1.00 0.00 C ATOM 1860 CG2 VAL A 123 14.847 7.320 -9.885 1.00 0.00 C ATOM 0 H VAL A 123 16.161 5.835 -11.707 1.00 0.00 H new ATOM 0 HA VAL A 123 14.335 4.666 -9.948 1.00 0.00 H new ATOM 0 HB VAL A 123 14.145 6.934 -11.902 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.289 7.792 -10.438 1.00 0.00 H new ATOM 0 HG12 VAL A 123 11.876 6.236 -11.197 1.00 0.00 H new ATOM 0 HG13 VAL A 123 12.375 6.289 -9.489 1.00 0.00 H new ATOM 0 HG21 VAL A 123 14.537 8.365 -9.868 1.00 0.00 H new ATOM 0 HG22 VAL A 123 14.719 6.888 -8.893 1.00 0.00 H new ATOM 0 HG23 VAL A 123 15.896 7.257 -10.176 1.00 0.00 H new ATOM 1870 N GLU A 124 13.436 4.318 -13.143 1.00 0.00 N ATOM 1871 CA GLU A 124 12.569 3.517 -14.006 1.00 0.00 C ATOM 1872 C GLU A 124 12.824 2.024 -13.787 1.00 0.00 C ATOM 1873 O GLU A 124 11.886 1.231 -13.724 1.00 0.00 O ATOM 1874 CB GLU A 124 12.763 3.857 -15.499 1.00 0.00 C ATOM 1875 CG GLU A 124 12.220 5.227 -15.918 1.00 0.00 C ATOM 1876 CD GLU A 124 12.486 5.509 -17.407 1.00 0.00 C ATOM 1877 OE1 GLU A 124 11.704 5.041 -18.266 1.00 0.00 O ATOM 1878 OE2 GLU A 124 13.465 6.222 -17.730 1.00 0.00 O ATOM 0 H GLU A 124 14.054 4.953 -13.648 1.00 0.00 H new ATOM 0 HA GLU A 124 11.541 3.758 -13.734 1.00 0.00 H new ATOM 0 HB2 GLU A 124 13.827 3.816 -15.732 1.00 0.00 H new ATOM 0 HB3 GLU A 124 12.275 3.089 -16.099 1.00 0.00 H new ATOM 0 HG2 GLU A 124 11.148 5.269 -15.725 1.00 0.00 H new ATOM 0 HG3 GLU A 124 12.684 6.004 -15.311 1.00 0.00 H new ATOM 1885 N ASN A 125 14.093 1.646 -13.632 1.00 0.00 N ATOM 1886 CA ASN A 125 14.517 0.275 -13.399 1.00 0.00 C ATOM 1887 C ASN A 125 13.944 -0.240 -12.083 1.00 0.00 C ATOM 1888 O ASN A 125 13.392 -1.335 -12.033 1.00 0.00 O ATOM 1889 CB ASN A 125 16.052 0.186 -13.395 1.00 0.00 C ATOM 1890 CG ASN A 125 16.525 -1.178 -13.868 1.00 0.00 C ATOM 1891 OD1 ASN A 125 16.503 -2.159 -13.130 1.00 0.00 O ATOM 1892 ND2 ASN A 125 16.961 -1.256 -15.115 1.00 0.00 N ATOM 0 H ASN A 125 14.870 2.305 -13.667 1.00 0.00 H new ATOM 0 HA ASN A 125 14.138 -0.352 -14.206 1.00 0.00 H new ATOM 0 HB2 ASN A 125 16.465 0.961 -14.040 1.00 0.00 H new ATOM 0 HB3 ASN A 125 16.427 0.375 -12.389 1.00 0.00 H new ATOM 0 HD21 ASN A 125 17.290 -2.148 -15.485 1.00 0.00 H new ATOM 0 HD22 ASN A 125 16.968 -0.425 -15.706 1.00 0.00 H new ATOM 1899 N LEU A 126 14.041 0.571 -11.025 1.00 0.00 N ATOM 1900 CA LEU A 126 13.523 0.252 -9.701 1.00 0.00 C ATOM 1901 C LEU A 126 12.009 0.063 -9.778 1.00 0.00 C ATOM 1902 O LEU A 126 11.513 -0.968 -9.342 1.00 0.00 O ATOM 1903 CB LEU A 126 14.061 1.225 -8.617 1.00 0.00 C ATOM 1904 CG LEU A 126 13.040 2.187 -7.992 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.156 1.505 -6.940 1.00 0.00 C ATOM 1906 CD2 LEU A 126 13.697 3.365 -7.276 1.00 0.00 C ATOM 0 H LEU A 126 14.492 1.485 -11.071 1.00 0.00 H new ATOM 0 HA LEU A 126 13.907 -0.707 -9.354 1.00 0.00 H new ATOM 0 HB2 LEU A 126 14.506 0.633 -7.817 1.00 0.00 H new ATOM 0 HB3 LEU A 126 14.863 1.818 -9.058 1.00 0.00 H new ATOM 0 HG LEU A 126 12.450 2.528 -8.843 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.453 2.230 -6.530 1.00 0.00 H new ATOM 0 HD12 LEU A 126 11.605 0.686 -7.403 1.00 0.00 H new ATOM 0 HD13 LEU A 126 12.781 1.113 -6.138 1.00 0.00 H new ATOM 0 HD21 LEU A 126 12.926 4.010 -6.855 1.00 0.00 H new ATOM 0 HD22 LEU A 126 14.337 2.993 -6.476 1.00 0.00 H new ATOM 0 HD23 LEU A 126 14.298 3.933 -7.986 1.00 0.00 H new ATOM 1918 N ILE A 127 11.286 0.998 -10.393 1.00 0.00 N ATOM 1919 CA ILE A 127 9.843 0.934 -10.591 1.00 0.00 C ATOM 1920 C ILE A 127 9.458 -0.317 -11.391 1.00 0.00 C ATOM 1921 O ILE A 127 8.425 -0.919 -11.099 1.00 0.00 O ATOM 1922 CB ILE A 127 9.400 2.238 -11.291 1.00 0.00 C ATOM 1923 CG1 ILE A 127 9.473 3.446 -10.330 1.00 0.00 C ATOM 1924 CG2 ILE A 127 7.984 2.107 -11.863 1.00 0.00 C ATOM 1925 CD1 ILE A 127 9.421 4.794 -11.062 1.00 0.00 C ATOM 0 H ILE A 127 11.703 1.845 -10.778 1.00 0.00 H new ATOM 0 HA ILE A 127 9.327 0.851 -9.634 1.00 0.00 H new ATOM 0 HB ILE A 127 10.092 2.412 -12.115 1.00 0.00 H new ATOM 0 HG12 ILE A 127 8.647 3.391 -9.621 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.394 3.388 -9.751 1.00 0.00 H new ATOM 0 HG21 ILE A 127 7.700 3.040 -12.349 1.00 0.00 H new ATOM 0 HG22 ILE A 127 7.959 1.296 -12.591 1.00 0.00 H new ATOM 0 HG23 ILE A 127 7.284 1.891 -11.056 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.476 5.605 -10.336 1.00 0.00 H new ATOM 0 HD12 ILE A 127 10.262 4.866 -11.751 1.00 0.00 H new ATOM 0 HD13 ILE A 127 8.488 4.869 -11.620 1.00 0.00 H new ATOM 1937 N ALA A 128 10.241 -0.737 -12.385 1.00 0.00 N ATOM 1938 CA ALA A 128 9.860 -1.849 -13.258 1.00 0.00 C ATOM 1939 C ALA A 128 9.692 -3.152 -12.462 1.00 0.00 C ATOM 1940 O ALA A 128 8.868 -4.001 -12.803 1.00 0.00 O ATOM 1941 CB ALA A 128 10.896 -2.023 -14.374 1.00 0.00 C ATOM 0 H ALA A 128 11.146 -0.323 -12.607 1.00 0.00 H new ATOM 0 HA ALA A 128 8.896 -1.613 -13.708 1.00 0.00 H new ATOM 0 HB1 ALA A 128 10.602 -2.853 -15.017 1.00 0.00 H new ATOM 0 HB2 ALA A 128 10.952 -1.108 -14.964 1.00 0.00 H new ATOM 0 HB3 ALA A 128 11.872 -2.232 -13.935 1.00 0.00 H new ATOM 1947 N LYS A 129 10.466 -3.292 -11.384 1.00 0.00 N ATOM 1948 CA LYS A 129 10.480 -4.444 -10.491 1.00 0.00 C ATOM 1949 C LYS A 129 9.212 -4.548 -9.631 1.00 0.00 C ATOM 1950 O LYS A 129 8.918 -5.632 -9.127 1.00 0.00 O ATOM 1951 CB LYS A 129 11.704 -4.316 -9.578 1.00 0.00 C ATOM 1952 CG LYS A 129 13.023 -4.353 -10.366 1.00 0.00 C ATOM 1953 CD LYS A 129 14.206 -3.959 -9.476 1.00 0.00 C ATOM 1954 CE LYS A 129 15.377 -3.376 -10.284 1.00 0.00 C ATOM 1955 NZ LYS A 129 15.918 -4.294 -11.316 1.00 0.00 N ATOM 0 H LYS A 129 11.129 -2.571 -11.100 1.00 0.00 H new ATOM 0 HA LYS A 129 10.521 -5.347 -11.100 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.642 -3.382 -9.020 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.696 -5.125 -8.848 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.183 -5.354 -10.767 1.00 0.00 H new ATOM 0 HG3 LYS A 129 12.962 -3.674 -11.217 1.00 0.00 H new ATOM 0 HD2 LYS A 129 13.875 -3.226 -8.740 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.549 -4.834 -8.923 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.048 -2.456 -10.768 1.00 0.00 H new ATOM 0 HE3 LYS A 129 16.179 -3.106 -9.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.189 -3.748 -12.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 16.753 -4.787 -10.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 15.192 -4.992 -11.575 1.00 0.00 H new ATOM 1969 N ILE A 130 8.468 -3.449 -9.462 1.00 0.00 N ATOM 1970 CA ILE A 130 7.382 -3.297 -8.508 1.00 0.00 C ATOM 1971 C ILE A 130 6.040 -2.856 -9.103 1.00 0.00 C ATOM 1972 O ILE A 130 4.999 -3.069 -8.480 1.00 0.00 O ATOM 1973 CB ILE A 130 7.853 -2.305 -7.425 1.00 0.00 C ATOM 1974 CG1 ILE A 130 8.436 -0.988 -7.968 1.00 0.00 C ATOM 1975 CG2 ILE A 130 8.850 -3.036 -6.505 1.00 0.00 C ATOM 1976 CD1 ILE A 130 9.077 -0.092 -6.910 1.00 0.00 C ATOM 0 H ILE A 130 8.620 -2.606 -10.016 1.00 0.00 H new ATOM 0 HA ILE A 130 7.170 -4.285 -8.099 1.00 0.00 H new ATOM 0 HB ILE A 130 6.974 -1.985 -6.866 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.182 -1.222 -8.727 1.00 0.00 H new ATOM 0 HG13 ILE A 130 7.641 -0.431 -8.464 1.00 0.00 H new ATOM 0 HG21 ILE A 130 9.198 -2.353 -5.730 1.00 0.00 H new ATOM 0 HG22 ILE A 130 8.358 -3.891 -6.042 1.00 0.00 H new ATOM 0 HG23 ILE A 130 9.701 -3.382 -7.092 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.460 0.812 -7.383 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.332 0.178 -6.162 1.00 0.00 H new ATOM 0 HD13 ILE A 130 9.897 -0.626 -6.430 1.00 0.00 H new ATOM 1988 N SER A 131 6.077 -2.252 -10.287 1.00 0.00 N ATOM 1989 CA SER A 131 4.923 -1.867 -11.095 1.00 0.00 C ATOM 1990 C SER A 131 3.867 -2.977 -11.116 1.00 0.00 C ATOM 1991 O SER A 131 2.685 -2.679 -10.846 1.00 0.00 O ATOM 1992 CB SER A 131 5.368 -1.531 -12.519 1.00 0.00 C ATOM 1993 OG SER A 131 6.192 -0.386 -12.510 1.00 0.00 O ATOM 1994 OXT SER A 131 4.211 -4.140 -11.422 1.00 0.00 O ATOM 0 H SER A 131 6.960 -2.004 -10.733 1.00 0.00 H new ATOM 0 HA SER A 131 4.472 -0.983 -10.644 1.00 0.00 H new ATOM 0 HB2 SER A 131 5.908 -2.375 -12.948 1.00 0.00 H new ATOM 0 HB3 SER A 131 4.496 -1.357 -13.150 1.00 0.00 H new ATOM 0 HG SER A 131 6.983 -0.557 -11.957 1.00 0.00 H new TER 2000 SER A 131