USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=28 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 5 MET CE :methyl 176:sc= -1.57 (180deg=-1.65) USER MOD Set 1.2: A 35 SER OG : rot -109:sc= 0.794 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 133:sc= 0.00168 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -168:sc= 1.31 (180deg=1.14) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 1.31 K(o=1.3,f=-0.009) USER MOD Single : A 12 SER OG : rot -80:sc= 0.485 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 170:sc= 0.0248 USER MOD Single : A 16 GLN : amide:sc= 2.11 K(o=2.1,f=-6.7!) USER MOD Single : A 17 MET CE :methyl -166:sc= -1.37 (180deg=-1.93!) USER MOD Single : A 23 LYS NZ :NH3+ 171:sc= 0.879 (180deg=0.823) USER MOD Single : A 24 THR OG1 : rot -140:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 170:sc= 0.572 USER MOD Single : A 39 SER OG : rot -140:sc= 0.425 USER MOD Single : A 40 SER OG : rot 32:sc= 0.439 USER MOD Single : A 43 HIS : no HD1:sc= -0.684 X(o=-0.68,f=-0.55) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.00154 USER MOD Single : A 49 MET CE :methyl 170:sc= -0.0127 (180deg=-0.0247) USER MOD Single : A 50 MET CE :methyl -142:sc= -0.122 (180deg=-2.54!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= 0.108 K(o=0.11,f=-0.99) USER MOD Single : A 61 THR OG1 : rot 150:sc= 0.526 USER MOD Single : A 62 SER OG : rot 77:sc= 1.24 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= 0 K(o=0,f=-2.1!) USER MOD Single : A 73 TYR OH : rot 130:sc= 0 USER MOD Single : A 78 SER OG : rot 124:sc= 0.0772 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.106 X(o=-0.11,f=-0.1) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0801 USER MOD Single : A 93 GLN : amide:sc= 0.419 K(o=0.42,f=-0.6) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 107 GLN : amide:sc= 0.822 K(o=0.82,f=-0.15) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 87:sc= 0.0807 USER MOD Single : A 118 GLN : amide:sc= 0.813 K(o=0.81,f=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= -0.309 K(o=-0.31,f=-2.7!) USER MOD Single : A 129 LYS NZ :NH3+ -170:sc= 1.27 (180deg=1.13) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.787 -0.312 0.816 1.00 0.00 N ATOM 2 CA MET A 1 2.607 -0.292 -0.434 1.00 0.00 C ATOM 3 C MET A 1 2.617 -1.674 -1.116 1.00 0.00 C ATOM 4 O MET A 1 2.743 -2.692 -0.442 1.00 0.00 O ATOM 5 CB MET A 1 4.075 0.156 -0.177 1.00 0.00 C ATOM 6 CG MET A 1 4.333 1.656 -0.361 1.00 0.00 C ATOM 7 SD MET A 1 4.100 2.183 -2.064 1.00 0.00 S ATOM 8 CE MET A 1 5.155 3.650 -2.167 1.00 0.00 C ATOM 0 H1 MET A 1 2.315 0.147 1.585 1.00 0.00 H new ATOM 0 H2 MET A 1 0.896 0.199 0.655 1.00 0.00 H new ATOM 0 H3 MET A 1 1.579 -1.296 1.079 1.00 0.00 H new ATOM 0 HA MET A 1 2.135 0.439 -1.091 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.352 -0.124 0.839 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.731 -0.396 -0.850 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.662 2.220 0.287 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.350 1.889 -0.047 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.098 4.069 -3.172 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.817 4.393 -1.444 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.186 3.373 -1.947 1.00 0.00 H new ATOM 18 N LYS A 2 2.568 -1.719 -2.459 1.00 0.00 N ATOM 19 CA LYS A 2 2.798 -2.960 -3.223 1.00 0.00 C ATOM 20 C LYS A 2 4.308 -3.069 -3.353 1.00 0.00 C ATOM 21 O LYS A 2 4.898 -2.200 -3.987 1.00 0.00 O ATOM 22 CB LYS A 2 2.090 -2.942 -4.601 1.00 0.00 C ATOM 23 CG LYS A 2 0.646 -2.406 -4.555 1.00 0.00 C ATOM 24 CD LYS A 2 0.008 -2.385 -5.954 1.00 0.00 C ATOM 25 CE LYS A 2 -1.141 -1.367 -6.062 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.403 -1.831 -5.419 1.00 0.00 N ATOM 0 H LYS A 2 2.370 -0.905 -3.041 1.00 0.00 H new ATOM 0 HA LYS A 2 2.375 -3.827 -2.716 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.672 -2.330 -5.290 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.079 -3.954 -5.006 1.00 0.00 H new ATOM 0 HG2 LYS A 2 0.047 -3.028 -3.890 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.644 -1.399 -4.138 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.771 -2.146 -6.694 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.368 -3.380 -6.193 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.830 -0.429 -5.602 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.333 -1.157 -7.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.136 -1.101 -5.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.721 -2.711 -5.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.234 -2.005 -4.408 1.00 0.00 H new ATOM 40 N LYS A 3 4.960 -4.046 -2.722 1.00 0.00 N ATOM 41 CA LYS A 3 6.416 -4.162 -2.846 1.00 0.00 C ATOM 42 C LYS A 3 6.717 -4.892 -4.136 1.00 0.00 C ATOM 43 O LYS A 3 6.084 -5.915 -4.405 1.00 0.00 O ATOM 44 CB LYS A 3 7.082 -4.816 -1.637 1.00 0.00 C ATOM 45 CG LYS A 3 6.704 -4.107 -0.335 1.00 0.00 C ATOM 46 CD LYS A 3 7.465 -4.704 0.846 1.00 0.00 C ATOM 47 CE LYS A 3 6.987 -3.972 2.101 1.00 0.00 C ATOM 48 NZ LYS A 3 7.660 -4.484 3.323 1.00 0.00 N ATOM 0 H LYS A 3 4.518 -4.753 -2.134 1.00 0.00 H new ATOM 0 HA LYS A 3 6.847 -3.161 -2.874 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.787 -5.864 -1.581 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.165 -4.796 -1.762 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.926 -3.043 -0.417 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.631 -4.196 -0.165 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.274 -5.774 0.927 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.540 -4.582 0.714 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.183 -2.905 1.997 1.00 0.00 H new ATOM 0 HE3 LYS A 3 5.908 -4.090 2.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.175 -4.117 4.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.626 -5.523 3.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.652 -4.170 3.330 1.00 0.00 H new ATOM 62 N VAL A 4 7.666 -4.363 -4.897 1.00 0.00 N ATOM 63 CA VAL A 4 7.967 -4.753 -6.264 1.00 0.00 C ATOM 64 C VAL A 4 9.417 -5.246 -6.331 1.00 0.00 C ATOM 65 O VAL A 4 10.295 -4.703 -5.657 1.00 0.00 O ATOM 66 CB VAL A 4 7.764 -3.554 -7.220 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.448 -4.001 -8.655 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.676 -2.554 -6.805 1.00 0.00 C ATOM 0 H VAL A 4 8.274 -3.616 -4.560 1.00 0.00 H new ATOM 0 HA VAL A 4 7.294 -5.553 -6.573 1.00 0.00 H new ATOM 0 HB VAL A 4 8.726 -3.045 -7.164 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.314 -3.124 -9.288 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.272 -4.603 -9.038 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.533 -4.594 -8.658 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.616 -1.754 -7.543 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.715 -3.065 -6.746 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.923 -2.131 -5.831 1.00 0.00 H new ATOM 78 N MET A 5 9.667 -6.209 -7.208 1.00 0.00 N ATOM 79 CA MET A 5 10.995 -6.682 -7.603 1.00 0.00 C ATOM 80 C MET A 5 11.064 -6.824 -9.116 1.00 0.00 C ATOM 81 O MET A 5 10.077 -7.239 -9.718 1.00 0.00 O ATOM 82 CB MET A 5 11.314 -8.062 -7.018 1.00 0.00 C ATOM 83 CG MET A 5 11.414 -8.111 -5.501 1.00 0.00 C ATOM 84 SD MET A 5 12.613 -9.352 -4.945 1.00 0.00 S ATOM 85 CE MET A 5 12.664 -8.923 -3.189 1.00 0.00 C ATOM 0 H MET A 5 8.917 -6.707 -7.688 1.00 0.00 H new ATOM 0 HA MET A 5 11.709 -5.949 -7.228 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.543 -8.763 -7.339 1.00 0.00 H new ATOM 0 HB3 MET A 5 12.257 -8.410 -7.440 1.00 0.00 H new ATOM 0 HG2 MET A 5 11.705 -7.130 -5.124 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.435 -8.337 -5.079 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.302 -9.631 -2.660 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.064 -7.916 -3.072 1.00 0.00 H new ATOM 0 HE3 MET A 5 11.656 -8.964 -2.775 1.00 0.00 H new ATOM 95 N PHE A 6 12.238 -6.583 -9.702 1.00 0.00 N ATOM 96 CA PHE A 6 12.566 -6.866 -11.095 1.00 0.00 C ATOM 97 C PHE A 6 13.950 -7.506 -11.076 1.00 0.00 C ATOM 98 O PHE A 6 14.905 -6.868 -10.641 1.00 0.00 O ATOM 99 CB PHE A 6 12.583 -5.588 -11.942 1.00 0.00 C ATOM 100 CG PHE A 6 11.304 -4.785 -11.971 1.00 0.00 C ATOM 101 CD1 PHE A 6 10.996 -3.920 -10.907 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.441 -4.871 -13.077 1.00 0.00 C ATOM 103 CE1 PHE A 6 9.818 -3.162 -10.937 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.263 -4.106 -13.113 1.00 0.00 C ATOM 105 CZ PHE A 6 8.949 -3.254 -12.037 1.00 0.00 C ATOM 0 H PHE A 6 13.018 -6.167 -9.194 1.00 0.00 H new ATOM 0 HA PHE A 6 11.818 -7.521 -11.542 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.382 -4.945 -11.574 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.839 -5.860 -12.966 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.668 -3.839 -10.065 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.684 -5.526 -13.901 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.578 -2.506 -10.113 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.600 -4.171 -13.963 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.040 -2.671 -12.057 1.00 0.00 H new ATOM 115 N VAL A 7 14.070 -8.762 -11.505 1.00 0.00 N ATOM 116 CA VAL A 7 15.298 -9.527 -11.303 1.00 0.00 C ATOM 117 C VAL A 7 15.420 -10.627 -12.366 1.00 0.00 C ATOM 118 O VAL A 7 14.438 -11.022 -12.985 1.00 0.00 O ATOM 119 CB VAL A 7 15.301 -10.025 -9.825 1.00 0.00 C ATOM 120 CG1 VAL A 7 13.987 -10.701 -9.393 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.481 -10.938 -9.462 1.00 0.00 C ATOM 0 H VAL A 7 13.333 -9.270 -11.994 1.00 0.00 H new ATOM 0 HA VAL A 7 16.194 -8.922 -11.441 1.00 0.00 H new ATOM 0 HB VAL A 7 15.414 -9.097 -9.265 1.00 0.00 H new ATOM 0 HG11 VAL A 7 14.066 -11.020 -8.354 1.00 0.00 H new ATOM 0 HG12 VAL A 7 13.164 -9.994 -9.494 1.00 0.00 H new ATOM 0 HG13 VAL A 7 13.799 -11.569 -10.025 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.402 -11.236 -8.416 1.00 0.00 H new ATOM 0 HG22 VAL A 7 16.462 -11.825 -10.095 1.00 0.00 H new ATOM 0 HG23 VAL A 7 17.417 -10.402 -9.617 1.00 0.00 H new ATOM 131 N CYS A 8 16.640 -11.088 -12.619 1.00 0.00 N ATOM 132 CA CYS A 8 17.001 -12.260 -13.416 1.00 0.00 C ATOM 133 C CYS A 8 18.345 -12.758 -12.851 1.00 0.00 C ATOM 134 O CYS A 8 18.908 -12.113 -11.961 1.00 0.00 O ATOM 135 CB CYS A 8 17.072 -11.863 -14.903 1.00 0.00 C ATOM 136 SG CYS A 8 17.467 -13.194 -16.077 1.00 0.00 S ATOM 0 H CYS A 8 17.465 -10.619 -12.246 1.00 0.00 H new ATOM 0 HA CYS A 8 16.267 -13.064 -13.358 1.00 0.00 H new ATOM 0 HB2 CYS A 8 16.113 -11.430 -15.187 1.00 0.00 H new ATOM 0 HB3 CYS A 8 17.821 -11.078 -15.012 1.00 0.00 H new ATOM 141 N LYS A 9 18.874 -13.894 -13.326 1.00 0.00 N ATOM 142 CA LYS A 9 20.232 -14.312 -12.954 1.00 0.00 C ATOM 143 C LYS A 9 21.252 -13.277 -13.453 1.00 0.00 C ATOM 144 O LYS A 9 21.094 -12.743 -14.551 1.00 0.00 O ATOM 145 CB LYS A 9 20.547 -15.752 -13.418 1.00 0.00 C ATOM 146 CG LYS A 9 20.565 -15.962 -14.946 1.00 0.00 C ATOM 147 CD LYS A 9 21.007 -17.392 -15.309 1.00 0.00 C ATOM 148 CE LYS A 9 21.017 -17.580 -16.837 1.00 0.00 C ATOM 149 NZ LYS A 9 21.513 -18.924 -17.244 1.00 0.00 N ATOM 0 H LYS A 9 18.391 -14.531 -13.959 1.00 0.00 H new ATOM 0 HA LYS A 9 20.302 -14.345 -11.867 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.518 -16.041 -13.016 1.00 0.00 H new ATOM 0 HB3 LYS A 9 19.809 -16.426 -12.984 1.00 0.00 H new ATOM 0 HG2 LYS A 9 19.572 -15.772 -15.353 1.00 0.00 H new ATOM 0 HG3 LYS A 9 21.242 -15.242 -15.406 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.001 -17.585 -14.906 1.00 0.00 H new ATOM 0 HD3 LYS A 9 20.332 -18.115 -14.852 1.00 0.00 H new ATOM 0 HE2 LYS A 9 20.008 -17.436 -17.224 1.00 0.00 H new ATOM 0 HE3 LYS A 9 21.644 -16.812 -17.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 21.500 -18.999 -18.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 22.486 -19.054 -16.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 20.900 -19.658 -16.836 1.00 0.00 H new ATOM 163 N ARG A 10 22.316 -13.060 -12.668 1.00 0.00 N ATOM 164 CA ARG A 10 23.353 -12.029 -12.862 1.00 0.00 C ATOM 165 C ARG A 10 22.784 -10.598 -12.908 1.00 0.00 C ATOM 166 O ARG A 10 21.576 -10.377 -12.950 1.00 0.00 O ATOM 167 CB ARG A 10 24.240 -12.354 -14.090 1.00 0.00 C ATOM 168 CG ARG A 10 24.953 -13.714 -14.011 1.00 0.00 C ATOM 169 CD ARG A 10 25.854 -13.939 -15.235 1.00 0.00 C ATOM 170 NE ARG A 10 26.977 -12.976 -15.286 1.00 0.00 N ATOM 171 CZ ARG A 10 28.262 -13.204 -14.974 1.00 0.00 C ATOM 172 NH1 ARG A 10 28.669 -14.400 -14.549 1.00 0.00 N ATOM 173 NH2 ARG A 10 29.136 -12.209 -15.089 1.00 0.00 N ATOM 0 H ARG A 10 22.488 -13.626 -11.837 1.00 0.00 H new ATOM 0 HA ARG A 10 23.992 -12.055 -11.979 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.621 -12.333 -14.987 1.00 0.00 H new ATOM 0 HB3 ARG A 10 24.989 -11.570 -14.201 1.00 0.00 H new ATOM 0 HG2 ARG A 10 25.552 -13.762 -13.101 1.00 0.00 H new ATOM 0 HG3 ARG A 10 24.214 -14.512 -13.948 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.249 -14.955 -15.212 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.259 -13.849 -16.144 1.00 0.00 H new ATOM 0 HE ARG A 10 26.748 -12.031 -15.594 1.00 0.00 H new ATOM 0 HH11 ARG A 10 27.999 -15.163 -14.456 1.00 0.00 H new ATOM 0 HH12 ARG A 10 29.651 -14.552 -14.317 1.00 0.00 H new ATOM 0 HH21 ARG A 10 28.825 -11.292 -15.410 1.00 0.00 H new ATOM 0 HH22 ARG A 10 30.117 -12.363 -14.857 1.00 0.00 H new ATOM 187 N ASN A 11 23.685 -9.607 -12.880 1.00 0.00 N ATOM 188 CA ASN A 11 23.362 -8.192 -13.124 1.00 0.00 C ATOM 189 C ASN A 11 24.112 -7.647 -14.352 1.00 0.00 C ATOM 190 O ASN A 11 23.978 -6.466 -14.668 1.00 0.00 O ATOM 191 CB ASN A 11 23.657 -7.358 -11.862 1.00 0.00 C ATOM 192 CG ASN A 11 22.592 -6.282 -11.670 1.00 0.00 C ATOM 193 OD1 ASN A 11 21.904 -6.250 -10.657 1.00 0.00 O ATOM 194 ND2 ASN A 11 22.377 -5.435 -12.657 1.00 0.00 N ATOM 0 H ASN A 11 24.673 -9.766 -12.685 1.00 0.00 H new ATOM 0 HA ASN A 11 22.298 -8.114 -13.345 1.00 0.00 H new ATOM 0 HB2 ASN A 11 23.686 -8.009 -10.988 1.00 0.00 H new ATOM 0 HB3 ASN A 11 24.640 -6.894 -11.947 1.00 0.00 H new ATOM 0 HD21 ASN A 11 21.631 -4.743 -12.582 1.00 0.00 H new ATOM 0 HD22 ASN A 11 22.957 -5.471 -13.496 1.00 0.00 H new ATOM 201 N SER A 12 24.926 -8.467 -15.031 1.00 0.00 N ATOM 202 CA SER A 12 25.784 -8.041 -16.140 1.00 0.00 C ATOM 203 C SER A 12 24.925 -7.555 -17.317 1.00 0.00 C ATOM 204 O SER A 12 25.252 -6.562 -17.969 1.00 0.00 O ATOM 205 CB SER A 12 26.680 -9.218 -16.557 1.00 0.00 C ATOM 206 OG SER A 12 27.080 -9.977 -15.414 1.00 0.00 O ATOM 0 H SER A 12 25.006 -9.462 -14.820 1.00 0.00 H new ATOM 0 HA SER A 12 26.415 -7.210 -15.825 1.00 0.00 H new ATOM 0 HB2 SER A 12 26.144 -9.860 -17.257 1.00 0.00 H new ATOM 0 HB3 SER A 12 27.561 -8.844 -17.078 1.00 0.00 H new ATOM 0 HG SER A 12 27.825 -9.525 -14.966 1.00 0.00 H new ATOM 212 N SER A 13 23.801 -8.234 -17.540 1.00 0.00 N ATOM 213 CA SER A 13 22.726 -7.859 -18.441 1.00 0.00 C ATOM 214 C SER A 13 21.414 -8.132 -17.693 1.00 0.00 C ATOM 215 O SER A 13 21.365 -8.992 -16.806 1.00 0.00 O ATOM 216 CB SER A 13 22.861 -8.617 -19.771 1.00 0.00 C ATOM 217 OG SER A 13 23.009 -10.018 -19.572 1.00 0.00 O ATOM 0 H SER A 13 23.610 -9.115 -17.063 1.00 0.00 H new ATOM 0 HA SER A 13 22.756 -6.805 -18.716 1.00 0.00 H new ATOM 0 HB2 SER A 13 21.981 -8.429 -20.387 1.00 0.00 H new ATOM 0 HB3 SER A 13 23.722 -8.236 -20.320 1.00 0.00 H new ATOM 0 HG SER A 13 23.090 -10.465 -20.440 1.00 0.00 H new ATOM 223 N ARG A 14 20.352 -7.399 -18.046 1.00 0.00 N ATOM 224 CA ARG A 14 19.080 -7.342 -17.319 1.00 0.00 C ATOM 225 C ARG A 14 19.325 -6.911 -15.863 1.00 0.00 C ATOM 226 O ARG A 14 20.423 -6.485 -15.499 1.00 0.00 O ATOM 227 CB ARG A 14 18.244 -8.635 -17.509 1.00 0.00 C ATOM 228 CG ARG A 14 17.653 -8.802 -18.905 1.00 0.00 C ATOM 229 CD ARG A 14 18.580 -9.529 -19.879 1.00 0.00 C ATOM 230 NE ARG A 14 17.789 -9.813 -21.076 1.00 0.00 N ATOM 231 CZ ARG A 14 18.186 -10.431 -22.193 1.00 0.00 C ATOM 232 NH1 ARG A 14 19.410 -10.943 -22.290 1.00 0.00 N ATOM 233 NH2 ARG A 14 17.346 -10.520 -23.213 1.00 0.00 N ATOM 0 H ARG A 14 20.356 -6.807 -18.877 1.00 0.00 H new ATOM 0 HA ARG A 14 18.443 -6.569 -17.748 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.874 -9.497 -17.289 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.433 -8.639 -16.781 1.00 0.00 H new ATOM 0 HG2 ARG A 14 16.715 -9.352 -18.830 1.00 0.00 H new ATOM 0 HG3 ARG A 14 17.414 -7.818 -19.309 1.00 0.00 H new ATOM 0 HD2 ARG A 14 19.445 -8.913 -20.124 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.960 -10.451 -19.438 1.00 0.00 H new ATOM 0 HE ARG A 14 16.818 -9.502 -21.056 1.00 0.00 H new ATOM 0 HH11 ARG A 14 20.058 -10.867 -21.506 1.00 0.00 H new ATOM 0 HH12 ARG A 14 19.700 -11.412 -23.148 1.00 0.00 H new ATOM 0 HH21 ARG A 14 16.411 -10.120 -23.140 1.00 0.00 H new ATOM 0 HH22 ARG A 14 17.634 -10.989 -24.072 1.00 0.00 H new ATOM 247 N SER A 15 18.254 -6.898 -15.066 1.00 0.00 N ATOM 248 CA SER A 15 18.239 -6.319 -13.724 1.00 0.00 C ATOM 249 C SER A 15 18.857 -4.911 -13.745 1.00 0.00 C ATOM 250 O SER A 15 19.736 -4.586 -12.953 1.00 0.00 O ATOM 251 CB SER A 15 18.863 -7.302 -12.727 1.00 0.00 C ATOM 252 OG SER A 15 18.390 -8.624 -12.971 1.00 0.00 O ATOM 0 H SER A 15 17.357 -7.298 -15.342 1.00 0.00 H new ATOM 0 HA SER A 15 17.218 -6.167 -13.373 1.00 0.00 H new ATOM 0 HB2 SER A 15 19.949 -7.276 -12.812 1.00 0.00 H new ATOM 0 HB3 SER A 15 18.616 -7.003 -11.708 1.00 0.00 H new ATOM 0 HG SER A 15 18.912 -9.261 -12.440 1.00 0.00 H new ATOM 258 N GLN A 16 18.456 -4.086 -14.712 1.00 0.00 N ATOM 259 CA GLN A 16 18.747 -2.674 -14.800 1.00 0.00 C ATOM 260 C GLN A 16 17.584 -2.046 -15.575 1.00 0.00 C ATOM 261 O GLN A 16 16.929 -2.729 -16.363 1.00 0.00 O ATOM 262 CB GLN A 16 20.105 -2.436 -15.454 1.00 0.00 C ATOM 263 CG GLN A 16 20.179 -2.667 -16.967 1.00 0.00 C ATOM 264 CD GLN A 16 21.644 -2.723 -17.400 1.00 0.00 C ATOM 265 OE1 GLN A 16 22.495 -2.069 -16.810 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.003 -3.519 -18.386 1.00 0.00 N ATOM 0 H GLN A 16 17.888 -4.413 -15.494 1.00 0.00 H new ATOM 0 HA GLN A 16 18.826 -2.210 -13.817 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.408 -1.409 -15.249 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.835 -3.086 -14.972 1.00 0.00 H new ATOM 0 HG2 GLN A 16 19.675 -3.597 -17.229 1.00 0.00 H new ATOM 0 HG3 GLN A 16 19.663 -1.865 -17.494 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.299 -4.066 -18.881 1.00 0.00 H new ATOM 0 HE22 GLN A 16 22.985 -3.588 -18.654 1.00 0.00 H new ATOM 275 N MET A 17 17.368 -0.747 -15.400 1.00 0.00 N ATOM 276 CA MET A 17 16.345 0.089 -16.023 1.00 0.00 C ATOM 277 C MET A 17 14.896 -0.258 -15.669 1.00 0.00 C ATOM 278 O MET A 17 14.106 0.670 -15.538 1.00 0.00 O ATOM 279 CB MET A 17 16.612 0.199 -17.531 1.00 0.00 C ATOM 280 CG MET A 17 15.662 1.126 -18.305 1.00 0.00 C ATOM 281 SD MET A 17 15.936 2.926 -18.276 1.00 0.00 S ATOM 282 CE MET A 17 15.726 3.476 -16.558 1.00 0.00 C ATOM 0 H MET A 17 17.953 -0.205 -14.765 1.00 0.00 H new ATOM 0 HA MET A 17 16.443 1.080 -15.581 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.633 0.551 -17.677 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.553 -0.798 -17.966 1.00 0.00 H new ATOM 0 HG2 MET A 17 15.678 0.811 -19.348 1.00 0.00 H new ATOM 0 HG3 MET A 17 14.654 0.944 -17.932 1.00 0.00 H new ATOM 0 HE1 MET A 17 15.635 4.562 -16.532 1.00 0.00 H new ATOM 0 HE2 MET A 17 14.826 3.026 -16.139 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.591 3.171 -15.970 1.00 0.00 H new ATOM 292 N ALA A 18 14.507 -1.521 -15.491 1.00 0.00 N ATOM 293 CA ALA A 18 13.104 -1.852 -15.220 1.00 0.00 C ATOM 294 C ALA A 18 12.723 -1.412 -13.807 1.00 0.00 C ATOM 295 O ALA A 18 11.769 -0.657 -13.624 1.00 0.00 O ATOM 296 CB ALA A 18 12.856 -3.342 -15.493 1.00 0.00 C ATOM 0 H ALA A 18 15.134 -2.325 -15.529 1.00 0.00 H new ATOM 0 HA ALA A 18 12.448 -1.303 -15.895 1.00 0.00 H new ATOM 0 HB1 ALA A 18 11.812 -3.580 -15.290 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.082 -3.563 -16.536 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.498 -3.942 -14.847 1.00 0.00 H new ATOM 302 N GLU A 19 13.549 -1.766 -12.825 1.00 0.00 N ATOM 303 CA GLU A 19 13.439 -1.248 -11.465 1.00 0.00 C ATOM 304 C GLU A 19 13.654 0.270 -11.451 1.00 0.00 C ATOM 305 O GLU A 19 12.915 0.984 -10.771 1.00 0.00 O ATOM 306 CB GLU A 19 14.407 -1.999 -10.534 1.00 0.00 C ATOM 307 CG GLU A 19 15.912 -1.758 -10.753 1.00 0.00 C ATOM 308 CD GLU A 19 16.391 -1.968 -12.191 1.00 0.00 C ATOM 309 OE1 GLU A 19 16.100 -3.011 -12.817 1.00 0.00 O ATOM 310 OE2 GLU A 19 16.963 -0.994 -12.720 1.00 0.00 O ATOM 0 H GLU A 19 14.318 -2.424 -12.952 1.00 0.00 H new ATOM 0 HA GLU A 19 12.432 -1.423 -11.086 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.166 -1.729 -9.506 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.216 -3.067 -10.636 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.151 -0.738 -10.450 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.472 -2.424 -10.097 1.00 0.00 H new ATOM 317 N GLY A 20 14.599 0.770 -12.263 1.00 0.00 N ATOM 318 CA GLY A 20 14.847 2.199 -12.443 1.00 0.00 C ATOM 319 C GLY A 20 13.603 2.956 -12.878 1.00 0.00 C ATOM 320 O GLY A 20 13.313 4.000 -12.318 1.00 0.00 O ATOM 0 H GLY A 20 15.218 0.180 -12.818 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.217 2.621 -11.508 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.631 2.337 -13.187 1.00 0.00 H new ATOM 324 N PHE A 21 12.815 2.440 -13.814 1.00 0.00 N ATOM 325 CA PHE A 21 11.583 3.107 -14.215 1.00 0.00 C ATOM 326 C PHE A 21 10.490 2.956 -13.184 1.00 0.00 C ATOM 327 O PHE A 21 9.670 3.857 -13.051 1.00 0.00 O ATOM 328 CB PHE A 21 11.086 2.576 -15.557 1.00 0.00 C ATOM 329 CG PHE A 21 11.490 3.460 -16.703 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.102 4.815 -16.729 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.259 2.917 -17.739 1.00 0.00 C ATOM 332 CE1 PHE A 21 11.473 5.613 -17.827 1.00 0.00 C ATOM 333 CE2 PHE A 21 12.634 3.718 -18.825 1.00 0.00 C ATOM 334 CZ PHE A 21 12.232 5.065 -18.879 1.00 0.00 C ATOM 0 H PHE A 21 13.006 1.567 -14.307 1.00 0.00 H new ATOM 0 HA PHE A 21 11.822 4.167 -14.307 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.481 1.573 -15.718 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.000 2.490 -15.532 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.527 5.235 -15.917 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.563 1.881 -17.701 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.174 6.650 -17.863 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.232 3.301 -19.622 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.505 5.678 -19.726 1.00 0.00 H new ATOM 344 N ALA A 22 10.442 1.842 -12.458 1.00 0.00 N ATOM 345 CA ALA A 22 9.328 1.577 -11.564 1.00 0.00 C ATOM 346 C ALA A 22 9.311 2.560 -10.393 1.00 0.00 C ATOM 347 O ALA A 22 8.234 3.008 -10.018 1.00 0.00 O ATOM 348 CB ALA A 22 9.380 0.107 -11.141 1.00 0.00 C ATOM 0 H ALA A 22 11.158 1.116 -12.473 1.00 0.00 H new ATOM 0 HA ALA A 22 8.380 1.739 -12.077 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.549 -0.108 -10.469 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.306 -0.528 -12.024 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.322 -0.091 -10.629 1.00 0.00 H new ATOM 354 N LYS A 23 10.474 3.003 -9.893 1.00 0.00 N ATOM 355 CA LYS A 23 10.524 4.096 -8.904 1.00 0.00 C ATOM 356 C LYS A 23 9.974 5.411 -9.473 1.00 0.00 C ATOM 357 O LYS A 23 9.473 6.226 -8.709 1.00 0.00 O ATOM 358 CB LYS A 23 11.962 4.287 -8.352 1.00 0.00 C ATOM 359 CG LYS A 23 12.976 4.460 -9.497 1.00 0.00 C ATOM 360 CD LYS A 23 14.361 5.033 -9.193 1.00 0.00 C ATOM 361 CE LYS A 23 15.215 4.066 -8.353 1.00 0.00 C ATOM 362 NZ LYS A 23 16.624 4.539 -8.206 1.00 0.00 N ATOM 0 H LYS A 23 11.386 2.627 -10.153 1.00 0.00 H new ATOM 0 HA LYS A 23 9.878 3.807 -8.075 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.992 5.160 -7.700 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.239 3.426 -7.744 1.00 0.00 H new ATOM 0 HG2 LYS A 23 13.120 3.482 -9.957 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.515 5.101 -10.249 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.876 5.252 -10.128 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.253 5.978 -8.660 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.767 3.952 -7.366 1.00 0.00 H new ATOM 0 HE3 LYS A 23 15.211 3.081 -8.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 17.120 3.943 -7.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 17.108 4.478 -9.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.626 5.526 -7.878 1.00 0.00 H new ATOM 376 N THR A 24 10.062 5.631 -10.788 1.00 0.00 N ATOM 377 CA THR A 24 9.632 6.847 -11.449 1.00 0.00 C ATOM 378 C THR A 24 8.131 6.795 -11.735 1.00 0.00 C ATOM 379 O THR A 24 7.370 7.651 -11.284 1.00 0.00 O ATOM 380 CB THR A 24 10.552 7.051 -12.665 1.00 0.00 C ATOM 381 OG1 THR A 24 11.770 7.617 -12.218 1.00 0.00 O ATOM 382 CG2 THR A 24 9.954 7.950 -13.738 1.00 0.00 C ATOM 0 H THR A 24 10.447 4.941 -11.433 1.00 0.00 H new ATOM 0 HA THR A 24 9.736 7.734 -10.824 1.00 0.00 H new ATOM 0 HB THR A 24 10.701 6.073 -13.123 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.070 8.295 -12.859 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.658 8.048 -14.564 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.025 7.512 -14.103 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.750 8.934 -13.316 1.00 0.00 H new ATOM 390 N LEU A 25 7.689 5.762 -12.449 1.00 0.00 N ATOM 391 CA LEU A 25 6.311 5.627 -12.920 1.00 0.00 C ATOM 392 C LEU A 25 5.387 5.278 -11.754 1.00 0.00 C ATOM 393 O LEU A 25 4.233 5.699 -11.725 1.00 0.00 O ATOM 394 CB LEU A 25 6.253 4.524 -13.993 1.00 0.00 C ATOM 395 CG LEU A 25 7.068 4.810 -15.267 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.163 3.523 -16.088 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.460 5.936 -16.107 1.00 0.00 C ATOM 0 H LEU A 25 8.287 4.982 -12.721 1.00 0.00 H new ATOM 0 HA LEU A 25 5.979 6.572 -13.350 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.609 3.592 -13.554 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.212 4.366 -14.274 1.00 0.00 H new ATOM 0 HG LEU A 25 8.062 5.145 -14.971 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.738 3.711 -16.994 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.657 2.751 -15.498 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.161 3.188 -16.357 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.072 6.099 -16.994 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.450 5.660 -16.409 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.425 6.852 -15.517 1.00 0.00 H new ATOM 409 N GLY A 26 5.899 4.500 -10.797 1.00 0.00 N ATOM 410 CA GLY A 26 5.177 4.003 -9.637 1.00 0.00 C ATOM 411 C GLY A 26 5.420 4.840 -8.386 1.00 0.00 C ATOM 412 O GLY A 26 5.067 4.387 -7.295 1.00 0.00 O ATOM 0 H GLY A 26 6.870 4.189 -10.816 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.110 3.989 -9.858 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.476 2.973 -9.443 1.00 0.00 H new ATOM 416 N ALA A 27 6.040 6.020 -8.511 1.00 0.00 N ATOM 417 CA ALA A 27 6.393 6.899 -7.399 1.00 0.00 C ATOM 418 C ALA A 27 5.178 7.124 -6.488 1.00 0.00 C ATOM 419 O ALA A 27 4.126 7.581 -6.946 1.00 0.00 O ATOM 420 CB ALA A 27 6.897 8.244 -7.947 1.00 0.00 C ATOM 0 H ALA A 27 6.316 6.397 -9.418 1.00 0.00 H new ATOM 0 HA ALA A 27 7.182 6.429 -6.812 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.160 8.899 -7.117 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.776 8.077 -8.570 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.113 8.711 -8.543 1.00 0.00 H new ATOM 426 N GLY A 28 5.327 6.792 -5.202 1.00 0.00 N ATOM 427 CA GLY A 28 4.284 6.953 -4.190 1.00 0.00 C ATOM 428 C GLY A 28 3.152 5.919 -4.276 1.00 0.00 C ATOM 429 O GLY A 28 2.267 5.935 -3.417 1.00 0.00 O ATOM 0 H GLY A 28 6.191 6.397 -4.831 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.741 6.892 -3.202 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.856 7.951 -4.283 1.00 0.00 H new ATOM 433 N LYS A 29 3.163 5.013 -5.267 1.00 0.00 N ATOM 434 CA LYS A 29 2.148 3.967 -5.433 1.00 0.00 C ATOM 435 C LYS A 29 2.674 2.610 -4.988 1.00 0.00 C ATOM 436 O LYS A 29 1.930 1.852 -4.367 1.00 0.00 O ATOM 437 CB LYS A 29 1.664 3.884 -6.898 1.00 0.00 C ATOM 438 CG LYS A 29 1.146 5.217 -7.460 1.00 0.00 C ATOM 439 CD LYS A 29 0.604 5.032 -8.890 1.00 0.00 C ATOM 440 CE LYS A 29 0.240 6.366 -9.562 1.00 0.00 C ATOM 441 NZ LYS A 29 -0.922 7.053 -8.929 1.00 0.00 N ATOM 0 H LYS A 29 3.888 4.988 -5.984 1.00 0.00 H new ATOM 0 HA LYS A 29 1.303 4.238 -4.800 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.486 3.533 -7.522 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.871 3.140 -6.966 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.359 5.608 -6.815 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.950 5.953 -7.463 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.351 4.517 -9.494 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.278 4.392 -8.860 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.105 7.028 -9.529 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.016 6.185 -10.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.113 7.944 -9.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.760 6.439 -8.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.705 7.256 -7.932 1.00 0.00 H new ATOM 455 N ILE A 30 3.926 2.285 -5.340 1.00 0.00 N ATOM 456 CA ILE A 30 4.535 0.958 -5.166 1.00 0.00 C ATOM 457 C ILE A 30 6.013 1.115 -4.755 1.00 0.00 C ATOM 458 O ILE A 30 6.636 2.130 -5.069 1.00 0.00 O ATOM 459 CB ILE A 30 4.310 0.114 -6.446 1.00 0.00 C ATOM 460 CG1 ILE A 30 5.041 0.699 -7.673 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.805 0.002 -6.746 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.770 -0.033 -9.000 1.00 0.00 C ATOM 0 H ILE A 30 4.562 2.958 -5.767 1.00 0.00 H new ATOM 0 HA ILE A 30 4.058 0.408 -4.355 1.00 0.00 H new ATOM 0 HB ILE A 30 4.727 -0.875 -6.255 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.752 1.744 -7.786 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.114 0.684 -7.480 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.657 -0.593 -7.647 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.302 -0.479 -5.907 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.389 0.998 -6.896 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.327 0.451 -9.803 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.087 -1.072 -8.914 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.704 0.004 -9.225 1.00 0.00 H new ATOM 474 N ALA A 31 6.563 0.127 -4.035 1.00 0.00 N ATOM 475 CA ALA A 31 7.881 0.180 -3.393 1.00 0.00 C ATOM 476 C ALA A 31 8.822 -0.825 -4.055 1.00 0.00 C ATOM 477 O ALA A 31 8.701 -2.021 -3.813 1.00 0.00 O ATOM 478 CB ALA A 31 7.723 -0.145 -1.900 1.00 0.00 C ATOM 0 H ALA A 31 6.085 -0.761 -3.879 1.00 0.00 H new ATOM 0 HA ALA A 31 8.306 1.178 -3.504 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.698 -0.108 -1.414 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.059 0.585 -1.437 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.299 -1.143 -1.788 1.00 0.00 H new ATOM 484 N VAL A 32 9.742 -0.383 -4.902 1.00 0.00 N ATOM 485 CA VAL A 32 10.662 -1.275 -5.604 1.00 0.00 C ATOM 486 C VAL A 32 11.879 -1.532 -4.706 1.00 0.00 C ATOM 487 O VAL A 32 12.535 -0.578 -4.276 1.00 0.00 O ATOM 488 CB VAL A 32 11.071 -0.638 -6.949 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.693 -1.700 -7.862 1.00 0.00 C ATOM 490 CG2 VAL A 32 9.898 0.021 -7.699 1.00 0.00 C ATOM 0 H VAL A 32 9.873 0.604 -5.123 1.00 0.00 H new ATOM 0 HA VAL A 32 10.184 -2.230 -5.821 1.00 0.00 H new ATOM 0 HB VAL A 32 11.788 0.146 -6.705 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.979 -1.243 -8.809 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.576 -2.121 -7.381 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.967 -2.492 -8.046 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.258 0.448 -8.635 1.00 0.00 H new ATOM 0 HG22 VAL A 32 9.135 -0.728 -7.912 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.469 0.810 -7.082 1.00 0.00 H new ATOM 500 N THR A 33 12.209 -2.807 -4.496 1.00 0.00 N ATOM 501 CA THR A 33 13.393 -3.268 -3.791 1.00 0.00 C ATOM 502 C THR A 33 13.710 -4.629 -4.407 1.00 0.00 C ATOM 503 O THR A 33 13.063 -5.604 -4.053 1.00 0.00 O ATOM 504 CB THR A 33 13.081 -3.424 -2.287 1.00 0.00 C ATOM 505 OG1 THR A 33 12.476 -2.262 -1.730 1.00 0.00 O ATOM 506 CG2 THR A 33 14.347 -3.748 -1.481 1.00 0.00 C ATOM 0 H THR A 33 11.628 -3.576 -4.830 1.00 0.00 H new ATOM 0 HA THR A 33 14.227 -2.572 -3.879 1.00 0.00 H new ATOM 0 HB THR A 33 12.376 -4.252 -2.219 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.297 -2.411 -0.778 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.091 -3.851 -0.427 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.779 -4.681 -1.842 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.071 -2.942 -1.601 1.00 0.00 H new ATOM 514 N SER A 34 14.652 -4.717 -5.351 1.00 0.00 N ATOM 515 CA SER A 34 14.821 -5.957 -6.116 1.00 0.00 C ATOM 516 C SER A 34 15.933 -6.881 -5.602 1.00 0.00 C ATOM 517 O SER A 34 16.201 -7.909 -6.226 1.00 0.00 O ATOM 518 CB SER A 34 14.953 -5.640 -7.603 1.00 0.00 C ATOM 519 OG SER A 34 13.837 -4.856 -8.009 1.00 0.00 O ATOM 0 H SER A 34 15.295 -3.965 -5.600 1.00 0.00 H new ATOM 0 HA SER A 34 13.915 -6.544 -5.963 1.00 0.00 H new ATOM 0 HB2 SER A 34 15.881 -5.101 -7.792 1.00 0.00 H new ATOM 0 HB3 SER A 34 14.996 -6.562 -8.182 1.00 0.00 H new ATOM 0 HG SER A 34 13.990 -4.513 -8.914 1.00 0.00 H new ATOM 525 N SER A 35 16.564 -6.539 -4.472 1.00 0.00 N ATOM 526 CA SER A 35 17.573 -7.371 -3.813 1.00 0.00 C ATOM 527 C SER A 35 18.700 -7.777 -4.793 1.00 0.00 C ATOM 528 O SER A 35 19.210 -6.920 -5.518 1.00 0.00 O ATOM 529 CB SER A 35 16.864 -8.544 -3.114 1.00 0.00 C ATOM 530 OG SER A 35 15.711 -8.122 -2.405 1.00 0.00 O ATOM 0 H SER A 35 16.383 -5.662 -3.984 1.00 0.00 H new ATOM 0 HA SER A 35 18.093 -6.808 -3.038 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.580 -9.290 -3.856 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.557 -9.027 -2.425 1.00 0.00 H new ATOM 0 HG SER A 35 15.879 -8.182 -1.441 1.00 0.00 H new ATOM 536 N GLY A 36 19.107 -9.051 -4.818 1.00 0.00 N ATOM 537 CA GLY A 36 20.139 -9.613 -5.676 1.00 0.00 C ATOM 538 C GLY A 36 20.205 -11.108 -5.379 1.00 0.00 C ATOM 539 O GLY A 36 19.569 -11.571 -4.431 1.00 0.00 O ATOM 0 H GLY A 36 18.697 -9.753 -4.202 1.00 0.00 H new ATOM 0 HA2 GLY A 36 19.904 -9.439 -6.726 1.00 0.00 H new ATOM 0 HA3 GLY A 36 21.101 -9.139 -5.482 1.00 0.00 H new ATOM 543 N LEU A 37 20.945 -11.879 -6.169 1.00 0.00 N ATOM 544 CA LEU A 37 21.111 -13.315 -5.997 1.00 0.00 C ATOM 545 C LEU A 37 22.560 -13.625 -5.619 1.00 0.00 C ATOM 546 O LEU A 37 22.826 -14.403 -4.703 1.00 0.00 O ATOM 547 CB LEU A 37 20.694 -14.029 -7.292 1.00 0.00 C ATOM 548 CG LEU A 37 19.169 -14.083 -7.517 1.00 0.00 C ATOM 549 CD1 LEU A 37 18.889 -14.301 -9.008 1.00 0.00 C ATOM 550 CD2 LEU A 37 18.519 -15.207 -6.698 1.00 0.00 C ATOM 0 H LEU A 37 21.460 -11.510 -6.969 1.00 0.00 H new ATOM 0 HA LEU A 37 20.475 -13.676 -5.189 1.00 0.00 H new ATOM 0 HB2 LEU A 37 21.158 -13.523 -8.139 1.00 0.00 H new ATOM 0 HB3 LEU A 37 21.084 -15.047 -7.275 1.00 0.00 H new ATOM 0 HG LEU A 37 18.738 -13.138 -7.187 1.00 0.00 H new ATOM 0 HD11 LEU A 37 17.812 -14.340 -9.174 1.00 0.00 H new ATOM 0 HD12 LEU A 37 19.315 -13.478 -9.582 1.00 0.00 H new ATOM 0 HD13 LEU A 37 19.340 -15.240 -9.329 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.444 -15.216 -6.881 1.00 0.00 H new ATOM 0 HD22 LEU A 37 18.945 -16.166 -6.993 1.00 0.00 H new ATOM 0 HD23 LEU A 37 18.705 -15.039 -5.637 1.00 0.00 H new ATOM 562 N GLU A 38 23.480 -12.955 -6.311 1.00 0.00 N ATOM 563 CA GLU A 38 24.912 -12.875 -6.052 1.00 0.00 C ATOM 564 C GLU A 38 25.226 -11.423 -6.394 1.00 0.00 C ATOM 565 O GLU A 38 25.567 -10.616 -5.529 1.00 0.00 O ATOM 566 CB GLU A 38 25.709 -13.857 -6.928 1.00 0.00 C ATOM 567 CG GLU A 38 25.285 -15.312 -6.720 1.00 0.00 C ATOM 568 CD GLU A 38 26.248 -16.289 -7.423 1.00 0.00 C ATOM 569 OE1 GLU A 38 26.102 -16.526 -8.647 1.00 0.00 O ATOM 570 OE2 GLU A 38 27.156 -16.838 -6.753 1.00 0.00 O ATOM 0 H GLU A 38 23.219 -12.411 -7.133 1.00 0.00 H new ATOM 0 HA GLU A 38 25.183 -13.147 -5.032 1.00 0.00 H new ATOM 0 HB2 GLU A 38 25.577 -13.591 -7.977 1.00 0.00 H new ATOM 0 HB3 GLU A 38 26.771 -13.757 -6.705 1.00 0.00 H new ATOM 0 HG2 GLU A 38 25.255 -15.534 -5.653 1.00 0.00 H new ATOM 0 HG3 GLU A 38 24.275 -15.456 -7.104 1.00 0.00 H new ATOM 577 N SER A 39 24.930 -11.109 -7.662 1.00 0.00 N ATOM 578 CA SER A 39 24.865 -9.786 -8.242 1.00 0.00 C ATOM 579 C SER A 39 26.154 -8.960 -8.164 1.00 0.00 C ATOM 580 O SER A 39 27.205 -9.403 -7.697 1.00 0.00 O ATOM 581 CB SER A 39 23.601 -9.126 -7.661 1.00 0.00 C ATOM 582 OG SER A 39 22.488 -10.003 -7.859 1.00 0.00 O ATOM 0 H SER A 39 24.717 -11.833 -8.348 1.00 0.00 H new ATOM 0 HA SER A 39 24.780 -9.855 -9.327 1.00 0.00 H new ATOM 0 HB2 SER A 39 23.736 -8.922 -6.599 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.418 -8.168 -8.148 1.00 0.00 H new ATOM 0 HG SER A 39 21.699 -9.479 -8.112 1.00 0.00 H new ATOM 588 N SER A 40 26.075 -7.789 -8.791 1.00 0.00 N ATOM 589 CA SER A 40 27.125 -6.840 -9.107 1.00 0.00 C ATOM 590 C SER A 40 26.377 -5.555 -9.491 1.00 0.00 C ATOM 591 O SER A 40 25.139 -5.538 -9.521 1.00 0.00 O ATOM 592 CB SER A 40 27.920 -7.409 -10.299 1.00 0.00 C ATOM 593 OG SER A 40 28.877 -8.367 -9.865 1.00 0.00 O ATOM 0 H SER A 40 25.172 -7.451 -9.124 1.00 0.00 H new ATOM 0 HA SER A 40 27.827 -6.652 -8.294 1.00 0.00 H new ATOM 0 HB2 SER A 40 27.235 -7.871 -11.010 1.00 0.00 H new ATOM 0 HB3 SER A 40 28.425 -6.598 -10.824 1.00 0.00 H new ATOM 0 HG SER A 40 28.538 -8.831 -9.071 1.00 0.00 H new ATOM 599 N ARG A 41 27.089 -4.478 -9.818 1.00 0.00 N ATOM 600 CA ARG A 41 26.448 -3.282 -10.351 1.00 0.00 C ATOM 601 C ARG A 41 25.834 -3.567 -11.724 1.00 0.00 C ATOM 602 O ARG A 41 26.158 -4.543 -12.405 1.00 0.00 O ATOM 603 CB ARG A 41 27.464 -2.118 -10.423 1.00 0.00 C ATOM 604 CG ARG A 41 27.072 -0.935 -9.526 1.00 0.00 C ATOM 605 CD ARG A 41 27.343 -1.265 -8.050 1.00 0.00 C ATOM 606 NE ARG A 41 26.683 -0.316 -7.141 1.00 0.00 N ATOM 607 CZ ARG A 41 27.126 0.887 -6.751 1.00 0.00 C ATOM 608 NH1 ARG A 41 28.279 1.377 -7.208 1.00 0.00 N ATOM 609 NH2 ARG A 41 26.410 1.594 -5.880 1.00 0.00 N ATOM 0 H ARG A 41 28.102 -4.411 -9.723 1.00 0.00 H new ATOM 0 HA ARG A 41 25.641 -2.987 -9.680 1.00 0.00 H new ATOM 0 HB2 ARG A 41 28.449 -2.481 -10.129 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.546 -1.775 -11.455 1.00 0.00 H new ATOM 0 HG2 ARG A 41 27.636 -0.049 -9.816 1.00 0.00 H new ATOM 0 HG3 ARG A 41 26.017 -0.700 -9.664 1.00 0.00 H new ATOM 0 HD2 ARG A 41 26.994 -2.275 -7.835 1.00 0.00 H new ATOM 0 HD3 ARG A 41 28.418 -1.253 -7.868 1.00 0.00 H new ATOM 0 HE ARG A 41 25.782 -0.608 -6.763 1.00 0.00 H new ATOM 0 HH11 ARG A 41 28.839 0.834 -7.865 1.00 0.00 H new ATOM 0 HH12 ARG A 41 28.601 2.295 -6.900 1.00 0.00 H new ATOM 0 HH21 ARG A 41 25.534 1.219 -5.516 1.00 0.00 H new ATOM 0 HH22 ARG A 41 26.737 2.511 -5.576 1.00 0.00 H new ATOM 623 N VAL A 42 24.950 -2.656 -12.102 1.00 0.00 N ATOM 624 CA VAL A 42 24.355 -2.534 -13.427 1.00 0.00 C ATOM 625 C VAL A 42 25.444 -2.119 -14.439 1.00 0.00 C ATOM 626 O VAL A 42 26.588 -1.852 -14.058 1.00 0.00 O ATOM 627 CB VAL A 42 23.175 -1.542 -13.313 1.00 0.00 C ATOM 628 CG1 VAL A 42 22.242 -1.837 -12.127 1.00 0.00 C ATOM 629 CG2 VAL A 42 23.662 -0.093 -13.151 1.00 0.00 C ATOM 0 H VAL A 42 24.609 -1.942 -11.458 1.00 0.00 H new ATOM 0 HA VAL A 42 23.955 -3.477 -13.800 1.00 0.00 H new ATOM 0 HB VAL A 42 22.625 -1.669 -14.246 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.436 -1.103 -12.107 1.00 0.00 H new ATOM 0 HG12 VAL A 42 21.820 -2.836 -12.236 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.807 -1.781 -11.197 1.00 0.00 H new ATOM 0 HG21 VAL A 42 22.803 0.573 -13.074 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.266 -0.011 -12.248 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.263 0.188 -14.016 1.00 0.00 H new ATOM 639 N HIS A 43 25.102 -2.051 -15.728 1.00 0.00 N ATOM 640 CA HIS A 43 26.089 -1.736 -16.770 1.00 0.00 C ATOM 641 C HIS A 43 26.468 -0.240 -16.688 1.00 0.00 C ATOM 642 O HIS A 43 25.572 0.583 -16.500 1.00 0.00 O ATOM 643 CB HIS A 43 25.536 -2.164 -18.143 1.00 0.00 C ATOM 644 CG HIS A 43 26.545 -2.137 -19.261 1.00 0.00 C ATOM 645 ND1 HIS A 43 26.766 -1.101 -20.143 1.00 0.00 N ATOM 646 CD2 HIS A 43 27.413 -3.142 -19.598 1.00 0.00 C ATOM 647 CE1 HIS A 43 27.746 -1.472 -20.986 1.00 0.00 C ATOM 648 NE2 HIS A 43 28.169 -2.714 -20.697 1.00 0.00 N ATOM 0 H HIS A 43 24.156 -2.208 -16.076 1.00 0.00 H new ATOM 0 HA HIS A 43 27.012 -2.295 -16.618 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.133 -3.173 -18.059 1.00 0.00 H new ATOM 0 HB3 HIS A 43 24.705 -1.510 -18.405 1.00 0.00 H new ATOM 0 HD2 HIS A 43 27.499 -4.098 -19.103 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.138 -0.858 -21.783 1.00 0.00 H new ATOM 0 HE2 HIS A 43 28.896 -3.241 -21.181 1.00 0.00 H new ATOM 656 N PRO A 44 27.742 0.170 -16.853 1.00 0.00 N ATOM 657 CA PRO A 44 28.164 1.556 -16.620 1.00 0.00 C ATOM 658 C PRO A 44 27.451 2.560 -17.530 1.00 0.00 C ATOM 659 O PRO A 44 26.894 3.544 -17.042 1.00 0.00 O ATOM 660 CB PRO A 44 29.687 1.575 -16.819 1.00 0.00 C ATOM 661 CG PRO A 44 29.974 0.311 -17.634 1.00 0.00 C ATOM 662 CD PRO A 44 28.906 -0.659 -17.142 1.00 0.00 C ATOM 0 HA PRO A 44 27.892 1.871 -15.613 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.008 2.472 -17.348 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.214 1.562 -15.865 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.892 0.493 -18.705 1.00 0.00 H new ATOM 0 HG3 PRO A 44 30.980 -0.068 -17.451 1.00 0.00 H new ATOM 0 HD2 PRO A 44 28.677 -1.410 -17.898 1.00 0.00 H new ATOM 0 HD3 PRO A 44 29.239 -1.194 -16.253 1.00 0.00 H new ATOM 670 N THR A 45 27.389 2.294 -18.839 1.00 0.00 N ATOM 671 CA THR A 45 26.718 3.185 -19.786 1.00 0.00 C ATOM 672 C THR A 45 25.208 3.241 -19.510 1.00 0.00 C ATOM 673 O THR A 45 24.580 4.250 -19.820 1.00 0.00 O ATOM 674 CB THR A 45 27.070 2.776 -21.225 1.00 0.00 C ATOM 675 OG1 THR A 45 28.457 2.482 -21.313 1.00 0.00 O ATOM 676 CG2 THR A 45 26.688 3.823 -22.277 1.00 0.00 C ATOM 0 H THR A 45 27.799 1.463 -19.267 1.00 0.00 H new ATOM 0 HA THR A 45 27.077 4.205 -19.653 1.00 0.00 H new ATOM 0 HB THR A 45 26.476 1.890 -21.449 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.678 2.220 -22.231 1.00 0.00 H new ATOM 0 HG21 THR A 45 26.968 3.463 -23.267 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.612 3.996 -22.244 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.212 4.756 -22.069 1.00 0.00 H new ATOM 684 N ALA A 46 24.622 2.218 -18.862 1.00 0.00 N ATOM 685 CA ALA A 46 23.206 2.246 -18.512 1.00 0.00 C ATOM 686 C ALA A 46 22.948 3.445 -17.632 1.00 0.00 C ATOM 687 O ALA A 46 22.030 4.195 -17.901 1.00 0.00 O ATOM 688 CB ALA A 46 22.769 0.967 -17.776 1.00 0.00 C ATOM 0 H ALA A 46 25.111 1.370 -18.575 1.00 0.00 H new ATOM 0 HA ALA A 46 22.627 2.309 -19.434 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.708 1.031 -17.535 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.944 0.102 -18.415 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.345 0.862 -16.856 1.00 0.00 H new ATOM 694 N ILE A 47 23.779 3.672 -16.625 1.00 0.00 N ATOM 695 CA ILE A 47 23.541 4.733 -15.657 1.00 0.00 C ATOM 696 C ILE A 47 23.529 6.075 -16.387 1.00 0.00 C ATOM 697 O ILE A 47 22.667 6.900 -16.111 1.00 0.00 O ATOM 698 CB ILE A 47 24.626 4.665 -14.557 1.00 0.00 C ATOM 699 CG1 ILE A 47 24.533 3.342 -13.764 1.00 0.00 C ATOM 700 CG2 ILE A 47 24.521 5.861 -13.593 1.00 0.00 C ATOM 701 CD1 ILE A 47 25.868 2.937 -13.127 1.00 0.00 C ATOM 0 H ILE A 47 24.628 3.133 -16.457 1.00 0.00 H new ATOM 0 HA ILE A 47 22.573 4.614 -15.170 1.00 0.00 H new ATOM 0 HB ILE A 47 25.594 4.706 -15.056 1.00 0.00 H new ATOM 0 HG12 ILE A 47 23.779 3.444 -12.983 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.197 2.547 -14.430 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.297 5.784 -12.832 1.00 0.00 H new ATOM 0 HG22 ILE A 47 24.650 6.789 -14.150 1.00 0.00 H new ATOM 0 HG23 ILE A 47 23.542 5.858 -13.114 1.00 0.00 H new ATOM 0 HD11 ILE A 47 25.742 2.001 -12.583 1.00 0.00 H new ATOM 0 HD12 ILE A 47 26.618 2.806 -13.907 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.193 3.716 -12.438 1.00 0.00 H new ATOM 713 N ALA A 48 24.424 6.278 -17.358 1.00 0.00 N ATOM 714 CA ALA A 48 24.490 7.525 -18.106 1.00 0.00 C ATOM 715 C ALA A 48 23.224 7.727 -18.948 1.00 0.00 C ATOM 716 O ALA A 48 22.630 8.805 -18.950 1.00 0.00 O ATOM 717 CB ALA A 48 25.753 7.539 -18.974 1.00 0.00 C ATOM 0 H ALA A 48 25.116 5.585 -17.642 1.00 0.00 H new ATOM 0 HA ALA A 48 24.544 8.358 -17.406 1.00 0.00 H new ATOM 0 HB1 ALA A 48 25.800 8.474 -19.533 1.00 0.00 H new ATOM 0 HB2 ALA A 48 26.633 7.452 -18.337 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.725 6.701 -19.670 1.00 0.00 H new ATOM 723 N MET A 49 22.783 6.674 -19.637 1.00 0.00 N ATOM 724 CA MET A 49 21.602 6.700 -20.504 1.00 0.00 C ATOM 725 C MET A 49 20.332 6.868 -19.657 1.00 0.00 C ATOM 726 O MET A 49 19.378 7.575 -19.998 1.00 0.00 O ATOM 727 CB MET A 49 21.589 5.398 -21.317 1.00 0.00 C ATOM 728 CG MET A 49 22.826 5.278 -22.226 1.00 0.00 C ATOM 729 SD MET A 49 22.802 6.314 -23.707 1.00 0.00 S ATOM 730 CE MET A 49 23.960 7.598 -23.172 1.00 0.00 C ATOM 0 H MET A 49 23.243 5.764 -19.609 1.00 0.00 H new ATOM 0 HA MET A 49 21.635 7.546 -21.190 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.553 4.546 -20.638 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.686 5.359 -21.926 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.711 5.529 -21.642 1.00 0.00 H new ATOM 0 HG3 MET A 49 22.931 4.237 -22.533 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.213 8.236 -24.019 1.00 0.00 H new ATOM 0 HE2 MET A 49 23.499 8.200 -22.389 1.00 0.00 H new ATOM 0 HE3 MET A 49 24.867 7.132 -22.786 1.00 0.00 H new ATOM 740 N MET A 50 20.325 6.245 -18.491 1.00 0.00 N ATOM 741 CA MET A 50 19.178 6.227 -17.620 1.00 0.00 C ATOM 742 C MET A 50 19.127 7.590 -16.937 1.00 0.00 C ATOM 743 O MET A 50 18.041 8.128 -16.751 1.00 0.00 O ATOM 744 CB MET A 50 19.216 5.002 -16.698 1.00 0.00 C ATOM 745 CG MET A 50 19.185 3.626 -17.426 1.00 0.00 C ATOM 746 SD MET A 50 19.104 3.568 -19.253 1.00 0.00 S ATOM 747 CE MET A 50 19.148 1.790 -19.625 1.00 0.00 C ATOM 0 H MET A 50 21.128 5.734 -18.125 1.00 0.00 H new ATOM 0 HA MET A 50 18.235 6.099 -18.152 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.118 5.053 -16.089 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.368 5.054 -16.016 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.076 3.077 -17.122 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.325 3.075 -17.044 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.747 1.620 -20.520 1.00 0.00 H new ATOM 0 HE2 MET A 50 19.590 1.253 -18.785 1.00 0.00 H new ATOM 0 HE3 MET A 50 18.134 1.428 -19.793 1.00 0.00 H new ATOM 757 N GLU A 51 20.273 8.234 -16.714 1.00 0.00 N ATOM 758 CA GLU A 51 20.358 9.609 -16.277 1.00 0.00 C ATOM 759 C GLU A 51 19.911 10.548 -17.405 1.00 0.00 C ATOM 760 O GLU A 51 19.464 11.657 -17.109 1.00 0.00 O ATOM 761 CB GLU A 51 21.763 9.912 -15.736 1.00 0.00 C ATOM 762 CG GLU A 51 21.879 11.310 -15.120 1.00 0.00 C ATOM 763 CD GLU A 51 23.237 11.498 -14.420 1.00 0.00 C ATOM 764 OE1 GLU A 51 24.242 11.811 -15.105 1.00 0.00 O ATOM 765 OE2 GLU A 51 23.306 11.365 -13.174 1.00 0.00 O ATOM 0 H GLU A 51 21.185 7.794 -16.838 1.00 0.00 H new ATOM 0 HA GLU A 51 19.674 9.781 -15.446 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.025 9.167 -14.985 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.486 9.817 -16.546 1.00 0.00 H new ATOM 0 HG2 GLU A 51 21.760 12.064 -15.898 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.073 11.462 -14.403 1.00 0.00 H new ATOM 772 N GLU A 52 19.928 10.119 -18.679 1.00 0.00 N ATOM 773 CA GLU A 52 19.286 10.915 -19.730 1.00 0.00 C ATOM 774 C GLU A 52 17.786 10.988 -19.451 1.00 0.00 C ATOM 775 O GLU A 52 17.184 12.052 -19.622 1.00 0.00 O ATOM 776 CB GLU A 52 19.459 10.420 -21.177 1.00 0.00 C ATOM 777 CG GLU A 52 20.890 10.305 -21.696 1.00 0.00 C ATOM 778 CD GLU A 52 20.891 9.913 -23.184 1.00 0.00 C ATOM 779 OE1 GLU A 52 20.298 8.872 -23.569 1.00 0.00 O ATOM 780 OE2 GLU A 52 21.463 10.671 -23.999 1.00 0.00 O ATOM 0 H GLU A 52 20.365 9.254 -18.996 1.00 0.00 H new ATOM 0 HA GLU A 52 19.795 11.878 -19.682 1.00 0.00 H new ATOM 0 HB2 GLU A 52 18.987 9.441 -21.260 1.00 0.00 H new ATOM 0 HB3 GLU A 52 18.912 11.095 -21.835 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.409 11.254 -21.563 1.00 0.00 H new ATOM 0 HG3 GLU A 52 21.435 9.560 -21.117 1.00 0.00 H new ATOM 787 N VAL A 53 17.190 9.880 -18.985 1.00 0.00 N ATOM 788 CA VAL A 53 15.792 9.907 -18.516 1.00 0.00 C ATOM 789 C VAL A 53 15.684 10.361 -17.039 1.00 0.00 C ATOM 790 O VAL A 53 14.595 10.365 -16.463 1.00 0.00 O ATOM 791 CB VAL A 53 15.017 8.638 -18.942 1.00 0.00 C ATOM 792 CG1 VAL A 53 15.362 7.374 -18.149 1.00 0.00 C ATOM 793 CG2 VAL A 53 13.495 8.834 -18.948 1.00 0.00 C ATOM 0 H VAL A 53 17.643 8.968 -18.922 1.00 0.00 H new ATOM 0 HA VAL A 53 15.247 10.695 -19.036 1.00 0.00 H new ATOM 0 HB VAL A 53 15.361 8.479 -19.964 1.00 0.00 H new ATOM 0 HG11 VAL A 53 14.769 6.538 -18.520 1.00 0.00 H new ATOM 0 HG12 VAL A 53 16.422 7.148 -18.268 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.142 7.535 -17.094 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.010 7.908 -19.256 1.00 0.00 H new ATOM 0 HG22 VAL A 53 13.159 9.105 -17.947 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.233 9.629 -19.646 1.00 0.00 H new ATOM 803 N GLY A 54 16.783 10.826 -16.435 1.00 0.00 N ATOM 804 CA GLY A 54 16.822 11.399 -15.095 1.00 0.00 C ATOM 805 C GLY A 54 16.825 10.350 -13.981 1.00 0.00 C ATOM 806 O GLY A 54 16.458 10.671 -12.848 1.00 0.00 O ATOM 0 H GLY A 54 17.698 10.811 -16.885 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.713 12.020 -15.000 1.00 0.00 H new ATOM 0 HA3 GLY A 54 15.961 12.054 -14.964 1.00 0.00 H new ATOM 810 N ILE A 55 17.200 9.106 -14.287 1.00 0.00 N ATOM 811 CA ILE A 55 17.091 7.955 -13.390 1.00 0.00 C ATOM 812 C ILE A 55 18.479 7.398 -13.059 1.00 0.00 C ATOM 813 O ILE A 55 19.363 7.379 -13.914 1.00 0.00 O ATOM 814 CB ILE A 55 16.147 6.916 -14.022 1.00 0.00 C ATOM 815 CG1 ILE A 55 14.733 7.521 -14.158 1.00 0.00 C ATOM 816 CG2 ILE A 55 16.123 5.571 -13.266 1.00 0.00 C ATOM 817 CD1 ILE A 55 13.652 6.532 -14.594 1.00 0.00 C ATOM 0 H ILE A 55 17.600 8.865 -15.194 1.00 0.00 H new ATOM 0 HA ILE A 55 16.657 8.253 -12.436 1.00 0.00 H new ATOM 0 HB ILE A 55 16.535 6.678 -15.012 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.445 7.954 -13.200 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.770 8.338 -14.879 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.438 4.885 -13.765 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.124 5.141 -13.257 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.790 5.735 -12.241 1.00 0.00 H new ATOM 0 HD11 ILE A 55 12.694 7.047 -14.662 1.00 0.00 H new ATOM 0 HD12 ILE A 55 13.911 6.116 -15.568 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.580 5.726 -13.863 1.00 0.00 H new ATOM 829 N ASP A 56 18.652 6.889 -11.833 1.00 0.00 N ATOM 830 CA ASP A 56 19.828 6.114 -11.436 1.00 0.00 C ATOM 831 C ASP A 56 19.384 4.697 -11.072 1.00 0.00 C ATOM 832 O ASP A 56 18.265 4.480 -10.606 1.00 0.00 O ATOM 833 CB ASP A 56 20.630 6.765 -10.300 1.00 0.00 C ATOM 834 CG ASP A 56 21.782 5.840 -9.852 1.00 0.00 C ATOM 835 OD1 ASP A 56 22.492 5.293 -10.731 1.00 0.00 O ATOM 836 OD2 ASP A 56 21.913 5.582 -8.633 1.00 0.00 O ATOM 0 H ASP A 56 17.971 7.006 -11.083 1.00 0.00 H new ATOM 0 HA ASP A 56 20.513 6.082 -12.283 1.00 0.00 H new ATOM 0 HB2 ASP A 56 21.033 7.722 -10.633 1.00 0.00 H new ATOM 0 HB3 ASP A 56 19.973 6.972 -9.455 1.00 0.00 H new ATOM 841 N ILE A 57 20.277 3.742 -11.312 1.00 0.00 N ATOM 842 CA ILE A 57 20.109 2.297 -11.176 1.00 0.00 C ATOM 843 C ILE A 57 21.350 1.651 -10.545 1.00 0.00 C ATOM 844 O ILE A 57 21.236 0.553 -10.009 1.00 0.00 O ATOM 845 CB ILE A 57 19.789 1.677 -12.556 1.00 0.00 C ATOM 846 CG1 ILE A 57 20.603 2.332 -13.695 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.286 1.786 -12.841 1.00 0.00 C ATOM 848 CD1 ILE A 57 20.703 1.473 -14.950 1.00 0.00 C ATOM 0 H ILE A 57 21.216 3.978 -11.634 1.00 0.00 H new ATOM 0 HA ILE A 57 19.272 2.102 -10.505 1.00 0.00 H new ATOM 0 HB ILE A 57 20.078 0.627 -12.520 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.145 3.286 -13.954 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.608 2.549 -13.333 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.068 1.347 -13.815 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.730 1.253 -12.070 1.00 0.00 H new ATOM 0 HG23 ILE A 57 17.991 2.835 -12.841 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.288 1.998 -15.705 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.189 0.528 -14.706 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.703 1.277 -15.338 1.00 0.00 H new ATOM 860 N SER A 58 22.510 2.318 -10.552 1.00 0.00 N ATOM 861 CA SER A 58 23.703 1.904 -9.801 1.00 0.00 C ATOM 862 C SER A 58 23.370 1.539 -8.346 1.00 0.00 C ATOM 863 O SER A 58 23.866 0.544 -7.820 1.00 0.00 O ATOM 864 CB SER A 58 24.734 3.045 -9.823 1.00 0.00 C ATOM 865 OG SER A 58 26.046 2.522 -9.691 1.00 0.00 O ATOM 0 H SER A 58 22.649 3.175 -11.088 1.00 0.00 H new ATOM 0 HA SER A 58 24.109 1.013 -10.279 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.649 3.604 -10.755 1.00 0.00 H new ATOM 0 HB3 SER A 58 24.530 3.745 -9.012 1.00 0.00 H new ATOM 0 HG SER A 58 26.694 3.257 -9.708 1.00 0.00 H new ATOM 871 N GLY A 59 22.479 2.304 -7.710 1.00 0.00 N ATOM 872 CA GLY A 59 22.088 2.147 -6.311 1.00 0.00 C ATOM 873 C GLY A 59 21.277 0.883 -5.994 1.00 0.00 C ATOM 874 O GLY A 59 20.804 0.753 -4.864 1.00 0.00 O ATOM 0 H GLY A 59 21.995 3.074 -8.172 1.00 0.00 H new ATOM 0 HA2 GLY A 59 22.989 2.144 -5.697 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.503 3.018 -6.014 1.00 0.00 H new ATOM 878 N GLN A 60 21.088 -0.040 -6.949 1.00 0.00 N ATOM 879 CA GLN A 60 20.346 -1.281 -6.737 1.00 0.00 C ATOM 880 C GLN A 60 20.966 -2.183 -5.670 1.00 0.00 C ATOM 881 O GLN A 60 20.241 -2.928 -5.011 1.00 0.00 O ATOM 882 CB GLN A 60 20.303 -2.095 -8.043 1.00 0.00 C ATOM 883 CG GLN A 60 18.915 -2.107 -8.687 1.00 0.00 C ATOM 884 CD GLN A 60 18.910 -3.130 -9.817 1.00 0.00 C ATOM 885 OE1 GLN A 60 18.629 -4.307 -9.615 1.00 0.00 O ATOM 886 NE2 GLN A 60 19.248 -2.706 -11.019 1.00 0.00 N ATOM 0 H GLN A 60 21.451 0.060 -7.897 1.00 0.00 H new ATOM 0 HA GLN A 60 19.353 -0.978 -6.406 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.023 -1.680 -8.749 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.612 -3.120 -7.838 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.157 -2.359 -7.946 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.668 -1.117 -9.072 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.478 -1.723 -11.167 1.00 0.00 H new ATOM 0 HE22 GLN A 60 19.279 -3.361 -11.801 1.00 0.00 H new ATOM 895 N THR A 61 22.292 -2.176 -5.556 1.00 0.00 N ATOM 896 CA THR A 61 23.036 -3.133 -4.751 1.00 0.00 C ATOM 897 C THR A 61 22.590 -3.036 -3.288 1.00 0.00 C ATOM 898 O THR A 61 22.666 -1.972 -2.663 1.00 0.00 O ATOM 899 CB THR A 61 24.544 -2.943 -4.991 1.00 0.00 C ATOM 900 OG1 THR A 61 24.864 -1.580 -5.243 1.00 0.00 O ATOM 901 CG2 THR A 61 24.973 -3.745 -6.218 1.00 0.00 C ATOM 0 H THR A 61 22.886 -1.494 -6.028 1.00 0.00 H new ATOM 0 HA THR A 61 22.820 -4.159 -5.049 1.00 0.00 H new ATOM 0 HB THR A 61 25.061 -3.280 -4.093 1.00 0.00 H new ATOM 0 HG1 THR A 61 25.772 -1.393 -4.925 1.00 0.00 H new ATOM 0 HG21 THR A 61 26.041 -3.609 -6.386 1.00 0.00 H new ATOM 0 HG22 THR A 61 24.763 -4.802 -6.053 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.421 -3.397 -7.091 1.00 0.00 H new ATOM 909 N SER A 62 22.075 -4.158 -2.780 1.00 0.00 N ATOM 910 CA SER A 62 21.380 -4.289 -1.512 1.00 0.00 C ATOM 911 C SER A 62 21.648 -5.699 -0.960 1.00 0.00 C ATOM 912 O SER A 62 22.487 -6.439 -1.487 1.00 0.00 O ATOM 913 CB SER A 62 19.875 -4.076 -1.792 1.00 0.00 C ATOM 914 OG SER A 62 19.583 -2.800 -2.335 1.00 0.00 O ATOM 0 H SER A 62 22.139 -5.047 -3.277 1.00 0.00 H new ATOM 0 HA SER A 62 21.719 -3.560 -0.776 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.528 -4.845 -2.482 1.00 0.00 H new ATOM 0 HB3 SER A 62 19.318 -4.205 -0.864 1.00 0.00 H new ATOM 0 HG SER A 62 19.832 -2.783 -3.283 1.00 0.00 H new ATOM 920 N ASP A 63 20.923 -6.079 0.092 1.00 0.00 N ATOM 921 CA ASP A 63 20.884 -7.443 0.620 1.00 0.00 C ATOM 922 C ASP A 63 20.502 -8.461 -0.468 1.00 0.00 C ATOM 923 O ASP A 63 19.793 -8.106 -1.420 1.00 0.00 O ATOM 924 CB ASP A 63 19.835 -7.529 1.732 1.00 0.00 C ATOM 925 CG ASP A 63 20.406 -7.109 3.093 1.00 0.00 C ATOM 926 OD1 ASP A 63 21.178 -7.893 3.694 1.00 0.00 O ATOM 927 OD2 ASP A 63 20.103 -5.983 3.558 1.00 0.00 O ATOM 0 H ASP A 63 20.332 -5.431 0.613 1.00 0.00 H new ATOM 0 HA ASP A 63 21.880 -7.678 0.996 1.00 0.00 H new ATOM 0 HB2 ASP A 63 18.988 -6.891 1.482 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.457 -8.549 1.796 1.00 0.00 H new ATOM 932 N PRO A 64 20.908 -9.738 -0.324 1.00 0.00 N ATOM 933 CA PRO A 64 20.442 -10.805 -1.195 1.00 0.00 C ATOM 934 C PRO A 64 18.942 -11.038 -0.991 1.00 0.00 C ATOM 935 O PRO A 64 18.396 -10.783 0.080 1.00 0.00 O ATOM 936 CB PRO A 64 21.272 -12.033 -0.806 1.00 0.00 C ATOM 937 CG PRO A 64 21.552 -11.802 0.679 1.00 0.00 C ATOM 938 CD PRO A 64 21.720 -10.285 0.756 1.00 0.00 C ATOM 0 HA PRO A 64 20.568 -10.570 -2.252 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.724 -12.960 -0.974 1.00 0.00 H new ATOM 0 HB3 PRO A 64 22.193 -12.098 -1.385 1.00 0.00 H new ATOM 0 HG2 PRO A 64 20.731 -12.151 1.305 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.449 -12.326 1.008 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.392 -9.904 1.723 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.766 -10.001 0.640 1.00 0.00 H new ATOM 946 N ILE A 65 18.283 -11.612 -1.992 1.00 0.00 N ATOM 947 CA ILE A 65 16.849 -11.886 -1.981 1.00 0.00 C ATOM 948 C ILE A 65 16.482 -12.845 -0.842 1.00 0.00 C ATOM 949 O ILE A 65 15.371 -12.810 -0.321 1.00 0.00 O ATOM 950 CB ILE A 65 16.452 -12.415 -3.377 1.00 0.00 C ATOM 951 CG1 ILE A 65 14.942 -12.284 -3.620 1.00 0.00 C ATOM 952 CG2 ILE A 65 16.962 -13.844 -3.649 1.00 0.00 C ATOM 953 CD1 ILE A 65 14.519 -12.599 -5.063 1.00 0.00 C ATOM 0 H ILE A 65 18.741 -11.907 -2.854 1.00 0.00 H new ATOM 0 HA ILE A 65 16.282 -10.976 -1.784 1.00 0.00 H new ATOM 0 HB ILE A 65 16.957 -11.778 -4.103 1.00 0.00 H new ATOM 0 HG12 ILE A 65 14.414 -12.954 -2.942 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.630 -11.269 -3.373 1.00 0.00 H new ATOM 0 HG21 ILE A 65 16.651 -14.158 -4.645 1.00 0.00 H new ATOM 0 HG22 ILE A 65 18.050 -13.860 -3.587 1.00 0.00 H new ATOM 0 HG23 ILE A 65 16.546 -14.526 -2.907 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.439 -12.485 -5.159 1.00 0.00 H new ATOM 0 HD12 ILE A 65 15.018 -11.912 -5.747 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.799 -13.623 -5.309 1.00 0.00 H new ATOM 965 N GLU A 66 17.445 -13.675 -0.428 1.00 0.00 N ATOM 966 CA GLU A 66 17.264 -14.716 0.576 1.00 0.00 C ATOM 967 C GLU A 66 17.015 -14.097 1.957 1.00 0.00 C ATOM 968 O GLU A 66 16.436 -14.724 2.848 1.00 0.00 O ATOM 969 CB GLU A 66 18.526 -15.593 0.669 1.00 0.00 C ATOM 970 CG GLU A 66 19.156 -15.921 -0.687 1.00 0.00 C ATOM 971 CD GLU A 66 20.303 -16.939 -0.543 1.00 0.00 C ATOM 972 OE1 GLU A 66 21.457 -16.523 -0.278 1.00 0.00 O ATOM 973 OE2 GLU A 66 20.057 -18.160 -0.692 1.00 0.00 O ATOM 0 H GLU A 66 18.396 -13.636 -0.795 1.00 0.00 H new ATOM 0 HA GLU A 66 16.406 -15.318 0.277 1.00 0.00 H new ATOM 0 HB2 GLU A 66 19.265 -15.084 1.288 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.273 -16.524 1.175 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.394 -16.321 -1.356 1.00 0.00 H new ATOM 0 HG3 GLU A 66 19.534 -15.007 -1.145 1.00 0.00 H new ATOM 980 N ASN A 67 17.503 -12.863 2.125 1.00 0.00 N ATOM 981 CA ASN A 67 17.341 -12.060 3.333 1.00 0.00 C ATOM 982 C ASN A 67 15.864 -11.733 3.619 1.00 0.00 C ATOM 983 O ASN A 67 15.514 -11.402 4.754 1.00 0.00 O ATOM 984 CB ASN A 67 18.142 -10.758 3.188 1.00 0.00 C ATOM 985 CG ASN A 67 18.385 -10.099 4.542 1.00 0.00 C ATOM 986 OD1 ASN A 67 17.689 -9.170 4.947 1.00 0.00 O ATOM 987 ND2 ASN A 67 19.392 -10.572 5.263 1.00 0.00 N ATOM 0 H ASN A 67 18.037 -12.385 1.400 1.00 0.00 H new ATOM 0 HA ASN A 67 17.714 -12.643 4.175 1.00 0.00 H new ATOM 0 HB2 ASN A 67 19.098 -10.969 2.708 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.604 -10.069 2.538 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.603 -10.164 6.174 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.956 -11.344 4.907 1.00 0.00 H new ATOM 994 N PHE A 68 15.000 -11.846 2.605 1.00 0.00 N ATOM 995 CA PHE A 68 13.573 -11.554 2.646 1.00 0.00 C ATOM 996 C PHE A 68 12.790 -12.810 2.276 1.00 0.00 C ATOM 997 O PHE A 68 13.362 -13.823 1.856 1.00 0.00 O ATOM 998 CB PHE A 68 13.220 -10.463 1.617 1.00 0.00 C ATOM 999 CG PHE A 68 14.139 -9.262 1.588 1.00 0.00 C ATOM 1000 CD1 PHE A 68 15.326 -9.329 0.842 1.00 0.00 C ATOM 1001 CD2 PHE A 68 13.816 -8.093 2.298 1.00 0.00 C ATOM 1002 CE1 PHE A 68 16.215 -8.240 0.825 1.00 0.00 C ATOM 1003 CE2 PHE A 68 14.687 -6.986 2.256 1.00 0.00 C ATOM 1004 CZ PHE A 68 15.888 -7.062 1.525 1.00 0.00 C ATOM 0 H PHE A 68 15.300 -12.162 1.683 1.00 0.00 H new ATOM 0 HA PHE A 68 13.319 -11.216 3.651 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.212 -10.915 0.625 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.206 -10.116 1.817 1.00 0.00 H new ATOM 0 HD1 PHE A 68 15.557 -10.221 0.279 1.00 0.00 H new ATOM 0 HD2 PHE A 68 12.904 -8.043 2.874 1.00 0.00 H new ATOM 0 HE1 PHE A 68 17.144 -8.306 0.278 1.00 0.00 H new ATOM 0 HE2 PHE A 68 14.433 -6.079 2.785 1.00 0.00 H new ATOM 0 HZ PHE A 68 16.559 -6.216 1.501 1.00 0.00 H new ATOM 1014 N ASN A 69 11.462 -12.733 2.390 1.00 0.00 N ATOM 1015 CA ASN A 69 10.540 -13.711 1.883 1.00 0.00 C ATOM 1016 C ASN A 69 9.515 -13.067 0.968 1.00 0.00 C ATOM 1017 O ASN A 69 9.135 -11.905 1.146 1.00 0.00 O ATOM 1018 CB ASN A 69 9.867 -14.490 3.003 1.00 0.00 C ATOM 1019 CG ASN A 69 8.876 -13.707 3.868 1.00 0.00 C ATOM 1020 OD1 ASN A 69 8.997 -12.503 4.070 1.00 0.00 O ATOM 1021 ND2 ASN A 69 7.905 -14.393 4.451 1.00 0.00 N ATOM 0 H ASN A 69 10.998 -11.954 2.857 1.00 0.00 H new ATOM 0 HA ASN A 69 11.115 -14.427 1.296 1.00 0.00 H new ATOM 0 HB2 ASN A 69 9.343 -15.339 2.563 1.00 0.00 H new ATOM 0 HB3 ASN A 69 10.643 -14.896 3.652 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.250 -13.921 5.074 1.00 0.00 H new ATOM 0 HD22 ASN A 69 7.812 -15.394 4.277 1.00 0.00 H new ATOM 1028 N ALA A 70 9.044 -13.831 -0.016 1.00 0.00 N ATOM 1029 CA ALA A 70 8.240 -13.277 -1.067 1.00 0.00 C ATOM 1030 C ALA A 70 6.840 -13.011 -0.550 1.00 0.00 C ATOM 1031 O ALA A 70 6.137 -12.176 -1.112 1.00 0.00 O ATOM 1032 CB ALA A 70 8.210 -14.211 -2.269 1.00 0.00 C ATOM 0 H ALA A 70 9.214 -14.834 -0.094 1.00 0.00 H new ATOM 0 HA ALA A 70 8.678 -12.333 -1.392 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.595 -13.773 -3.055 1.00 0.00 H new ATOM 0 HB2 ALA A 70 9.224 -14.358 -2.641 1.00 0.00 H new ATOM 0 HB3 ALA A 70 7.789 -15.172 -1.973 1.00 0.00 H new ATOM 1038 N ASP A 71 6.451 -13.705 0.526 1.00 0.00 N ATOM 1039 CA ASP A 71 5.132 -13.555 1.093 1.00 0.00 C ATOM 1040 C ASP A 71 4.909 -12.140 1.655 1.00 0.00 C ATOM 1041 O ASP A 71 3.765 -11.685 1.740 1.00 0.00 O ATOM 1042 CB ASP A 71 4.883 -14.618 2.164 1.00 0.00 C ATOM 1043 CG ASP A 71 3.468 -14.498 2.759 1.00 0.00 C ATOM 1044 OD1 ASP A 71 2.484 -14.827 2.055 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.337 -14.124 3.950 1.00 0.00 O ATOM 0 H ASP A 71 7.044 -14.376 1.014 1.00 0.00 H new ATOM 0 HA ASP A 71 4.409 -13.699 0.290 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.014 -15.610 1.731 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.623 -14.516 2.958 1.00 0.00 H new ATOM 1050 N ASP A 72 5.985 -11.422 2.008 1.00 0.00 N ATOM 1051 CA ASP A 72 5.898 -10.029 2.430 1.00 0.00 C ATOM 1052 C ASP A 72 5.696 -9.082 1.241 1.00 0.00 C ATOM 1053 O ASP A 72 5.086 -8.017 1.375 1.00 0.00 O ATOM 1054 CB ASP A 72 7.162 -9.611 3.180 1.00 0.00 C ATOM 1055 CG ASP A 72 7.010 -8.194 3.760 1.00 0.00 C ATOM 1056 OD1 ASP A 72 6.188 -8.009 4.691 1.00 0.00 O ATOM 1057 OD2 ASP A 72 7.728 -7.263 3.322 1.00 0.00 O ATOM 0 H ASP A 72 6.934 -11.795 2.007 1.00 0.00 H new ATOM 0 HA ASP A 72 5.032 -9.955 3.088 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.364 -10.318 3.984 1.00 0.00 H new ATOM 0 HB3 ASP A 72 8.018 -9.643 2.506 1.00 0.00 H new ATOM 1062 N TYR A 73 6.213 -9.479 0.078 1.00 0.00 N ATOM 1063 CA TYR A 73 6.129 -8.742 -1.166 1.00 0.00 C ATOM 1064 C TYR A 73 4.752 -8.919 -1.816 1.00 0.00 C ATOM 1065 O TYR A 73 3.951 -9.764 -1.404 1.00 0.00 O ATOM 1066 CB TYR A 73 7.296 -9.119 -2.100 1.00 0.00 C ATOM 1067 CG TYR A 73 8.593 -8.414 -1.749 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.275 -8.738 -0.561 1.00 0.00 C ATOM 1069 CD2 TYR A 73 9.099 -7.401 -2.590 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.426 -8.024 -0.184 1.00 0.00 C ATOM 1071 CE2 TYR A 73 10.249 -6.681 -2.219 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.915 -6.982 -1.005 1.00 0.00 C ATOM 1073 OH TYR A 73 12.019 -6.271 -0.629 1.00 0.00 O ATOM 0 H TYR A 73 6.720 -10.359 -0.018 1.00 0.00 H new ATOM 0 HA TYR A 73 6.231 -7.677 -0.956 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.453 -10.197 -2.058 1.00 0.00 H new ATOM 0 HB3 TYR A 73 7.024 -8.876 -3.127 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.912 -9.540 0.065 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.602 -7.177 -3.522 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.937 -8.272 0.734 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.625 -5.898 -2.860 1.00 0.00 H new ATOM 0 HH TYR A 73 12.656 -6.237 -1.373 1.00 0.00 H new ATOM 1083 N ASP A 74 4.458 -8.094 -2.831 1.00 0.00 N ATOM 1084 CA ASP A 74 3.191 -8.156 -3.566 1.00 0.00 C ATOM 1085 C ASP A 74 3.417 -8.543 -5.025 1.00 0.00 C ATOM 1086 O ASP A 74 2.664 -9.353 -5.568 1.00 0.00 O ATOM 1087 CB ASP A 74 2.459 -6.819 -3.480 1.00 0.00 C ATOM 1088 CG ASP A 74 1.116 -6.898 -4.221 1.00 0.00 C ATOM 1089 OD1 ASP A 74 0.130 -7.368 -3.605 1.00 0.00 O ATOM 1090 OD2 ASP A 74 1.035 -6.446 -5.388 1.00 0.00 O ATOM 0 H ASP A 74 5.092 -7.367 -3.163 1.00 0.00 H new ATOM 0 HA ASP A 74 2.573 -8.926 -3.104 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.291 -6.555 -2.436 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.075 -6.031 -3.913 1.00 0.00 H new ATOM 1095 N VAL A 75 4.472 -8.013 -5.653 1.00 0.00 N ATOM 1096 CA VAL A 75 4.705 -8.146 -7.077 1.00 0.00 C ATOM 1097 C VAL A 75 6.183 -8.426 -7.322 1.00 0.00 C ATOM 1098 O VAL A 75 7.069 -7.794 -6.742 1.00 0.00 O ATOM 1099 CB VAL A 75 4.172 -6.891 -7.810 1.00 0.00 C ATOM 1100 CG1 VAL A 75 4.257 -5.552 -7.056 1.00 0.00 C ATOM 1101 CG2 VAL A 75 4.777 -6.752 -9.216 1.00 0.00 C ATOM 0 H VAL A 75 5.192 -7.474 -5.171 1.00 0.00 H new ATOM 0 HA VAL A 75 4.157 -8.994 -7.488 1.00 0.00 H new ATOM 0 HB VAL A 75 3.103 -7.093 -7.876 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.851 -4.756 -7.681 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.682 -5.617 -6.132 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.298 -5.333 -6.820 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.378 -5.859 -9.697 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.861 -6.669 -9.139 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.522 -7.629 -9.810 1.00 0.00 H new ATOM 1111 N VAL A 76 6.459 -9.373 -8.211 1.00 0.00 N ATOM 1112 CA VAL A 76 7.805 -9.806 -8.511 1.00 0.00 C ATOM 1113 C VAL A 76 7.829 -10.110 -10.005 1.00 0.00 C ATOM 1114 O VAL A 76 6.894 -10.712 -10.540 1.00 0.00 O ATOM 1115 CB VAL A 76 8.136 -11.032 -7.651 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.496 -11.635 -8.031 1.00 0.00 C ATOM 1117 CG2 VAL A 76 8.142 -10.753 -6.132 1.00 0.00 C ATOM 0 H VAL A 76 5.742 -9.863 -8.746 1.00 0.00 H new ATOM 0 HA VAL A 76 8.559 -9.053 -8.283 1.00 0.00 H new ATOM 0 HB VAL A 76 7.330 -11.735 -7.861 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.698 -12.502 -7.402 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.478 -11.942 -9.077 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.278 -10.890 -7.885 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.384 -11.670 -5.595 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.888 -9.991 -5.905 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.158 -10.401 -5.823 1.00 0.00 H new ATOM 1127 N ILE A 77 8.890 -9.670 -10.674 1.00 0.00 N ATOM 1128 CA ILE A 77 8.995 -9.675 -12.117 1.00 0.00 C ATOM 1129 C ILE A 77 10.310 -10.336 -12.471 1.00 0.00 C ATOM 1130 O ILE A 77 11.365 -9.923 -11.975 1.00 0.00 O ATOM 1131 CB ILE A 77 8.970 -8.223 -12.635 1.00 0.00 C ATOM 1132 CG1 ILE A 77 7.709 -7.450 -12.192 1.00 0.00 C ATOM 1133 CG2 ILE A 77 9.186 -8.147 -14.158 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.389 -7.986 -12.757 1.00 0.00 C ATOM 0 H ILE A 77 9.717 -9.292 -10.211 1.00 0.00 H new ATOM 0 HA ILE A 77 8.165 -10.216 -12.572 1.00 0.00 H new ATOM 0 HB ILE A 77 9.816 -7.721 -12.166 1.00 0.00 H new ATOM 0 HG12 ILE A 77 7.654 -7.467 -11.103 1.00 0.00 H new ATOM 0 HG13 ILE A 77 7.817 -6.407 -12.489 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.160 -7.105 -14.478 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.154 -8.580 -14.410 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.397 -8.702 -14.666 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.562 -7.378 -12.389 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.415 -7.943 -13.846 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.250 -9.019 -12.438 1.00 0.00 H new ATOM 1146 N SER A 78 10.241 -11.336 -13.336 1.00 0.00 N ATOM 1147 CA SER A 78 11.424 -11.879 -13.942 1.00 0.00 C ATOM 1148 C SER A 78 11.684 -11.035 -15.183 1.00 0.00 C ATOM 1149 O SER A 78 10.785 -10.766 -15.982 1.00 0.00 O ATOM 1150 CB SER A 78 11.267 -13.358 -14.267 1.00 0.00 C ATOM 1151 OG SER A 78 11.402 -14.124 -13.082 1.00 0.00 O ATOM 0 H SER A 78 9.371 -11.782 -13.628 1.00 0.00 H new ATOM 0 HA SER A 78 12.274 -11.835 -13.261 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.292 -13.539 -14.720 1.00 0.00 H new ATOM 0 HB3 SER A 78 12.018 -13.662 -14.996 1.00 0.00 H new ATOM 0 HG SER A 78 10.607 -14.684 -12.962 1.00 0.00 H new ATOM 1157 N LEU A 79 12.926 -10.582 -15.339 1.00 0.00 N ATOM 1158 CA LEU A 79 13.370 -9.907 -16.557 1.00 0.00 C ATOM 1159 C LEU A 79 13.894 -10.922 -17.575 1.00 0.00 C ATOM 1160 O LEU A 79 14.152 -10.557 -18.720 1.00 0.00 O ATOM 1161 CB LEU A 79 14.380 -8.806 -16.200 1.00 0.00 C ATOM 1162 CG LEU A 79 13.751 -7.632 -15.424 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.889 -6.748 -14.917 1.00 0.00 C ATOM 1164 CD2 LEU A 79 12.813 -6.797 -16.300 1.00 0.00 C ATOM 0 H LEU A 79 13.651 -10.672 -14.627 1.00 0.00 H new ATOM 0 HA LEU A 79 12.528 -9.413 -17.041 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.183 -9.239 -15.603 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.833 -8.426 -17.116 1.00 0.00 H new ATOM 0 HG LEU A 79 13.155 -8.032 -14.604 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.476 -5.906 -14.362 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.538 -7.330 -14.263 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.466 -6.377 -15.764 1.00 0.00 H new ATOM 0 HD21 LEU A 79 12.394 -5.982 -15.710 1.00 0.00 H new ATOM 0 HD22 LEU A 79 13.371 -6.386 -17.142 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.006 -7.428 -16.673 1.00 0.00 H new ATOM 1176 N CYS A 80 14.094 -12.167 -17.139 1.00 0.00 N ATOM 1177 CA CYS A 80 14.354 -13.335 -17.952 1.00 0.00 C ATOM 1178 C CYS A 80 14.194 -14.567 -17.048 1.00 0.00 C ATOM 1179 O CYS A 80 14.511 -14.498 -15.856 1.00 0.00 O ATOM 1180 CB CYS A 80 15.734 -13.299 -18.643 1.00 0.00 C ATOM 1181 SG CYS A 80 17.125 -12.376 -17.907 1.00 0.00 S ATOM 0 H CYS A 80 14.076 -12.390 -16.144 1.00 0.00 H new ATOM 0 HA CYS A 80 13.640 -13.369 -18.775 1.00 0.00 H new ATOM 0 HB2 CYS A 80 16.061 -14.332 -18.758 1.00 0.00 H new ATOM 0 HB3 CYS A 80 15.580 -12.900 -19.645 1.00 0.00 H new ATOM 1186 N GLY A 81 13.759 -15.694 -17.619 1.00 0.00 N ATOM 1187 CA GLY A 81 13.666 -16.989 -16.947 1.00 0.00 C ATOM 1188 C GLY A 81 12.531 -17.091 -15.918 1.00 0.00 C ATOM 1189 O GLY A 81 11.943 -16.093 -15.503 1.00 0.00 O ATOM 0 H GLY A 81 13.453 -15.729 -18.591 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.529 -17.766 -17.699 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.613 -17.194 -16.447 1.00 0.00 H new ATOM 1193 N SER A 82 12.257 -18.321 -15.475 1.00 0.00 N ATOM 1194 CA SER A 82 11.233 -18.639 -14.480 1.00 0.00 C ATOM 1195 C SER A 82 11.795 -19.743 -13.579 1.00 0.00 C ATOM 1196 O SER A 82 12.032 -20.858 -14.049 1.00 0.00 O ATOM 1197 CB SER A 82 9.941 -19.092 -15.183 1.00 0.00 C ATOM 1198 OG SER A 82 9.455 -18.109 -16.091 1.00 0.00 O ATOM 0 H SER A 82 12.756 -19.145 -15.809 1.00 0.00 H new ATOM 0 HA SER A 82 10.984 -17.765 -13.879 1.00 0.00 H new ATOM 0 HB2 SER A 82 10.128 -20.022 -15.721 1.00 0.00 H new ATOM 0 HB3 SER A 82 9.177 -19.304 -14.435 1.00 0.00 H new ATOM 0 HG SER A 82 8.635 -18.435 -16.518 1.00 0.00 H new ATOM 1204 N GLY A 83 12.081 -19.421 -12.307 1.00 0.00 N ATOM 1205 CA GLY A 83 12.727 -20.350 -11.372 1.00 0.00 C ATOM 1206 C GLY A 83 14.110 -20.786 -11.875 1.00 0.00 C ATOM 1207 O GLY A 83 14.531 -21.916 -11.635 1.00 0.00 O ATOM 0 H GLY A 83 11.870 -18.510 -11.900 1.00 0.00 H new ATOM 0 HA2 GLY A 83 12.827 -19.874 -10.396 1.00 0.00 H new ATOM 0 HA3 GLY A 83 12.095 -21.228 -11.235 1.00 0.00 H new ATOM 1211 N VAL A 84 14.796 -19.901 -12.616 1.00 0.00 N ATOM 1212 CA VAL A 84 16.014 -20.229 -13.359 1.00 0.00 C ATOM 1213 C VAL A 84 17.182 -20.557 -12.411 1.00 0.00 C ATOM 1214 O VAL A 84 17.798 -21.618 -12.526 1.00 0.00 O ATOM 1215 CB VAL A 84 16.274 -19.116 -14.405 1.00 0.00 C ATOM 1216 CG1 VAL A 84 16.494 -17.707 -13.814 1.00 0.00 C ATOM 1217 CG2 VAL A 84 17.428 -19.457 -15.351 1.00 0.00 C ATOM 0 H VAL A 84 14.513 -18.926 -12.714 1.00 0.00 H new ATOM 0 HA VAL A 84 15.894 -21.152 -13.926 1.00 0.00 H new ATOM 0 HB VAL A 84 15.341 -19.080 -14.968 1.00 0.00 H new ATOM 0 HG11 VAL A 84 16.668 -16.997 -14.622 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.610 -17.407 -13.251 1.00 0.00 H new ATOM 0 HG13 VAL A 84 17.359 -17.721 -13.151 1.00 0.00 H new ATOM 0 HG21 VAL A 84 17.567 -18.644 -16.063 1.00 0.00 H new ATOM 0 HG22 VAL A 84 18.343 -19.595 -14.774 1.00 0.00 H new ATOM 0 HG23 VAL A 84 17.197 -20.376 -15.890 1.00 0.00 H new ATOM 1227 N ASN A 85 17.456 -19.672 -11.445 1.00 0.00 N ATOM 1228 CA ASN A 85 18.429 -19.871 -10.361 1.00 0.00 C ATOM 1229 C ASN A 85 17.985 -18.987 -9.187 1.00 0.00 C ATOM 1230 O ASN A 85 18.771 -18.258 -8.589 1.00 0.00 O ATOM 1231 CB ASN A 85 19.854 -19.541 -10.858 1.00 0.00 C ATOM 1232 CG ASN A 85 20.929 -19.871 -9.819 1.00 0.00 C ATOM 1233 OD1 ASN A 85 21.653 -18.999 -9.341 1.00 0.00 O ATOM 1234 ND2 ASN A 85 21.089 -21.142 -9.472 1.00 0.00 N ATOM 0 H ASN A 85 16.991 -18.766 -11.394 1.00 0.00 H new ATOM 0 HA ASN A 85 18.461 -20.909 -10.031 1.00 0.00 H new ATOM 0 HB2 ASN A 85 20.054 -20.099 -11.773 1.00 0.00 H new ATOM 0 HB3 ASN A 85 19.911 -18.482 -11.111 1.00 0.00 H new ATOM 0 HD21 ASN A 85 21.816 -21.401 -8.805 1.00 0.00 H new ATOM 0 HD22 ASN A 85 20.485 -21.860 -9.872 1.00 0.00 H new ATOM 1241 N LEU A 86 16.669 -18.969 -8.941 1.00 0.00 N ATOM 1242 CA LEU A 86 15.979 -18.054 -8.037 1.00 0.00 C ATOM 1243 C LEU A 86 14.780 -18.807 -7.427 1.00 0.00 C ATOM 1244 O LEU A 86 14.158 -19.576 -8.164 1.00 0.00 O ATOM 1245 CB LEU A 86 15.595 -16.810 -8.869 1.00 0.00 C ATOM 1246 CG LEU A 86 14.567 -15.873 -8.212 1.00 0.00 C ATOM 1247 CD1 LEU A 86 14.862 -14.394 -8.498 1.00 0.00 C ATOM 1248 CD2 LEU A 86 13.159 -16.159 -8.750 1.00 0.00 C ATOM 0 H LEU A 86 16.030 -19.625 -9.391 1.00 0.00 H new ATOM 0 HA LEU A 86 16.587 -17.713 -7.199 1.00 0.00 H new ATOM 0 HB2 LEU A 86 16.500 -16.240 -9.079 1.00 0.00 H new ATOM 0 HB3 LEU A 86 15.198 -17.143 -9.828 1.00 0.00 H new ATOM 0 HG LEU A 86 14.631 -16.060 -7.140 1.00 0.00 H new ATOM 0 HD11 LEU A 86 14.109 -13.772 -8.013 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.848 -14.138 -8.110 1.00 0.00 H new ATOM 0 HD13 LEU A 86 14.839 -14.220 -9.574 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.444 -15.487 -8.274 1.00 0.00 H new ATOM 0 HD22 LEU A 86 13.143 -16.002 -9.828 1.00 0.00 H new ATOM 0 HD23 LEU A 86 12.888 -17.192 -8.530 1.00 0.00 H new ATOM 1260 N PRO A 87 14.441 -18.632 -6.127 1.00 0.00 N ATOM 1261 CA PRO A 87 13.452 -19.498 -5.481 1.00 0.00 C ATOM 1262 C PRO A 87 12.016 -19.319 -6.005 1.00 0.00 C ATOM 1263 O PRO A 87 11.638 -18.211 -6.383 1.00 0.00 O ATOM 1264 CB PRO A 87 13.573 -19.275 -3.967 1.00 0.00 C ATOM 1265 CG PRO A 87 14.970 -18.676 -3.809 1.00 0.00 C ATOM 1266 CD PRO A 87 15.171 -17.889 -5.102 1.00 0.00 C ATOM 0 HA PRO A 87 13.670 -20.536 -5.730 1.00 0.00 H new ATOM 0 HB2 PRO A 87 12.802 -18.599 -3.597 1.00 0.00 H new ATOM 0 HB3 PRO A 87 13.471 -20.209 -3.414 1.00 0.00 H new ATOM 0 HG2 PRO A 87 15.033 -18.031 -2.933 1.00 0.00 H new ATOM 0 HG3 PRO A 87 15.727 -19.451 -3.689 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.789 -16.873 -5.007 1.00 0.00 H new ATOM 0 HD3 PRO A 87 16.229 -17.810 -5.353 1.00 0.00 H new ATOM 1274 N PRO A 88 11.173 -20.369 -5.988 1.00 0.00 N ATOM 1275 CA PRO A 88 9.876 -20.344 -6.659 1.00 0.00 C ATOM 1276 C PRO A 88 8.855 -19.420 -6.013 1.00 0.00 C ATOM 1277 O PRO A 88 8.050 -18.853 -6.743 1.00 0.00 O ATOM 1278 CB PRO A 88 9.407 -21.804 -6.706 1.00 0.00 C ATOM 1279 CG PRO A 88 10.114 -22.442 -5.511 1.00 0.00 C ATOM 1280 CD PRO A 88 11.450 -21.703 -5.472 1.00 0.00 C ATOM 0 HA PRO A 88 9.980 -19.921 -7.658 1.00 0.00 H new ATOM 0 HB2 PRO A 88 8.323 -21.881 -6.619 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.687 -22.286 -7.643 1.00 0.00 H new ATOM 0 HG2 PRO A 88 9.550 -22.306 -4.588 1.00 0.00 H new ATOM 0 HG3 PRO A 88 10.249 -23.515 -5.647 1.00 0.00 H new ATOM 0 HD2 PRO A 88 11.843 -21.657 -4.456 1.00 0.00 H new ATOM 0 HD3 PRO A 88 12.198 -22.212 -6.081 1.00 0.00 H new ATOM 1288 N GLU A 89 8.914 -19.182 -4.699 1.00 0.00 N ATOM 1289 CA GLU A 89 7.933 -18.317 -4.037 1.00 0.00 C ATOM 1290 C GLU A 89 7.962 -16.882 -4.589 1.00 0.00 C ATOM 1291 O GLU A 89 7.004 -16.124 -4.426 1.00 0.00 O ATOM 1292 CB GLU A 89 8.127 -18.350 -2.512 1.00 0.00 C ATOM 1293 CG GLU A 89 9.457 -17.751 -2.021 1.00 0.00 C ATOM 1294 CD GLU A 89 9.511 -17.710 -0.481 1.00 0.00 C ATOM 1295 OE1 GLU A 89 9.958 -18.705 0.139 1.00 0.00 O ATOM 1296 OE2 GLU A 89 9.113 -16.676 0.109 1.00 0.00 O ATOM 0 H GLU A 89 9.623 -19.572 -4.078 1.00 0.00 H new ATOM 0 HA GLU A 89 6.940 -18.709 -4.258 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.305 -17.809 -2.043 1.00 0.00 H new ATOM 0 HB3 GLU A 89 8.063 -19.384 -2.173 1.00 0.00 H new ATOM 0 HG2 GLU A 89 10.289 -18.343 -2.402 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.575 -16.743 -2.419 1.00 0.00 H new ATOM 1303 N TRP A 90 9.053 -16.514 -5.264 1.00 0.00 N ATOM 1304 CA TRP A 90 9.212 -15.215 -5.885 1.00 0.00 C ATOM 1305 C TRP A 90 8.398 -15.132 -7.167 1.00 0.00 C ATOM 1306 O TRP A 90 7.614 -14.202 -7.344 1.00 0.00 O ATOM 1307 CB TRP A 90 10.709 -14.972 -6.081 1.00 0.00 C ATOM 1308 CG TRP A 90 11.412 -14.742 -4.781 1.00 0.00 C ATOM 1309 CD1 TRP A 90 12.187 -15.620 -4.112 1.00 0.00 C ATOM 1310 CD2 TRP A 90 11.306 -13.582 -3.910 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.528 -15.101 -2.876 1.00 0.00 N ATOM 1312 CE2 TRP A 90 11.961 -13.857 -2.677 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.663 -12.339 -4.035 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 11.957 -12.941 -1.612 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.614 -11.432 -2.967 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.267 -11.723 -1.760 1.00 0.00 C ATOM 0 H TRP A 90 9.859 -17.126 -5.391 1.00 0.00 H new ATOM 0 HA TRP A 90 8.822 -14.418 -5.252 1.00 0.00 H new ATOM 0 HB2 TRP A 90 11.153 -15.830 -6.587 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.855 -14.109 -6.730 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.496 -16.585 -4.486 1.00 0.00 H new ATOM 0 HE1 TRP A 90 13.123 -15.577 -2.197 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.197 -12.077 -4.973 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.476 -13.168 -0.693 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.071 -10.505 -3.074 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.240 -11.014 -0.946 1.00 0.00 H new ATOM 1327 N VAL A 91 8.525 -16.125 -8.040 1.00 0.00 N ATOM 1328 CA VAL A 91 7.828 -16.156 -9.314 1.00 0.00 C ATOM 1329 C VAL A 91 6.350 -16.548 -9.164 1.00 0.00 C ATOM 1330 O VAL A 91 5.642 -16.618 -10.165 1.00 0.00 O ATOM 1331 CB VAL A 91 8.602 -16.996 -10.345 1.00 0.00 C ATOM 1332 CG1 VAL A 91 10.000 -16.404 -10.589 1.00 0.00 C ATOM 1333 CG2 VAL A 91 8.758 -18.472 -9.966 1.00 0.00 C ATOM 0 H VAL A 91 9.121 -16.937 -7.879 1.00 0.00 H new ATOM 0 HA VAL A 91 7.801 -15.141 -9.711 1.00 0.00 H new ATOM 0 HB VAL A 91 7.996 -16.957 -11.250 1.00 0.00 H new ATOM 0 HG11 VAL A 91 10.530 -17.013 -11.321 1.00 0.00 H new ATOM 0 HG12 VAL A 91 9.903 -15.386 -10.966 1.00 0.00 H new ATOM 0 HG13 VAL A 91 10.559 -16.393 -9.653 1.00 0.00 H new ATOM 0 HG21 VAL A 91 9.315 -18.991 -10.746 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.297 -18.550 -9.022 1.00 0.00 H new ATOM 0 HG23 VAL A 91 7.773 -18.926 -9.860 1.00 0.00 H new ATOM 1343 N THR A 92 5.852 -16.791 -7.946 1.00 0.00 N ATOM 1344 CA THR A 92 4.439 -17.074 -7.710 1.00 0.00 C ATOM 1345 C THR A 92 3.692 -15.970 -6.945 1.00 0.00 C ATOM 1346 O THR A 92 2.627 -16.239 -6.378 1.00 0.00 O ATOM 1347 CB THR A 92 4.329 -18.448 -7.025 1.00 0.00 C ATOM 1348 OG1 THR A 92 5.004 -18.433 -5.779 1.00 0.00 O ATOM 1349 CG2 THR A 92 4.943 -19.563 -7.872 1.00 0.00 C ATOM 0 H THR A 92 6.420 -16.796 -7.099 1.00 0.00 H new ATOM 0 HA THR A 92 3.932 -17.098 -8.675 1.00 0.00 H new ATOM 0 HB THR A 92 3.265 -18.643 -6.891 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.925 -19.312 -5.354 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.843 -20.514 -7.349 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.426 -19.619 -8.830 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.999 -19.352 -8.041 1.00 0.00 H new ATOM 1357 N GLN A 93 4.213 -14.733 -6.907 1.00 0.00 N ATOM 1358 CA GLN A 93 3.518 -13.644 -6.226 1.00 0.00 C ATOM 1359 C GLN A 93 2.210 -13.248 -6.934 1.00 0.00 C ATOM 1360 O GLN A 93 1.890 -13.786 -7.998 1.00 0.00 O ATOM 1361 CB GLN A 93 4.474 -12.472 -5.919 1.00 0.00 C ATOM 1362 CG GLN A 93 5.441 -12.835 -4.777 1.00 0.00 C ATOM 1363 CD GLN A 93 4.698 -13.374 -3.547 1.00 0.00 C ATOM 1364 OE1 GLN A 93 3.748 -12.764 -3.063 1.00 0.00 O ATOM 1365 NE2 GLN A 93 5.031 -14.576 -3.092 1.00 0.00 N ATOM 0 H GLN A 93 5.101 -14.470 -7.335 1.00 0.00 H new ATOM 0 HA GLN A 93 3.189 -14.007 -5.252 1.00 0.00 H new ATOM 0 HB2 GLN A 93 5.042 -12.217 -6.814 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.897 -11.589 -5.645 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.152 -13.583 -5.128 1.00 0.00 H new ATOM 0 HG3 GLN A 93 6.017 -11.954 -4.496 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.821 -15.075 -3.500 1.00 0.00 H new ATOM 0 HE22 GLN A 93 4.496 -15.001 -2.334 1.00 0.00 H new ATOM 1374 N GLU A 94 1.438 -12.330 -6.325 1.00 0.00 N ATOM 1375 CA GLU A 94 0.059 -11.996 -6.723 1.00 0.00 C ATOM 1376 C GLU A 94 -0.053 -11.667 -8.217 1.00 0.00 C ATOM 1377 O GLU A 94 -1.068 -11.960 -8.852 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.491 -10.839 -5.871 1.00 0.00 C ATOM 1379 CG GLU A 94 -0.544 -11.141 -4.364 1.00 0.00 C ATOM 1380 CD GLU A 94 -1.457 -12.339 -4.041 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -2.702 -12.175 -4.041 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -0.943 -13.453 -3.775 1.00 0.00 O ATOM 0 H GLU A 94 1.763 -11.788 -5.525 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.547 -12.884 -6.543 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.128 -9.956 -6.033 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.495 -10.592 -6.217 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.463 -11.346 -4.001 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -0.902 -10.260 -3.831 1.00 0.00 H new ATOM 1389 N ILE A 95 1.007 -11.085 -8.775 1.00 0.00 N ATOM 1390 CA ILE A 95 1.214 -10.914 -10.198 1.00 0.00 C ATOM 1391 C ILE A 95 2.644 -11.404 -10.423 1.00 0.00 C ATOM 1392 O ILE A 95 3.566 -11.014 -9.692 1.00 0.00 O ATOM 1393 CB ILE A 95 0.939 -9.469 -10.678 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.432 -9.278 -12.135 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.572 -8.436 -9.733 1.00 0.00 C ATOM 1396 CD1 ILE A 95 0.859 -8.041 -12.847 1.00 0.00 C ATOM 0 H ILE A 95 1.773 -10.706 -8.218 1.00 0.00 H new ATOM 0 HA ILE A 95 0.507 -11.483 -10.802 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.138 -9.305 -10.660 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.520 -9.207 -12.130 1.00 0.00 H new ATOM 0 HG13 ILE A 95 1.173 -10.166 -12.712 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.361 -7.431 -10.098 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.155 -8.554 -8.733 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.651 -8.589 -9.696 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.258 -7.987 -13.860 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.228 -8.116 -12.888 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.140 -7.142 -12.298 1.00 0.00 H new ATOM 1408 N PHE A 96 2.813 -12.270 -11.417 1.00 0.00 N ATOM 1409 CA PHE A 96 4.107 -12.668 -11.920 1.00 0.00 C ATOM 1410 C PHE A 96 4.124 -12.279 -13.399 1.00 0.00 C ATOM 1411 O PHE A 96 3.112 -12.443 -14.087 1.00 0.00 O ATOM 1412 CB PHE A 96 4.374 -14.160 -11.732 1.00 0.00 C ATOM 1413 CG PHE A 96 5.674 -14.585 -12.393 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.885 -13.991 -11.990 1.00 0.00 C ATOM 1415 CD2 PHE A 96 5.672 -15.522 -13.446 1.00 0.00 C ATOM 1416 CE1 PHE A 96 8.081 -14.316 -12.644 1.00 0.00 C ATOM 1417 CE2 PHE A 96 6.877 -15.859 -14.089 1.00 0.00 C ATOM 1418 CZ PHE A 96 8.081 -15.258 -13.688 1.00 0.00 C ATOM 0 H PHE A 96 2.034 -12.719 -11.899 1.00 0.00 H new ATOM 0 HA PHE A 96 4.901 -12.168 -11.366 1.00 0.00 H new ATOM 0 HB2 PHE A 96 4.414 -14.391 -10.668 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.548 -14.733 -12.152 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.892 -13.283 -11.175 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.746 -15.981 -13.759 1.00 0.00 H new ATOM 0 HE1 PHE A 96 9.004 -13.842 -12.346 1.00 0.00 H new ATOM 0 HE2 PHE A 96 6.876 -16.581 -14.892 1.00 0.00 H new ATOM 0 HZ PHE A 96 9.006 -15.519 -14.181 1.00 0.00 H new ATOM 1428 N GLU A 97 5.259 -11.790 -13.891 1.00 0.00 N ATOM 1429 CA GLU A 97 5.499 -11.581 -15.310 1.00 0.00 C ATOM 1430 C GLU A 97 6.939 -12.012 -15.566 1.00 0.00 C ATOM 1431 O GLU A 97 7.808 -11.788 -14.715 1.00 0.00 O ATOM 1432 CB GLU A 97 5.320 -10.111 -15.735 1.00 0.00 C ATOM 1433 CG GLU A 97 3.908 -9.530 -15.566 1.00 0.00 C ATOM 1434 CD GLU A 97 2.862 -10.036 -16.585 1.00 0.00 C ATOM 1435 OE1 GLU A 97 3.107 -11.007 -17.346 1.00 0.00 O ATOM 1436 OE2 GLU A 97 1.757 -9.439 -16.633 1.00 0.00 O ATOM 0 H GLU A 97 6.049 -11.524 -13.303 1.00 0.00 H new ATOM 0 HA GLU A 97 4.777 -12.156 -15.889 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.015 -9.500 -15.159 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.607 -10.019 -16.783 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.555 -9.762 -14.561 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.968 -8.444 -15.640 1.00 0.00 H new ATOM 1443 N ASP A 98 7.189 -12.593 -16.735 1.00 0.00 N ATOM 1444 CA ASP A 98 8.529 -12.860 -17.236 1.00 0.00 C ATOM 1445 C ASP A 98 8.617 -12.083 -18.537 1.00 0.00 C ATOM 1446 O ASP A 98 7.980 -12.459 -19.529 1.00 0.00 O ATOM 1447 CB ASP A 98 8.806 -14.347 -17.451 1.00 0.00 C ATOM 1448 CG ASP A 98 10.114 -14.518 -18.247 1.00 0.00 C ATOM 1449 OD1 ASP A 98 11.103 -13.804 -17.963 1.00 0.00 O ATOM 1450 OD2 ASP A 98 10.147 -15.360 -19.179 1.00 0.00 O ATOM 0 H ASP A 98 6.451 -12.896 -17.371 1.00 0.00 H new ATOM 0 HA ASP A 98 9.284 -12.552 -16.512 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.884 -14.856 -16.490 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.978 -14.808 -17.989 1.00 0.00 H new ATOM 1455 N TRP A 99 9.309 -10.946 -18.513 1.00 0.00 N ATOM 1456 CA TRP A 99 9.277 -10.013 -19.627 1.00 0.00 C ATOM 1457 C TRP A 99 10.313 -10.384 -20.676 1.00 0.00 C ATOM 1458 O TRP A 99 11.480 -10.617 -20.353 1.00 0.00 O ATOM 1459 CB TRP A 99 9.470 -8.555 -19.176 1.00 0.00 C ATOM 1460 CG TRP A 99 8.344 -7.894 -18.437 1.00 0.00 C ATOM 1461 CD1 TRP A 99 8.503 -7.086 -17.366 1.00 0.00 C ATOM 1462 CD2 TRP A 99 6.907 -7.875 -18.731 1.00 0.00 C ATOM 1463 NE1 TRP A 99 7.281 -6.590 -16.962 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.261 -7.029 -17.776 1.00 0.00 C ATOM 1465 CE3 TRP A 99 6.078 -8.455 -19.719 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 4.881 -6.782 -17.799 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 4.688 -8.236 -19.732 1.00 0.00 C ATOM 1468 CH2 TRP A 99 4.087 -7.397 -18.780 1.00 0.00 C ATOM 0 H TRP A 99 9.897 -10.652 -17.733 1.00 0.00 H new ATOM 0 HA TRP A 99 8.284 -10.087 -20.070 1.00 0.00 H new ATOM 0 HB2 TRP A 99 10.355 -8.516 -18.541 1.00 0.00 H new ATOM 0 HB3 TRP A 99 9.686 -7.957 -20.061 1.00 0.00 H new ATOM 0 HD1 TRP A 99 9.449 -6.861 -16.895 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.149 -5.974 -16.160 1.00 0.00 H new ATOM 0 HE3 TRP A 99 6.521 -9.080 -20.480 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.433 -6.125 -17.069 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 4.078 -8.718 -20.481 1.00 0.00 H new ATOM 0 HH2 TRP A 99 3.021 -7.226 -18.802 1.00 0.00 H new ATOM 1479 N GLN A 100 9.899 -10.370 -21.947 1.00 0.00 N ATOM 1480 CA GLN A 100 10.824 -10.465 -23.063 1.00 0.00 C ATOM 1481 C GLN A 100 11.335 -9.034 -23.228 1.00 0.00 C ATOM 1482 O GLN A 100 10.617 -8.176 -23.754 1.00 0.00 O ATOM 1483 CB GLN A 100 10.106 -11.040 -24.300 1.00 0.00 C ATOM 1484 CG GLN A 100 11.057 -11.246 -25.494 1.00 0.00 C ATOM 1485 CD GLN A 100 10.367 -11.840 -26.732 1.00 0.00 C ATOM 1486 OE1 GLN A 100 9.154 -12.041 -26.782 1.00 0.00 O ATOM 1487 NE2 GLN A 100 11.133 -12.137 -27.773 1.00 0.00 N ATOM 0 H GLN A 100 8.920 -10.293 -22.222 1.00 0.00 H new ATOM 0 HA GLN A 100 11.659 -11.148 -22.909 1.00 0.00 H new ATOM 0 HB2 GLN A 100 9.646 -11.993 -24.038 1.00 0.00 H new ATOM 0 HB3 GLN A 100 9.301 -10.367 -24.594 1.00 0.00 H new ATOM 0 HG2 GLN A 100 11.504 -10.289 -25.761 1.00 0.00 H new ATOM 0 HG3 GLN A 100 11.871 -11.904 -25.191 1.00 0.00 H new ATOM 0 HE21 GLN A 100 12.138 -11.970 -27.731 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.717 -12.532 -28.616 1.00 0.00 H new ATOM 1496 N LEU A 101 12.526 -8.755 -22.702 1.00 0.00 N ATOM 1497 CA LEU A 101 13.188 -7.459 -22.783 1.00 0.00 C ATOM 1498 C LEU A 101 14.604 -7.700 -23.280 1.00 0.00 C ATOM 1499 O LEU A 101 15.296 -8.594 -22.789 1.00 0.00 O ATOM 1500 CB LEU A 101 13.193 -6.738 -21.411 1.00 0.00 C ATOM 1501 CG LEU A 101 11.990 -5.813 -21.159 1.00 0.00 C ATOM 1502 CD1 LEU A 101 11.997 -5.384 -19.685 1.00 0.00 C ATOM 1503 CD2 LEU A 101 11.944 -4.643 -22.160 1.00 0.00 C ATOM 0 H LEU A 101 13.073 -9.449 -22.192 1.00 0.00 H new ATOM 0 HA LEU A 101 12.650 -6.807 -23.470 1.00 0.00 H new ATOM 0 HB2 LEU A 101 13.226 -7.490 -20.622 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.107 -6.150 -21.329 1.00 0.00 H new ATOM 0 HG LEU A 101 11.059 -6.351 -21.339 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.148 -4.727 -19.493 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.924 -6.266 -19.049 1.00 0.00 H new ATOM 0 HD13 LEU A 101 12.923 -4.853 -19.465 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.079 -4.015 -21.946 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.854 -4.050 -22.069 1.00 0.00 H new ATOM 0 HD23 LEU A 101 11.866 -5.035 -23.174 1.00 0.00 H new ATOM 1515 N GLU A 102 15.021 -6.900 -24.257 1.00 0.00 N ATOM 1516 CA GLU A 102 16.390 -6.813 -24.732 1.00 0.00 C ATOM 1517 C GLU A 102 17.200 -5.996 -23.720 1.00 0.00 C ATOM 1518 O GLU A 102 16.626 -5.303 -22.875 1.00 0.00 O ATOM 1519 CB GLU A 102 16.403 -6.176 -26.132 1.00 0.00 C ATOM 1520 CG GLU A 102 15.750 -7.088 -27.182 1.00 0.00 C ATOM 1521 CD GLU A 102 15.466 -6.322 -28.481 1.00 0.00 C ATOM 1522 OE1 GLU A 102 14.486 -5.539 -28.502 1.00 0.00 O ATOM 1523 OE2 GLU A 102 16.211 -6.502 -29.477 1.00 0.00 O ATOM 0 H GLU A 102 14.389 -6.274 -24.755 1.00 0.00 H new ATOM 0 HA GLU A 102 16.842 -7.801 -24.818 1.00 0.00 H new ATOM 0 HB2 GLU A 102 15.876 -5.222 -26.102 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.431 -5.963 -26.425 1.00 0.00 H new ATOM 0 HG2 GLU A 102 16.405 -7.934 -27.391 1.00 0.00 H new ATOM 0 HG3 GLU A 102 14.820 -7.495 -26.786 1.00 0.00 H new ATOM 1530 N ASP A 103 18.528 -6.054 -23.805 1.00 0.00 N ATOM 1531 CA ASP A 103 19.429 -5.378 -22.886 1.00 0.00 C ATOM 1532 C ASP A 103 20.630 -4.801 -23.651 1.00 0.00 C ATOM 1533 O ASP A 103 21.107 -5.454 -24.584 1.00 0.00 O ATOM 1534 CB ASP A 103 19.863 -6.350 -21.788 1.00 0.00 C ATOM 1535 CG ASP A 103 20.743 -5.643 -20.765 1.00 0.00 C ATOM 1536 OD1 ASP A 103 21.965 -5.555 -20.977 1.00 0.00 O ATOM 1537 OD2 ASP A 103 20.213 -5.190 -19.729 1.00 0.00 O ATOM 0 H ASP A 103 19.013 -6.583 -24.530 1.00 0.00 H new ATOM 0 HA ASP A 103 18.915 -4.542 -22.411 1.00 0.00 H new ATOM 0 HB2 ASP A 103 18.985 -6.766 -21.295 1.00 0.00 H new ATOM 0 HB3 ASP A 103 20.407 -7.186 -22.228 1.00 0.00 H new ATOM 1542 N PRO A 104 21.103 -3.585 -23.321 1.00 0.00 N ATOM 1543 CA PRO A 104 22.135 -2.896 -24.087 1.00 0.00 C ATOM 1544 C PRO A 104 23.579 -3.291 -23.711 1.00 0.00 C ATOM 1545 O PRO A 104 24.504 -2.728 -24.295 1.00 0.00 O ATOM 1546 CB PRO A 104 21.860 -1.422 -23.827 1.00 0.00 C ATOM 1547 CG PRO A 104 21.400 -1.418 -22.372 1.00 0.00 C ATOM 1548 CD PRO A 104 20.540 -2.673 -22.326 1.00 0.00 C ATOM 0 HA PRO A 104 22.082 -3.166 -25.142 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.752 -0.812 -23.971 1.00 0.00 H new ATOM 0 HB3 PRO A 104 21.094 -1.029 -24.495 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.238 -1.468 -21.676 1.00 0.00 H new ATOM 0 HG3 PRO A 104 20.832 -0.522 -22.123 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.557 -3.121 -21.333 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.500 -2.441 -22.554 1.00 0.00 H new ATOM 1556 N ASP A 105 23.808 -4.211 -22.765 1.00 0.00 N ATOM 1557 CA ASP A 105 25.147 -4.677 -22.386 1.00 0.00 C ATOM 1558 C ASP A 105 25.968 -5.049 -23.625 1.00 0.00 C ATOM 1559 O ASP A 105 25.576 -5.922 -24.406 1.00 0.00 O ATOM 1560 CB ASP A 105 25.050 -5.893 -21.459 1.00 0.00 C ATOM 1561 CG ASP A 105 26.368 -6.686 -21.393 1.00 0.00 C ATOM 1562 OD1 ASP A 105 27.421 -6.117 -21.026 1.00 0.00 O ATOM 1563 OD2 ASP A 105 26.361 -7.903 -21.707 1.00 0.00 O ATOM 0 H ASP A 105 23.059 -4.658 -22.235 1.00 0.00 H new ATOM 0 HA ASP A 105 25.646 -3.862 -21.862 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.778 -5.562 -20.457 1.00 0.00 H new ATOM 0 HB3 ASP A 105 24.251 -6.549 -21.806 1.00 0.00 H new ATOM 1568 N GLY A 106 27.101 -4.364 -23.804 1.00 0.00 N ATOM 1569 CA GLY A 106 28.026 -4.583 -24.908 1.00 0.00 C ATOM 1570 C GLY A 106 27.484 -4.188 -26.290 1.00 0.00 C ATOM 1571 O GLY A 106 28.169 -4.432 -27.288 1.00 0.00 O ATOM 0 H GLY A 106 27.403 -3.626 -23.168 1.00 0.00 H new ATOM 0 HA2 GLY A 106 28.939 -4.019 -24.716 1.00 0.00 H new ATOM 0 HA3 GLY A 106 28.302 -5.637 -24.929 1.00 0.00 H new ATOM 1575 N GLN A 107 26.285 -3.600 -26.380 1.00 0.00 N ATOM 1576 CA GLN A 107 25.653 -3.206 -27.639 1.00 0.00 C ATOM 1577 C GLN A 107 25.959 -1.732 -27.955 1.00 0.00 C ATOM 1578 O GLN A 107 26.501 -0.995 -27.123 1.00 0.00 O ATOM 1579 CB GLN A 107 24.135 -3.475 -27.607 1.00 0.00 C ATOM 1580 CG GLN A 107 23.746 -4.899 -27.161 1.00 0.00 C ATOM 1581 CD GLN A 107 22.624 -5.534 -27.990 1.00 0.00 C ATOM 1582 OE1 GLN A 107 22.694 -5.608 -29.216 1.00 0.00 O ATOM 1583 NE2 GLN A 107 21.573 -6.025 -27.350 1.00 0.00 N ATOM 0 H GLN A 107 25.718 -3.382 -25.561 1.00 0.00 H new ATOM 0 HA GLN A 107 26.072 -3.815 -28.440 1.00 0.00 H new ATOM 0 HB2 GLN A 107 23.666 -2.757 -26.935 1.00 0.00 H new ATOM 0 HB3 GLN A 107 23.726 -3.295 -28.601 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.628 -5.538 -27.214 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.437 -4.869 -26.116 1.00 0.00 H new ATOM 0 HE21 GLN A 107 21.519 -5.961 -26.333 1.00 0.00 H new ATOM 0 HE22 GLN A 107 20.817 -6.467 -27.874 1.00 0.00 H new ATOM 1592 N SER A 108 25.595 -1.299 -29.164 1.00 0.00 N ATOM 1593 CA SER A 108 25.764 0.073 -29.632 1.00 0.00 C ATOM 1594 C SER A 108 24.832 1.024 -28.866 1.00 0.00 C ATOM 1595 O SER A 108 23.817 0.603 -28.306 1.00 0.00 O ATOM 1596 CB SER A 108 25.517 0.111 -31.149 1.00 0.00 C ATOM 1597 OG SER A 108 26.288 -0.889 -31.809 1.00 0.00 O ATOM 0 H SER A 108 25.165 -1.909 -29.859 1.00 0.00 H new ATOM 0 HA SER A 108 26.781 0.414 -29.439 1.00 0.00 H new ATOM 0 HB2 SER A 108 24.458 -0.045 -31.354 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.776 1.095 -31.540 1.00 0.00 H new ATOM 0 HG SER A 108 26.117 -0.851 -32.773 1.00 0.00 H new ATOM 1603 N LEU A 109 25.148 2.326 -28.867 1.00 0.00 N ATOM 1604 CA LEU A 109 24.491 3.328 -28.020 1.00 0.00 C ATOM 1605 C LEU A 109 22.986 3.419 -28.295 1.00 0.00 C ATOM 1606 O LEU A 109 22.199 3.618 -27.376 1.00 0.00 O ATOM 1607 CB LEU A 109 25.199 4.684 -28.209 1.00 0.00 C ATOM 1608 CG LEU A 109 24.961 5.673 -27.053 1.00 0.00 C ATOM 1609 CD1 LEU A 109 25.616 5.201 -25.747 1.00 0.00 C ATOM 1610 CD2 LEU A 109 25.526 7.044 -27.430 1.00 0.00 C ATOM 0 H LEU A 109 25.877 2.717 -29.464 1.00 0.00 H new ATOM 0 HA LEU A 109 24.580 3.024 -26.977 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.270 4.513 -28.314 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.856 5.137 -29.139 1.00 0.00 H new ATOM 0 HG LEU A 109 23.885 5.734 -26.887 1.00 0.00 H new ATOM 0 HD11 LEU A 109 25.423 5.929 -24.959 1.00 0.00 H new ATOM 0 HD12 LEU A 109 25.200 4.236 -25.459 1.00 0.00 H new ATOM 0 HD13 LEU A 109 26.692 5.103 -25.894 1.00 0.00 H new ATOM 0 HD21 LEU A 109 25.358 7.744 -26.612 1.00 0.00 H new ATOM 0 HD22 LEU A 109 26.596 6.957 -27.619 1.00 0.00 H new ATOM 0 HD23 LEU A 109 25.027 7.409 -28.328 1.00 0.00 H new ATOM 1622 N GLU A 110 22.573 3.178 -29.540 1.00 0.00 N ATOM 1623 CA GLU A 110 21.178 3.134 -29.993 1.00 0.00 C ATOM 1624 C GLU A 110 20.333 2.165 -29.164 1.00 0.00 C ATOM 1625 O GLU A 110 19.165 2.437 -28.876 1.00 0.00 O ATOM 1626 CB GLU A 110 21.116 2.738 -31.483 1.00 0.00 C ATOM 1627 CG GLU A 110 22.034 1.585 -31.925 1.00 0.00 C ATOM 1628 CD GLU A 110 21.859 1.273 -33.422 1.00 0.00 C ATOM 1629 OE1 GLU A 110 20.973 0.457 -33.777 1.00 0.00 O ATOM 1630 OE2 GLU A 110 22.618 1.827 -34.255 1.00 0.00 O ATOM 0 H GLU A 110 23.232 2.999 -30.298 1.00 0.00 H new ATOM 0 HA GLU A 110 20.762 4.133 -29.859 1.00 0.00 H new ATOM 0 HB2 GLU A 110 20.088 2.466 -31.721 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.360 3.617 -32.080 1.00 0.00 H new ATOM 0 HG2 GLU A 110 23.073 1.847 -31.725 1.00 0.00 H new ATOM 0 HG3 GLU A 110 21.811 0.694 -31.337 1.00 0.00 H new ATOM 1637 N VAL A 111 20.923 1.051 -28.739 1.00 0.00 N ATOM 1638 CA VAL A 111 20.209 -0.015 -28.052 1.00 0.00 C ATOM 1639 C VAL A 111 19.824 0.462 -26.656 1.00 0.00 C ATOM 1640 O VAL A 111 18.703 0.213 -26.232 1.00 0.00 O ATOM 1641 CB VAL A 111 21.045 -1.308 -28.073 1.00 0.00 C ATOM 1642 CG1 VAL A 111 20.298 -2.512 -27.483 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.469 -1.636 -29.520 1.00 0.00 C ATOM 0 H VAL A 111 21.918 0.864 -28.864 1.00 0.00 H new ATOM 0 HA VAL A 111 19.279 -0.260 -28.564 1.00 0.00 H new ATOM 0 HB VAL A 111 21.919 -1.126 -27.448 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.938 -3.393 -27.525 1.00 0.00 H new ATOM 0 HG12 VAL A 111 20.035 -2.304 -26.446 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.390 -2.695 -28.058 1.00 0.00 H new ATOM 0 HG21 VAL A 111 22.060 -2.552 -29.527 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.581 -1.772 -30.137 1.00 0.00 H new ATOM 0 HG23 VAL A 111 22.066 -0.816 -29.919 1.00 0.00 H new ATOM 1653 N PHE A 112 20.674 1.229 -25.969 1.00 0.00 N ATOM 1654 CA PHE A 112 20.310 1.852 -24.698 1.00 0.00 C ATOM 1655 C PHE A 112 19.066 2.725 -24.858 1.00 0.00 C ATOM 1656 O PHE A 112 18.101 2.563 -24.118 1.00 0.00 O ATOM 1657 CB PHE A 112 21.470 2.706 -24.163 1.00 0.00 C ATOM 1658 CG PHE A 112 22.696 1.934 -23.726 1.00 0.00 C ATOM 1659 CD1 PHE A 112 23.686 1.592 -24.663 1.00 0.00 C ATOM 1660 CD2 PHE A 112 22.847 1.544 -22.384 1.00 0.00 C ATOM 1661 CE1 PHE A 112 24.813 0.853 -24.272 1.00 0.00 C ATOM 1662 CE2 PHE A 112 23.960 0.779 -21.992 1.00 0.00 C ATOM 1663 CZ PHE A 112 24.943 0.431 -22.937 1.00 0.00 C ATOM 0 H PHE A 112 21.625 1.433 -26.276 1.00 0.00 H new ATOM 0 HA PHE A 112 20.094 1.055 -23.986 1.00 0.00 H new ATOM 0 HB2 PHE A 112 21.764 3.415 -24.937 1.00 0.00 H new ATOM 0 HB3 PHE A 112 21.109 3.290 -23.317 1.00 0.00 H new ATOM 0 HD1 PHE A 112 23.579 1.900 -25.692 1.00 0.00 H new ATOM 0 HD2 PHE A 112 22.107 1.832 -21.652 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.578 0.609 -24.994 1.00 0.00 H new ATOM 0 HE2 PHE A 112 24.060 0.459 -20.966 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.796 -0.159 -22.637 1.00 0.00 H new ATOM 1673 N ARG A 113 19.055 3.616 -25.856 1.00 0.00 N ATOM 1674 CA ARG A 113 17.951 4.576 -26.027 1.00 0.00 C ATOM 1675 C ARG A 113 16.661 3.825 -26.389 1.00 0.00 C ATOM 1676 O ARG A 113 15.596 4.150 -25.875 1.00 0.00 O ATOM 1677 CB ARG A 113 18.263 5.674 -27.077 1.00 0.00 C ATOM 1678 CG ARG A 113 19.724 5.871 -27.520 1.00 0.00 C ATOM 1679 CD ARG A 113 20.756 6.310 -26.467 1.00 0.00 C ATOM 1680 NE ARG A 113 20.829 7.770 -26.235 1.00 0.00 N ATOM 1681 CZ ARG A 113 21.363 8.688 -27.056 1.00 0.00 C ATOM 1682 NH1 ARG A 113 21.752 8.384 -28.294 1.00 0.00 N ATOM 1683 NH2 ARG A 113 21.515 9.932 -26.628 1.00 0.00 N ATOM 0 H ARG A 113 19.793 3.695 -26.556 1.00 0.00 H new ATOM 0 HA ARG A 113 17.819 5.092 -25.076 1.00 0.00 H new ATOM 0 HB2 ARG A 113 17.672 5.459 -27.968 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.906 6.624 -26.680 1.00 0.00 H new ATOM 0 HG2 ARG A 113 20.069 4.932 -27.952 1.00 0.00 H new ATOM 0 HG3 ARG A 113 19.731 6.611 -28.320 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.521 5.818 -25.523 1.00 0.00 H new ATOM 0 HD3 ARG A 113 21.740 5.956 -26.775 1.00 0.00 H new ATOM 0 HE ARG A 113 20.432 8.114 -25.361 1.00 0.00 H new ATOM 0 HH11 ARG A 113 21.647 7.431 -28.642 1.00 0.00 H new ATOM 0 HH12 ARG A 113 22.154 9.104 -28.894 1.00 0.00 H new ATOM 0 HH21 ARG A 113 21.227 10.185 -25.683 1.00 0.00 H new ATOM 0 HH22 ARG A 113 21.920 10.637 -27.244 1.00 0.00 H new ATOM 1697 N THR A 114 16.770 2.776 -27.208 1.00 0.00 N ATOM 1698 CA THR A 114 15.683 1.878 -27.549 1.00 0.00 C ATOM 1699 C THR A 114 15.156 1.192 -26.287 1.00 0.00 C ATOM 1700 O THR A 114 13.951 1.193 -26.038 1.00 0.00 O ATOM 1701 CB THR A 114 16.250 0.885 -28.580 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.362 1.506 -29.848 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.431 -0.396 -28.692 1.00 0.00 C ATOM 0 H THR A 114 17.649 2.527 -27.662 1.00 0.00 H new ATOM 0 HA THR A 114 14.830 2.402 -27.980 1.00 0.00 H new ATOM 0 HB THR A 114 17.238 0.594 -28.222 1.00 0.00 H new ATOM 0 HG1 THR A 114 17.228 1.960 -29.915 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.883 -1.053 -29.435 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.410 -0.900 -27.726 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.413 -0.152 -28.996 1.00 0.00 H new ATOM 1711 N VAL A 115 16.040 0.620 -25.465 1.00 0.00 N ATOM 1712 CA VAL A 115 15.633 -0.203 -24.337 1.00 0.00 C ATOM 1713 C VAL A 115 14.981 0.668 -23.265 1.00 0.00 C ATOM 1714 O VAL A 115 14.079 0.174 -22.597 1.00 0.00 O ATOM 1715 CB VAL A 115 16.798 -1.115 -23.884 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.500 -1.872 -22.583 1.00 0.00 C ATOM 1717 CG2 VAL A 115 17.063 -2.188 -24.957 1.00 0.00 C ATOM 0 H VAL A 115 17.050 0.717 -25.567 1.00 0.00 H new ATOM 0 HA VAL A 115 14.851 -0.908 -24.620 1.00 0.00 H new ATOM 0 HB VAL A 115 17.651 -0.454 -23.728 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.356 -2.494 -22.320 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.310 -1.158 -21.782 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.622 -2.503 -22.722 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.884 -2.829 -24.636 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.166 -2.791 -25.098 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.327 -1.705 -25.898 1.00 0.00 H new ATOM 1727 N ARG A 116 15.294 1.969 -23.172 1.00 0.00 N ATOM 1728 CA ARG A 116 14.526 2.868 -22.305 1.00 0.00 C ATOM 1729 C ARG A 116 13.047 2.834 -22.705 1.00 0.00 C ATOM 1730 O ARG A 116 12.206 2.602 -21.846 1.00 0.00 O ATOM 1731 CB ARG A 116 15.068 4.316 -22.325 1.00 0.00 C ATOM 1732 CG ARG A 116 16.463 4.467 -21.691 1.00 0.00 C ATOM 1733 CD ARG A 116 16.748 5.890 -21.183 1.00 0.00 C ATOM 1734 NE ARG A 116 17.393 6.771 -22.186 1.00 0.00 N ATOM 1735 CZ ARG A 116 16.820 7.608 -23.064 1.00 0.00 C ATOM 1736 NH1 ARG A 116 15.498 7.669 -23.205 1.00 0.00 N ATOM 1737 NH2 ARG A 116 17.587 8.398 -23.807 1.00 0.00 N ATOM 0 H ARG A 116 16.060 2.414 -23.678 1.00 0.00 H new ATOM 0 HA ARG A 116 14.633 2.511 -21.281 1.00 0.00 H new ATOM 0 HB2 ARG A 116 15.109 4.664 -23.357 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.368 4.963 -21.797 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.555 3.767 -20.861 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.220 4.192 -22.425 1.00 0.00 H new ATOM 0 HD2 ARG A 116 15.810 6.345 -20.864 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.388 5.829 -20.303 1.00 0.00 H new ATOM 0 HE ARG A 116 18.412 6.736 -22.212 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.897 7.071 -22.638 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.086 8.314 -23.880 1.00 0.00 H new ATOM 0 HH21 ARG A 116 18.602 8.365 -23.707 1.00 0.00 H new ATOM 0 HH22 ARG A 116 17.161 9.038 -24.478 1.00 0.00 H new ATOM 1751 N GLY A 117 12.730 2.979 -23.993 1.00 0.00 N ATOM 1752 CA GLY A 117 11.351 2.972 -24.479 1.00 0.00 C ATOM 1753 C GLY A 117 10.665 1.630 -24.231 1.00 0.00 C ATOM 1754 O GLY A 117 9.576 1.595 -23.655 1.00 0.00 O ATOM 0 H GLY A 117 13.425 3.105 -24.729 1.00 0.00 H new ATOM 0 HA2 GLY A 117 10.788 3.764 -23.985 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.341 3.193 -25.546 1.00 0.00 H new ATOM 1758 N GLN A 118 11.323 0.518 -24.588 1.00 0.00 N ATOM 1759 CA GLN A 118 10.750 -0.820 -24.411 1.00 0.00 C ATOM 1760 C GLN A 118 10.468 -1.096 -22.942 1.00 0.00 C ATOM 1761 O GLN A 118 9.392 -1.567 -22.576 1.00 0.00 O ATOM 1762 CB GLN A 118 11.645 -1.914 -25.010 1.00 0.00 C ATOM 1763 CG GLN A 118 11.982 -1.666 -26.491 1.00 0.00 C ATOM 1764 CD GLN A 118 12.369 -2.941 -27.236 1.00 0.00 C ATOM 1765 OE1 GLN A 118 11.884 -3.205 -28.334 1.00 0.00 O ATOM 1766 NE2 GLN A 118 13.259 -3.744 -26.670 1.00 0.00 N ATOM 0 H GLN A 118 12.255 0.521 -25.002 1.00 0.00 H new ATOM 0 HA GLN A 118 9.806 -0.842 -24.956 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.570 -1.974 -24.437 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.147 -2.878 -24.912 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.122 -1.211 -26.982 1.00 0.00 H new ATOM 0 HG3 GLN A 118 12.802 -0.950 -26.557 1.00 0.00 H new ATOM 0 HE21 GLN A 118 13.651 -3.509 -25.758 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.552 -4.597 -27.146 1.00 0.00 H new ATOM 1775 N VAL A 119 11.434 -0.781 -22.088 1.00 0.00 N ATOM 1776 CA VAL A 119 11.309 -1.085 -20.665 1.00 0.00 C ATOM 1777 C VAL A 119 10.259 -0.179 -20.019 1.00 0.00 C ATOM 1778 O VAL A 119 9.448 -0.683 -19.244 1.00 0.00 O ATOM 1779 CB VAL A 119 12.683 -1.016 -19.980 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.560 -1.202 -18.471 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.585 -2.141 -20.495 1.00 0.00 C ATOM 0 H VAL A 119 12.305 -0.320 -22.351 1.00 0.00 H new ATOM 0 HA VAL A 119 10.954 -2.108 -20.536 1.00 0.00 H new ATOM 0 HB VAL A 119 13.102 -0.035 -20.205 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.549 -1.148 -18.016 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.927 -0.417 -18.058 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.116 -2.175 -18.259 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.556 -2.083 -20.003 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.125 -3.105 -20.277 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.717 -2.037 -21.572 1.00 0.00 H new ATOM 1791 N LYS A 120 10.213 1.112 -20.374 1.00 0.00 N ATOM 1792 CA LYS A 120 9.184 2.023 -19.875 1.00 0.00 C ATOM 1793 C LYS A 120 7.819 1.404 -20.138 1.00 0.00 C ATOM 1794 O LYS A 120 7.011 1.331 -19.223 1.00 0.00 O ATOM 1795 CB LYS A 120 9.286 3.375 -20.601 1.00 0.00 C ATOM 1796 CG LYS A 120 8.360 4.438 -19.986 1.00 0.00 C ATOM 1797 CD LYS A 120 8.406 5.739 -20.804 1.00 0.00 C ATOM 1798 CE LYS A 120 7.432 6.775 -20.222 1.00 0.00 C ATOM 1799 NZ LYS A 120 7.391 8.026 -21.029 1.00 0.00 N ATOM 0 H LYS A 120 10.882 1.547 -21.009 1.00 0.00 H new ATOM 0 HA LYS A 120 9.322 2.186 -18.806 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.316 3.728 -20.564 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.033 3.240 -21.653 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.338 4.061 -19.951 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.661 4.638 -18.958 1.00 0.00 H new ATOM 0 HD2 LYS A 120 9.419 6.142 -20.801 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.148 5.532 -21.843 1.00 0.00 H new ATOM 0 HE2 LYS A 120 6.432 6.344 -20.173 1.00 0.00 H new ATOM 0 HE3 LYS A 120 7.726 7.014 -19.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 6.721 8.695 -20.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 8.339 8.454 -21.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.085 7.804 -21.998 1.00 0.00 H new ATOM 1813 N GLU A 121 7.591 0.909 -21.351 1.00 0.00 N ATOM 1814 CA GLU A 121 6.297 0.388 -21.752 1.00 0.00 C ATOM 1815 C GLU A 121 5.920 -0.857 -20.934 1.00 0.00 C ATOM 1816 O GLU A 121 4.783 -0.946 -20.460 1.00 0.00 O ATOM 1817 CB GLU A 121 6.346 0.150 -23.264 1.00 0.00 C ATOM 1818 CG GLU A 121 5.014 -0.381 -23.805 1.00 0.00 C ATOM 1819 CD GLU A 121 5.031 -0.474 -25.342 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.455 -1.522 -25.886 1.00 0.00 O ATOM 1821 OE2 GLU A 121 4.608 0.498 -26.017 1.00 0.00 O ATOM 0 H GLU A 121 8.302 0.860 -22.081 1.00 0.00 H new ATOM 0 HA GLU A 121 5.500 1.101 -21.542 1.00 0.00 H new ATOM 0 HB2 GLU A 121 6.597 1.082 -23.770 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.140 -0.561 -23.494 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.813 -1.365 -23.381 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.203 0.274 -23.487 1.00 0.00 H new ATOM 1828 N ARG A 122 6.861 -1.786 -20.695 1.00 0.00 N ATOM 1829 CA ARG A 122 6.598 -2.959 -19.846 1.00 0.00 C ATOM 1830 C ARG A 122 6.213 -2.520 -18.434 1.00 0.00 C ATOM 1831 O ARG A 122 5.237 -3.013 -17.867 1.00 0.00 O ATOM 1832 CB ARG A 122 7.829 -3.886 -19.756 1.00 0.00 C ATOM 1833 CG ARG A 122 8.293 -4.571 -21.050 1.00 0.00 C ATOM 1834 CD ARG A 122 7.222 -5.421 -21.734 1.00 0.00 C ATOM 1835 NE ARG A 122 7.821 -6.293 -22.770 1.00 0.00 N ATOM 1836 CZ ARG A 122 7.158 -7.108 -23.604 1.00 0.00 C ATOM 1837 NH1 ARG A 122 5.834 -7.196 -23.561 1.00 0.00 N ATOM 1838 NH2 ARG A 122 7.845 -7.842 -24.475 1.00 0.00 N ATOM 0 H ARG A 122 7.806 -1.747 -21.076 1.00 0.00 H new ATOM 0 HA ARG A 122 5.776 -3.508 -20.306 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.663 -3.302 -19.366 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.613 -4.663 -19.022 1.00 0.00 H new ATOM 0 HG2 ARG A 122 8.634 -3.807 -21.749 1.00 0.00 H new ATOM 0 HG3 ARG A 122 9.152 -5.203 -20.824 1.00 0.00 H new ATOM 0 HD2 ARG A 122 6.708 -6.032 -20.992 1.00 0.00 H new ATOM 0 HD3 ARG A 122 6.472 -4.773 -22.188 1.00 0.00 H new ATOM 0 HE ARG A 122 8.837 -6.272 -22.858 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.307 -6.640 -22.888 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.343 -7.820 -24.201 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.863 -7.781 -24.503 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.354 -8.466 -25.115 1.00 0.00 H new ATOM 1852 N VAL A 123 6.980 -1.599 -17.862 1.00 0.00 N ATOM 1853 CA VAL A 123 6.787 -1.165 -16.486 1.00 0.00 C ATOM 1854 C VAL A 123 5.485 -0.352 -16.380 1.00 0.00 C ATOM 1855 O VAL A 123 4.745 -0.533 -15.415 1.00 0.00 O ATOM 1856 CB VAL A 123 8.056 -0.436 -16.028 1.00 0.00 C ATOM 1857 CG1 VAL A 123 7.928 0.107 -14.600 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.300 -1.348 -16.051 1.00 0.00 C ATOM 0 H VAL A 123 7.752 -1.133 -18.339 1.00 0.00 H new ATOM 0 HA VAL A 123 6.652 -2.002 -15.801 1.00 0.00 H new ATOM 0 HB VAL A 123 8.176 0.382 -16.738 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.851 0.615 -14.320 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.097 0.811 -14.552 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.745 -0.718 -13.912 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.171 -0.784 -15.718 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.141 -2.197 -15.386 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.468 -1.709 -17.066 1.00 0.00 H new ATOM 1868 N GLU A 124 5.140 0.477 -17.371 1.00 0.00 N ATOM 1869 CA GLU A 124 3.869 1.190 -17.411 1.00 0.00 C ATOM 1870 C GLU A 124 2.714 0.198 -17.417 1.00 0.00 C ATOM 1871 O GLU A 124 1.756 0.380 -16.672 1.00 0.00 O ATOM 1872 CB GLU A 124 3.757 2.096 -18.652 1.00 0.00 C ATOM 1873 CG GLU A 124 4.497 3.432 -18.518 1.00 0.00 C ATOM 1874 CD GLU A 124 4.207 4.362 -19.710 1.00 0.00 C ATOM 1875 OE1 GLU A 124 4.571 4.024 -20.861 1.00 0.00 O ATOM 1876 OE2 GLU A 124 3.616 5.449 -19.499 1.00 0.00 O ATOM 0 H GLU A 124 5.742 0.670 -18.171 1.00 0.00 H new ATOM 0 HA GLU A 124 3.823 1.818 -16.522 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.149 1.560 -19.517 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.704 2.294 -18.851 1.00 0.00 H new ATOM 0 HG2 GLU A 124 4.198 3.923 -17.592 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.569 3.249 -18.451 1.00 0.00 H new ATOM 1883 N ASN A 125 2.808 -0.859 -18.220 1.00 0.00 N ATOM 1884 CA ASN A 125 1.753 -1.858 -18.333 1.00 0.00 C ATOM 1885 C ASN A 125 1.540 -2.579 -16.998 1.00 0.00 C ATOM 1886 O ASN A 125 0.404 -2.723 -16.549 1.00 0.00 O ATOM 1887 CB ASN A 125 2.085 -2.860 -19.446 1.00 0.00 C ATOM 1888 CG ASN A 125 0.992 -3.919 -19.563 1.00 0.00 C ATOM 1889 OD1 ASN A 125 1.079 -4.991 -18.971 1.00 0.00 O ATOM 1890 ND2 ASN A 125 -0.060 -3.639 -20.316 1.00 0.00 N ATOM 0 H ASN A 125 3.619 -1.045 -18.810 1.00 0.00 H new ATOM 0 HA ASN A 125 0.824 -1.350 -18.592 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.192 -2.335 -20.395 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.042 -3.339 -19.237 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.814 -4.319 -20.411 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.116 -2.743 -20.801 1.00 0.00 H new ATOM 1897 N LEU A 126 2.628 -2.971 -16.330 1.00 0.00 N ATOM 1898 CA LEU A 126 2.604 -3.590 -15.015 1.00 0.00 C ATOM 1899 C LEU A 126 1.932 -2.674 -13.986 1.00 0.00 C ATOM 1900 O LEU A 126 1.056 -3.120 -13.251 1.00 0.00 O ATOM 1901 CB LEU A 126 4.059 -3.900 -14.614 1.00 0.00 C ATOM 1902 CG LEU A 126 4.230 -4.345 -13.158 1.00 0.00 C ATOM 1903 CD1 LEU A 126 3.442 -5.625 -12.879 1.00 0.00 C ATOM 1904 CD2 LEU A 126 5.715 -4.560 -12.893 1.00 0.00 C ATOM 0 H LEU A 126 3.571 -2.861 -16.704 1.00 0.00 H new ATOM 0 HA LEU A 126 2.020 -4.510 -15.045 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.445 -4.681 -15.268 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.668 -3.012 -14.784 1.00 0.00 H new ATOM 0 HG LEU A 126 3.841 -3.574 -12.493 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.581 -5.918 -11.838 1.00 0.00 H new ATOM 0 HD12 LEU A 126 2.383 -5.449 -13.068 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.799 -6.422 -13.531 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.858 -4.878 -11.860 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.097 -5.328 -13.565 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.254 -3.628 -13.064 1.00 0.00 H new ATOM 1916 N ILE A 127 2.319 -1.400 -13.932 1.00 0.00 N ATOM 1917 CA ILE A 127 1.764 -0.423 -13.003 1.00 0.00 C ATOM 1918 C ILE A 127 0.280 -0.264 -13.322 1.00 0.00 C ATOM 1919 O ILE A 127 -0.540 -0.346 -12.414 1.00 0.00 O ATOM 1920 CB ILE A 127 2.571 0.874 -13.164 1.00 0.00 C ATOM 1921 CG1 ILE A 127 3.947 0.624 -12.520 1.00 0.00 C ATOM 1922 CG2 ILE A 127 1.877 2.078 -12.510 1.00 0.00 C ATOM 1923 CD1 ILE A 127 4.958 1.711 -12.838 1.00 0.00 C ATOM 0 H ILE A 127 3.039 -1.014 -14.543 1.00 0.00 H new ATOM 0 HA ILE A 127 1.837 -0.729 -11.959 1.00 0.00 H new ATOM 0 HB ILE A 127 2.664 1.122 -14.221 1.00 0.00 H new ATOM 0 HG12 ILE A 127 3.828 0.551 -11.439 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.334 -0.336 -12.863 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.487 2.970 -12.651 1.00 0.00 H new ATOM 0 HG22 ILE A 127 0.901 2.229 -12.970 1.00 0.00 H new ATOM 0 HG23 ILE A 127 1.750 1.890 -11.444 1.00 0.00 H new ATOM 0 HD11 ILE A 127 5.907 1.477 -12.356 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.104 1.768 -13.917 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.590 2.669 -12.470 1.00 0.00 H new ATOM 1935 N ALA A 128 -0.081 -0.102 -14.597 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.468 0.019 -15.021 1.00 0.00 C ATOM 1937 C ALA A 128 -2.312 -1.208 -14.628 1.00 0.00 C ATOM 1938 O ALA A 128 -3.522 -1.068 -14.436 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.512 0.254 -16.534 1.00 0.00 C ATOM 0 H ALA A 128 0.589 -0.051 -15.365 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.909 0.871 -14.504 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.549 0.346 -16.858 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.974 1.171 -16.776 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -1.045 -0.587 -17.047 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.710 -2.402 -14.498 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.394 -3.572 -13.959 1.00 0.00 C ATOM 1947 C LYS A 129 -2.608 -3.424 -12.456 1.00 0.00 C ATOM 1948 O LYS A 129 -3.746 -3.510 -11.989 1.00 0.00 O ATOM 1949 CB LYS A 129 -1.650 -4.885 -14.262 1.00 0.00 C ATOM 1950 CG LYS A 129 -1.747 -5.324 -15.730 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.991 -6.649 -15.925 1.00 0.00 C ATOM 1952 CE LYS A 129 -1.117 -7.127 -17.380 1.00 0.00 C ATOM 1953 NZ LYS A 129 -0.670 -8.534 -17.560 1.00 0.00 N ATOM 0 H LYS A 129 -0.741 -2.575 -14.764 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.361 -3.627 -14.458 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.600 -4.767 -13.996 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -2.053 -5.675 -13.628 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.792 -5.445 -16.015 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -1.326 -4.555 -16.378 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.060 -6.517 -15.668 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.391 -7.406 -15.251 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -2.155 -7.036 -17.700 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.526 -6.477 -18.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.614 -8.753 -18.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.267 -8.659 -17.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -1.350 -9.175 -17.104 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.529 -3.232 -11.694 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.583 -3.313 -10.242 1.00 0.00 C ATOM 1969 C ILE A 130 -2.210 -2.103 -9.545 1.00 0.00 C ATOM 1970 O ILE A 130 -2.875 -2.280 -8.520 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.206 -3.674 -9.666 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.842 -2.561 -9.853 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.264 -5.013 -10.256 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.261 -2.940 -9.425 1.00 0.00 C ATOM 0 H ILE A 130 -0.604 -3.018 -12.066 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.278 -4.123 -10.020 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.316 -3.780 -8.587 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.860 -2.270 -10.903 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.527 -1.686 -9.285 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.241 -5.268 -9.846 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.452 -5.794 -10.000 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.336 -4.928 -11.340 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.929 -2.096 -9.593 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.264 -3.201 -8.367 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.602 -3.794 -10.010 1.00 0.00 H new ATOM 1986 N SER A 131 -1.989 -0.897 -10.057 1.00 0.00 N ATOM 1987 CA SER A 131 -2.321 0.359 -9.428 1.00 0.00 C ATOM 1988 C SER A 131 -3.621 0.901 -10.020 1.00 0.00 C ATOM 1989 O SER A 131 -4.625 0.974 -9.275 1.00 0.00 O ATOM 1990 CB SER A 131 -1.140 1.320 -9.566 1.00 0.00 C ATOM 1991 OG SER A 131 -0.023 0.798 -8.855 1.00 0.00 O ATOM 1992 OXT SER A 131 -3.652 1.235 -11.228 1.00 0.00 O ATOM 0 H SER A 131 -1.550 -0.772 -10.969 1.00 0.00 H new ATOM 0 HA SER A 131 -2.498 0.227 -8.361 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.886 1.454 -10.618 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.408 2.302 -9.175 1.00 0.00 H new ATOM 0 HG SER A 131 0.736 1.411 -8.943 1.00 0.00 H new