USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 990 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= -0.421 K(o=0.86,f=-0.08) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -176:sc= 1.28 (180deg=1.19) USER MOD Set 2.1: A 5 MET CE :methyl 178:sc= -0.528 (180deg=-0.538) USER MOD Set 2.2: A 35 SER OG : rot -135:sc= 1.13 USER MOD Set 3.1: A 33 THR OG1 : rot 156:sc= 1.16 USER MOD Set 3.2: A 73 TYR OH : rot 30:sc= 1.08 USER MOD Single : A 1 MET CE :methyl 158:sc= 0 (180deg=-0.379) USER MOD Single : A 1 MET N :NH3+ -112:sc= 0.0585 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 175:sc= 1.28 (180deg=1.22) USER MOD Single : A 9 LYS NZ :NH3+ 173:sc= 1.27 (180deg=1.17) USER MOD Single : A 11 ASN : amide:sc= 0.251 K(o=0.25,f=-0.66) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0681 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot -118:sc= 0.7 USER MOD Single : A 16 GLN : amide:sc= 1.44 K(o=1.4,f=-6.6!) USER MOD Single : A 17 MET CE :methyl -123:sc= -2.32! (180deg=-2.56!) USER MOD Single : A 23 LYS NZ :NH3+ -148:sc= 2.06 (180deg=0.785) USER MOD Single : A 24 THR OG1 : rot -130:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -178:sc= 0.922 (180deg=0.919) USER MOD Single : A 34 SER OG : rot -155:sc= 1.01 USER MOD Single : A 39 SER OG : rot 160:sc= 0.253 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HE2:sc= 0.622 K(o=0.62,f=-4.4!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= -0.467 (180deg=-0.467) USER MOD Single : A 50 MET CE :methyl -179:sc= -2.04 (180deg=-2.05) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0946 USER MOD Single : A 60 GLN : amide:sc= 0.00812 K(o=0.0081,f=-4.2!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -100:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= -0.209 K(o=-0.21,f=-1.2) USER MOD Single : A 78 SER OG : rot 123:sc= 0.266 USER MOD Single : A 82 SER OG : rot 145:sc= 1.25 USER MOD Single : A 85 ASN : amide:sc=-0.00112 K(o=-0.0011,f=-0.97) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= -0.144 K(o=-0.14,f=-1.1) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 GLN : amide:sc= 0.506 K(o=0.51,f=-0.56) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 85:sc= 0.535 USER MOD Single : A 118 GLN : amide:sc= 0.954 K(o=0.95,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -169:sc= 1.35 (180deg=1.13) USER MOD Single : A 131 SER OG : rot 180:sc=-0.00383 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.459 -0.230 1.310 1.00 0.00 N ATOM 2 CA MET A 1 2.763 0.098 -0.120 1.00 0.00 C ATOM 3 C MET A 1 3.220 -1.163 -0.878 1.00 0.00 C ATOM 4 O MET A 1 3.765 -2.082 -0.268 1.00 0.00 O ATOM 5 CB MET A 1 3.740 1.307 -0.234 1.00 0.00 C ATOM 6 CG MET A 1 5.243 0.979 -0.203 1.00 0.00 C ATOM 7 SD MET A 1 6.327 2.376 0.230 1.00 0.00 S ATOM 8 CE MET A 1 6.375 3.292 -1.336 1.00 0.00 C ATOM 0 H1 MET A 1 1.437 -0.133 1.479 1.00 0.00 H new ATOM 0 H2 MET A 1 2.752 -1.207 1.512 1.00 0.00 H new ATOM 0 H3 MET A 1 2.976 0.422 1.933 1.00 0.00 H new ATOM 0 HA MET A 1 1.849 0.430 -0.613 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.525 1.833 -1.164 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.525 1.998 0.581 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.409 0.174 0.513 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.537 0.600 -1.182 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.651 4.329 -1.143 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.110 2.838 -2.000 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.392 3.260 -1.807 1.00 0.00 H new ATOM 18 N LYS A 2 3.006 -1.241 -2.202 1.00 0.00 N ATOM 19 CA LYS A 2 3.305 -2.461 -2.983 1.00 0.00 C ATOM 20 C LYS A 2 4.817 -2.535 -3.136 1.00 0.00 C ATOM 21 O LYS A 2 5.391 -1.560 -3.609 1.00 0.00 O ATOM 22 CB LYS A 2 2.568 -2.482 -4.350 1.00 0.00 C ATOM 23 CG LYS A 2 1.141 -1.898 -4.285 1.00 0.00 C ATOM 24 CD LYS A 2 0.466 -1.833 -5.662 1.00 0.00 C ATOM 25 CE LYS A 2 -0.667 -0.791 -5.689 1.00 0.00 C ATOM 26 NZ LYS A 2 -1.908 -1.240 -4.991 1.00 0.00 N ATOM 0 H LYS A 2 2.627 -0.474 -2.758 1.00 0.00 H new ATOM 0 HA LYS A 2 2.938 -3.344 -2.459 1.00 0.00 H new ATOM 0 HB2 LYS A 2 3.151 -1.917 -5.078 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.516 -3.509 -4.711 1.00 0.00 H new ATOM 0 HG2 LYS A 2 0.534 -2.507 -3.615 1.00 0.00 H new ATOM 0 HG3 LYS A 2 1.182 -0.896 -3.857 1.00 0.00 H new ATOM 0 HD2 LYS A 2 1.208 -1.584 -6.420 1.00 0.00 H new ATOM 0 HD3 LYS A 2 0.065 -2.814 -5.918 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.313 0.130 -5.227 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -0.908 -0.555 -6.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -2.628 -0.492 -5.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.269 -2.103 -5.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -1.693 -1.438 -3.993 1.00 0.00 H new ATOM 40 N LYS A 3 5.478 -3.626 -2.750 1.00 0.00 N ATOM 41 CA LYS A 3 6.913 -3.770 -3.013 1.00 0.00 C ATOM 42 C LYS A 3 7.079 -4.616 -4.262 1.00 0.00 C ATOM 43 O LYS A 3 6.386 -5.626 -4.418 1.00 0.00 O ATOM 44 CB LYS A 3 7.708 -4.322 -1.824 1.00 0.00 C ATOM 45 CG LYS A 3 7.317 -3.731 -0.463 1.00 0.00 C ATOM 46 CD LYS A 3 8.180 -4.344 0.647 1.00 0.00 C ATOM 47 CE LYS A 3 7.772 -3.729 1.990 1.00 0.00 C ATOM 48 NZ LYS A 3 8.472 -4.370 3.134 1.00 0.00 N ATOM 0 H LYS A 3 5.052 -4.413 -2.261 1.00 0.00 H new ATOM 0 HA LYS A 3 7.338 -2.779 -3.173 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.576 -5.403 -1.787 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.768 -4.136 -1.995 1.00 0.00 H new ATOM 0 HG2 LYS A 3 7.445 -2.649 -0.478 1.00 0.00 H new ATOM 0 HG3 LYS A 3 6.263 -3.924 -0.263 1.00 0.00 H new ATOM 0 HD2 LYS A 3 8.049 -5.426 0.672 1.00 0.00 H new ATOM 0 HD3 LYS A 3 9.236 -4.155 0.451 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.994 -2.662 1.982 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.695 -3.830 2.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 8.232 -3.869 4.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 8.175 -5.364 3.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 9.500 -4.326 2.981 1.00 0.00 H new ATOM 62 N VAL A 4 7.987 -4.176 -5.119 1.00 0.00 N ATOM 63 CA VAL A 4 8.216 -4.644 -6.470 1.00 0.00 C ATOM 64 C VAL A 4 9.617 -5.250 -6.534 1.00 0.00 C ATOM 65 O VAL A 4 10.524 -4.826 -5.819 1.00 0.00 O ATOM 66 CB VAL A 4 8.090 -3.466 -7.468 1.00 0.00 C ATOM 67 CG1 VAL A 4 8.032 -3.934 -8.930 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.892 -2.519 -7.282 1.00 0.00 C ATOM 0 H VAL A 4 8.630 -3.426 -4.865 1.00 0.00 H new ATOM 0 HA VAL A 4 7.475 -5.396 -6.740 1.00 0.00 H new ATOM 0 HB VAL A 4 8.999 -2.910 -7.237 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.944 -3.068 -9.586 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.942 -4.482 -9.173 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.169 -4.584 -9.070 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.922 -1.740 -8.044 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.964 -3.083 -7.376 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.940 -2.062 -6.294 1.00 0.00 H new ATOM 78 N MET A 5 9.812 -6.194 -7.441 1.00 0.00 N ATOM 79 CA MET A 5 11.113 -6.728 -7.823 1.00 0.00 C ATOM 80 C MET A 5 11.140 -6.865 -9.335 1.00 0.00 C ATOM 81 O MET A 5 10.130 -7.251 -9.926 1.00 0.00 O ATOM 82 CB MET A 5 11.403 -8.097 -7.189 1.00 0.00 C ATOM 83 CG MET A 5 11.430 -8.106 -5.662 1.00 0.00 C ATOM 84 SD MET A 5 12.531 -9.393 -5.024 1.00 0.00 S ATOM 85 CE MET A 5 12.507 -8.944 -3.272 1.00 0.00 C ATOM 0 H MET A 5 9.042 -6.626 -7.951 1.00 0.00 H new ATOM 0 HA MET A 5 11.880 -6.041 -7.464 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.648 -8.806 -7.529 1.00 0.00 H new ATOM 0 HB3 MET A 5 12.364 -8.455 -7.557 1.00 0.00 H new ATOM 0 HG2 MET A 5 11.757 -7.132 -5.297 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.422 -8.267 -5.280 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.109 -9.655 -2.706 1.00 0.00 H new ATOM 0 HE2 MET A 5 12.917 -7.942 -3.148 1.00 0.00 H new ATOM 0 HE3 MET A 5 11.481 -8.964 -2.905 1.00 0.00 H new ATOM 95 N PHE A 6 12.297 -6.615 -9.946 1.00 0.00 N ATOM 96 CA PHE A 6 12.574 -6.889 -11.347 1.00 0.00 C ATOM 97 C PHE A 6 13.822 -7.748 -11.282 1.00 0.00 C ATOM 98 O PHE A 6 14.859 -7.273 -10.832 1.00 0.00 O ATOM 99 CB PHE A 6 12.766 -5.581 -12.135 1.00 0.00 C ATOM 100 CG PHE A 6 11.547 -4.671 -12.178 1.00 0.00 C ATOM 101 CD1 PHE A 6 11.306 -3.769 -11.125 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.656 -4.711 -13.268 1.00 0.00 C ATOM 103 CE1 PHE A 6 10.190 -2.919 -11.166 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.532 -3.870 -13.301 1.00 0.00 C ATOM 105 CZ PHE A 6 9.299 -2.971 -12.249 1.00 0.00 C ATOM 0 H PHE A 6 13.092 -6.202 -9.458 1.00 0.00 H new ATOM 0 HA PHE A 6 11.765 -7.393 -11.875 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.597 -5.029 -11.697 1.00 0.00 H new ATOM 0 HB3 PHE A 6 13.052 -5.829 -13.157 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.982 -3.731 -10.283 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.839 -5.394 -14.085 1.00 0.00 H new ATOM 0 HE1 PHE A 6 10.016 -2.221 -10.360 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.848 -3.915 -14.135 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.437 -2.321 -12.273 1.00 0.00 H new ATOM 115 N VAL A 7 13.737 -9.014 -11.676 1.00 0.00 N ATOM 116 CA VAL A 7 14.808 -9.963 -11.406 1.00 0.00 C ATOM 117 C VAL A 7 15.032 -10.908 -12.588 1.00 0.00 C ATOM 118 O VAL A 7 14.087 -11.382 -13.214 1.00 0.00 O ATOM 119 CB VAL A 7 14.511 -10.631 -10.033 1.00 0.00 C ATOM 120 CG1 VAL A 7 13.029 -10.982 -9.790 1.00 0.00 C ATOM 121 CG2 VAL A 7 15.379 -11.865 -9.747 1.00 0.00 C ATOM 0 H VAL A 7 12.941 -9.404 -12.181 1.00 0.00 H new ATOM 0 HA VAL A 7 15.777 -9.472 -11.312 1.00 0.00 H new ATOM 0 HB VAL A 7 14.779 -9.844 -9.328 1.00 0.00 H new ATOM 0 HG11 VAL A 7 12.920 -11.443 -8.808 1.00 0.00 H new ATOM 0 HG12 VAL A 7 12.428 -10.074 -9.833 1.00 0.00 H new ATOM 0 HG13 VAL A 7 12.689 -11.678 -10.557 1.00 0.00 H new ATOM 0 HG21 VAL A 7 15.116 -12.277 -8.773 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.208 -12.617 -10.517 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.431 -11.578 -9.747 1.00 0.00 H new ATOM 131 N CYS A 8 16.307 -11.139 -12.897 1.00 0.00 N ATOM 132 CA CYS A 8 16.854 -12.102 -13.846 1.00 0.00 C ATOM 133 C CYS A 8 18.356 -12.173 -13.518 1.00 0.00 C ATOM 134 O CYS A 8 18.903 -11.222 -12.952 1.00 0.00 O ATOM 135 CB CYS A 8 16.570 -11.601 -15.266 1.00 0.00 C ATOM 136 SG CYS A 8 17.207 -12.538 -16.674 1.00 0.00 S ATOM 0 H CYS A 8 17.051 -10.606 -12.446 1.00 0.00 H new ATOM 0 HA CYS A 8 16.415 -13.097 -13.779 1.00 0.00 H new ATOM 0 HB2 CYS A 8 15.488 -11.532 -15.380 1.00 0.00 H new ATOM 0 HB3 CYS A 8 16.963 -10.587 -15.341 1.00 0.00 H new ATOM 141 N LYS A 9 19.020 -13.299 -13.798 1.00 0.00 N ATOM 142 CA LYS A 9 20.393 -13.519 -13.320 1.00 0.00 C ATOM 143 C LYS A 9 21.407 -12.703 -14.133 1.00 0.00 C ATOM 144 O LYS A 9 21.116 -12.259 -15.242 1.00 0.00 O ATOM 145 CB LYS A 9 20.732 -15.025 -13.291 1.00 0.00 C ATOM 146 CG LYS A 9 19.780 -15.812 -12.371 1.00 0.00 C ATOM 147 CD LYS A 9 20.370 -17.140 -11.868 1.00 0.00 C ATOM 148 CE LYS A 9 20.774 -18.104 -13.001 1.00 0.00 C ATOM 149 NZ LYS A 9 21.461 -19.312 -12.472 1.00 0.00 N ATOM 0 H LYS A 9 18.635 -14.067 -14.348 1.00 0.00 H new ATOM 0 HA LYS A 9 20.459 -13.158 -12.294 1.00 0.00 H new ATOM 0 HB2 LYS A 9 20.676 -15.429 -14.302 1.00 0.00 H new ATOM 0 HB3 LYS A 9 21.759 -15.159 -12.951 1.00 0.00 H new ATOM 0 HG2 LYS A 9 19.521 -15.191 -11.513 1.00 0.00 H new ATOM 0 HG3 LYS A 9 18.854 -16.016 -12.909 1.00 0.00 H new ATOM 0 HD2 LYS A 9 21.244 -16.929 -11.252 1.00 0.00 H new ATOM 0 HD3 LYS A 9 19.640 -17.633 -11.226 1.00 0.00 H new ATOM 0 HE2 LYS A 9 19.887 -18.404 -13.558 1.00 0.00 H new ATOM 0 HE3 LYS A 9 21.431 -17.588 -13.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 21.613 -19.991 -13.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 22.379 -19.039 -12.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 20.873 -19.751 -11.735 1.00 0.00 H new ATOM 163 N ARG A 10 22.613 -12.562 -13.567 1.00 0.00 N ATOM 164 CA ARG A 10 23.737 -11.776 -14.081 1.00 0.00 C ATOM 165 C ARG A 10 23.309 -10.336 -14.369 1.00 0.00 C ATOM 166 O ARG A 10 23.293 -9.923 -15.522 1.00 0.00 O ATOM 167 CB ARG A 10 24.422 -12.499 -15.266 1.00 0.00 C ATOM 168 CG ARG A 10 24.890 -13.932 -14.953 1.00 0.00 C ATOM 169 CD ARG A 10 25.979 -13.994 -13.870 1.00 0.00 C ATOM 170 NE ARG A 10 26.268 -15.380 -13.471 1.00 0.00 N ATOM 171 CZ ARG A 10 27.100 -16.254 -14.048 1.00 0.00 C ATOM 172 NH1 ARG A 10 27.798 -15.949 -15.141 1.00 0.00 N ATOM 173 NH2 ARG A 10 27.203 -17.454 -13.495 1.00 0.00 N ATOM 0 H ARG A 10 22.841 -13.022 -12.686 1.00 0.00 H new ATOM 0 HA ARG A 10 24.507 -11.697 -13.313 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.728 -12.532 -16.106 1.00 0.00 H new ATOM 0 HB3 ARG A 10 25.282 -11.911 -15.586 1.00 0.00 H new ATOM 0 HG2 ARG A 10 24.033 -14.524 -14.631 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.269 -14.390 -15.866 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.890 -13.524 -14.242 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.659 -13.423 -12.998 1.00 0.00 H new ATOM 0 HE ARG A 10 25.769 -15.718 -12.648 1.00 0.00 H new ATOM 0 HH11 ARG A 10 27.707 -15.025 -15.563 1.00 0.00 H new ATOM 0 HH12 ARG A 10 28.424 -16.639 -15.556 1.00 0.00 H new ATOM 0 HH21 ARG A 10 26.659 -17.680 -12.662 1.00 0.00 H new ATOM 0 HH22 ARG A 10 27.826 -18.151 -13.902 1.00 0.00 H new ATOM 187 N ASN A 11 23.046 -9.569 -13.295 1.00 0.00 N ATOM 188 CA ASN A 11 22.677 -8.129 -13.271 1.00 0.00 C ATOM 189 C ASN A 11 23.516 -7.227 -14.198 1.00 0.00 C ATOM 190 O ASN A 11 23.077 -6.132 -14.552 1.00 0.00 O ATOM 191 CB ASN A 11 22.754 -7.594 -11.832 1.00 0.00 C ATOM 192 CG ASN A 11 22.178 -6.189 -11.660 1.00 0.00 C ATOM 193 OD1 ASN A 11 22.613 -5.436 -10.795 1.00 0.00 O ATOM 194 ND2 ASN A 11 21.161 -5.821 -12.416 1.00 0.00 N ATOM 0 H ASN A 11 23.087 -9.959 -12.353 1.00 0.00 H new ATOM 0 HA ASN A 11 21.658 -8.086 -13.656 1.00 0.00 H new ATOM 0 HB2 ASN A 11 22.220 -8.278 -11.172 1.00 0.00 H new ATOM 0 HB3 ASN A 11 23.796 -7.590 -11.512 1.00 0.00 H new ATOM 0 HD21 ASN A 11 20.732 -4.905 -12.283 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.804 -6.452 -13.134 1.00 0.00 H new ATOM 201 N SER A 12 24.706 -7.664 -14.613 1.00 0.00 N ATOM 202 CA SER A 12 25.494 -7.028 -15.662 1.00 0.00 C ATOM 203 C SER A 12 24.649 -6.783 -16.932 1.00 0.00 C ATOM 204 O SER A 12 24.908 -5.829 -17.671 1.00 0.00 O ATOM 205 CB SER A 12 26.650 -7.973 -16.014 1.00 0.00 C ATOM 206 OG SER A 12 27.225 -8.534 -14.836 1.00 0.00 O ATOM 0 H SER A 12 25.156 -8.489 -14.218 1.00 0.00 H new ATOM 0 HA SER A 12 25.854 -6.064 -15.304 1.00 0.00 H new ATOM 0 HB2 SER A 12 26.288 -8.771 -16.662 1.00 0.00 H new ATOM 0 HB3 SER A 12 27.412 -7.430 -16.572 1.00 0.00 H new ATOM 0 HG SER A 12 27.959 -9.134 -15.084 1.00 0.00 H new ATOM 212 N SER A 13 23.624 -7.614 -17.153 1.00 0.00 N ATOM 213 CA SER A 13 22.607 -7.487 -18.177 1.00 0.00 C ATOM 214 C SER A 13 21.240 -7.682 -17.510 1.00 0.00 C ATOM 215 O SER A 13 21.065 -8.568 -16.671 1.00 0.00 O ATOM 216 CB SER A 13 22.829 -8.541 -19.272 1.00 0.00 C ATOM 217 OG SER A 13 24.182 -8.567 -19.714 1.00 0.00 O ATOM 0 H SER A 13 23.483 -8.444 -16.578 1.00 0.00 H new ATOM 0 HA SER A 13 22.656 -6.504 -18.645 1.00 0.00 H new ATOM 0 HB2 SER A 13 22.552 -9.524 -18.892 1.00 0.00 H new ATOM 0 HB3 SER A 13 22.174 -8.330 -20.118 1.00 0.00 H new ATOM 0 HG SER A 13 24.286 -9.250 -20.409 1.00 0.00 H new ATOM 223 N ARG A 14 20.250 -6.889 -17.924 1.00 0.00 N ATOM 224 CA ARG A 14 18.911 -6.792 -17.343 1.00 0.00 C ATOM 225 C ARG A 14 18.937 -6.378 -15.864 1.00 0.00 C ATOM 226 O ARG A 14 19.982 -6.339 -15.208 1.00 0.00 O ATOM 227 CB ARG A 14 18.064 -8.056 -17.615 1.00 0.00 C ATOM 228 CG ARG A 14 17.620 -8.211 -19.066 1.00 0.00 C ATOM 229 CD ARG A 14 18.501 -9.167 -19.874 1.00 0.00 C ATOM 230 NE ARG A 14 17.734 -9.563 -21.057 1.00 0.00 N ATOM 231 CZ ARG A 14 18.103 -10.388 -22.043 1.00 0.00 C ATOM 232 NH1 ARG A 14 19.307 -10.951 -22.055 1.00 0.00 N ATOM 233 NH2 ARG A 14 17.240 -10.640 -23.022 1.00 0.00 N ATOM 0 H ARG A 14 20.369 -6.262 -18.719 1.00 0.00 H new ATOM 0 HA ARG A 14 18.402 -5.978 -17.859 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.641 -8.935 -17.327 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.181 -8.032 -16.977 1.00 0.00 H new ATOM 0 HG2 ARG A 14 16.592 -8.572 -19.087 1.00 0.00 H new ATOM 0 HG3 ARG A 14 17.624 -7.232 -19.546 1.00 0.00 H new ATOM 0 HD2 ARG A 14 19.432 -8.681 -20.164 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.769 -10.040 -19.279 1.00 0.00 H new ATOM 0 HE ARG A 14 16.801 -9.159 -21.139 1.00 0.00 H new ATOM 0 HH11 ARG A 14 19.968 -10.757 -21.303 1.00 0.00 H new ATOM 0 HH12 ARG A 14 19.569 -11.577 -22.816 1.00 0.00 H new ATOM 0 HH21 ARG A 14 16.316 -10.207 -23.012 1.00 0.00 H new ATOM 0 HH22 ARG A 14 17.501 -11.266 -23.784 1.00 0.00 H new ATOM 247 N SER A 15 17.762 -5.974 -15.364 1.00 0.00 N ATOM 248 CA SER A 15 17.630 -5.337 -14.057 1.00 0.00 C ATOM 249 C SER A 15 18.599 -4.151 -13.941 1.00 0.00 C ATOM 250 O SER A 15 19.252 -3.962 -12.923 1.00 0.00 O ATOM 251 CB SER A 15 17.748 -6.381 -12.935 1.00 0.00 C ATOM 252 OG SER A 15 16.725 -7.356 -13.063 1.00 0.00 O ATOM 0 H SER A 15 16.877 -6.082 -15.859 1.00 0.00 H new ATOM 0 HA SER A 15 16.634 -4.909 -13.945 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.726 -6.861 -12.977 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.675 -5.892 -11.964 1.00 0.00 H new ATOM 0 HG SER A 15 16.147 -7.330 -12.272 1.00 0.00 H new ATOM 258 N GLN A 16 18.768 -3.369 -15.011 1.00 0.00 N ATOM 259 CA GLN A 16 19.561 -2.149 -15.007 1.00 0.00 C ATOM 260 C GLN A 16 18.805 -1.044 -15.737 1.00 0.00 C ATOM 261 O GLN A 16 19.397 -0.240 -16.444 1.00 0.00 O ATOM 262 CB GLN A 16 20.977 -2.419 -15.535 1.00 0.00 C ATOM 263 CG GLN A 16 21.082 -2.841 -17.006 1.00 0.00 C ATOM 264 CD GLN A 16 22.544 -3.104 -17.413 1.00 0.00 C ATOM 265 OE1 GLN A 16 23.480 -2.798 -16.673 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.786 -3.649 -18.595 1.00 0.00 N ATOM 0 H GLN A 16 18.348 -3.575 -15.917 1.00 0.00 H new ATOM 0 HA GLN A 16 19.707 -1.791 -13.988 1.00 0.00 H new ATOM 0 HB2 GLN A 16 21.573 -1.517 -15.394 1.00 0.00 H new ATOM 0 HB3 GLN A 16 21.428 -3.199 -14.922 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.489 -3.741 -17.171 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.661 -2.061 -17.641 1.00 0.00 H new ATOM 0 HE21 GLN A 16 22.011 -3.903 -19.208 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.747 -3.815 -18.893 1.00 0.00 H new ATOM 275 N MET A 17 17.478 -1.050 -15.646 1.00 0.00 N ATOM 276 CA MET A 17 16.609 -0.097 -16.319 1.00 0.00 C ATOM 277 C MET A 17 15.210 -0.136 -15.693 1.00 0.00 C ATOM 278 O MET A 17 14.673 0.905 -15.328 1.00 0.00 O ATOM 279 CB MET A 17 16.549 -0.416 -17.831 1.00 0.00 C ATOM 280 CG MET A 17 16.417 0.836 -18.709 1.00 0.00 C ATOM 281 SD MET A 17 15.221 2.110 -18.255 1.00 0.00 S ATOM 282 CE MET A 17 16.086 3.216 -17.081 1.00 0.00 C ATOM 0 H MET A 17 16.968 -1.735 -15.088 1.00 0.00 H new ATOM 0 HA MET A 17 17.011 0.909 -16.198 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.450 -0.959 -18.117 1.00 0.00 H new ATOM 0 HB3 MET A 17 15.704 -1.077 -18.023 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.398 1.309 -18.755 1.00 0.00 H new ATOM 0 HG3 MET A 17 16.175 0.504 -19.719 1.00 0.00 H new ATOM 0 HE1 MET A 17 15.527 3.263 -16.146 1.00 0.00 H new ATOM 0 HE2 MET A 17 17.087 2.830 -16.887 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.160 4.215 -17.510 1.00 0.00 H new ATOM 292 N ALA A 18 14.615 -1.330 -15.542 1.00 0.00 N ATOM 293 CA ALA A 18 13.208 -1.478 -15.170 1.00 0.00 C ATOM 294 C ALA A 18 12.928 -1.015 -13.750 1.00 0.00 C ATOM 295 O ALA A 18 11.991 -0.257 -13.529 1.00 0.00 O ATOM 296 CB ALA A 18 12.776 -2.936 -15.387 1.00 0.00 C ATOM 0 H ALA A 18 15.100 -2.217 -15.676 1.00 0.00 H new ATOM 0 HA ALA A 18 12.615 -0.829 -15.814 1.00 0.00 H new ATOM 0 HB1 ALA A 18 11.728 -3.050 -15.111 1.00 0.00 H new ATOM 0 HB2 ALA A 18 12.906 -3.202 -16.436 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.388 -3.593 -14.768 1.00 0.00 H new ATOM 302 N GLU A 19 13.771 -1.403 -12.801 1.00 0.00 N ATOM 303 CA GLU A 19 13.660 -0.919 -11.430 1.00 0.00 C ATOM 304 C GLU A 19 13.968 0.569 -11.391 1.00 0.00 C ATOM 305 O GLU A 19 13.334 1.301 -10.632 1.00 0.00 O ATOM 306 CB GLU A 19 14.568 -1.683 -10.467 1.00 0.00 C ATOM 307 CG GLU A 19 16.059 -1.702 -10.817 1.00 0.00 C ATOM 308 CD GLU A 19 16.327 -2.591 -12.024 1.00 0.00 C ATOM 309 OE1 GLU A 19 16.243 -3.822 -11.846 1.00 0.00 O ATOM 310 OE2 GLU A 19 16.484 -2.060 -13.151 1.00 0.00 O ATOM 0 H GLU A 19 14.541 -2.053 -12.956 1.00 0.00 H new ATOM 0 HA GLU A 19 12.637 -1.091 -11.097 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.455 -1.251 -9.473 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.216 -2.713 -10.408 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.400 -0.688 -11.025 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.632 -2.061 -9.962 1.00 0.00 H new ATOM 317 N GLY A 20 14.902 1.001 -12.246 1.00 0.00 N ATOM 318 CA GLY A 20 15.183 2.404 -12.506 1.00 0.00 C ATOM 319 C GLY A 20 13.882 3.161 -12.761 1.00 0.00 C ATOM 320 O GLY A 20 13.459 3.962 -11.930 1.00 0.00 O ATOM 0 H GLY A 20 15.492 0.366 -12.784 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.707 2.842 -11.656 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.842 2.497 -13.369 1.00 0.00 H new ATOM 324 N PHE A 21 13.188 2.866 -13.864 1.00 0.00 N ATOM 325 CA PHE A 21 11.912 3.520 -14.154 1.00 0.00 C ATOM 326 C PHE A 21 10.867 3.297 -13.088 1.00 0.00 C ATOM 327 O PHE A 21 10.043 4.182 -12.865 1.00 0.00 O ATOM 328 CB PHE A 21 11.307 3.040 -15.470 1.00 0.00 C ATOM 329 CG PHE A 21 11.685 3.920 -16.624 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.424 5.306 -16.601 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.334 3.333 -17.711 1.00 0.00 C ATOM 332 CE1 PHE A 21 11.832 6.096 -17.693 1.00 0.00 C ATOM 333 CE2 PHE A 21 12.773 4.125 -18.774 1.00 0.00 C ATOM 334 CZ PHE A 21 12.510 5.503 -18.778 1.00 0.00 C ATOM 0 H PHE A 21 13.485 2.186 -14.563 1.00 0.00 H new ATOM 0 HA PHE A 21 12.164 4.579 -14.203 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.638 2.021 -15.669 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.221 3.010 -15.379 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.919 5.755 -15.758 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.497 2.266 -17.730 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.626 7.156 -17.700 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.315 3.677 -19.593 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.827 6.110 -19.613 1.00 0.00 H new ATOM 344 N ALA A 22 10.850 2.130 -12.452 1.00 0.00 N ATOM 345 CA ALA A 22 9.786 1.832 -11.518 1.00 0.00 C ATOM 346 C ALA A 22 9.882 2.756 -10.307 1.00 0.00 C ATOM 347 O ALA A 22 8.853 3.169 -9.785 1.00 0.00 O ATOM 348 CB ALA A 22 9.845 0.359 -11.118 1.00 0.00 C ATOM 0 H ALA A 22 11.547 1.394 -12.566 1.00 0.00 H new ATOM 0 HA ALA A 22 8.820 2.009 -11.991 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.041 0.141 -10.415 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.730 -0.264 -12.005 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.806 0.148 -10.648 1.00 0.00 H new ATOM 354 N LYS A 23 11.095 3.156 -9.906 1.00 0.00 N ATOM 355 CA LYS A 23 11.274 4.129 -8.826 1.00 0.00 C ATOM 356 C LYS A 23 10.726 5.501 -9.237 1.00 0.00 C ATOM 357 O LYS A 23 10.191 6.224 -8.401 1.00 0.00 O ATOM 358 CB LYS A 23 12.763 4.137 -8.391 1.00 0.00 C ATOM 359 CG LYS A 23 13.661 5.277 -8.937 1.00 0.00 C ATOM 360 CD LYS A 23 15.143 4.920 -9.162 1.00 0.00 C ATOM 361 CE LYS A 23 15.721 3.978 -8.084 1.00 0.00 C ATOM 362 NZ LYS A 23 17.163 3.677 -8.287 1.00 0.00 N ATOM 0 H LYS A 23 11.967 2.819 -10.315 1.00 0.00 H new ATOM 0 HA LYS A 23 10.693 3.844 -7.949 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.795 4.175 -7.302 1.00 0.00 H new ATOM 0 HB3 LYS A 23 13.206 3.187 -8.690 1.00 0.00 H new ATOM 0 HG2 LYS A 23 13.243 5.621 -9.883 1.00 0.00 H new ATOM 0 HG3 LYS A 23 13.611 6.116 -8.243 1.00 0.00 H new ATOM 0 HD2 LYS A 23 15.251 4.450 -10.139 1.00 0.00 H new ATOM 0 HD3 LYS A 23 15.730 5.838 -9.183 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.585 4.432 -7.102 1.00 0.00 H new ATOM 0 HE3 LYS A 23 15.157 3.045 -8.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 17.368 2.716 -7.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 17.392 3.742 -9.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 17.739 4.362 -7.757 1.00 0.00 H new ATOM 376 N THR A 24 10.834 5.846 -10.522 1.00 0.00 N ATOM 377 CA THR A 24 10.438 7.120 -11.086 1.00 0.00 C ATOM 378 C THR A 24 8.914 7.201 -11.200 1.00 0.00 C ATOM 379 O THR A 24 8.281 8.098 -10.646 1.00 0.00 O ATOM 380 CB THR A 24 11.212 7.255 -12.403 1.00 0.00 C ATOM 381 OG1 THR A 24 12.559 7.546 -12.095 1.00 0.00 O ATOM 382 CG2 THR A 24 10.644 8.263 -13.388 1.00 0.00 C ATOM 0 H THR A 24 11.218 5.210 -11.221 1.00 0.00 H new ATOM 0 HA THR A 24 10.690 7.974 -10.457 1.00 0.00 H new ATOM 0 HB THR A 24 11.120 6.303 -12.925 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.855 8.319 -12.619 1.00 0.00 H new ATOM 0 HG21 THR A 24 11.262 8.283 -14.285 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.626 7.977 -13.655 1.00 0.00 H new ATOM 0 HG23 THR A 24 10.635 9.253 -12.931 1.00 0.00 H new ATOM 390 N LEU A 25 8.318 6.230 -11.888 1.00 0.00 N ATOM 391 CA LEU A 25 6.892 6.204 -12.210 1.00 0.00 C ATOM 392 C LEU A 25 6.093 5.834 -10.958 1.00 0.00 C ATOM 393 O LEU A 25 5.027 6.387 -10.688 1.00 0.00 O ATOM 394 CB LEU A 25 6.678 5.171 -13.334 1.00 0.00 C ATOM 395 CG LEU A 25 7.384 5.497 -14.660 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.444 4.232 -15.518 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.689 6.632 -15.417 1.00 0.00 C ATOM 0 H LEU A 25 8.824 5.420 -12.246 1.00 0.00 H new ATOM 0 HA LEU A 25 6.548 7.182 -12.548 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.026 4.199 -12.984 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.608 5.078 -13.523 1.00 0.00 H new ATOM 0 HG LEU A 25 8.394 5.841 -14.437 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.944 4.455 -16.461 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.999 3.458 -14.987 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.432 3.880 -15.718 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.222 6.828 -16.347 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.662 6.344 -15.641 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.688 7.532 -14.802 1.00 0.00 H new ATOM 409 N GLY A 26 6.634 4.906 -10.167 1.00 0.00 N ATOM 410 CA GLY A 26 6.032 4.375 -8.955 1.00 0.00 C ATOM 411 C GLY A 26 6.303 5.223 -7.715 1.00 0.00 C ATOM 412 O GLY A 26 5.919 4.803 -6.625 1.00 0.00 O ATOM 0 H GLY A 26 7.543 4.490 -10.367 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.955 4.293 -9.100 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.408 3.366 -8.784 1.00 0.00 H new ATOM 416 N ALA A 27 6.949 6.387 -7.858 1.00 0.00 N ATOM 417 CA ALA A 27 7.289 7.280 -6.755 1.00 0.00 C ATOM 418 C ALA A 27 6.035 7.594 -5.937 1.00 0.00 C ATOM 419 O ALA A 27 5.009 7.978 -6.504 1.00 0.00 O ATOM 420 CB ALA A 27 7.914 8.573 -7.294 1.00 0.00 C ATOM 0 H ALA A 27 7.254 6.737 -8.766 1.00 0.00 H new ATOM 0 HA ALA A 27 8.017 6.788 -6.109 1.00 0.00 H new ATOM 0 HB1 ALA A 27 8.163 9.231 -6.462 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.820 8.334 -7.852 1.00 0.00 H new ATOM 0 HB3 ALA A 27 7.204 9.074 -7.952 1.00 0.00 H new ATOM 426 N GLY A 28 6.121 7.407 -4.619 1.00 0.00 N ATOM 427 CA GLY A 28 5.023 7.619 -3.678 1.00 0.00 C ATOM 428 C GLY A 28 3.939 6.532 -3.716 1.00 0.00 C ATOM 429 O GLY A 28 2.914 6.686 -3.048 1.00 0.00 O ATOM 0 H GLY A 28 6.980 7.096 -4.166 1.00 0.00 H new ATOM 0 HA2 GLY A 28 5.431 7.674 -2.669 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.561 8.584 -3.888 1.00 0.00 H new ATOM 433 N LYS A 29 4.138 5.442 -4.476 1.00 0.00 N ATOM 434 CA LYS A 29 3.131 4.390 -4.674 1.00 0.00 C ATOM 435 C LYS A 29 3.687 3.029 -4.302 1.00 0.00 C ATOM 436 O LYS A 29 3.040 2.287 -3.566 1.00 0.00 O ATOM 437 CB LYS A 29 2.616 4.365 -6.135 1.00 0.00 C ATOM 438 CG LYS A 29 2.229 5.742 -6.696 1.00 0.00 C ATOM 439 CD LYS A 29 1.898 5.671 -8.195 1.00 0.00 C ATOM 440 CE LYS A 29 1.757 7.070 -8.812 1.00 0.00 C ATOM 441 NZ LYS A 29 3.058 7.788 -8.975 1.00 0.00 N ATOM 0 H LYS A 29 5.011 5.266 -4.974 1.00 0.00 H new ATOM 0 HA LYS A 29 2.292 4.621 -4.017 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.387 3.931 -6.772 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.749 3.707 -6.190 1.00 0.00 H new ATOM 0 HG2 LYS A 29 1.368 6.128 -6.151 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.048 6.443 -6.537 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.682 5.121 -8.715 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.971 5.115 -8.337 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.276 6.981 -9.786 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.097 7.669 -8.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.885 8.737 -9.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.525 7.874 -8.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 3.670 7.254 -9.624 1.00 0.00 H new ATOM 455 N ILE A 30 4.863 2.677 -4.828 1.00 0.00 N ATOM 456 CA ILE A 30 5.414 1.325 -4.748 1.00 0.00 C ATOM 457 C ILE A 30 6.925 1.381 -4.467 1.00 0.00 C ATOM 458 O ILE A 30 7.600 2.325 -4.880 1.00 0.00 O ATOM 459 CB ILE A 30 5.012 0.529 -6.023 1.00 0.00 C ATOM 460 CG1 ILE A 30 5.619 1.117 -7.312 1.00 0.00 C ATOM 461 CG2 ILE A 30 3.477 0.477 -6.171 1.00 0.00 C ATOM 462 CD1 ILE A 30 5.186 0.424 -8.611 1.00 0.00 C ATOM 0 H ILE A 30 5.465 3.332 -5.327 1.00 0.00 H new ATOM 0 HA ILE A 30 4.991 0.777 -3.906 1.00 0.00 H new ATOM 0 HB ILE A 30 5.413 -0.476 -5.891 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.349 2.171 -7.374 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.705 1.070 -7.238 1.00 0.00 H new ATOM 0 HG21 ILE A 30 3.217 -0.084 -7.069 1.00 0.00 H new ATOM 0 HG22 ILE A 30 3.044 -0.013 -5.299 1.00 0.00 H new ATOM 0 HG23 ILE A 30 3.085 1.491 -6.250 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.666 0.910 -9.460 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.480 -0.625 -8.579 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.103 0.494 -8.717 1.00 0.00 H new ATOM 474 N ALA A 31 7.441 0.388 -3.738 1.00 0.00 N ATOM 475 CA ALA A 31 8.863 0.197 -3.431 1.00 0.00 C ATOM 476 C ALA A 31 9.438 -0.785 -4.443 1.00 0.00 C ATOM 477 O ALA A 31 8.683 -1.534 -5.043 1.00 0.00 O ATOM 478 CB ALA A 31 9.049 -0.333 -2.001 1.00 0.00 C ATOM 0 H ALA A 31 6.854 -0.338 -3.327 1.00 0.00 H new ATOM 0 HA ALA A 31 9.385 1.152 -3.494 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.112 -0.466 -1.798 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.630 0.381 -1.291 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.537 -1.290 -1.898 1.00 0.00 H new ATOM 484 N VAL A 32 10.748 -0.817 -4.648 1.00 0.00 N ATOM 485 CA VAL A 32 11.387 -1.616 -5.687 1.00 0.00 C ATOM 486 C VAL A 32 12.699 -2.164 -5.121 1.00 0.00 C ATOM 487 O VAL A 32 13.456 -1.423 -4.489 1.00 0.00 O ATOM 488 CB VAL A 32 11.625 -0.733 -6.926 1.00 0.00 C ATOM 489 CG1 VAL A 32 12.025 -1.613 -8.111 1.00 0.00 C ATOM 490 CG2 VAL A 32 10.408 0.108 -7.356 1.00 0.00 C ATOM 0 H VAL A 32 11.409 -0.279 -4.087 1.00 0.00 H new ATOM 0 HA VAL A 32 10.758 -2.453 -5.992 1.00 0.00 H new ATOM 0 HB VAL A 32 12.413 -0.037 -6.638 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.193 -0.988 -8.988 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.940 -2.154 -7.870 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.227 -2.325 -8.321 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.666 0.698 -8.235 1.00 0.00 H new ATOM 0 HG22 VAL A 32 9.575 -0.553 -7.594 1.00 0.00 H new ATOM 0 HG23 VAL A 32 10.121 0.775 -6.543 1.00 0.00 H new ATOM 500 N THR A 33 12.975 -3.446 -5.362 1.00 0.00 N ATOM 501 CA THR A 33 14.136 -4.146 -4.859 1.00 0.00 C ATOM 502 C THR A 33 14.530 -5.207 -5.889 1.00 0.00 C ATOM 503 O THR A 33 13.878 -6.242 -5.992 1.00 0.00 O ATOM 504 CB THR A 33 13.768 -4.798 -3.515 1.00 0.00 C ATOM 505 OG1 THR A 33 12.987 -3.953 -2.677 1.00 0.00 O ATOM 506 CG2 THR A 33 15.006 -5.240 -2.731 1.00 0.00 C ATOM 0 H THR A 33 12.370 -4.037 -5.933 1.00 0.00 H new ATOM 0 HA THR A 33 14.975 -3.469 -4.701 1.00 0.00 H new ATOM 0 HB THR A 33 13.171 -5.669 -3.787 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.467 -4.501 -2.053 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.697 -5.695 -1.790 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.568 -5.967 -3.318 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.636 -4.374 -2.527 1.00 0.00 H new ATOM 514 N SER A 34 15.573 -4.973 -6.683 1.00 0.00 N ATOM 515 CA SER A 34 16.027 -5.972 -7.650 1.00 0.00 C ATOM 516 C SER A 34 17.065 -6.920 -7.047 1.00 0.00 C ATOM 517 O SER A 34 18.256 -6.865 -7.364 1.00 0.00 O ATOM 518 CB SER A 34 16.489 -5.309 -8.941 1.00 0.00 C ATOM 519 OG SER A 34 15.399 -4.611 -9.493 1.00 0.00 O ATOM 0 H SER A 34 16.116 -4.109 -6.677 1.00 0.00 H new ATOM 0 HA SER A 34 15.178 -6.603 -7.913 1.00 0.00 H new ATOM 0 HB2 SER A 34 17.316 -4.627 -8.743 1.00 0.00 H new ATOM 0 HB3 SER A 34 16.855 -6.058 -9.643 1.00 0.00 H new ATOM 0 HG SER A 34 15.527 -4.516 -10.460 1.00 0.00 H new ATOM 525 N SER A 35 16.602 -7.791 -6.155 1.00 0.00 N ATOM 526 CA SER A 35 17.367 -8.903 -5.602 1.00 0.00 C ATOM 527 C SER A 35 17.626 -9.975 -6.679 1.00 0.00 C ATOM 528 O SER A 35 17.122 -9.874 -7.801 1.00 0.00 O ATOM 529 CB SER A 35 16.575 -9.475 -4.425 1.00 0.00 C ATOM 530 OG SER A 35 15.997 -8.427 -3.662 1.00 0.00 O ATOM 0 H SER A 35 15.653 -7.740 -5.785 1.00 0.00 H new ATOM 0 HA SER A 35 18.343 -8.560 -5.258 1.00 0.00 H new ATOM 0 HB2 SER A 35 15.793 -10.139 -4.793 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.231 -10.074 -3.794 1.00 0.00 H new ATOM 0 HG SER A 35 16.136 -8.602 -2.708 1.00 0.00 H new ATOM 536 N GLY A 36 18.377 -11.034 -6.353 1.00 0.00 N ATOM 537 CA GLY A 36 18.699 -12.122 -7.258 1.00 0.00 C ATOM 538 C GLY A 36 19.283 -13.262 -6.437 1.00 0.00 C ATOM 539 O GLY A 36 19.175 -13.263 -5.214 1.00 0.00 O ATOM 0 H GLY A 36 18.784 -11.152 -5.425 1.00 0.00 H new ATOM 0 HA2 GLY A 36 17.806 -12.453 -7.788 1.00 0.00 H new ATOM 0 HA3 GLY A 36 19.413 -11.791 -8.012 1.00 0.00 H new ATOM 543 N LEU A 37 19.873 -14.260 -7.089 1.00 0.00 N ATOM 544 CA LEU A 37 20.477 -15.428 -6.449 1.00 0.00 C ATOM 545 C LEU A 37 21.944 -15.605 -6.861 1.00 0.00 C ATOM 546 O LEU A 37 22.612 -16.554 -6.447 1.00 0.00 O ATOM 547 CB LEU A 37 19.602 -16.643 -6.781 1.00 0.00 C ATOM 548 CG LEU A 37 18.296 -16.643 -5.967 1.00 0.00 C ATOM 549 CD1 LEU A 37 17.207 -17.448 -6.684 1.00 0.00 C ATOM 550 CD2 LEU A 37 18.519 -17.205 -4.559 1.00 0.00 C ATOM 0 H LEU A 37 19.947 -14.280 -8.106 1.00 0.00 H new ATOM 0 HA LEU A 37 20.509 -15.300 -5.367 1.00 0.00 H new ATOM 0 HB2 LEU A 37 19.367 -16.643 -7.845 1.00 0.00 H new ATOM 0 HB3 LEU A 37 20.158 -17.558 -6.577 1.00 0.00 H new ATOM 0 HG LEU A 37 17.967 -15.608 -5.876 1.00 0.00 H new ATOM 0 HD11 LEU A 37 16.293 -17.434 -6.090 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.011 -17.006 -7.661 1.00 0.00 H new ATOM 0 HD13 LEU A 37 17.541 -18.478 -6.812 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.578 -17.192 -4.009 1.00 0.00 H new ATOM 0 HD22 LEU A 37 18.884 -18.230 -4.630 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.254 -16.594 -4.035 1.00 0.00 H new ATOM 562 N GLU A 38 22.424 -14.661 -7.666 1.00 0.00 N ATOM 563 CA GLU A 38 23.783 -14.474 -8.158 1.00 0.00 C ATOM 564 C GLU A 38 23.982 -12.952 -8.244 1.00 0.00 C ATOM 565 O GLU A 38 23.234 -12.191 -7.619 1.00 0.00 O ATOM 566 CB GLU A 38 23.930 -15.168 -9.537 1.00 0.00 C ATOM 567 CG GLU A 38 24.104 -16.675 -9.382 1.00 0.00 C ATOM 568 CD GLU A 38 24.413 -17.396 -10.708 1.00 0.00 C ATOM 569 OE1 GLU A 38 25.433 -17.072 -11.363 1.00 0.00 O ATOM 570 OE2 GLU A 38 23.643 -18.308 -11.098 1.00 0.00 O ATOM 0 H GLU A 38 21.805 -13.934 -8.026 1.00 0.00 H new ATOM 0 HA GLU A 38 24.539 -14.916 -7.509 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.050 -14.962 -10.146 1.00 0.00 H new ATOM 0 HB3 GLU A 38 24.788 -14.753 -10.066 1.00 0.00 H new ATOM 0 HG2 GLU A 38 24.911 -16.869 -8.675 1.00 0.00 H new ATOM 0 HG3 GLU A 38 23.195 -17.096 -8.952 1.00 0.00 H new ATOM 577 N SER A 39 24.903 -12.512 -9.106 1.00 0.00 N ATOM 578 CA SER A 39 25.095 -11.122 -9.499 1.00 0.00 C ATOM 579 C SER A 39 25.674 -10.219 -8.409 1.00 0.00 C ATOM 580 O SER A 39 25.941 -10.641 -7.279 1.00 0.00 O ATOM 581 CB SER A 39 23.794 -10.579 -10.096 1.00 0.00 C ATOM 582 OG SER A 39 23.240 -11.495 -11.023 1.00 0.00 O ATOM 0 H SER A 39 25.559 -13.144 -9.565 1.00 0.00 H new ATOM 0 HA SER A 39 25.872 -11.111 -10.263 1.00 0.00 H new ATOM 0 HB2 SER A 39 23.077 -10.385 -9.298 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.986 -9.627 -10.591 1.00 0.00 H new ATOM 0 HG SER A 39 22.288 -11.299 -11.147 1.00 0.00 H new ATOM 588 N SER A 40 25.904 -8.968 -8.820 1.00 0.00 N ATOM 589 CA SER A 40 26.649 -7.975 -8.067 1.00 0.00 C ATOM 590 C SER A 40 26.027 -6.592 -8.277 1.00 0.00 C ATOM 591 O SER A 40 25.353 -6.080 -7.379 1.00 0.00 O ATOM 592 CB SER A 40 28.117 -8.086 -8.521 1.00 0.00 C ATOM 593 OG SER A 40 28.743 -9.220 -7.940 1.00 0.00 O ATOM 0 H SER A 40 25.563 -8.616 -9.714 1.00 0.00 H new ATOM 0 HA SER A 40 26.611 -8.142 -6.991 1.00 0.00 H new ATOM 0 HB2 SER A 40 28.161 -8.158 -9.608 1.00 0.00 H new ATOM 0 HB3 SER A 40 28.658 -7.183 -8.239 1.00 0.00 H new ATOM 0 HG SER A 40 29.673 -9.271 -8.243 1.00 0.00 H new ATOM 599 N ARG A 41 26.204 -5.993 -9.461 1.00 0.00 N ATOM 600 CA ARG A 41 25.749 -4.632 -9.767 1.00 0.00 C ATOM 601 C ARG A 41 25.462 -4.469 -11.259 1.00 0.00 C ATOM 602 O ARG A 41 25.749 -5.357 -12.064 1.00 0.00 O ATOM 603 CB ARG A 41 26.821 -3.621 -9.286 1.00 0.00 C ATOM 604 CG ARG A 41 26.198 -2.534 -8.402 1.00 0.00 C ATOM 605 CD ARG A 41 27.263 -1.595 -7.829 1.00 0.00 C ATOM 606 NE ARG A 41 26.637 -0.496 -7.079 1.00 0.00 N ATOM 607 CZ ARG A 41 27.216 0.272 -6.147 1.00 0.00 C ATOM 608 NH1 ARG A 41 28.461 0.038 -5.738 1.00 0.00 N ATOM 609 NH2 ARG A 41 26.527 1.286 -5.635 1.00 0.00 N ATOM 0 H ARG A 41 26.674 -6.447 -10.244 1.00 0.00 H new ATOM 0 HA ARG A 41 24.814 -4.438 -9.241 1.00 0.00 H new ATOM 0 HB2 ARG A 41 27.597 -4.146 -8.729 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.304 -3.161 -10.148 1.00 0.00 H new ATOM 0 HG2 ARG A 41 25.479 -1.958 -8.985 1.00 0.00 H new ATOM 0 HG3 ARG A 41 25.646 -3.000 -7.586 1.00 0.00 H new ATOM 0 HD2 ARG A 41 27.933 -2.153 -7.175 1.00 0.00 H new ATOM 0 HD3 ARG A 41 27.871 -1.190 -8.638 1.00 0.00 H new ATOM 0 HE ARG A 41 25.659 -0.298 -7.291 1.00 0.00 H new ATOM 0 HH11 ARG A 41 28.991 -0.737 -6.136 1.00 0.00 H new ATOM 0 HH12 ARG A 41 28.885 0.634 -5.027 1.00 0.00 H new ATOM 0 HH21 ARG A 41 25.575 1.468 -5.953 1.00 0.00 H new ATOM 0 HH22 ARG A 41 26.950 1.883 -4.924 1.00 0.00 H new ATOM 623 N VAL A 42 24.889 -3.319 -11.605 1.00 0.00 N ATOM 624 CA VAL A 42 24.592 -2.925 -12.972 1.00 0.00 C ATOM 625 C VAL A 42 25.894 -2.545 -13.701 1.00 0.00 C ATOM 626 O VAL A 42 26.936 -2.387 -13.057 1.00 0.00 O ATOM 627 CB VAL A 42 23.544 -1.796 -12.947 1.00 0.00 C ATOM 628 CG1 VAL A 42 22.367 -2.072 -11.995 1.00 0.00 C ATOM 629 CG2 VAL A 42 24.139 -0.416 -12.628 1.00 0.00 C ATOM 0 H VAL A 42 24.612 -2.617 -10.918 1.00 0.00 H new ATOM 0 HA VAL A 42 24.161 -3.752 -13.536 1.00 0.00 H new ATOM 0 HB VAL A 42 23.163 -1.778 -13.968 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.668 -1.236 -12.028 1.00 0.00 H new ATOM 0 HG12 VAL A 42 21.856 -2.984 -12.303 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.742 -2.192 -10.978 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.345 0.331 -12.627 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.614 -0.442 -11.647 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.881 -0.156 -13.383 1.00 0.00 H new ATOM 639 N HIS A 43 25.846 -2.379 -15.026 1.00 0.00 N ATOM 640 CA HIS A 43 27.024 -2.063 -15.839 1.00 0.00 C ATOM 641 C HIS A 43 27.197 -0.547 -16.073 1.00 0.00 C ATOM 642 O HIS A 43 26.238 0.210 -15.913 1.00 0.00 O ATOM 643 CB HIS A 43 27.010 -2.936 -17.111 1.00 0.00 C ATOM 644 CG HIS A 43 27.986 -4.098 -17.059 1.00 0.00 C ATOM 645 ND1 HIS A 43 28.573 -4.692 -18.149 1.00 0.00 N ATOM 646 CD2 HIS A 43 28.495 -4.730 -15.951 1.00 0.00 C ATOM 647 CE1 HIS A 43 29.424 -5.638 -17.721 1.00 0.00 C ATOM 648 NE2 HIS A 43 29.419 -5.693 -16.376 1.00 0.00 N ATOM 0 H HIS A 43 24.985 -2.460 -15.567 1.00 0.00 H new ATOM 0 HA HIS A 43 27.931 -2.323 -15.293 1.00 0.00 H new ATOM 0 HB2 HIS A 43 26.003 -3.324 -17.265 1.00 0.00 H new ATOM 0 HB3 HIS A 43 27.246 -2.312 -17.973 1.00 0.00 H new ATOM 0 HD1 HIS A 43 28.392 -4.454 -19.124 1.00 0.00 H new ATOM 0 HD2 HIS A 43 28.228 -4.520 -14.926 1.00 0.00 H new ATOM 0 HE1 HIS A 43 30.026 -6.264 -18.363 1.00 0.00 H new ATOM 656 N PRO A 44 28.412 -0.077 -16.435 1.00 0.00 N ATOM 657 CA PRO A 44 28.765 1.346 -16.467 1.00 0.00 C ATOM 658 C PRO A 44 27.919 2.170 -17.441 1.00 0.00 C ATOM 659 O PRO A 44 27.312 3.164 -17.039 1.00 0.00 O ATOM 660 CB PRO A 44 30.258 1.395 -16.832 1.00 0.00 C ATOM 661 CG PRO A 44 30.486 0.075 -17.573 1.00 0.00 C ATOM 662 CD PRO A 44 29.586 -0.870 -16.788 1.00 0.00 C ATOM 0 HA PRO A 44 28.563 1.801 -15.498 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.490 2.254 -17.461 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.886 1.471 -15.945 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.199 0.138 -18.623 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.530 -0.236 -17.546 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.309 -1.738 -17.387 1.00 0.00 H new ATOM 0 HD3 PRO A 44 30.090 -1.245 -15.897 1.00 0.00 H new ATOM 670 N THR A 45 27.843 1.762 -18.712 1.00 0.00 N ATOM 671 CA THR A 45 27.161 2.548 -19.741 1.00 0.00 C ATOM 672 C THR A 45 25.658 2.616 -19.451 1.00 0.00 C ATOM 673 O THR A 45 25.027 3.616 -19.791 1.00 0.00 O ATOM 674 CB THR A 45 27.497 1.999 -21.135 1.00 0.00 C ATOM 675 OG1 THR A 45 28.886 1.700 -21.210 1.00 0.00 O ATOM 676 CG2 THR A 45 27.120 2.967 -22.267 1.00 0.00 C ATOM 0 H THR A 45 28.247 0.889 -19.052 1.00 0.00 H new ATOM 0 HA THR A 45 27.519 3.577 -19.722 1.00 0.00 H new ATOM 0 HB THR A 45 26.902 1.096 -21.273 1.00 0.00 H new ATOM 0 HG1 THR A 45 29.097 1.348 -22.100 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.382 2.523 -23.228 1.00 0.00 H new ATOM 0 HG22 THR A 45 26.048 3.162 -22.237 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.663 3.904 -22.140 1.00 0.00 H new ATOM 684 N ALA A 46 25.093 1.617 -18.748 1.00 0.00 N ATOM 685 CA ALA A 46 23.698 1.658 -18.333 1.00 0.00 C ATOM 686 C ALA A 46 23.456 2.938 -17.571 1.00 0.00 C ATOM 687 O ALA A 46 22.586 3.713 -17.941 1.00 0.00 O ATOM 688 CB ALA A 46 23.326 0.441 -17.463 1.00 0.00 C ATOM 0 H ALA A 46 25.591 0.775 -18.460 1.00 0.00 H new ATOM 0 HA ALA A 46 23.068 1.623 -19.222 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.277 0.508 -17.173 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.488 -0.475 -18.031 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.949 0.429 -16.569 1.00 0.00 H new ATOM 694 N ILE A 47 24.267 3.191 -16.551 1.00 0.00 N ATOM 695 CA ILE A 47 24.031 4.287 -15.632 1.00 0.00 C ATOM 696 C ILE A 47 24.056 5.592 -16.414 1.00 0.00 C ATOM 697 O ILE A 47 23.197 6.435 -16.185 1.00 0.00 O ATOM 698 CB ILE A 47 25.121 4.274 -14.531 1.00 0.00 C ATOM 699 CG1 ILE A 47 25.071 2.990 -13.676 1.00 0.00 C ATOM 700 CG2 ILE A 47 25.023 5.521 -13.637 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.380 2.686 -12.939 1.00 0.00 C ATOM 0 H ILE A 47 25.101 2.643 -16.342 1.00 0.00 H new ATOM 0 HA ILE A 47 23.059 4.184 -15.150 1.00 0.00 H new ATOM 0 HB ILE A 47 26.084 4.289 -15.042 1.00 0.00 H new ATOM 0 HG12 ILE A 47 24.267 3.082 -12.946 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.823 2.146 -14.319 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.800 5.484 -12.874 1.00 0.00 H new ATOM 0 HG22 ILE A 47 25.154 6.416 -14.245 1.00 0.00 H new ATOM 0 HG23 ILE A 47 24.045 5.549 -13.157 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.267 1.769 -12.360 1.00 0.00 H new ATOM 0 HD12 ILE A 47 27.185 2.561 -13.663 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.620 3.511 -12.269 1.00 0.00 H new ATOM 713 N ALA A 48 24.983 5.747 -17.363 1.00 0.00 N ATOM 714 CA ALA A 48 25.087 6.972 -18.140 1.00 0.00 C ATOM 715 C ALA A 48 23.814 7.206 -18.960 1.00 0.00 C ATOM 716 O ALA A 48 23.313 8.326 -19.029 1.00 0.00 O ATOM 717 CB ALA A 48 26.323 6.916 -19.046 1.00 0.00 C ATOM 0 H ALA A 48 25.671 5.035 -17.608 1.00 0.00 H new ATOM 0 HA ALA A 48 25.199 7.813 -17.455 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.393 7.838 -19.624 1.00 0.00 H new ATOM 0 HB2 ALA A 48 27.218 6.803 -18.434 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.238 6.067 -19.725 1.00 0.00 H new ATOM 723 N MET A 49 23.259 6.147 -19.550 1.00 0.00 N ATOM 724 CA MET A 49 22.058 6.226 -20.382 1.00 0.00 C ATOM 725 C MET A 49 20.822 6.434 -19.511 1.00 0.00 C ATOM 726 O MET A 49 19.894 7.177 -19.846 1.00 0.00 O ATOM 727 CB MET A 49 21.961 4.942 -21.212 1.00 0.00 C ATOM 728 CG MET A 49 23.169 4.816 -22.151 1.00 0.00 C ATOM 729 SD MET A 49 23.227 6.029 -23.484 1.00 0.00 S ATOM 730 CE MET A 49 24.593 7.034 -22.843 1.00 0.00 C ATOM 0 H MET A 49 23.634 5.202 -19.463 1.00 0.00 H new ATOM 0 HA MET A 49 22.117 7.080 -21.057 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.915 4.077 -20.550 1.00 0.00 H new ATOM 0 HB3 MET A 49 21.039 4.947 -21.794 1.00 0.00 H new ATOM 0 HG2 MET A 49 24.081 4.904 -21.560 1.00 0.00 H new ATOM 0 HG3 MET A 49 23.168 3.818 -22.588 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.794 7.855 -23.531 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.322 7.436 -21.867 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.485 6.415 -22.745 1.00 0.00 H new ATOM 740 N MET A 50 20.819 5.819 -18.341 1.00 0.00 N ATOM 741 CA MET A 50 19.698 5.920 -17.440 1.00 0.00 C ATOM 742 C MET A 50 19.731 7.329 -16.850 1.00 0.00 C ATOM 743 O MET A 50 18.681 7.941 -16.699 1.00 0.00 O ATOM 744 CB MET A 50 19.705 4.764 -16.431 1.00 0.00 C ATOM 745 CG MET A 50 19.705 3.346 -17.066 1.00 0.00 C ATOM 746 SD MET A 50 19.337 3.177 -18.851 1.00 0.00 S ATOM 747 CE MET A 50 19.857 1.473 -19.211 1.00 0.00 C ATOM 0 H MET A 50 21.587 5.243 -17.997 1.00 0.00 H new ATOM 0 HA MET A 50 18.737 5.802 -17.941 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.584 4.862 -15.794 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.832 4.858 -15.786 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.686 2.905 -16.888 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.980 2.741 -16.521 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.699 1.260 -20.268 1.00 0.00 H new ATOM 0 HE2 MET A 50 20.914 1.357 -18.972 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.270 0.779 -18.609 1.00 0.00 H new ATOM 757 N GLU A 51 20.917 7.914 -16.687 1.00 0.00 N ATOM 758 CA GLU A 51 21.108 9.302 -16.335 1.00 0.00 C ATOM 759 C GLU A 51 20.725 10.224 -17.500 1.00 0.00 C ATOM 760 O GLU A 51 20.362 11.373 -17.242 1.00 0.00 O ATOM 761 CB GLU A 51 22.539 9.521 -15.818 1.00 0.00 C ATOM 762 CG GLU A 51 22.779 10.935 -15.277 1.00 0.00 C ATOM 763 CD GLU A 51 24.159 11.050 -14.601 1.00 0.00 C ATOM 764 OE1 GLU A 51 25.178 11.212 -15.315 1.00 0.00 O ATOM 765 OE2 GLU A 51 24.232 11.005 -13.348 1.00 0.00 O ATOM 0 H GLU A 51 21.795 7.409 -16.803 1.00 0.00 H new ATOM 0 HA GLU A 51 20.436 9.568 -15.519 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.748 8.798 -15.030 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.244 9.324 -16.626 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.710 11.655 -16.092 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.998 11.190 -14.560 1.00 0.00 H new ATOM 772 N GLU A 52 20.691 9.746 -18.756 1.00 0.00 N ATOM 773 CA GLU A 52 20.109 10.547 -19.836 1.00 0.00 C ATOM 774 C GLU A 52 18.620 10.757 -19.557 1.00 0.00 C ATOM 775 O GLU A 52 18.107 11.856 -19.783 1.00 0.00 O ATOM 776 CB GLU A 52 20.250 9.970 -21.256 1.00 0.00 C ATOM 777 CG GLU A 52 21.683 9.847 -21.768 1.00 0.00 C ATOM 778 CD GLU A 52 21.731 9.400 -23.243 1.00 0.00 C ATOM 779 OE1 GLU A 52 20.877 8.593 -23.691 1.00 0.00 O ATOM 780 OE2 GLU A 52 22.624 9.882 -23.976 1.00 0.00 O ATOM 0 H GLU A 52 21.050 8.834 -19.039 1.00 0.00 H new ATOM 0 HA GLU A 52 20.682 11.474 -19.832 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.787 8.983 -21.278 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.688 10.601 -21.945 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.190 10.806 -21.663 1.00 0.00 H new ATOM 0 HG3 GLU A 52 22.228 9.130 -21.154 1.00 0.00 H new ATOM 787 N VAL A 53 17.941 9.733 -19.022 1.00 0.00 N ATOM 788 CA VAL A 53 16.559 9.893 -18.538 1.00 0.00 C ATOM 789 C VAL A 53 16.506 10.348 -17.059 1.00 0.00 C ATOM 790 O VAL A 53 15.443 10.359 -16.434 1.00 0.00 O ATOM 791 CB VAL A 53 15.685 8.686 -18.958 1.00 0.00 C ATOM 792 CG1 VAL A 53 15.962 7.403 -18.167 1.00 0.00 C ATOM 793 CG2 VAL A 53 14.184 9.004 -18.932 1.00 0.00 C ATOM 0 H VAL A 53 18.320 8.792 -18.913 1.00 0.00 H new ATOM 0 HA VAL A 53 16.079 10.733 -19.040 1.00 0.00 H new ATOM 0 HB VAL A 53 15.983 8.494 -19.989 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.308 6.607 -18.524 1.00 0.00 H new ATOM 0 HG12 VAL A 53 17.002 7.107 -18.306 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.773 7.580 -17.108 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.620 8.122 -19.235 1.00 0.00 H new ATOM 0 HG22 VAL A 53 13.891 9.293 -17.923 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.974 9.823 -19.620 1.00 0.00 H new ATOM 803 N GLY A 54 17.637 10.784 -16.492 1.00 0.00 N ATOM 804 CA GLY A 54 17.722 11.345 -15.148 1.00 0.00 C ATOM 805 C GLY A 54 17.554 10.308 -14.031 1.00 0.00 C ATOM 806 O GLY A 54 17.269 10.682 -12.890 1.00 0.00 O ATOM 0 H GLY A 54 18.537 10.754 -16.970 1.00 0.00 H new ATOM 0 HA2 GLY A 54 18.687 11.838 -15.031 1.00 0.00 H new ATOM 0 HA3 GLY A 54 16.956 12.113 -15.036 1.00 0.00 H new ATOM 810 N ILE A 55 17.704 9.020 -14.345 1.00 0.00 N ATOM 811 CA ILE A 55 17.463 7.901 -13.440 1.00 0.00 C ATOM 812 C ILE A 55 18.770 7.360 -12.857 1.00 0.00 C ATOM 813 O ILE A 55 19.796 7.293 -13.536 1.00 0.00 O ATOM 814 CB ILE A 55 16.596 6.839 -14.145 1.00 0.00 C ATOM 815 CG1 ILE A 55 15.155 7.396 -14.250 1.00 0.00 C ATOM 816 CG2 ILE A 55 16.639 5.445 -13.485 1.00 0.00 C ATOM 817 CD1 ILE A 55 14.090 6.354 -14.576 1.00 0.00 C ATOM 0 H ILE A 55 18.008 8.719 -15.271 1.00 0.00 H new ATOM 0 HA ILE A 55 16.895 8.243 -12.575 1.00 0.00 H new ATOM 0 HB ILE A 55 17.010 6.663 -15.138 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.896 7.877 -13.307 1.00 0.00 H new ATOM 0 HG13 ILE A 55 15.134 8.169 -15.018 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.002 4.758 -14.043 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.663 5.073 -13.487 1.00 0.00 H new ATOM 0 HG23 ILE A 55 16.282 5.518 -12.458 1.00 0.00 H new ATOM 0 HD11 ILE A 55 13.114 6.836 -14.629 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.318 5.889 -15.535 1.00 0.00 H new ATOM 0 HD13 ILE A 55 14.076 5.592 -13.797 1.00 0.00 H new ATOM 829 N ASP A 56 18.682 6.914 -11.603 1.00 0.00 N ATOM 830 CA ASP A 56 19.714 6.163 -10.903 1.00 0.00 C ATOM 831 C ASP A 56 19.394 4.669 -11.004 1.00 0.00 C ATOM 832 O ASP A 56 18.249 4.256 -10.806 1.00 0.00 O ATOM 833 CB ASP A 56 19.777 6.620 -9.436 1.00 0.00 C ATOM 834 CG ASP A 56 20.305 5.511 -8.515 1.00 0.00 C ATOM 835 OD1 ASP A 56 21.490 5.132 -8.629 1.00 0.00 O ATOM 836 OD2 ASP A 56 19.493 4.976 -7.724 1.00 0.00 O ATOM 0 H ASP A 56 17.855 7.075 -11.028 1.00 0.00 H new ATOM 0 HA ASP A 56 20.689 6.344 -11.356 1.00 0.00 H new ATOM 0 HB2 ASP A 56 20.420 7.496 -9.356 1.00 0.00 H new ATOM 0 HB3 ASP A 56 18.783 6.923 -9.107 1.00 0.00 H new ATOM 841 N ILE A 57 20.417 3.863 -11.264 1.00 0.00 N ATOM 842 CA ILE A 57 20.386 2.397 -11.190 1.00 0.00 C ATOM 843 C ILE A 57 21.631 1.898 -10.442 1.00 0.00 C ATOM 844 O ILE A 57 21.588 0.871 -9.779 1.00 0.00 O ATOM 845 CB ILE A 57 20.282 1.746 -12.584 1.00 0.00 C ATOM 846 CG1 ILE A 57 21.257 2.405 -13.573 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.851 1.733 -13.154 1.00 0.00 C ATOM 848 CD1 ILE A 57 21.627 1.456 -14.697 1.00 0.00 C ATOM 0 H ILE A 57 21.330 4.222 -11.544 1.00 0.00 H new ATOM 0 HA ILE A 57 19.491 2.102 -10.643 1.00 0.00 H new ATOM 0 HB ILE A 57 20.564 0.702 -12.448 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.804 3.305 -13.988 1.00 0.00 H new ATOM 0 HG13 ILE A 57 22.159 2.716 -13.045 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.855 1.260 -14.136 1.00 0.00 H new ATOM 0 HG22 ILE A 57 18.198 1.173 -12.485 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.486 2.756 -13.245 1.00 0.00 H new ATOM 0 HD11 ILE A 57 22.317 1.952 -15.379 1.00 0.00 H new ATOM 0 HD12 ILE A 57 22.103 0.568 -14.281 1.00 0.00 H new ATOM 0 HD13 ILE A 57 20.727 1.166 -15.239 1.00 0.00 H new ATOM 860 N SER A 58 22.732 2.644 -10.513 1.00 0.00 N ATOM 861 CA SER A 58 23.965 2.517 -9.745 1.00 0.00 C ATOM 862 C SER A 58 23.733 2.169 -8.266 1.00 0.00 C ATOM 863 O SER A 58 24.485 1.380 -7.693 1.00 0.00 O ATOM 864 CB SER A 58 24.711 3.867 -9.853 1.00 0.00 C ATOM 865 OG SER A 58 24.121 4.739 -10.815 1.00 0.00 O ATOM 0 H SER A 58 22.786 3.423 -11.170 1.00 0.00 H new ATOM 0 HA SER A 58 24.544 1.690 -10.157 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.716 4.355 -8.879 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.751 3.684 -10.123 1.00 0.00 H new ATOM 0 HG SER A 58 24.624 5.579 -10.847 1.00 0.00 H new ATOM 871 N GLY A 59 22.692 2.723 -7.647 1.00 0.00 N ATOM 872 CA GLY A 59 22.333 2.478 -6.254 1.00 0.00 C ATOM 873 C GLY A 59 21.867 1.043 -5.962 1.00 0.00 C ATOM 874 O GLY A 59 21.763 0.672 -4.791 1.00 0.00 O ATOM 0 H GLY A 59 22.059 3.372 -8.114 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.194 2.703 -5.625 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.540 3.170 -5.969 1.00 0.00 H new ATOM 878 N GLN A 60 21.588 0.231 -6.988 1.00 0.00 N ATOM 879 CA GLN A 60 21.254 -1.173 -6.845 1.00 0.00 C ATOM 880 C GLN A 60 22.481 -1.967 -6.427 1.00 0.00 C ATOM 881 O GLN A 60 23.615 -1.622 -6.767 1.00 0.00 O ATOM 882 CB GLN A 60 20.804 -1.759 -8.185 1.00 0.00 C ATOM 883 CG GLN A 60 19.424 -1.237 -8.601 1.00 0.00 C ATOM 884 CD GLN A 60 19.195 -1.370 -10.095 1.00 0.00 C ATOM 885 OE1 GLN A 60 18.941 -0.390 -10.772 1.00 0.00 O ATOM 886 NE2 GLN A 60 19.232 -2.563 -10.654 1.00 0.00 N ATOM 0 H GLN A 60 21.591 0.548 -7.958 1.00 0.00 H new ATOM 0 HA GLN A 60 20.462 -1.240 -6.100 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.534 -1.509 -8.955 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.775 -2.846 -8.115 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.651 -1.788 -8.065 1.00 0.00 H new ATOM 0 HG3 GLN A 60 19.329 -0.191 -8.311 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.445 -3.385 -10.088 1.00 0.00 H new ATOM 0 HE22 GLN A 60 19.048 -2.664 -11.652 1.00 0.00 H new ATOM 895 N THR A 61 22.208 -3.107 -5.809 1.00 0.00 N ATOM 896 CA THR A 61 23.116 -4.169 -5.502 1.00 0.00 C ATOM 897 C THR A 61 22.253 -5.437 -5.520 1.00 0.00 C ATOM 898 O THR A 61 21.042 -5.388 -5.269 1.00 0.00 O ATOM 899 CB THR A 61 23.803 -3.942 -4.143 1.00 0.00 C ATOM 900 OG1 THR A 61 22.936 -3.341 -3.187 1.00 0.00 O ATOM 901 CG2 THR A 61 25.057 -3.076 -4.273 1.00 0.00 C ATOM 0 H THR A 61 21.263 -3.316 -5.489 1.00 0.00 H new ATOM 0 HA THR A 61 23.935 -4.238 -6.218 1.00 0.00 H new ATOM 0 HB THR A 61 24.081 -4.936 -3.793 1.00 0.00 H new ATOM 0 HG1 THR A 61 23.416 -3.219 -2.341 1.00 0.00 H new ATOM 0 HG21 THR A 61 25.510 -2.941 -3.291 1.00 0.00 H new ATOM 0 HG22 THR A 61 25.770 -3.565 -4.937 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.787 -2.103 -4.684 1.00 0.00 H new ATOM 909 N SER A 62 22.859 -6.570 -5.852 1.00 0.00 N ATOM 910 CA SER A 62 22.165 -7.830 -6.036 1.00 0.00 C ATOM 911 C SER A 62 22.186 -8.576 -4.700 1.00 0.00 C ATOM 912 O SER A 62 22.986 -9.493 -4.491 1.00 0.00 O ATOM 913 CB SER A 62 22.839 -8.588 -7.173 1.00 0.00 C ATOM 914 OG SER A 62 22.775 -7.871 -8.402 1.00 0.00 O ATOM 0 H SER A 62 23.866 -6.636 -6.003 1.00 0.00 H new ATOM 0 HA SER A 62 21.121 -7.700 -6.319 1.00 0.00 H new ATOM 0 HB2 SER A 62 23.882 -8.775 -6.916 1.00 0.00 H new ATOM 0 HB3 SER A 62 22.361 -9.560 -7.295 1.00 0.00 H new ATOM 0 HG SER A 62 22.051 -8.233 -8.955 1.00 0.00 H new ATOM 920 N ASP A 63 21.343 -8.136 -3.763 1.00 0.00 N ATOM 921 CA ASP A 63 21.130 -8.875 -2.520 1.00 0.00 C ATOM 922 C ASP A 63 20.527 -10.239 -2.851 1.00 0.00 C ATOM 923 O ASP A 63 19.807 -10.358 -3.855 1.00 0.00 O ATOM 924 CB ASP A 63 20.168 -8.153 -1.561 1.00 0.00 C ATOM 925 CG ASP A 63 20.917 -7.302 -0.525 1.00 0.00 C ATOM 926 OD1 ASP A 63 21.634 -7.880 0.326 1.00 0.00 O ATOM 927 OD2 ASP A 63 20.791 -6.055 -0.558 1.00 0.00 O ATOM 0 H ASP A 63 20.800 -7.276 -3.842 1.00 0.00 H new ATOM 0 HA ASP A 63 22.099 -8.966 -2.029 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.495 -7.516 -2.135 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.549 -8.888 -1.047 1.00 0.00 H new ATOM 932 N PRO A 64 20.745 -11.259 -2.003 1.00 0.00 N ATOM 933 CA PRO A 64 20.026 -12.509 -2.128 1.00 0.00 C ATOM 934 C PRO A 64 18.531 -12.200 -2.043 1.00 0.00 C ATOM 935 O PRO A 64 18.089 -11.511 -1.126 1.00 0.00 O ATOM 936 CB PRO A 64 20.482 -13.392 -0.958 1.00 0.00 C ATOM 937 CG PRO A 64 21.786 -12.754 -0.479 1.00 0.00 C ATOM 938 CD PRO A 64 21.623 -11.280 -0.845 1.00 0.00 C ATOM 0 HA PRO A 64 20.218 -13.021 -3.071 1.00 0.00 H new ATOM 0 HB2 PRO A 64 19.736 -13.414 -0.164 1.00 0.00 H new ATOM 0 HB3 PRO A 64 20.638 -14.423 -1.277 1.00 0.00 H new ATOM 0 HG2 PRO A 64 21.927 -12.887 0.594 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.652 -13.196 -0.971 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.193 -10.716 -0.017 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.586 -10.825 -1.075 1.00 0.00 H new ATOM 946 N ILE A 65 17.726 -12.773 -2.930 1.00 0.00 N ATOM 947 CA ILE A 65 16.271 -12.701 -2.823 1.00 0.00 C ATOM 948 C ILE A 65 15.818 -13.362 -1.515 1.00 0.00 C ATOM 949 O ILE A 65 14.784 -13.019 -0.950 1.00 0.00 O ATOM 950 CB ILE A 65 15.664 -13.329 -4.094 1.00 0.00 C ATOM 951 CG1 ILE A 65 14.279 -12.732 -4.392 1.00 0.00 C ATOM 952 CG2 ILE A 65 15.642 -14.866 -4.065 1.00 0.00 C ATOM 953 CD1 ILE A 65 13.707 -13.159 -5.749 1.00 0.00 C ATOM 0 H ILE A 65 18.059 -13.298 -3.739 1.00 0.00 H new ATOM 0 HA ILE A 65 15.915 -11.672 -2.771 1.00 0.00 H new ATOM 0 HB ILE A 65 16.327 -13.069 -4.919 1.00 0.00 H new ATOM 0 HG12 ILE A 65 13.587 -13.031 -3.605 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.347 -11.645 -4.361 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.202 -15.241 -4.989 1.00 0.00 H new ATOM 0 HG22 ILE A 65 16.660 -15.243 -3.968 1.00 0.00 H new ATOM 0 HG23 ILE A 65 15.048 -15.205 -3.217 1.00 0.00 H new ATOM 0 HD11 ILE A 65 12.729 -12.700 -5.892 1.00 0.00 H new ATOM 0 HD12 ILE A 65 14.379 -12.837 -6.545 1.00 0.00 H new ATOM 0 HD13 ILE A 65 13.607 -14.244 -5.776 1.00 0.00 H new ATOM 965 N GLU A 66 16.656 -14.264 -1.001 1.00 0.00 N ATOM 966 CA GLU A 66 16.484 -15.026 0.201 1.00 0.00 C ATOM 967 C GLU A 66 16.591 -14.120 1.443 1.00 0.00 C ATOM 968 O GLU A 66 16.078 -14.446 2.514 1.00 0.00 O ATOM 969 CB GLU A 66 17.612 -16.065 0.127 1.00 0.00 C ATOM 970 CG GLU A 66 17.913 -16.730 1.457 1.00 0.00 C ATOM 971 CD GLU A 66 18.886 -17.914 1.313 1.00 0.00 C ATOM 972 OE1 GLU A 66 20.122 -17.694 1.277 1.00 0.00 O ATOM 973 OE2 GLU A 66 18.421 -19.078 1.244 1.00 0.00 O ATOM 0 H GLU A 66 17.537 -14.485 -1.464 1.00 0.00 H new ATOM 0 HA GLU A 66 15.504 -15.496 0.287 1.00 0.00 H new ATOM 0 HB2 GLU A 66 17.342 -16.831 -0.600 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.517 -15.581 -0.241 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.338 -15.995 2.140 1.00 0.00 H new ATOM 0 HG3 GLU A 66 16.983 -17.080 1.904 1.00 0.00 H new ATOM 980 N ASN A 67 17.262 -12.969 1.297 1.00 0.00 N ATOM 981 CA ASN A 67 17.367 -11.932 2.322 1.00 0.00 C ATOM 982 C ASN A 67 15.984 -11.378 2.715 1.00 0.00 C ATOM 983 O ASN A 67 15.840 -10.774 3.782 1.00 0.00 O ATOM 984 CB ASN A 67 18.271 -10.797 1.821 1.00 0.00 C ATOM 985 CG ASN A 67 18.751 -9.902 2.959 1.00 0.00 C ATOM 986 OD1 ASN A 67 18.196 -8.838 3.226 1.00 0.00 O ATOM 987 ND2 ASN A 67 19.809 -10.311 3.647 1.00 0.00 N ATOM 0 H ASN A 67 17.758 -12.731 0.438 1.00 0.00 H new ATOM 0 HA ASN A 67 17.806 -12.381 3.213 1.00 0.00 H new ATOM 0 HB2 ASN A 67 19.133 -11.221 1.306 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.727 -10.196 1.092 1.00 0.00 H new ATOM 0 HD21 ASN A 67 20.173 -9.740 4.410 1.00 0.00 H new ATOM 0 HD22 ASN A 67 20.258 -11.196 3.413 1.00 0.00 H new ATOM 994 N PHE A 68 14.969 -11.609 1.877 1.00 0.00 N ATOM 995 CA PHE A 68 13.586 -11.185 2.035 1.00 0.00 C ATOM 996 C PHE A 68 12.679 -12.406 1.857 1.00 0.00 C ATOM 997 O PHE A 68 13.144 -13.513 1.566 1.00 0.00 O ATOM 998 CB PHE A 68 13.225 -10.145 0.955 1.00 0.00 C ATOM 999 CG PHE A 68 14.296 -9.115 0.656 1.00 0.00 C ATOM 1000 CD1 PHE A 68 15.301 -9.425 -0.276 1.00 0.00 C ATOM 1001 CD2 PHE A 68 14.306 -7.875 1.318 1.00 0.00 C ATOM 1002 CE1 PHE A 68 16.335 -8.503 -0.528 1.00 0.00 C ATOM 1003 CE2 PHE A 68 15.327 -6.946 1.052 1.00 0.00 C ATOM 1004 CZ PHE A 68 16.348 -7.263 0.134 1.00 0.00 C ATOM 0 H PHE A 68 15.108 -12.133 1.013 1.00 0.00 H new ATOM 0 HA PHE A 68 13.454 -10.743 3.022 1.00 0.00 H new ATOM 0 HB2 PHE A 68 12.986 -10.674 0.032 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.320 -9.623 1.266 1.00 0.00 H new ATOM 0 HD1 PHE A 68 15.280 -10.370 -0.799 1.00 0.00 H new ATOM 0 HD2 PHE A 68 13.530 -7.636 2.030 1.00 0.00 H new ATOM 0 HE1 PHE A 68 17.118 -8.749 -1.230 1.00 0.00 H new ATOM 0 HE2 PHE A 68 15.329 -5.989 1.552 1.00 0.00 H new ATOM 0 HZ PHE A 68 17.139 -6.554 -0.061 1.00 0.00 H new ATOM 1014 N ASN A 69 11.367 -12.211 2.003 1.00 0.00 N ATOM 1015 CA ASN A 69 10.353 -13.172 1.661 1.00 0.00 C ATOM 1016 C ASN A 69 9.307 -12.541 0.769 1.00 0.00 C ATOM 1017 O ASN A 69 8.940 -11.374 0.940 1.00 0.00 O ATOM 1018 CB ASN A 69 9.706 -13.756 2.904 1.00 0.00 C ATOM 1019 CG ASN A 69 8.836 -12.772 3.688 1.00 0.00 C ATOM 1020 OD1 ASN A 69 9.297 -11.714 4.110 1.00 0.00 O ATOM 1021 ND2 ASN A 69 7.577 -13.104 3.926 1.00 0.00 N ATOM 0 H ASN A 69 10.982 -11.344 2.377 1.00 0.00 H new ATOM 0 HA ASN A 69 10.833 -13.986 1.118 1.00 0.00 H new ATOM 0 HB2 ASN A 69 9.094 -14.610 2.613 1.00 0.00 H new ATOM 0 HB3 ASN A 69 10.488 -14.134 3.562 1.00 0.00 H new ATOM 0 HD21 ASN A 69 6.978 -12.479 4.465 1.00 0.00 H new ATOM 0 HD22 ASN A 69 7.206 -13.985 3.570 1.00 0.00 H new ATOM 1028 N ALA A 70 8.795 -13.316 -0.183 1.00 0.00 N ATOM 1029 CA ALA A 70 7.950 -12.766 -1.200 1.00 0.00 C ATOM 1030 C ALA A 70 6.572 -12.534 -0.627 1.00 0.00 C ATOM 1031 O ALA A 70 5.835 -11.697 -1.137 1.00 0.00 O ATOM 1032 CB ALA A 70 7.842 -13.687 -2.405 1.00 0.00 C ATOM 0 H ALA A 70 8.958 -14.320 -0.259 1.00 0.00 H new ATOM 0 HA ALA A 70 8.392 -11.827 -1.534 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.192 -13.233 -3.153 1.00 0.00 H new ATOM 0 HB2 ALA A 70 8.832 -13.845 -2.832 1.00 0.00 H new ATOM 0 HB3 ALA A 70 7.424 -14.645 -2.095 1.00 0.00 H new ATOM 1038 N ASP A 71 6.208 -13.285 0.412 1.00 0.00 N ATOM 1039 CA ASP A 71 4.896 -13.136 0.998 1.00 0.00 C ATOM 1040 C ASP A 71 4.721 -11.737 1.628 1.00 0.00 C ATOM 1041 O ASP A 71 3.592 -11.276 1.811 1.00 0.00 O ATOM 1042 CB ASP A 71 4.623 -14.255 2.010 1.00 0.00 C ATOM 1043 CG ASP A 71 3.216 -14.135 2.618 1.00 0.00 C ATOM 1044 OD1 ASP A 71 2.220 -14.369 1.892 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.108 -13.853 3.835 1.00 0.00 O ATOM 0 H ASP A 71 6.800 -13.989 0.853 1.00 0.00 H new ATOM 0 HA ASP A 71 4.156 -13.224 0.203 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.727 -15.223 1.520 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.368 -14.218 2.805 1.00 0.00 H new ATOM 1050 N ASP A 72 5.827 -11.036 1.926 1.00 0.00 N ATOM 1051 CA ASP A 72 5.828 -9.648 2.370 1.00 0.00 C ATOM 1052 C ASP A 72 5.769 -8.661 1.197 1.00 0.00 C ATOM 1053 O ASP A 72 5.200 -7.572 1.318 1.00 0.00 O ATOM 1054 CB ASP A 72 7.079 -9.361 3.196 1.00 0.00 C ATOM 1055 CG ASP A 72 7.076 -7.912 3.714 1.00 0.00 C ATOM 1056 OD1 ASP A 72 6.262 -7.597 4.616 1.00 0.00 O ATOM 1057 OD2 ASP A 72 7.910 -7.093 3.256 1.00 0.00 O ATOM 0 H ASP A 72 6.763 -11.435 1.861 1.00 0.00 H new ATOM 0 HA ASP A 72 4.933 -9.509 2.976 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.130 -10.052 4.038 1.00 0.00 H new ATOM 0 HB3 ASP A 72 7.968 -9.532 2.589 1.00 0.00 H new ATOM 1062 N TYR A 73 6.345 -9.056 0.060 1.00 0.00 N ATOM 1063 CA TYR A 73 6.278 -8.335 -1.200 1.00 0.00 C ATOM 1064 C TYR A 73 4.871 -8.465 -1.816 1.00 0.00 C ATOM 1065 O TYR A 73 4.015 -9.207 -1.317 1.00 0.00 O ATOM 1066 CB TYR A 73 7.410 -8.793 -2.144 1.00 0.00 C ATOM 1067 CG TYR A 73 8.731 -8.086 -1.875 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.385 -8.258 -0.639 1.00 0.00 C ATOM 1069 CD2 TYR A 73 9.256 -7.173 -2.815 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.508 -7.479 -0.313 1.00 0.00 C ATOM 1071 CE2 TYR A 73 10.380 -6.387 -2.495 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.998 -6.523 -1.228 1.00 0.00 C ATOM 1073 OH TYR A 73 12.041 -5.731 -0.857 1.00 0.00 O ATOM 0 H TYR A 73 6.888 -9.917 -0.005 1.00 0.00 H new ATOM 0 HA TYR A 73 6.440 -7.271 -1.025 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.552 -9.869 -2.038 1.00 0.00 H new ATOM 0 HB3 TYR A 73 7.111 -8.611 -3.176 1.00 0.00 H new ATOM 0 HD1 TYR A 73 9.021 -8.994 0.063 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.793 -7.077 -3.786 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.997 -7.612 0.640 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.770 -5.682 -3.214 1.00 0.00 H new ATOM 0 HH TYR A 73 12.609 -6.214 -0.221 1.00 0.00 H new ATOM 1083 N ASP A 74 4.608 -7.689 -2.872 1.00 0.00 N ATOM 1084 CA ASP A 74 3.321 -7.698 -3.568 1.00 0.00 C ATOM 1085 C ASP A 74 3.478 -8.079 -5.040 1.00 0.00 C ATOM 1086 O ASP A 74 2.615 -8.776 -5.586 1.00 0.00 O ATOM 1087 CB ASP A 74 2.660 -6.326 -3.449 1.00 0.00 C ATOM 1088 CG ASP A 74 1.304 -6.311 -4.175 1.00 0.00 C ATOM 1089 OD1 ASP A 74 0.300 -6.739 -3.558 1.00 0.00 O ATOM 1090 OD2 ASP A 74 1.234 -5.827 -5.330 1.00 0.00 O ATOM 0 H ASP A 74 5.284 -7.036 -3.268 1.00 0.00 H new ATOM 0 HA ASP A 74 2.689 -8.451 -3.097 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.518 -6.075 -2.398 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.314 -5.564 -3.873 1.00 0.00 H new ATOM 1095 N VAL A 75 4.574 -7.655 -5.682 1.00 0.00 N ATOM 1096 CA VAL A 75 4.738 -7.760 -7.114 1.00 0.00 C ATOM 1097 C VAL A 75 6.181 -8.127 -7.461 1.00 0.00 C ATOM 1098 O VAL A 75 7.141 -7.567 -6.927 1.00 0.00 O ATOM 1099 CB VAL A 75 4.226 -6.455 -7.766 1.00 0.00 C ATOM 1100 CG1 VAL A 75 4.469 -5.138 -7.010 1.00 0.00 C ATOM 1101 CG2 VAL A 75 4.688 -6.343 -9.224 1.00 0.00 C ATOM 0 H VAL A 75 5.370 -7.229 -5.208 1.00 0.00 H new ATOM 0 HA VAL A 75 4.139 -8.572 -7.525 1.00 0.00 H new ATOM 0 HB VAL A 75 3.143 -6.572 -7.715 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.058 -4.308 -7.584 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.982 -5.182 -6.036 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.540 -4.989 -6.873 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.312 -5.415 -9.655 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.777 -6.345 -9.262 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.304 -7.189 -9.794 1.00 0.00 H new ATOM 1111 N VAL A 76 6.359 -9.072 -8.382 1.00 0.00 N ATOM 1112 CA VAL A 76 7.666 -9.567 -8.781 1.00 0.00 C ATOM 1113 C VAL A 76 7.594 -9.829 -10.284 1.00 0.00 C ATOM 1114 O VAL A 76 6.586 -10.333 -10.786 1.00 0.00 O ATOM 1115 CB VAL A 76 7.990 -10.837 -7.974 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.266 -11.547 -8.454 1.00 0.00 C ATOM 1117 CG2 VAL A 76 8.139 -10.586 -6.457 1.00 0.00 C ATOM 0 H VAL A 76 5.586 -9.519 -8.876 1.00 0.00 H new ATOM 0 HA VAL A 76 8.466 -8.854 -8.580 1.00 0.00 H new ATOM 0 HB VAL A 76 7.123 -11.474 -8.150 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.440 -12.434 -7.845 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.149 -11.840 -9.497 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.116 -10.871 -8.360 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.367 -11.525 -5.953 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.948 -9.876 -6.283 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.208 -10.179 -6.062 1.00 0.00 H new ATOM 1127 N ILE A 77 8.654 -9.458 -10.993 1.00 0.00 N ATOM 1128 CA ILE A 77 8.713 -9.435 -12.439 1.00 0.00 C ATOM 1129 C ILE A 77 9.946 -10.237 -12.824 1.00 0.00 C ATOM 1130 O ILE A 77 11.061 -9.822 -12.492 1.00 0.00 O ATOM 1131 CB ILE A 77 8.821 -7.966 -12.912 1.00 0.00 C ATOM 1132 CG1 ILE A 77 7.713 -7.046 -12.354 1.00 0.00 C ATOM 1133 CG2 ILE A 77 8.921 -7.871 -14.443 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.287 -7.419 -12.771 1.00 0.00 C ATOM 0 H ILE A 77 9.524 -9.155 -10.555 1.00 0.00 H new ATOM 0 HA ILE A 77 7.825 -9.864 -12.904 1.00 0.00 H new ATOM 0 HB ILE A 77 9.752 -7.589 -12.488 1.00 0.00 H new ATOM 0 HG12 ILE A 77 7.770 -7.053 -11.266 1.00 0.00 H new ATOM 0 HG13 ILE A 77 7.914 -6.024 -12.677 1.00 0.00 H new ATOM 0 HG21 ILE A 77 8.995 -6.824 -14.739 1.00 0.00 H new ATOM 0 HG22 ILE A 77 9.806 -8.408 -14.784 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.032 -8.313 -14.894 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.583 -6.714 -12.329 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.204 -7.382 -13.857 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.058 -8.427 -12.424 1.00 0.00 H new ATOM 1146 N SER A 78 9.768 -11.344 -13.540 1.00 0.00 N ATOM 1147 CA SER A 78 10.886 -12.043 -14.140 1.00 0.00 C ATOM 1148 C SER A 78 10.976 -11.519 -15.570 1.00 0.00 C ATOM 1149 O SER A 78 10.289 -11.985 -16.478 1.00 0.00 O ATOM 1150 CB SER A 78 10.739 -13.557 -14.025 1.00 0.00 C ATOM 1151 OG SER A 78 10.743 -13.960 -12.663 1.00 0.00 O ATOM 0 H SER A 78 8.858 -11.771 -13.715 1.00 0.00 H new ATOM 0 HA SER A 78 11.825 -11.850 -13.621 1.00 0.00 H new ATOM 0 HB2 SER A 78 9.811 -13.874 -14.501 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.554 -14.048 -14.557 1.00 0.00 H new ATOM 0 HG SER A 78 9.922 -14.458 -12.467 1.00 0.00 H new ATOM 1157 N LEU A 79 11.780 -10.467 -15.750 1.00 0.00 N ATOM 1158 CA LEU A 79 11.898 -9.782 -17.042 1.00 0.00 C ATOM 1159 C LEU A 79 12.730 -10.572 -18.064 1.00 0.00 C ATOM 1160 O LEU A 79 12.827 -10.152 -19.219 1.00 0.00 O ATOM 1161 CB LEU A 79 12.287 -8.292 -16.905 1.00 0.00 C ATOM 1162 CG LEU A 79 13.309 -7.907 -15.825 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.589 -8.737 -15.913 1.00 0.00 C ATOM 1164 CD2 LEU A 79 13.666 -6.426 -15.974 1.00 0.00 C ATOM 0 H LEU A 79 12.362 -10.069 -15.013 1.00 0.00 H new ATOM 0 HA LEU A 79 10.896 -9.758 -17.470 1.00 0.00 H new ATOM 0 HB2 LEU A 79 12.677 -7.960 -17.867 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.375 -7.725 -16.718 1.00 0.00 H new ATOM 0 HG LEU A 79 12.851 -8.103 -14.856 1.00 0.00 H new ATOM 0 HD11 LEU A 79 15.279 -8.426 -15.128 1.00 0.00 H new ATOM 0 HD12 LEU A 79 14.348 -9.792 -15.787 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.055 -8.585 -16.887 1.00 0.00 H new ATOM 0 HD21 LEU A 79 14.391 -6.148 -15.209 1.00 0.00 H new ATOM 0 HD22 LEU A 79 14.095 -6.253 -16.961 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.766 -5.821 -15.858 1.00 0.00 H new ATOM 1176 N CYS A 80 13.342 -11.678 -17.638 1.00 0.00 N ATOM 1177 CA CYS A 80 13.978 -12.705 -18.450 1.00 0.00 C ATOM 1178 C CYS A 80 14.222 -13.920 -17.550 1.00 0.00 C ATOM 1179 O CYS A 80 14.143 -13.809 -16.322 1.00 0.00 O ATOM 1180 CB CYS A 80 15.269 -12.227 -19.134 1.00 0.00 C ATOM 1181 SG CYS A 80 16.552 -11.355 -18.190 1.00 0.00 S ATOM 0 H CYS A 80 13.408 -11.891 -16.643 1.00 0.00 H new ATOM 0 HA CYS A 80 13.316 -12.968 -19.275 1.00 0.00 H new ATOM 0 HB2 CYS A 80 15.739 -13.104 -19.580 1.00 0.00 H new ATOM 0 HB3 CYS A 80 14.974 -11.572 -19.954 1.00 0.00 H new ATOM 1186 N GLY A 81 14.559 -15.066 -18.149 1.00 0.00 N ATOM 1187 CA GLY A 81 14.935 -16.281 -17.435 1.00 0.00 C ATOM 1188 C GLY A 81 13.698 -16.989 -16.890 1.00 0.00 C ATOM 1189 O GLY A 81 13.212 -17.932 -17.517 1.00 0.00 O ATOM 0 H GLY A 81 14.577 -15.173 -19.163 1.00 0.00 H new ATOM 0 HA2 GLY A 81 15.478 -16.949 -18.104 1.00 0.00 H new ATOM 0 HA3 GLY A 81 15.610 -16.033 -16.615 1.00 0.00 H new ATOM 1193 N SER A 82 13.200 -16.517 -15.743 1.00 0.00 N ATOM 1194 CA SER A 82 12.010 -16.986 -15.021 1.00 0.00 C ATOM 1195 C SER A 82 12.163 -18.395 -14.425 1.00 0.00 C ATOM 1196 O SER A 82 12.024 -18.558 -13.212 1.00 0.00 O ATOM 1197 CB SER A 82 10.752 -16.802 -15.892 1.00 0.00 C ATOM 1198 OG SER A 82 10.755 -15.522 -16.499 1.00 0.00 O ATOM 0 H SER A 82 13.650 -15.740 -15.258 1.00 0.00 H new ATOM 0 HA SER A 82 11.887 -16.357 -14.140 1.00 0.00 H new ATOM 0 HB2 SER A 82 10.717 -17.575 -16.659 1.00 0.00 H new ATOM 0 HB3 SER A 82 9.858 -16.919 -15.280 1.00 0.00 H new ATOM 0 HG SER A 82 10.357 -15.583 -17.392 1.00 0.00 H new ATOM 1204 N GLY A 83 12.543 -19.398 -15.218 1.00 0.00 N ATOM 1205 CA GLY A 83 12.912 -20.733 -14.754 1.00 0.00 C ATOM 1206 C GLY A 83 14.359 -20.748 -14.262 1.00 0.00 C ATOM 1207 O GLY A 83 15.183 -21.483 -14.809 1.00 0.00 O ATOM 0 H GLY A 83 12.604 -19.299 -16.231 1.00 0.00 H new ATOM 0 HA2 GLY A 83 12.245 -21.042 -13.949 1.00 0.00 H new ATOM 0 HA3 GLY A 83 12.789 -21.453 -15.564 1.00 0.00 H new ATOM 1211 N VAL A 84 14.690 -19.903 -13.274 1.00 0.00 N ATOM 1212 CA VAL A 84 16.071 -19.644 -12.839 1.00 0.00 C ATOM 1213 C VAL A 84 16.464 -20.433 -11.572 1.00 0.00 C ATOM 1214 O VAL A 84 17.493 -20.129 -10.969 1.00 0.00 O ATOM 1215 CB VAL A 84 16.367 -18.125 -12.783 1.00 0.00 C ATOM 1216 CG1 VAL A 84 16.285 -17.509 -14.188 1.00 0.00 C ATOM 1217 CG2 VAL A 84 15.436 -17.345 -11.844 1.00 0.00 C ATOM 0 H VAL A 84 13.996 -19.373 -12.747 1.00 0.00 H new ATOM 0 HA VAL A 84 16.741 -20.043 -13.601 1.00 0.00 H new ATOM 0 HB VAL A 84 17.376 -18.040 -12.381 1.00 0.00 H new ATOM 0 HG11 VAL A 84 16.496 -16.441 -14.130 1.00 0.00 H new ATOM 0 HG12 VAL A 84 17.016 -17.988 -14.839 1.00 0.00 H new ATOM 0 HG13 VAL A 84 15.285 -17.660 -14.594 1.00 0.00 H new ATOM 0 HG21 VAL A 84 15.706 -16.289 -11.859 1.00 0.00 H new ATOM 0 HG22 VAL A 84 14.404 -17.461 -12.176 1.00 0.00 H new ATOM 0 HG23 VAL A 84 15.536 -17.731 -10.829 1.00 0.00 H new ATOM 1227 N ASN A 85 15.678 -21.455 -11.188 1.00 0.00 N ATOM 1228 CA ASN A 85 15.841 -22.265 -9.967 1.00 0.00 C ATOM 1229 C ASN A 85 15.780 -21.351 -8.744 1.00 0.00 C ATOM 1230 O ASN A 85 16.781 -21.062 -8.082 1.00 0.00 O ATOM 1231 CB ASN A 85 17.094 -23.157 -10.015 1.00 0.00 C ATOM 1232 CG ASN A 85 17.200 -24.078 -8.796 1.00 0.00 C ATOM 1233 OD1 ASN A 85 16.238 -24.295 -8.061 1.00 0.00 O ATOM 1234 ND2 ASN A 85 18.364 -24.670 -8.566 1.00 0.00 N ATOM 0 H ASN A 85 14.877 -21.752 -11.745 1.00 0.00 H new ATOM 0 HA ASN A 85 15.015 -22.972 -9.894 1.00 0.00 H new ATOM 0 HB2 ASN A 85 17.073 -23.760 -10.923 1.00 0.00 H new ATOM 0 HB3 ASN A 85 17.983 -22.528 -10.071 1.00 0.00 H new ATOM 0 HD21 ASN A 85 18.464 -25.308 -7.777 1.00 0.00 H new ATOM 0 HD22 ASN A 85 19.159 -24.487 -9.178 1.00 0.00 H new ATOM 1241 N LEU A 86 14.572 -20.839 -8.510 1.00 0.00 N ATOM 1242 CA LEU A 86 14.258 -19.772 -7.567 1.00 0.00 C ATOM 1243 C LEU A 86 12.938 -20.109 -6.836 1.00 0.00 C ATOM 1244 O LEU A 86 12.099 -20.782 -7.444 1.00 0.00 O ATOM 1245 CB LEU A 86 14.244 -18.479 -8.414 1.00 0.00 C ATOM 1246 CG LEU A 86 13.393 -17.305 -7.916 1.00 0.00 C ATOM 1247 CD1 LEU A 86 14.013 -15.970 -8.362 1.00 0.00 C ATOM 1248 CD2 LEU A 86 11.997 -17.383 -8.548 1.00 0.00 C ATOM 0 H LEU A 86 13.744 -21.177 -9.000 1.00 0.00 H new ATOM 0 HA LEU A 86 14.981 -19.646 -6.761 1.00 0.00 H new ATOM 0 HB2 LEU A 86 15.272 -18.130 -8.509 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.902 -18.739 -9.416 1.00 0.00 H new ATOM 0 HG LEU A 86 13.342 -17.359 -6.829 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.399 -15.145 -8.002 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.018 -15.880 -7.951 1.00 0.00 H new ATOM 0 HD13 LEU A 86 14.062 -15.937 -9.450 1.00 0.00 H new ATOM 0 HD21 LEU A 86 11.391 -16.549 -8.195 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.086 -17.333 -9.633 1.00 0.00 H new ATOM 0 HD23 LEU A 86 11.522 -18.322 -8.265 1.00 0.00 H new ATOM 1260 N PRO A 87 12.735 -19.700 -5.559 1.00 0.00 N ATOM 1261 CA PRO A 87 11.603 -20.189 -4.771 1.00 0.00 C ATOM 1262 C PRO A 87 10.220 -19.809 -5.335 1.00 0.00 C ATOM 1263 O PRO A 87 10.068 -18.731 -5.914 1.00 0.00 O ATOM 1264 CB PRO A 87 11.828 -19.731 -3.323 1.00 0.00 C ATOM 1265 CG PRO A 87 13.341 -19.523 -3.259 1.00 0.00 C ATOM 1266 CD PRO A 87 13.691 -19.044 -4.666 1.00 0.00 C ATOM 0 HA PRO A 87 11.575 -21.278 -4.819 1.00 0.00 H new ATOM 0 HB2 PRO A 87 11.285 -18.812 -3.101 1.00 0.00 H new ATOM 0 HB3 PRO A 87 11.493 -20.481 -2.606 1.00 0.00 H new ATOM 0 HG2 PRO A 87 13.614 -18.786 -2.504 1.00 0.00 H new ATOM 0 HG3 PRO A 87 13.863 -20.446 -3.007 1.00 0.00 H new ATOM 0 HD2 PRO A 87 13.615 -17.959 -4.740 1.00 0.00 H new ATOM 0 HD3 PRO A 87 14.715 -19.310 -4.926 1.00 0.00 H new ATOM 1274 N PRO A 88 9.183 -20.642 -5.125 1.00 0.00 N ATOM 1275 CA PRO A 88 7.901 -20.490 -5.805 1.00 0.00 C ATOM 1276 C PRO A 88 7.125 -19.238 -5.421 1.00 0.00 C ATOM 1277 O PRO A 88 6.513 -18.631 -6.296 1.00 0.00 O ATOM 1278 CB PRO A 88 7.115 -21.777 -5.521 1.00 0.00 C ATOM 1279 CG PRO A 88 7.727 -22.291 -4.218 1.00 0.00 C ATOM 1280 CD PRO A 88 9.191 -21.877 -4.348 1.00 0.00 C ATOM 0 HA PRO A 88 8.070 -20.348 -6.872 1.00 0.00 H new ATOM 0 HB2 PRO A 88 6.048 -21.580 -5.413 1.00 0.00 H new ATOM 0 HB3 PRO A 88 7.225 -22.501 -6.329 1.00 0.00 H new ATOM 0 HG2 PRO A 88 7.255 -21.842 -3.344 1.00 0.00 H new ATOM 0 HG3 PRO A 88 7.619 -23.371 -4.118 1.00 0.00 H new ATOM 0 HD2 PRO A 88 9.642 -21.721 -3.368 1.00 0.00 H new ATOM 0 HD3 PRO A 88 9.774 -22.651 -4.848 1.00 0.00 H new ATOM 1288 N GLU A 89 7.184 -18.777 -4.168 1.00 0.00 N ATOM 1289 CA GLU A 89 6.390 -17.616 -3.749 1.00 0.00 C ATOM 1290 C GLU A 89 6.805 -16.331 -4.489 1.00 0.00 C ATOM 1291 O GLU A 89 6.065 -15.345 -4.456 1.00 0.00 O ATOM 1292 CB GLU A 89 6.400 -17.475 -2.212 1.00 0.00 C ATOM 1293 CG GLU A 89 7.780 -17.225 -1.585 1.00 0.00 C ATOM 1294 CD GLU A 89 7.684 -17.019 -0.059 1.00 0.00 C ATOM 1295 OE1 GLU A 89 7.560 -18.027 0.680 1.00 0.00 O ATOM 1296 OE2 GLU A 89 7.760 -15.853 0.406 1.00 0.00 O ATOM 0 H GLU A 89 7.765 -19.183 -3.434 1.00 0.00 H new ATOM 0 HA GLU A 89 5.354 -17.787 -4.040 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.739 -16.654 -1.935 1.00 0.00 H new ATOM 0 HB3 GLU A 89 5.981 -18.383 -1.778 1.00 0.00 H new ATOM 0 HG2 GLU A 89 8.435 -18.070 -1.798 1.00 0.00 H new ATOM 0 HG3 GLU A 89 8.234 -16.346 -2.043 1.00 0.00 H new ATOM 1303 N TRP A 90 7.938 -16.344 -5.201 1.00 0.00 N ATOM 1304 CA TRP A 90 8.370 -15.237 -6.045 1.00 0.00 C ATOM 1305 C TRP A 90 7.667 -15.247 -7.407 1.00 0.00 C ATOM 1306 O TRP A 90 7.342 -14.182 -7.930 1.00 0.00 O ATOM 1307 CB TRP A 90 9.894 -15.289 -6.189 1.00 0.00 C ATOM 1308 CG TRP A 90 10.638 -15.081 -4.904 1.00 0.00 C ATOM 1309 CD1 TRP A 90 11.257 -16.030 -4.172 1.00 0.00 C ATOM 1310 CD2 TRP A 90 10.770 -13.856 -4.135 1.00 0.00 C ATOM 1311 NE1 TRP A 90 11.728 -15.485 -2.991 1.00 0.00 N ATOM 1312 CE2 TRP A 90 11.396 -14.149 -2.888 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.368 -12.527 -4.358 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 11.569 -13.173 -1.896 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.491 -11.551 -3.357 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.095 -11.868 -2.129 1.00 0.00 C ATOM 0 H TRP A 90 8.583 -17.134 -5.204 1.00 0.00 H new ATOM 0 HA TRP A 90 8.088 -14.297 -5.571 1.00 0.00 H new ATOM 0 HB2 TRP A 90 10.176 -16.255 -6.607 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.207 -14.529 -6.905 1.00 0.00 H new ATOM 0 HD1 TRP A 90 11.369 -17.064 -4.465 1.00 0.00 H new ATOM 0 HE1 TRP A 90 12.253 -16.004 -2.287 1.00 0.00 H new ATOM 0 HE3 TRP A 90 9.957 -12.252 -5.318 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.059 -13.419 -0.966 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.120 -10.552 -3.532 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.196 -11.112 -1.365 1.00 0.00 H new ATOM 1327 N VAL A 91 7.396 -16.426 -7.966 1.00 0.00 N ATOM 1328 CA VAL A 91 6.742 -16.610 -9.252 1.00 0.00 C ATOM 1329 C VAL A 91 5.215 -16.758 -9.126 1.00 0.00 C ATOM 1330 O VAL A 91 4.516 -16.794 -10.140 1.00 0.00 O ATOM 1331 CB VAL A 91 7.419 -17.743 -10.050 1.00 0.00 C ATOM 1332 CG1 VAL A 91 8.839 -17.349 -10.482 1.00 0.00 C ATOM 1333 CG2 VAL A 91 7.506 -19.075 -9.292 1.00 0.00 C ATOM 0 H VAL A 91 7.637 -17.309 -7.515 1.00 0.00 H new ATOM 0 HA VAL A 91 6.876 -15.698 -9.833 1.00 0.00 H new ATOM 0 HB VAL A 91 6.775 -17.890 -10.917 1.00 0.00 H new ATOM 0 HG11 VAL A 91 9.289 -18.168 -11.042 1.00 0.00 H new ATOM 0 HG12 VAL A 91 8.794 -16.460 -11.112 1.00 0.00 H new ATOM 0 HG13 VAL A 91 9.443 -17.138 -9.599 1.00 0.00 H new ATOM 0 HG21 VAL A 91 7.994 -19.820 -9.920 1.00 0.00 H new ATOM 0 HG22 VAL A 91 8.083 -18.936 -8.378 1.00 0.00 H new ATOM 0 HG23 VAL A 91 6.502 -19.416 -9.039 1.00 0.00 H new ATOM 1343 N THR A 92 4.677 -16.799 -7.905 1.00 0.00 N ATOM 1344 CA THR A 92 3.247 -16.720 -7.640 1.00 0.00 C ATOM 1345 C THR A 92 3.051 -15.697 -6.507 1.00 0.00 C ATOM 1346 O THR A 92 3.031 -16.006 -5.313 1.00 0.00 O ATOM 1347 CB THR A 92 2.637 -18.133 -7.468 1.00 0.00 C ATOM 1348 OG1 THR A 92 1.273 -18.090 -7.075 1.00 0.00 O ATOM 1349 CG2 THR A 92 3.411 -19.055 -6.517 1.00 0.00 C ATOM 0 H THR A 92 5.239 -16.890 -7.058 1.00 0.00 H new ATOM 0 HA THR A 92 2.666 -16.339 -8.480 1.00 0.00 H new ATOM 0 HB THR A 92 2.716 -18.567 -8.465 1.00 0.00 H new ATOM 0 HG1 THR A 92 0.931 -19.003 -6.980 1.00 0.00 H new ATOM 0 HG21 THR A 92 2.910 -20.021 -6.459 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.426 -19.194 -6.890 1.00 0.00 H new ATOM 0 HG23 THR A 92 3.448 -18.606 -5.525 1.00 0.00 H new ATOM 1357 N GLN A 93 2.973 -14.439 -6.940 1.00 0.00 N ATOM 1358 CA GLN A 93 2.670 -13.247 -6.165 1.00 0.00 C ATOM 1359 C GLN A 93 1.214 -12.832 -6.436 1.00 0.00 C ATOM 1360 O GLN A 93 0.496 -13.529 -7.162 1.00 0.00 O ATOM 1361 CB GLN A 93 3.679 -12.164 -6.584 1.00 0.00 C ATOM 1362 CG GLN A 93 5.055 -12.356 -5.947 1.00 0.00 C ATOM 1363 CD GLN A 93 5.055 -11.909 -4.488 1.00 0.00 C ATOM 1364 OE1 GLN A 93 5.163 -10.720 -4.204 1.00 0.00 O ATOM 1365 NE2 GLN A 93 4.912 -12.827 -3.547 1.00 0.00 N ATOM 0 H GLN A 93 3.134 -14.215 -7.922 1.00 0.00 H new ATOM 0 HA GLN A 93 2.760 -13.415 -5.092 1.00 0.00 H new ATOM 0 HB2 GLN A 93 3.782 -12.171 -7.669 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.289 -11.184 -6.307 1.00 0.00 H new ATOM 0 HG2 GLN A 93 5.344 -13.405 -6.009 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.799 -11.787 -6.504 1.00 0.00 H new ATOM 0 HE21 GLN A 93 4.824 -13.810 -3.803 1.00 0.00 H new ATOM 0 HE22 GLN A 93 4.890 -12.552 -2.565 1.00 0.00 H new ATOM 1374 N GLU A 94 0.777 -11.681 -5.905 1.00 0.00 N ATOM 1375 CA GLU A 94 -0.540 -11.138 -6.245 1.00 0.00 C ATOM 1376 C GLU A 94 -0.588 -10.767 -7.738 1.00 0.00 C ATOM 1377 O GLU A 94 -1.644 -10.849 -8.372 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.884 -9.933 -5.354 1.00 0.00 C ATOM 1379 CG GLU A 94 -1.015 -10.284 -3.862 1.00 0.00 C ATOM 1380 CD GLU A 94 -2.127 -11.316 -3.595 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -3.327 -10.950 -3.644 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -1.813 -12.502 -3.323 1.00 0.00 O ATOM 0 H GLU A 94 1.312 -11.115 -5.246 1.00 0.00 H new ATOM 0 HA GLU A 94 -1.294 -11.903 -6.060 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.112 -9.173 -5.473 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.820 -9.493 -5.698 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.065 -10.676 -3.499 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.222 -9.376 -3.295 1.00 0.00 H new ATOM 1389 N ILE A 95 0.568 -10.417 -8.309 1.00 0.00 N ATOM 1390 CA ILE A 95 0.807 -10.240 -9.729 1.00 0.00 C ATOM 1391 C ILE A 95 2.214 -10.781 -9.982 1.00 0.00 C ATOM 1392 O ILE A 95 3.163 -10.415 -9.282 1.00 0.00 O ATOM 1393 CB ILE A 95 0.651 -8.764 -10.176 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.232 -8.552 -11.601 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.310 -7.813 -9.168 1.00 0.00 C ATOM 1396 CD1 ILE A 95 0.951 -7.182 -12.237 1.00 0.00 C ATOM 0 H ILE A 95 1.405 -10.241 -7.753 1.00 0.00 H new ATOM 0 HA ILE A 95 0.067 -10.778 -10.322 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.414 -8.533 -10.209 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.311 -8.698 -11.559 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.831 -9.325 -12.256 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.187 -6.784 -9.505 1.00 0.00 H new ATOM 0 HG22 ILE A 95 0.840 -7.934 -8.192 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.372 -8.044 -9.090 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.401 -7.142 -13.229 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.126 -7.034 -12.321 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.378 -6.397 -11.613 1.00 0.00 H new ATOM 1408 N PHE A 96 2.333 -11.639 -10.987 1.00 0.00 N ATOM 1409 CA PHE A 96 3.601 -12.084 -11.527 1.00 0.00 C ATOM 1410 C PHE A 96 3.569 -11.731 -13.014 1.00 0.00 C ATOM 1411 O PHE A 96 2.511 -11.861 -13.638 1.00 0.00 O ATOM 1412 CB PHE A 96 3.807 -13.582 -11.286 1.00 0.00 C ATOM 1413 CG PHE A 96 5.094 -14.091 -11.894 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.328 -13.659 -11.370 1.00 0.00 C ATOM 1415 CD2 PHE A 96 5.065 -14.947 -13.013 1.00 0.00 C ATOM 1416 CE1 PHE A 96 7.528 -14.091 -11.957 1.00 0.00 C ATOM 1417 CE2 PHE A 96 6.268 -15.386 -13.594 1.00 0.00 C ATOM 1418 CZ PHE A 96 7.499 -14.960 -13.062 1.00 0.00 C ATOM 0 H PHE A 96 1.528 -12.052 -11.457 1.00 0.00 H new ATOM 0 HA PHE A 96 4.444 -11.597 -11.037 1.00 0.00 H new ATOM 0 HB2 PHE A 96 3.813 -13.777 -10.214 1.00 0.00 H new ATOM 0 HB3 PHE A 96 2.966 -14.134 -11.706 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.351 -12.996 -10.518 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.119 -15.266 -13.424 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.474 -13.755 -11.559 1.00 0.00 H new ATOM 0 HE2 PHE A 96 6.247 -16.049 -14.447 1.00 0.00 H new ATOM 0 HZ PHE A 96 8.424 -15.301 -13.503 1.00 0.00 H new ATOM 1428 N GLU A 97 4.695 -11.303 -13.584 1.00 0.00 N ATOM 1429 CA GLU A 97 4.812 -11.060 -15.018 1.00 0.00 C ATOM 1430 C GLU A 97 6.098 -11.720 -15.499 1.00 0.00 C ATOM 1431 O GLU A 97 7.141 -11.637 -14.841 1.00 0.00 O ATOM 1432 CB GLU A 97 4.846 -9.564 -15.375 1.00 0.00 C ATOM 1433 CG GLU A 97 3.590 -8.749 -15.020 1.00 0.00 C ATOM 1434 CD GLU A 97 2.416 -8.908 -16.012 1.00 0.00 C ATOM 1435 OE1 GLU A 97 2.215 -10.000 -16.599 1.00 0.00 O ATOM 1436 OE2 GLU A 97 1.657 -7.922 -16.187 1.00 0.00 O ATOM 0 H GLU A 97 5.551 -11.115 -13.063 1.00 0.00 H new ATOM 0 HA GLU A 97 3.931 -11.478 -15.505 1.00 0.00 H new ATOM 0 HB2 GLU A 97 5.701 -9.112 -14.872 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.022 -9.472 -16.447 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.251 -9.043 -14.027 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.861 -7.695 -14.965 1.00 0.00 H new ATOM 1443 N ASP A 98 6.004 -12.347 -16.667 1.00 0.00 N ATOM 1444 CA ASP A 98 7.124 -12.866 -17.428 1.00 0.00 C ATOM 1445 C ASP A 98 7.281 -11.956 -18.640 1.00 0.00 C ATOM 1446 O ASP A 98 6.343 -11.829 -19.437 1.00 0.00 O ATOM 1447 CB ASP A 98 6.855 -14.314 -17.848 1.00 0.00 C ATOM 1448 CG ASP A 98 7.937 -14.825 -18.812 1.00 0.00 C ATOM 1449 OD1 ASP A 98 8.939 -15.401 -18.325 1.00 0.00 O ATOM 1450 OD2 ASP A 98 7.768 -14.703 -20.049 1.00 0.00 O ATOM 0 H ASP A 98 5.107 -12.512 -17.124 1.00 0.00 H new ATOM 0 HA ASP A 98 8.040 -12.876 -16.837 1.00 0.00 H new ATOM 0 HB2 ASP A 98 6.822 -14.951 -16.964 1.00 0.00 H new ATOM 0 HB3 ASP A 98 5.878 -14.381 -18.326 1.00 0.00 H new ATOM 1455 N TRP A 99 8.436 -11.300 -18.765 1.00 0.00 N ATOM 1456 CA TRP A 99 8.812 -10.559 -19.965 1.00 0.00 C ATOM 1457 C TRP A 99 10.043 -11.226 -20.590 1.00 0.00 C ATOM 1458 O TRP A 99 10.676 -12.092 -19.981 1.00 0.00 O ATOM 1459 CB TRP A 99 9.068 -9.061 -19.684 1.00 0.00 C ATOM 1460 CG TRP A 99 8.054 -8.270 -18.899 1.00 0.00 C ATOM 1461 CD1 TRP A 99 8.349 -7.427 -17.885 1.00 0.00 C ATOM 1462 CD2 TRP A 99 6.610 -8.135 -19.100 1.00 0.00 C ATOM 1463 NE1 TRP A 99 7.203 -6.808 -17.426 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.101 -7.197 -18.150 1.00 0.00 C ATOM 1465 CE3 TRP A 99 5.680 -8.675 -20.012 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 4.749 -6.828 -18.100 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 4.315 -8.330 -19.962 1.00 0.00 C ATOM 1468 CH2 TRP A 99 3.849 -7.406 -19.010 1.00 0.00 C ATOM 0 H TRP A 99 9.141 -11.269 -18.029 1.00 0.00 H new ATOM 0 HA TRP A 99 7.977 -10.590 -20.665 1.00 0.00 H new ATOM 0 HB2 TRP A 99 10.020 -8.985 -19.158 1.00 0.00 H new ATOM 0 HB3 TRP A 99 9.195 -8.565 -20.646 1.00 0.00 H new ATOM 0 HD1 TRP A 99 9.340 -7.261 -17.490 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.177 -6.147 -16.650 1.00 0.00 H new ATOM 0 HE3 TRP A 99 6.022 -9.369 -20.766 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.405 -6.109 -17.371 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 3.622 -8.778 -20.659 1.00 0.00 H new ATOM 0 HH2 TRP A 99 2.802 -7.142 -18.979 1.00 0.00 H new ATOM 1479 N GLN A 100 10.392 -10.788 -21.800 1.00 0.00 N ATOM 1480 CA GLN A 100 11.640 -11.131 -22.478 1.00 0.00 C ATOM 1481 C GLN A 100 12.266 -9.812 -22.950 1.00 0.00 C ATOM 1482 O GLN A 100 12.442 -9.584 -24.149 1.00 0.00 O ATOM 1483 CB GLN A 100 11.378 -12.140 -23.613 1.00 0.00 C ATOM 1484 CG GLN A 100 10.839 -13.487 -23.107 1.00 0.00 C ATOM 1485 CD GLN A 100 10.649 -14.482 -24.253 1.00 0.00 C ATOM 1486 OE1 GLN A 100 9.554 -14.633 -24.796 1.00 0.00 O ATOM 1487 NE2 GLN A 100 11.703 -15.177 -24.667 1.00 0.00 N ATOM 0 H GLN A 100 9.797 -10.168 -22.350 1.00 0.00 H new ATOM 0 HA GLN A 100 12.344 -11.633 -21.815 1.00 0.00 H new ATOM 0 HB2 GLN A 100 10.664 -11.710 -24.316 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.304 -12.309 -24.162 1.00 0.00 H new ATOM 0 HG2 GLN A 100 11.529 -13.903 -22.373 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.888 -13.331 -22.598 1.00 0.00 H new ATOM 0 HE21 GLN A 100 12.608 -15.049 -24.215 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.607 -15.839 -25.437 1.00 0.00 H new ATOM 1496 N LEU A 101 12.521 -8.900 -22.002 1.00 0.00 N ATOM 1497 CA LEU A 101 13.110 -7.594 -22.300 1.00 0.00 C ATOM 1498 C LEU A 101 14.547 -7.814 -22.764 1.00 0.00 C ATOM 1499 O LEU A 101 15.271 -8.649 -22.219 1.00 0.00 O ATOM 1500 CB LEU A 101 13.029 -6.650 -21.078 1.00 0.00 C ATOM 1501 CG LEU A 101 11.848 -5.649 -21.104 1.00 0.00 C ATOM 1502 CD1 LEU A 101 11.633 -5.109 -19.684 1.00 0.00 C ATOM 1503 CD2 LEU A 101 12.026 -4.555 -22.177 1.00 0.00 C ATOM 0 H LEU A 101 12.325 -9.049 -21.012 1.00 0.00 H new ATOM 0 HA LEU A 101 12.549 -7.103 -23.095 1.00 0.00 H new ATOM 0 HB2 LEU A 101 12.954 -7.255 -20.174 1.00 0.00 H new ATOM 0 HB3 LEU A 101 13.961 -6.088 -21.009 1.00 0.00 H new ATOM 0 HG LEU A 101 10.936 -6.162 -21.409 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.804 -4.402 -19.685 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.404 -5.935 -19.011 1.00 0.00 H new ATOM 0 HD13 LEU A 101 12.538 -4.606 -19.345 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.171 -3.879 -22.153 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.938 -3.993 -21.976 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.095 -5.018 -23.161 1.00 0.00 H new ATOM 1515 N GLU A 102 14.954 -7.058 -23.780 1.00 0.00 N ATOM 1516 CA GLU A 102 16.309 -7.021 -24.302 1.00 0.00 C ATOM 1517 C GLU A 102 17.200 -6.239 -23.329 1.00 0.00 C ATOM 1518 O GLU A 102 16.701 -5.602 -22.400 1.00 0.00 O ATOM 1519 CB GLU A 102 16.291 -6.384 -25.703 1.00 0.00 C ATOM 1520 CG GLU A 102 15.560 -7.259 -26.731 1.00 0.00 C ATOM 1521 CD GLU A 102 15.300 -6.483 -28.034 1.00 0.00 C ATOM 1522 OE1 GLU A 102 14.361 -5.651 -28.046 1.00 0.00 O ATOM 1523 OE2 GLU A 102 16.022 -6.703 -29.038 1.00 0.00 O ATOM 0 H GLU A 102 14.322 -6.432 -24.279 1.00 0.00 H new ATOM 0 HA GLU A 102 16.716 -8.028 -24.396 1.00 0.00 H new ATOM 0 HB2 GLU A 102 15.807 -5.409 -25.650 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.315 -6.215 -26.036 1.00 0.00 H new ATOM 0 HG2 GLU A 102 16.154 -8.147 -26.945 1.00 0.00 H new ATOM 0 HG3 GLU A 102 14.613 -7.602 -26.313 1.00 0.00 H new ATOM 1530 N ASP A 103 18.519 -6.259 -23.539 1.00 0.00 N ATOM 1531 CA ASP A 103 19.464 -5.508 -22.732 1.00 0.00 C ATOM 1532 C ASP A 103 20.606 -4.963 -23.596 1.00 0.00 C ATOM 1533 O ASP A 103 21.084 -5.667 -24.490 1.00 0.00 O ATOM 1534 CB ASP A 103 20.004 -6.368 -21.597 1.00 0.00 C ATOM 1535 CG ASP A 103 21.012 -5.572 -20.779 1.00 0.00 C ATOM 1536 OD1 ASP A 103 22.209 -5.606 -21.105 1.00 0.00 O ATOM 1537 OD2 ASP A 103 20.600 -4.908 -19.804 1.00 0.00 O ATOM 0 H ASP A 103 18.957 -6.804 -24.282 1.00 0.00 H new ATOM 0 HA ASP A 103 18.939 -4.659 -22.294 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.185 -6.699 -20.959 1.00 0.00 H new ATOM 0 HB3 ASP A 103 20.476 -7.264 -22.001 1.00 0.00 H new ATOM 1542 N PRO A 104 21.033 -3.710 -23.379 1.00 0.00 N ATOM 1543 CA PRO A 104 21.999 -3.034 -24.236 1.00 0.00 C ATOM 1544 C PRO A 104 23.478 -3.290 -23.891 1.00 0.00 C ATOM 1545 O PRO A 104 24.339 -2.762 -24.599 1.00 0.00 O ATOM 1546 CB PRO A 104 21.630 -1.570 -24.074 1.00 0.00 C ATOM 1547 CG PRO A 104 21.251 -1.480 -22.600 1.00 0.00 C ATOM 1548 CD PRO A 104 20.443 -2.752 -22.446 1.00 0.00 C ATOM 0 HA PRO A 104 21.938 -3.406 -25.259 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.465 -0.913 -24.318 1.00 0.00 H new ATOM 0 HB3 PRO A 104 20.801 -1.287 -24.723 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.124 -1.462 -21.948 1.00 0.00 H new ATOM 0 HG3 PRO A 104 20.667 -0.588 -22.376 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.489 -3.123 -21.422 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.392 -2.578 -22.676 1.00 0.00 H new ATOM 1556 N ASP A 105 23.805 -4.038 -22.833 1.00 0.00 N ATOM 1557 CA ASP A 105 25.188 -4.204 -22.398 1.00 0.00 C ATOM 1558 C ASP A 105 26.048 -4.762 -23.538 1.00 0.00 C ATOM 1559 O ASP A 105 25.680 -5.758 -24.173 1.00 0.00 O ATOM 1560 CB ASP A 105 25.324 -5.131 -21.189 1.00 0.00 C ATOM 1561 CG ASP A 105 26.815 -5.325 -20.879 1.00 0.00 C ATOM 1562 OD1 ASP A 105 27.514 -4.303 -20.672 1.00 0.00 O ATOM 1563 OD2 ASP A 105 27.303 -6.479 -20.875 1.00 0.00 O ATOM 0 H ASP A 105 23.124 -4.539 -22.262 1.00 0.00 H new ATOM 0 HA ASP A 105 25.533 -3.212 -22.107 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.812 -4.704 -20.327 1.00 0.00 H new ATOM 0 HB3 ASP A 105 24.853 -6.092 -21.396 1.00 0.00 H new ATOM 1568 N GLY A 106 27.197 -4.130 -23.790 1.00 0.00 N ATOM 1569 CA GLY A 106 28.179 -4.606 -24.754 1.00 0.00 C ATOM 1570 C GLY A 106 27.755 -4.435 -26.218 1.00 0.00 C ATOM 1571 O GLY A 106 28.448 -4.959 -27.095 1.00 0.00 O ATOM 0 H GLY A 106 27.470 -3.265 -23.323 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.117 -4.074 -24.594 1.00 0.00 H new ATOM 0 HA3 GLY A 106 28.376 -5.661 -24.565 1.00 0.00 H new ATOM 1575 N GLN A 107 26.659 -3.718 -26.503 1.00 0.00 N ATOM 1576 CA GLN A 107 26.255 -3.356 -27.860 1.00 0.00 C ATOM 1577 C GLN A 107 26.040 -1.839 -27.979 1.00 0.00 C ATOM 1578 O GLN A 107 26.459 -1.073 -27.105 1.00 0.00 O ATOM 1579 CB GLN A 107 25.098 -4.250 -28.351 1.00 0.00 C ATOM 1580 CG GLN A 107 23.817 -4.180 -27.518 1.00 0.00 C ATOM 1581 CD GLN A 107 22.751 -5.152 -28.057 1.00 0.00 C ATOM 1582 OE1 GLN A 107 22.630 -5.368 -29.261 1.00 0.00 O ATOM 1583 NE2 GLN A 107 21.949 -5.774 -27.205 1.00 0.00 N ATOM 0 H GLN A 107 26.023 -3.371 -25.785 1.00 0.00 H new ATOM 0 HA GLN A 107 27.063 -3.566 -28.561 1.00 0.00 H new ATOM 0 HB2 GLN A 107 24.859 -3.975 -29.378 1.00 0.00 H new ATOM 0 HB3 GLN A 107 25.443 -5.284 -28.370 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.042 -4.421 -26.479 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.426 -3.163 -27.531 1.00 0.00 H new ATOM 0 HE21 GLN A 107 22.039 -5.604 -26.203 1.00 0.00 H new ATOM 0 HE22 GLN A 107 21.242 -6.423 -27.551 1.00 0.00 H new ATOM 1592 N SER A 108 25.429 -1.402 -29.082 1.00 0.00 N ATOM 1593 CA SER A 108 25.373 0.000 -29.470 1.00 0.00 C ATOM 1594 C SER A 108 24.553 0.920 -28.560 1.00 0.00 C ATOM 1595 O SER A 108 23.579 0.502 -27.933 1.00 0.00 O ATOM 1596 CB SER A 108 24.930 0.107 -30.944 1.00 0.00 C ATOM 1597 OG SER A 108 25.534 -0.911 -31.735 1.00 0.00 O ATOM 0 H SER A 108 24.954 -2.024 -29.736 1.00 0.00 H new ATOM 0 HA SER A 108 26.387 0.379 -29.347 1.00 0.00 H new ATOM 0 HB2 SER A 108 23.845 0.026 -31.008 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.200 1.087 -31.338 1.00 0.00 H new ATOM 0 HG SER A 108 25.236 -0.823 -32.665 1.00 0.00 H new ATOM 1603 N LEU A 109 24.904 2.215 -28.576 1.00 0.00 N ATOM 1604 CA LEU A 109 24.247 3.302 -27.839 1.00 0.00 C ATOM 1605 C LEU A 109 22.764 3.400 -28.203 1.00 0.00 C ATOM 1606 O LEU A 109 21.921 3.665 -27.348 1.00 0.00 O ATOM 1607 CB LEU A 109 24.978 4.620 -28.175 1.00 0.00 C ATOM 1608 CG LEU A 109 24.856 5.696 -27.079 1.00 0.00 C ATOM 1609 CD1 LEU A 109 25.717 5.328 -25.863 1.00 0.00 C ATOM 1610 CD2 LEU A 109 25.334 7.045 -27.631 1.00 0.00 C ATOM 0 H LEU A 109 25.693 2.547 -29.131 1.00 0.00 H new ATOM 0 HA LEU A 109 24.301 3.104 -26.769 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.033 4.406 -28.345 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.579 5.018 -29.108 1.00 0.00 H new ATOM 0 HG LEU A 109 23.812 5.760 -26.773 1.00 0.00 H new ATOM 0 HD11 LEU A 109 25.618 6.100 -25.100 1.00 0.00 H new ATOM 0 HD12 LEU A 109 25.385 4.372 -25.458 1.00 0.00 H new ATOM 0 HD13 LEU A 109 26.761 5.250 -26.167 1.00 0.00 H new ATOM 0 HD21 LEU A 109 25.248 7.806 -26.856 1.00 0.00 H new ATOM 0 HD22 LEU A 109 26.375 6.962 -27.944 1.00 0.00 H new ATOM 0 HD23 LEU A 109 24.719 7.327 -28.486 1.00 0.00 H new ATOM 1622 N GLU A 110 22.441 3.113 -29.467 1.00 0.00 N ATOM 1623 CA GLU A 110 21.075 3.067 -29.976 1.00 0.00 C ATOM 1624 C GLU A 110 20.247 2.031 -29.212 1.00 0.00 C ATOM 1625 O GLU A 110 19.066 2.254 -28.962 1.00 0.00 O ATOM 1626 CB GLU A 110 21.135 2.765 -31.484 1.00 0.00 C ATOM 1627 CG GLU A 110 19.751 2.687 -32.140 1.00 0.00 C ATOM 1628 CD GLU A 110 19.864 2.565 -33.671 1.00 0.00 C ATOM 1629 OE1 GLU A 110 20.023 1.430 -34.184 1.00 0.00 O ATOM 1630 OE2 GLU A 110 19.783 3.602 -34.376 1.00 0.00 O ATOM 0 H GLU A 110 23.141 2.902 -30.178 1.00 0.00 H new ATOM 0 HA GLU A 110 20.580 4.026 -29.826 1.00 0.00 H new ATOM 0 HB2 GLU A 110 21.722 3.538 -31.980 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.657 1.821 -31.638 1.00 0.00 H new ATOM 0 HG2 GLU A 110 19.206 1.830 -31.744 1.00 0.00 H new ATOM 0 HG3 GLU A 110 19.175 3.577 -31.885 1.00 0.00 H new ATOM 1637 N VAL A 111 20.855 0.921 -28.795 1.00 0.00 N ATOM 1638 CA VAL A 111 20.155 -0.142 -28.089 1.00 0.00 C ATOM 1639 C VAL A 111 19.843 0.313 -26.664 1.00 0.00 C ATOM 1640 O VAL A 111 18.727 0.087 -26.216 1.00 0.00 O ATOM 1641 CB VAL A 111 20.912 -1.489 -28.145 1.00 0.00 C ATOM 1642 CG1 VAL A 111 19.960 -2.632 -27.762 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.503 -1.799 -29.531 1.00 0.00 C ATOM 0 H VAL A 111 21.848 0.737 -28.939 1.00 0.00 H new ATOM 0 HA VAL A 111 19.210 -0.336 -28.596 1.00 0.00 H new ATOM 0 HB VAL A 111 21.741 -1.404 -27.442 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.496 -3.580 -27.802 1.00 0.00 H new ATOM 0 HG12 VAL A 111 19.585 -2.470 -26.752 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.123 -2.658 -28.460 1.00 0.00 H new ATOM 0 HG21 VAL A 111 22.020 -2.758 -29.500 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.700 -1.844 -30.267 1.00 0.00 H new ATOM 0 HG23 VAL A 111 22.208 -1.015 -29.810 1.00 0.00 H new ATOM 1653 N PHE A 112 20.748 1.010 -25.965 1.00 0.00 N ATOM 1654 CA PHE A 112 20.438 1.608 -24.657 1.00 0.00 C ATOM 1655 C PHE A 112 19.233 2.541 -24.798 1.00 0.00 C ATOM 1656 O PHE A 112 18.249 2.407 -24.073 1.00 0.00 O ATOM 1657 CB PHE A 112 21.642 2.387 -24.096 1.00 0.00 C ATOM 1658 CG PHE A 112 22.827 1.566 -23.603 1.00 0.00 C ATOM 1659 CD1 PHE A 112 23.865 1.200 -24.483 1.00 0.00 C ATOM 1660 CD2 PHE A 112 22.907 1.183 -22.250 1.00 0.00 C ATOM 1661 CE1 PHE A 112 24.938 0.413 -24.029 1.00 0.00 C ATOM 1662 CE2 PHE A 112 23.979 0.388 -21.799 1.00 0.00 C ATOM 1663 CZ PHE A 112 24.986 -0.011 -22.691 1.00 0.00 C ATOM 0 H PHE A 112 21.703 1.175 -26.283 1.00 0.00 H new ATOM 0 HA PHE A 112 20.205 0.805 -23.958 1.00 0.00 H new ATOM 0 HB2 PHE A 112 21.998 3.065 -24.872 1.00 0.00 H new ATOM 0 HB3 PHE A 112 21.291 3.005 -23.270 1.00 0.00 H new ATOM 0 HD1 PHE A 112 23.836 1.526 -25.512 1.00 0.00 H new ATOM 0 HD2 PHE A 112 22.143 1.500 -21.555 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.727 0.134 -24.711 1.00 0.00 H new ATOM 0 HE2 PHE A 112 24.026 0.085 -20.764 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.794 -0.641 -22.350 1.00 0.00 H new ATOM 1673 N ARG A 113 19.273 3.439 -25.782 1.00 0.00 N ATOM 1674 CA ARG A 113 18.216 4.432 -25.987 1.00 0.00 C ATOM 1675 C ARG A 113 16.894 3.770 -26.399 1.00 0.00 C ATOM 1676 O ARG A 113 15.835 4.213 -25.958 1.00 0.00 O ATOM 1677 CB ARG A 113 18.732 5.466 -27.005 1.00 0.00 C ATOM 1678 CG ARG A 113 19.815 6.355 -26.357 1.00 0.00 C ATOM 1679 CD ARG A 113 20.636 7.127 -27.388 1.00 0.00 C ATOM 1680 NE ARG A 113 21.475 8.152 -26.738 1.00 0.00 N ATOM 1681 CZ ARG A 113 22.245 9.040 -27.384 1.00 0.00 C ATOM 1682 NH1 ARG A 113 22.317 9.055 -28.716 1.00 0.00 N ATOM 1683 NH2 ARG A 113 22.946 9.920 -26.684 1.00 0.00 N ATOM 0 H ARG A 113 20.035 3.500 -26.457 1.00 0.00 H new ATOM 0 HA ARG A 113 17.985 4.949 -25.055 1.00 0.00 H new ATOM 0 HB2 ARG A 113 19.143 4.956 -27.876 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.906 6.084 -27.357 1.00 0.00 H new ATOM 0 HG2 ARG A 113 19.340 7.060 -25.674 1.00 0.00 H new ATOM 0 HG3 ARG A 113 20.481 5.732 -25.760 1.00 0.00 H new ATOM 0 HD2 ARG A 113 21.268 6.436 -27.946 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.969 7.601 -28.108 1.00 0.00 H new ATOM 0 HE ARG A 113 21.469 8.188 -25.719 1.00 0.00 H new ATOM 0 HH11 ARG A 113 21.780 8.382 -29.263 1.00 0.00 H new ATOM 0 HH12 ARG A 113 22.909 9.739 -29.187 1.00 0.00 H new ATOM 0 HH21 ARG A 113 22.896 9.917 -25.665 1.00 0.00 H new ATOM 0 HH22 ARG A 113 23.535 10.600 -27.164 1.00 0.00 H new ATOM 1697 N THR A 114 16.942 2.665 -27.143 1.00 0.00 N ATOM 1698 CA THR A 114 15.786 1.860 -27.482 1.00 0.00 C ATOM 1699 C THR A 114 15.232 1.188 -26.227 1.00 0.00 C ATOM 1700 O THR A 114 14.032 1.266 -25.967 1.00 0.00 O ATOM 1701 CB THR A 114 16.247 0.840 -28.539 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.418 1.475 -29.795 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.304 -0.346 -28.676 1.00 0.00 C ATOM 0 H THR A 114 17.812 2.302 -27.533 1.00 0.00 H new ATOM 0 HA THR A 114 14.975 2.464 -27.889 1.00 0.00 H new ATOM 0 HB THR A 114 17.202 0.444 -28.193 1.00 0.00 H new ATOM 0 HG1 THR A 114 17.314 1.869 -29.843 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.685 -1.028 -29.436 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.235 -0.868 -27.722 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.315 0.007 -28.968 1.00 0.00 H new ATOM 1711 N VAL A 115 16.082 0.527 -25.433 1.00 0.00 N ATOM 1712 CA VAL A 115 15.623 -0.303 -24.327 1.00 0.00 C ATOM 1713 C VAL A 115 15.051 0.588 -23.228 1.00 0.00 C ATOM 1714 O VAL A 115 14.103 0.158 -22.583 1.00 0.00 O ATOM 1715 CB VAL A 115 16.718 -1.317 -23.902 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.335 -2.126 -22.652 1.00 0.00 C ATOM 1717 CG2 VAL A 115 16.950 -2.344 -25.027 1.00 0.00 C ATOM 0 H VAL A 115 17.096 0.555 -25.542 1.00 0.00 H new ATOM 0 HA VAL A 115 14.795 -0.944 -24.628 1.00 0.00 H new ATOM 0 HB VAL A 115 17.606 -0.721 -23.691 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.141 -2.817 -22.405 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.170 -1.447 -21.815 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.422 -2.688 -22.848 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.720 -3.052 -24.720 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.023 -2.881 -25.227 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.272 -1.827 -25.931 1.00 0.00 H new ATOM 1727 N ARG A 116 15.480 1.852 -23.089 1.00 0.00 N ATOM 1728 CA ARG A 116 14.792 2.790 -22.191 1.00 0.00 C ATOM 1729 C ARG A 116 13.310 2.896 -22.587 1.00 0.00 C ATOM 1730 O ARG A 116 12.455 2.733 -21.727 1.00 0.00 O ATOM 1731 CB ARG A 116 15.465 4.183 -22.176 1.00 0.00 C ATOM 1732 CG ARG A 116 16.818 4.209 -21.440 1.00 0.00 C ATOM 1733 CD ARG A 116 17.272 5.622 -21.034 1.00 0.00 C ATOM 1734 NE ARG A 116 17.903 6.408 -22.121 1.00 0.00 N ATOM 1735 CZ ARG A 116 17.364 7.412 -22.831 1.00 0.00 C ATOM 1736 NH1 ARG A 116 16.053 7.637 -22.825 1.00 0.00 N ATOM 1737 NH2 ARG A 116 18.144 8.206 -23.553 1.00 0.00 N ATOM 0 H ARG A 116 16.286 2.242 -23.578 1.00 0.00 H new ATOM 0 HA ARG A 116 14.864 2.399 -21.176 1.00 0.00 H new ATOM 0 HB2 ARG A 116 15.614 4.516 -23.203 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.791 4.897 -21.704 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.748 3.588 -20.547 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.579 3.762 -22.080 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.409 6.173 -20.661 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.978 5.538 -20.208 1.00 0.00 H new ATOM 0 HE ARG A 116 18.862 6.156 -22.358 1.00 0.00 H new ATOM 0 HH11 ARG A 116 15.436 7.041 -22.273 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.665 8.406 -23.372 1.00 0.00 H new ATOM 0 HH21 ARG A 116 19.152 8.053 -23.568 1.00 0.00 H new ATOM 0 HH22 ARG A 116 17.735 8.969 -24.093 1.00 0.00 H new ATOM 1751 N GLY A 117 12.996 3.074 -23.871 1.00 0.00 N ATOM 1752 CA GLY A 117 11.616 3.175 -24.350 1.00 0.00 C ATOM 1753 C GLY A 117 10.824 1.885 -24.113 1.00 0.00 C ATOM 1754 O GLY A 117 9.738 1.928 -23.533 1.00 0.00 O ATOM 0 H GLY A 117 13.694 3.152 -24.611 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.118 4.003 -23.845 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.619 3.407 -25.415 1.00 0.00 H new ATOM 1758 N GLN A 118 11.388 0.731 -24.498 1.00 0.00 N ATOM 1759 CA GLN A 118 10.738 -0.575 -24.312 1.00 0.00 C ATOM 1760 C GLN A 118 10.426 -0.815 -22.843 1.00 0.00 C ATOM 1761 O GLN A 118 9.319 -1.208 -22.480 1.00 0.00 O ATOM 1762 CB GLN A 118 11.591 -1.720 -24.868 1.00 0.00 C ATOM 1763 CG GLN A 118 11.917 -1.548 -26.362 1.00 0.00 C ATOM 1764 CD GLN A 118 12.333 -2.852 -27.046 1.00 0.00 C ATOM 1765 OE1 GLN A 118 11.905 -3.141 -28.162 1.00 0.00 O ATOM 1766 NE2 GLN A 118 13.181 -3.657 -26.419 1.00 0.00 N ATOM 0 H GLN A 118 12.303 0.676 -24.945 1.00 0.00 H new ATOM 0 HA GLN A 118 9.804 -0.555 -24.873 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.521 -1.782 -24.303 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.065 -2.663 -24.722 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.044 -1.141 -26.872 1.00 0.00 H new ATOM 0 HG3 GLN A 118 12.719 -0.818 -26.470 1.00 0.00 H new ATOM 0 HE21 GLN A 118 13.530 -3.409 -25.493 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.484 -4.524 -26.862 1.00 0.00 H new ATOM 1775 N VAL A 119 11.406 -0.544 -21.992 1.00 0.00 N ATOM 1776 CA VAL A 119 11.256 -0.799 -20.573 1.00 0.00 C ATOM 1777 C VAL A 119 10.266 0.184 -19.958 1.00 0.00 C ATOM 1778 O VAL A 119 9.424 -0.244 -19.171 1.00 0.00 O ATOM 1779 CB VAL A 119 12.640 -0.769 -19.916 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.534 -0.821 -18.399 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.444 -1.988 -20.385 1.00 0.00 C ATOM 0 H VAL A 119 12.307 -0.150 -22.261 1.00 0.00 H new ATOM 0 HA VAL A 119 10.835 -1.789 -20.400 1.00 0.00 H new ATOM 0 HB VAL A 119 13.131 0.160 -20.203 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.533 -0.798 -17.963 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.964 0.038 -18.044 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.029 -1.740 -18.101 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.430 -1.974 -19.921 1.00 0.00 H new ATOM 0 HG22 VAL A 119 12.922 -2.901 -20.098 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.552 -1.957 -21.469 1.00 0.00 H new ATOM 1791 N LYS A 120 10.300 1.467 -20.329 1.00 0.00 N ATOM 1792 CA LYS A 120 9.381 2.464 -19.783 1.00 0.00 C ATOM 1793 C LYS A 120 7.954 1.990 -19.985 1.00 0.00 C ATOM 1794 O LYS A 120 7.168 2.013 -19.047 1.00 0.00 O ATOM 1795 CB LYS A 120 9.582 3.798 -20.519 1.00 0.00 C ATOM 1796 CG LYS A 120 8.726 4.928 -19.923 1.00 0.00 C ATOM 1797 CD LYS A 120 9.083 6.262 -20.600 1.00 0.00 C ATOM 1798 CE LYS A 120 8.242 7.447 -20.102 1.00 0.00 C ATOM 1799 NZ LYS A 120 6.881 7.490 -20.705 1.00 0.00 N ATOM 0 H LYS A 120 10.961 1.840 -21.011 1.00 0.00 H new ATOM 0 HA LYS A 120 9.576 2.600 -18.719 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.634 4.080 -20.475 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.330 3.671 -21.572 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.668 4.709 -20.065 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.896 4.998 -18.849 1.00 0.00 H new ATOM 0 HD2 LYS A 120 10.137 6.477 -20.427 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.951 6.160 -21.677 1.00 0.00 H new ATOM 0 HE2 LYS A 120 8.151 7.390 -19.017 1.00 0.00 H new ATOM 0 HE3 LYS A 120 8.764 8.377 -20.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 6.431 8.400 -20.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 6.955 7.385 -21.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 6.305 6.715 -20.319 1.00 0.00 H new ATOM 1813 N GLU A 121 7.641 1.520 -21.188 1.00 0.00 N ATOM 1814 CA GLU A 121 6.303 1.097 -21.546 1.00 0.00 C ATOM 1815 C GLU A 121 5.875 -0.117 -20.707 1.00 0.00 C ATOM 1816 O GLU A 121 4.760 -0.140 -20.181 1.00 0.00 O ATOM 1817 CB GLU A 121 6.311 0.832 -23.057 1.00 0.00 C ATOM 1818 CG GLU A 121 4.944 0.383 -23.580 1.00 0.00 C ATOM 1819 CD GLU A 121 4.937 0.284 -25.117 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.264 -0.797 -25.664 1.00 0.00 O ATOM 1821 OE2 GLU A 121 4.577 1.281 -25.791 1.00 0.00 O ATOM 0 H GLU A 121 8.319 1.423 -21.944 1.00 0.00 H new ATOM 0 HA GLU A 121 5.560 1.863 -21.327 1.00 0.00 H new ATOM 0 HB2 GLU A 121 6.617 1.738 -23.580 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.053 0.067 -23.285 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.688 -0.585 -23.150 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.179 1.088 -23.256 1.00 0.00 H new ATOM 1828 N ARG A 122 6.768 -1.095 -20.511 1.00 0.00 N ATOM 1829 CA ARG A 122 6.484 -2.282 -19.692 1.00 0.00 C ATOM 1830 C ARG A 122 6.225 -1.890 -18.240 1.00 0.00 C ATOM 1831 O ARG A 122 5.260 -2.344 -17.631 1.00 0.00 O ATOM 1832 CB ARG A 122 7.658 -3.284 -19.786 1.00 0.00 C ATOM 1833 CG ARG A 122 7.852 -3.905 -21.180 1.00 0.00 C ATOM 1834 CD ARG A 122 6.840 -5.014 -21.472 1.00 0.00 C ATOM 1835 NE ARG A 122 6.989 -5.528 -22.847 1.00 0.00 N ATOM 1836 CZ ARG A 122 6.169 -6.396 -23.461 1.00 0.00 C ATOM 1837 NH1 ARG A 122 5.138 -6.931 -22.813 1.00 0.00 N ATOM 1838 NH2 ARG A 122 6.384 -6.728 -24.730 1.00 0.00 N ATOM 0 H ARG A 122 7.705 -1.087 -20.914 1.00 0.00 H new ATOM 0 HA ARG A 122 5.583 -2.761 -20.076 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.578 -2.776 -19.497 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.495 -4.084 -19.064 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.762 -3.126 -21.937 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.861 -4.309 -21.257 1.00 0.00 H new ATOM 0 HD2 ARG A 122 6.975 -5.829 -20.760 1.00 0.00 H new ATOM 0 HD3 ARG A 122 5.829 -4.632 -21.332 1.00 0.00 H new ATOM 0 HE ARG A 122 7.790 -5.192 -23.381 1.00 0.00 H new ATOM 0 HH11 ARG A 122 4.963 -6.683 -21.839 1.00 0.00 H new ATOM 0 HH12 ARG A 122 4.522 -7.589 -23.290 1.00 0.00 H new ATOM 0 HH21 ARG A 122 7.171 -6.323 -25.237 1.00 0.00 H new ATOM 0 HH22 ARG A 122 5.762 -7.387 -25.197 1.00 0.00 H new ATOM 1852 N VAL A 123 7.077 -1.033 -17.684 1.00 0.00 N ATOM 1853 CA VAL A 123 6.989 -0.625 -16.288 1.00 0.00 C ATOM 1854 C VAL A 123 5.748 0.262 -16.105 1.00 0.00 C ATOM 1855 O VAL A 123 5.032 0.096 -15.122 1.00 0.00 O ATOM 1856 CB VAL A 123 8.311 0.030 -15.869 1.00 0.00 C ATOM 1857 CG1 VAL A 123 8.274 0.537 -14.430 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.493 -0.943 -15.977 1.00 0.00 C ATOM 0 H VAL A 123 7.849 -0.602 -18.192 1.00 0.00 H new ATOM 0 HA VAL A 123 6.854 -1.477 -15.622 1.00 0.00 H new ATOM 0 HB VAL A 123 8.444 0.866 -16.556 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.232 0.992 -14.180 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.482 1.278 -14.326 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.082 -0.297 -13.755 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.409 -0.438 -15.671 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.318 -1.802 -15.329 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.593 -1.281 -17.008 1.00 0.00 H new ATOM 1868 N GLU A 124 5.428 1.147 -17.055 1.00 0.00 N ATOM 1869 CA GLU A 124 4.217 1.957 -17.003 1.00 0.00 C ATOM 1870 C GLU A 124 2.982 1.063 -16.998 1.00 0.00 C ATOM 1871 O GLU A 124 2.077 1.293 -16.202 1.00 0.00 O ATOM 1872 CB GLU A 124 4.128 2.953 -18.179 1.00 0.00 C ATOM 1873 CG GLU A 124 4.827 4.283 -17.895 1.00 0.00 C ATOM 1874 CD GLU A 124 4.419 5.354 -18.921 1.00 0.00 C ATOM 1875 OE1 GLU A 124 3.421 6.077 -18.682 1.00 0.00 O ATOM 1876 OE2 GLU A 124 5.120 5.513 -19.948 1.00 0.00 O ATOM 0 H GLU A 124 6.004 1.318 -17.879 1.00 0.00 H new ATOM 0 HA GLU A 124 4.260 2.535 -16.080 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.571 2.499 -19.066 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.079 3.143 -18.408 1.00 0.00 H new ATOM 0 HG2 GLU A 124 4.575 4.623 -16.890 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.908 4.142 -17.922 1.00 0.00 H new ATOM 1883 N ASN A 125 2.952 0.032 -17.840 1.00 0.00 N ATOM 1884 CA ASN A 125 1.807 -0.867 -17.955 1.00 0.00 C ATOM 1885 C ASN A 125 1.571 -1.629 -16.649 1.00 0.00 C ATOM 1886 O ASN A 125 0.437 -1.709 -16.180 1.00 0.00 O ATOM 1887 CB ASN A 125 2.025 -1.844 -19.121 1.00 0.00 C ATOM 1888 CG ASN A 125 0.831 -2.778 -19.291 1.00 0.00 C ATOM 1889 OD1 ASN A 125 0.833 -3.900 -18.796 1.00 0.00 O ATOM 1890 ND2 ASN A 125 -0.212 -2.340 -19.979 1.00 0.00 N ATOM 0 H ASN A 125 3.724 -0.204 -18.464 1.00 0.00 H new ATOM 0 HA ASN A 125 0.917 -0.270 -18.155 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.186 -1.284 -20.042 1.00 0.00 H new ATOM 0 HB3 ASN A 125 2.926 -2.431 -18.943 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -1.029 -2.938 -20.103 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.199 -1.404 -20.385 1.00 0.00 H new ATOM 1897 N LEU A 126 2.646 -2.130 -16.033 1.00 0.00 N ATOM 1898 CA LEU A 126 2.648 -2.780 -14.734 1.00 0.00 C ATOM 1899 C LEU A 126 2.096 -1.851 -13.651 1.00 0.00 C ATOM 1900 O LEU A 126 1.213 -2.241 -12.894 1.00 0.00 O ATOM 1901 CB LEU A 126 4.104 -3.182 -14.447 1.00 0.00 C ATOM 1902 CG LEU A 126 4.359 -3.692 -13.027 1.00 0.00 C ATOM 1903 CD1 LEU A 126 3.528 -4.945 -12.754 1.00 0.00 C ATOM 1904 CD2 LEU A 126 5.851 -3.975 -12.875 1.00 0.00 C ATOM 0 H LEU A 126 3.576 -2.088 -16.451 1.00 0.00 H new ATOM 0 HA LEU A 126 2.001 -3.657 -14.734 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.399 -3.957 -15.155 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.747 -2.321 -14.630 1.00 0.00 H new ATOM 0 HG LEU A 126 4.060 -2.938 -12.299 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.721 -5.296 -11.740 1.00 0.00 H new ATOM 0 HD12 LEU A 126 2.469 -4.710 -12.862 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.801 -5.725 -13.465 1.00 0.00 H new ATOM 0 HD21 LEU A 126 6.051 -4.340 -11.868 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.154 -4.729 -13.601 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.415 -3.058 -13.048 1.00 0.00 H new ATOM 1916 N ILE A 127 2.589 -0.618 -13.582 1.00 0.00 N ATOM 1917 CA ILE A 127 2.168 0.359 -12.584 1.00 0.00 C ATOM 1918 C ILE A 127 0.695 0.684 -12.824 1.00 0.00 C ATOM 1919 O ILE A 127 -0.086 0.652 -11.880 1.00 0.00 O ATOM 1920 CB ILE A 127 3.099 1.573 -12.709 1.00 0.00 C ATOM 1921 CG1 ILE A 127 4.473 1.137 -12.164 1.00 0.00 C ATOM 1922 CG2 ILE A 127 2.574 2.791 -11.937 1.00 0.00 C ATOM 1923 CD1 ILE A 127 5.561 2.157 -12.442 1.00 0.00 C ATOM 0 H ILE A 127 3.299 -0.266 -14.224 1.00 0.00 H new ATOM 0 HA ILE A 127 2.245 -0.011 -11.562 1.00 0.00 H new ATOM 0 HB ILE A 127 3.162 1.884 -13.752 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.398 0.975 -11.089 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.751 0.183 -12.612 1.00 0.00 H new ATOM 0 HG21 ILE A 127 3.267 3.624 -12.056 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.596 3.074 -12.326 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.486 2.541 -10.880 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.507 1.799 -12.037 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.658 2.301 -13.518 1.00 0.00 H new ATOM 0 HD13 ILE A 127 5.300 3.105 -11.971 1.00 0.00 H new ATOM 1935 N ALA A 128 0.295 0.929 -14.075 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.071 1.288 -14.417 1.00 0.00 C ATOM 1937 C ALA A 128 -2.076 0.201 -14.006 1.00 0.00 C ATOM 1938 O ALA A 128 -3.219 0.540 -13.686 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.163 1.569 -15.921 1.00 0.00 C ATOM 0 H ALA A 128 0.920 0.882 -14.880 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.334 2.187 -13.859 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.187 1.838 -16.179 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.496 2.391 -16.179 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.872 0.677 -16.476 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.682 -1.084 -14.002 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.568 -2.154 -13.556 1.00 0.00 C ATOM 1947 C LYS A 129 -2.577 -2.305 -12.035 1.00 0.00 C ATOM 1948 O LYS A 129 -3.649 -2.564 -11.485 1.00 0.00 O ATOM 1949 CB LYS A 129 -2.361 -3.468 -14.336 1.00 0.00 C ATOM 1950 CG LYS A 129 -0.998 -4.141 -14.126 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.801 -5.436 -14.926 1.00 0.00 C ATOM 1952 CE LYS A 129 -0.801 -5.206 -16.443 1.00 0.00 C ATOM 1953 NZ LYS A 129 -0.462 -6.444 -17.190 1.00 0.00 N ATOM 0 H LYS A 129 -0.759 -1.398 -14.302 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.585 -1.853 -13.810 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -3.144 -4.170 -14.049 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -2.489 -3.265 -15.399 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -0.212 -3.436 -14.399 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -0.874 -4.361 -13.066 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.142 -5.898 -14.634 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.593 -6.139 -14.670 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -1.782 -4.850 -16.756 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.084 -4.424 -16.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.406 -6.232 -18.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.455 -6.808 -16.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -1.198 -7.161 -17.026 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.444 -2.142 -11.337 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.409 -2.349 -9.895 1.00 0.00 C ATOM 1969 C ILE A 130 -1.909 -1.140 -9.095 1.00 0.00 C ATOM 1970 O ILE A 130 -2.612 -1.325 -8.098 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.036 -2.854 -9.422 1.00 0.00 C ATOM 1972 CG1 ILE A 130 1.069 -1.790 -9.528 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.328 -4.161 -10.146 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.472 -2.284 -9.186 1.00 0.00 C ATOM 0 H ILE A 130 -0.551 -1.870 -11.749 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.125 -3.143 -9.684 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.114 -3.068 -8.356 1.00 0.00 H new ATOM 0 HG12 ILE A 130 1.076 -1.395 -10.544 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.820 -0.961 -8.865 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.302 -4.508 -9.802 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.425 -4.919 -9.929 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.365 -3.984 -11.221 1.00 0.00 H new ATOM 0 HD11 ILE A 130 3.182 -1.463 -9.290 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.488 -2.651 -8.160 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.749 -3.091 -9.864 1.00 0.00 H new ATOM 1986 N SER A 131 -1.530 0.072 -9.497 1.00 0.00 N ATOM 1987 CA SER A 131 -1.721 1.305 -8.767 1.00 0.00 C ATOM 1988 C SER A 131 -3.001 1.993 -9.247 1.00 0.00 C ATOM 1989 O SER A 131 -3.982 2.023 -8.469 1.00 0.00 O ATOM 1990 CB SER A 131 -0.469 2.168 -8.911 1.00 0.00 C ATOM 1991 OG SER A 131 0.626 1.513 -8.279 1.00 0.00 O ATOM 1992 OXT SER A 131 -3.043 2.487 -10.399 1.00 0.00 O ATOM 0 H SER A 131 -1.057 0.218 -10.389 1.00 0.00 H new ATOM 0 HA SER A 131 -1.856 1.116 -7.702 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.248 2.337 -9.965 1.00 0.00 H new ATOM 0 HB3 SER A 131 -0.633 3.146 -8.459 1.00 0.00 H new ATOM 0 HG SER A 131 1.433 2.062 -8.370 1.00 0.00 H new TER 1998 SER A 131