USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=30 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 43 HIS : no HE2:sc= -0.518 K(o=-0.52,f=-3!) USER MOD Set 1.2: A 45 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 33 THR OG1 : rot 155:sc= 0.949 USER MOD Set 2.2: A 73 TYR OH : rot 30:sc= 0.839 USER MOD Set 3.1: A 11 ASN : amide:sc= 1.01 K(o=1.3,f=-1.6) USER MOD Set 3.2: A 60 GLN : amide:sc= 0.258 K(o=1.3,f=0.6) USER MOD Set 4.1: A 5 MET CE :methyl 179:sc= -0.245 (180deg=-0.251) USER MOD Set 4.2: A 35 SER OG : rot -132:sc= 0.963 USER MOD Single : A 1 MET CE :methyl -149:sc= 0 (180deg=-0.123) USER MOD Single : A 1 MET N :NH3+ -104:sc= 0.0635 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 138:sc= 0.00868 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -173:sc= 1.29 (180deg=1.18) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0.121 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -0.0366 USER MOD Single : A 16 GLN : amide:sc= 2.69 K(o=2.7,f=-5.4!) USER MOD Single : A 17 MET CE :methyl 151:sc= -0.0683 (180deg=-0.502) USER MOD Single : A 23 LYS NZ :NH3+ -177:sc= 2.14 (180deg=2.09) USER MOD Single : A 24 THR OG1 : rot -130:sc= -0.0107 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 80:sc= 0.395 USER MOD Single : A 39 SER OG : rot 57:sc= 1.1 USER MOD Single : A 40 SER OG : rot -177:sc= 0.682 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 143:sc= -0.241 (180deg=-1.56) USER MOD Single : A 58 SER OG : rot 180:sc= 0.803 USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.0237 USER MOD Single : A 62 SER OG : rot 32:sc= 1.15 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.0589 K(o=0.059,f=-7.7!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 1.07 K(o=1.1,f=-1.1) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0328 USER MOD Single : A 93 GLN : amide:sc= 0.544 K(o=0.54,f=-0.52) USER MOD Single : A 100 GLN : amide:sc= 0.658 K(o=0.66,f=-4.3!) USER MOD Single : A 107 GLN : amide:sc= 0.97 K(o=0.97,f=-1.6!) USER MOD Single : A 108 SER OG : rot 180:sc= 0.0037 USER MOD Single : A 114 THR OG1 : rot 86:sc= 0.716 USER MOD Single : A 118 GLN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 129 LYS NZ :NH3+ 176:sc= 1.25 (180deg=1.21) USER MOD Single : A 131 SER OG : rot 180:sc=-0.00095 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.354 -0.583 0.937 1.00 0.00 N ATOM 2 CA MET A 1 1.716 -0.300 -0.488 1.00 0.00 C ATOM 3 C MET A 1 2.291 -1.560 -1.165 1.00 0.00 C ATOM 4 O MET A 1 2.835 -2.431 -0.488 1.00 0.00 O ATOM 5 CB MET A 1 2.619 0.965 -0.616 1.00 0.00 C ATOM 6 CG MET A 1 4.136 0.744 -0.482 1.00 0.00 C ATOM 7 SD MET A 1 5.106 2.233 -0.093 1.00 0.00 S ATOM 8 CE MET A 1 4.972 3.163 -1.647 1.00 0.00 C ATOM 0 H1 MET A 1 0.322 -0.678 1.021 1.00 0.00 H new ATOM 0 H2 MET A 1 1.809 -1.467 1.242 1.00 0.00 H new ATOM 0 H3 MET A 1 1.680 0.199 1.540 1.00 0.00 H new ATOM 0 HA MET A 1 0.809 -0.051 -1.038 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.426 1.425 -1.585 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.311 1.682 0.144 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.311 0.002 0.297 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.509 0.321 -1.415 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.874 3.756 -1.795 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.854 2.468 -2.478 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.107 3.824 -1.602 1.00 0.00 H new ATOM 18 N LYS A 2 2.174 -1.697 -2.495 1.00 0.00 N ATOM 19 CA LYS A 2 2.551 -2.943 -3.201 1.00 0.00 C ATOM 20 C LYS A 2 4.072 -2.987 -3.283 1.00 0.00 C ATOM 21 O LYS A 2 4.657 -2.037 -3.791 1.00 0.00 O ATOM 22 CB LYS A 2 1.873 -3.075 -4.590 1.00 0.00 C ATOM 23 CG LYS A 2 0.438 -2.506 -4.645 1.00 0.00 C ATOM 24 CD LYS A 2 -0.148 -2.517 -6.063 1.00 0.00 C ATOM 25 CE LYS A 2 -1.267 -1.469 -6.221 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.562 -1.895 -5.615 1.00 0.00 N ATOM 0 H LYS A 2 1.821 -0.962 -3.108 1.00 0.00 H new ATOM 0 HA LYS A 2 2.188 -3.805 -2.641 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.485 -2.562 -5.332 1.00 0.00 H new ATOM 0 HB3 LYS A 2 1.847 -4.128 -4.871 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -0.205 -3.089 -3.986 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.442 -1.484 -4.265 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.643 -2.318 -6.786 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.542 -3.508 -6.287 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.948 -0.534 -5.760 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.419 -1.266 -7.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -2.991 -1.092 -5.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -3.206 -2.219 -6.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.393 -2.672 -4.944 1.00 0.00 H new ATOM 40 N LYS A 3 4.729 -4.037 -2.793 1.00 0.00 N ATOM 41 CA LYS A 3 6.186 -4.155 -2.914 1.00 0.00 C ATOM 42 C LYS A 3 6.499 -4.938 -4.178 1.00 0.00 C ATOM 43 O LYS A 3 5.863 -5.964 -4.419 1.00 0.00 O ATOM 44 CB LYS A 3 6.841 -4.753 -1.669 1.00 0.00 C ATOM 45 CG LYS A 3 6.432 -4.043 -0.377 1.00 0.00 C ATOM 46 CD LYS A 3 7.244 -4.582 0.803 1.00 0.00 C ATOM 47 CE LYS A 3 6.793 -3.853 2.072 1.00 0.00 C ATOM 48 NZ LYS A 3 7.511 -4.350 3.274 1.00 0.00 N ATOM 0 H LYS A 3 4.281 -4.816 -2.310 1.00 0.00 H new ATOM 0 HA LYS A 3 6.619 -3.158 -2.993 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.575 -5.808 -1.597 1.00 0.00 H new ATOM 0 HB3 LYS A 3 7.925 -4.704 -1.776 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.592 -2.969 -0.477 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.368 -4.191 -0.193 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.093 -5.656 0.909 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.309 -4.425 0.634 1.00 0.00 H new ATOM 0 HE2 LYS A 3 6.969 -2.783 1.959 1.00 0.00 H new ATOM 0 HE3 LYS A 3 5.720 -3.987 2.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.099 -3.921 4.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.421 -5.385 3.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.517 -4.093 3.209 1.00 0.00 H new ATOM 62 N VAL A 4 7.464 -4.455 -4.950 1.00 0.00 N ATOM 63 CA VAL A 4 7.800 -4.885 -6.300 1.00 0.00 C ATOM 64 C VAL A 4 9.234 -5.415 -6.307 1.00 0.00 C ATOM 65 O VAL A 4 10.082 -4.905 -5.579 1.00 0.00 O ATOM 66 CB VAL A 4 7.670 -3.699 -7.287 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.378 -4.157 -8.722 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.608 -2.651 -6.928 1.00 0.00 C ATOM 0 H VAL A 4 8.073 -3.703 -4.628 1.00 0.00 H new ATOM 0 HA VAL A 4 7.114 -5.672 -6.614 1.00 0.00 H new ATOM 0 HB VAL A 4 8.651 -3.230 -7.208 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.297 -3.286 -9.372 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.188 -4.797 -9.072 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.441 -4.714 -8.743 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.601 -1.866 -7.684 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.627 -3.125 -6.889 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.840 -2.216 -5.956 1.00 0.00 H new ATOM 78 N MET A 5 9.523 -6.361 -7.193 1.00 0.00 N ATOM 79 CA MET A 5 10.865 -6.844 -7.516 1.00 0.00 C ATOM 80 C MET A 5 10.974 -7.060 -9.024 1.00 0.00 C ATOM 81 O MET A 5 9.988 -7.471 -9.634 1.00 0.00 O ATOM 82 CB MET A 5 11.169 -8.176 -6.816 1.00 0.00 C ATOM 83 CG MET A 5 11.101 -8.155 -5.288 1.00 0.00 C ATOM 84 SD MET A 5 12.381 -9.204 -4.548 1.00 0.00 S ATOM 85 CE MET A 5 12.228 -8.694 -2.824 1.00 0.00 C ATOM 0 H MET A 5 8.798 -6.835 -7.731 1.00 0.00 H new ATOM 0 HA MET A 5 11.580 -6.096 -7.174 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.467 -8.926 -7.182 1.00 0.00 H new ATOM 0 HB3 MET A 5 12.166 -8.501 -7.112 1.00 0.00 H new ATOM 0 HG2 MET A 5 11.218 -7.131 -4.932 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.118 -8.495 -4.962 1.00 0.00 H new ATOM 0 HE1 MET A 5 12.935 -9.256 -2.214 1.00 0.00 H new ATOM 0 HE2 MET A 5 12.442 -7.629 -2.739 1.00 0.00 H new ATOM 0 HE3 MET A 5 11.214 -8.889 -2.476 1.00 0.00 H new ATOM 95 N PHE A 6 12.160 -6.864 -9.607 1.00 0.00 N ATOM 96 CA PHE A 6 12.488 -7.177 -10.997 1.00 0.00 C ATOM 97 C PHE A 6 13.816 -7.918 -10.925 1.00 0.00 C ATOM 98 O PHE A 6 14.835 -7.301 -10.638 1.00 0.00 O ATOM 99 CB PHE A 6 12.622 -5.890 -11.829 1.00 0.00 C ATOM 100 CG PHE A 6 11.364 -5.060 -11.948 1.00 0.00 C ATOM 101 CD1 PHE A 6 11.045 -4.146 -10.928 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.531 -5.167 -13.077 1.00 0.00 C ATOM 103 CE1 PHE A 6 9.887 -3.363 -11.023 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.387 -4.358 -13.184 1.00 0.00 C ATOM 105 CZ PHE A 6 9.060 -3.462 -12.152 1.00 0.00 C ATOM 0 H PHE A 6 12.950 -6.466 -9.100 1.00 0.00 H new ATOM 0 HA PHE A 6 11.712 -7.772 -11.479 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.404 -5.272 -11.388 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.956 -6.159 -12.831 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.694 -4.047 -10.070 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.771 -5.870 -13.861 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.630 -2.682 -10.225 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.759 -4.425 -14.060 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.173 -2.850 -12.228 1.00 0.00 H new ATOM 115 N VAL A 7 13.828 -9.236 -11.120 1.00 0.00 N ATOM 116 CA VAL A 7 15.008 -10.049 -10.832 1.00 0.00 C ATOM 117 C VAL A 7 15.333 -10.986 -11.998 1.00 0.00 C ATOM 118 O VAL A 7 14.454 -11.576 -12.621 1.00 0.00 O ATOM 119 CB VAL A 7 14.769 -10.732 -9.458 1.00 0.00 C ATOM 120 CG1 VAL A 7 15.694 -11.926 -9.173 1.00 0.00 C ATOM 121 CG2 VAL A 7 14.942 -9.721 -8.309 1.00 0.00 C ATOM 0 H VAL A 7 13.032 -9.764 -11.477 1.00 0.00 H new ATOM 0 HA VAL A 7 15.914 -9.449 -10.743 1.00 0.00 H new ATOM 0 HB VAL A 7 13.747 -11.108 -9.513 1.00 0.00 H new ATOM 0 HG11 VAL A 7 15.459 -12.343 -8.194 1.00 0.00 H new ATOM 0 HG12 VAL A 7 15.548 -12.690 -9.937 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.732 -11.593 -9.186 1.00 0.00 H new ATOM 0 HG21 VAL A 7 14.770 -10.221 -7.356 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.954 -9.317 -8.329 1.00 0.00 H new ATOM 0 HG23 VAL A 7 14.224 -8.909 -8.428 1.00 0.00 H new ATOM 131 N CYS A 8 16.629 -11.102 -12.291 1.00 0.00 N ATOM 132 CA CYS A 8 17.253 -12.068 -13.189 1.00 0.00 C ATOM 133 C CYS A 8 18.698 -12.210 -12.688 1.00 0.00 C ATOM 134 O CYS A 8 19.215 -11.293 -12.049 1.00 0.00 O ATOM 135 CB CYS A 8 17.180 -11.567 -14.642 1.00 0.00 C ATOM 136 SG CYS A 8 18.041 -12.580 -15.878 1.00 0.00 S ATOM 0 H CYS A 8 17.318 -10.476 -11.875 1.00 0.00 H new ATOM 0 HA CYS A 8 16.750 -13.035 -13.186 1.00 0.00 H new ATOM 0 HB2 CYS A 8 16.131 -11.495 -14.928 1.00 0.00 H new ATOM 0 HB3 CYS A 8 17.591 -10.558 -14.678 1.00 0.00 H new ATOM 141 N LYS A 9 19.366 -13.334 -12.972 1.00 0.00 N ATOM 142 CA LYS A 9 20.670 -13.646 -12.365 1.00 0.00 C ATOM 143 C LYS A 9 21.805 -12.693 -12.760 1.00 0.00 C ATOM 144 O LYS A 9 22.793 -12.623 -12.036 1.00 0.00 O ATOM 145 CB LYS A 9 21.032 -15.125 -12.615 1.00 0.00 C ATOM 146 CG LYS A 9 21.258 -15.487 -14.098 1.00 0.00 C ATOM 147 CD LYS A 9 21.610 -16.974 -14.255 1.00 0.00 C ATOM 148 CE LYS A 9 21.840 -17.325 -15.733 1.00 0.00 C ATOM 149 NZ LYS A 9 22.218 -18.752 -15.923 1.00 0.00 N ATOM 0 H LYS A 9 19.026 -14.045 -13.619 1.00 0.00 H new ATOM 0 HA LYS A 9 20.556 -13.485 -11.293 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.935 -15.365 -12.054 1.00 0.00 H new ATOM 0 HB3 LYS A 9 20.234 -15.753 -12.218 1.00 0.00 H new ATOM 0 HG2 LYS A 9 20.360 -15.260 -14.672 1.00 0.00 H new ATOM 0 HG3 LYS A 9 22.061 -14.874 -14.507 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.506 -17.204 -13.678 1.00 0.00 H new ATOM 0 HD3 LYS A 9 20.805 -17.588 -13.851 1.00 0.00 H new ATOM 0 HE2 LYS A 9 20.933 -17.113 -16.300 1.00 0.00 H new ATOM 0 HE3 LYS A 9 22.625 -16.687 -16.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 22.363 -18.941 -16.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 23.098 -18.950 -15.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 21.458 -19.363 -15.562 1.00 0.00 H new ATOM 163 N ARG A 10 21.708 -11.972 -13.884 1.00 0.00 N ATOM 164 CA ARG A 10 22.802 -11.137 -14.400 1.00 0.00 C ATOM 165 C ARG A 10 22.305 -9.717 -14.645 1.00 0.00 C ATOM 166 O ARG A 10 22.057 -9.326 -15.782 1.00 0.00 O ATOM 167 CB ARG A 10 23.406 -11.822 -15.649 1.00 0.00 C ATOM 168 CG ARG A 10 24.806 -11.299 -16.038 1.00 0.00 C ATOM 169 CD ARG A 10 25.884 -11.482 -14.951 1.00 0.00 C ATOM 170 NE ARG A 10 25.948 -12.881 -14.478 1.00 0.00 N ATOM 171 CZ ARG A 10 26.118 -13.309 -13.218 1.00 0.00 C ATOM 172 NH1 ARG A 10 26.368 -12.458 -12.227 1.00 0.00 N ATOM 173 NH2 ARG A 10 26.034 -14.613 -12.959 1.00 0.00 N ATOM 0 H ARG A 10 20.868 -11.951 -14.463 1.00 0.00 H new ATOM 0 HA ARG A 10 23.606 -11.043 -13.670 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.468 -12.895 -15.468 1.00 0.00 H new ATOM 0 HB3 ARG A 10 22.729 -11.680 -16.492 1.00 0.00 H new ATOM 0 HG2 ARG A 10 25.132 -11.810 -16.944 1.00 0.00 H new ATOM 0 HG3 ARG A 10 24.729 -10.239 -16.280 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.855 -11.187 -15.348 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.669 -10.823 -14.110 1.00 0.00 H new ATOM 0 HE ARG A 10 25.852 -13.604 -15.191 1.00 0.00 H new ATOM 0 HH11 ARG A 10 26.434 -11.458 -12.418 1.00 0.00 H new ATOM 0 HH12 ARG A 10 26.494 -12.805 -11.276 1.00 0.00 H new ATOM 0 HH21 ARG A 10 25.843 -15.272 -13.714 1.00 0.00 H new ATOM 0 HH22 ARG A 10 26.161 -14.953 -12.006 1.00 0.00 H new ATOM 187 N ASN A 11 22.180 -8.939 -13.566 1.00 0.00 N ATOM 188 CA ASN A 11 21.791 -7.519 -13.585 1.00 0.00 C ATOM 189 C ASN A 11 22.496 -6.741 -14.697 1.00 0.00 C ATOM 190 O ASN A 11 21.844 -6.051 -15.481 1.00 0.00 O ATOM 191 CB ASN A 11 22.180 -6.888 -12.234 1.00 0.00 C ATOM 192 CG ASN A 11 21.888 -5.392 -12.137 1.00 0.00 C ATOM 193 OD1 ASN A 11 21.105 -4.825 -12.893 1.00 0.00 O ATOM 194 ND2 ASN A 11 22.513 -4.726 -11.182 1.00 0.00 N ATOM 0 H ASN A 11 22.351 -9.288 -12.623 1.00 0.00 H new ATOM 0 HA ASN A 11 20.717 -7.468 -13.764 1.00 0.00 H new ATOM 0 HB2 ASN A 11 21.645 -7.404 -11.437 1.00 0.00 H new ATOM 0 HB3 ASN A 11 23.244 -7.051 -12.062 1.00 0.00 H new ATOM 0 HD21 ASN A 11 22.348 -3.726 -11.065 1.00 0.00 H new ATOM 0 HD22 ASN A 11 23.161 -5.212 -10.562 1.00 0.00 H new ATOM 201 N SER A 12 23.816 -6.915 -14.790 1.00 0.00 N ATOM 202 CA SER A 12 24.722 -6.225 -15.700 1.00 0.00 C ATOM 203 C SER A 12 24.263 -6.280 -17.153 1.00 0.00 C ATOM 204 O SER A 12 24.484 -5.312 -17.882 1.00 0.00 O ATOM 205 CB SER A 12 26.123 -6.847 -15.565 1.00 0.00 C ATOM 206 OG SER A 12 26.055 -8.190 -15.092 1.00 0.00 O ATOM 0 H SER A 12 24.307 -7.582 -14.195 1.00 0.00 H new ATOM 0 HA SER A 12 24.736 -5.171 -15.422 1.00 0.00 H new ATOM 0 HB2 SER A 12 26.626 -6.826 -16.532 1.00 0.00 H new ATOM 0 HB3 SER A 12 26.723 -6.249 -14.880 1.00 0.00 H new ATOM 0 HG SER A 12 26.961 -8.557 -15.019 1.00 0.00 H new ATOM 212 N SER A 13 23.597 -7.365 -17.550 1.00 0.00 N ATOM 213 CA SER A 13 23.222 -7.624 -18.932 1.00 0.00 C ATOM 214 C SER A 13 21.714 -7.870 -19.077 1.00 0.00 C ATOM 215 O SER A 13 21.301 -8.452 -20.084 1.00 0.00 O ATOM 216 CB SER A 13 24.061 -8.791 -19.476 1.00 0.00 C ATOM 217 OG SER A 13 25.447 -8.613 -19.181 1.00 0.00 O ATOM 0 H SER A 13 23.300 -8.098 -16.906 1.00 0.00 H new ATOM 0 HA SER A 13 23.436 -6.738 -19.530 1.00 0.00 H new ATOM 0 HB2 SER A 13 23.711 -9.727 -19.041 1.00 0.00 H new ATOM 0 HB3 SER A 13 23.923 -8.869 -20.554 1.00 0.00 H new ATOM 0 HG SER A 13 25.957 -9.370 -19.537 1.00 0.00 H new ATOM 223 N ARG A 14 20.874 -7.491 -18.093 1.00 0.00 N ATOM 224 CA ARG A 14 19.428 -7.706 -18.223 1.00 0.00 C ATOM 225 C ARG A 14 18.542 -6.720 -17.470 1.00 0.00 C ATOM 226 O ARG A 14 17.657 -6.143 -18.094 1.00 0.00 O ATOM 227 CB ARG A 14 19.084 -9.148 -17.802 1.00 0.00 C ATOM 228 CG ARG A 14 17.734 -9.609 -18.330 1.00 0.00 C ATOM 229 CD ARG A 14 17.778 -9.977 -19.816 1.00 0.00 C ATOM 230 NE ARG A 14 16.605 -10.803 -20.063 1.00 0.00 N ATOM 231 CZ ARG A 14 16.312 -11.566 -21.119 1.00 0.00 C ATOM 232 NH1 ARG A 14 17.096 -11.600 -22.190 1.00 0.00 N ATOM 233 NH2 ARG A 14 15.215 -12.309 -21.071 1.00 0.00 N ATOM 0 H ARG A 14 21.166 -7.046 -17.223 1.00 0.00 H new ATOM 0 HA ARG A 14 19.206 -7.531 -19.276 1.00 0.00 H new ATOM 0 HB2 ARG A 14 19.860 -9.822 -18.164 1.00 0.00 H new ATOM 0 HB3 ARG A 14 19.086 -9.214 -16.714 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.399 -10.472 -17.755 1.00 0.00 H new ATOM 0 HG3 ARG A 14 16.999 -8.819 -18.177 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.763 -9.083 -20.439 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.693 -10.518 -20.056 1.00 0.00 H new ATOM 0 HE ARG A 14 15.905 -10.798 -19.321 1.00 0.00 H new ATOM 0 HH11 ARG A 14 17.945 -11.035 -22.219 1.00 0.00 H new ATOM 0 HH12 ARG A 14 16.850 -12.191 -22.984 1.00 0.00 H new ATOM 0 HH21 ARG A 14 14.620 -12.288 -20.242 1.00 0.00 H new ATOM 0 HH22 ARG A 14 14.966 -12.902 -21.863 1.00 0.00 H new ATOM 247 N SER A 15 18.705 -6.558 -16.152 1.00 0.00 N ATOM 248 CA SER A 15 17.730 -5.820 -15.345 1.00 0.00 C ATOM 249 C SER A 15 17.674 -4.338 -15.719 1.00 0.00 C ATOM 250 O SER A 15 16.605 -3.840 -16.067 1.00 0.00 O ATOM 251 CB SER A 15 17.958 -6.093 -13.854 1.00 0.00 C ATOM 252 OG SER A 15 18.214 -7.483 -13.691 1.00 0.00 O ATOM 0 H SER A 15 19.498 -6.926 -15.626 1.00 0.00 H new ATOM 0 HA SER A 15 16.730 -6.189 -15.573 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.798 -5.506 -13.484 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.083 -5.797 -13.275 1.00 0.00 H new ATOM 0 HG SER A 15 18.365 -7.679 -12.743 1.00 0.00 H new ATOM 258 N GLN A 16 18.824 -3.654 -15.683 1.00 0.00 N ATOM 259 CA GLN A 16 19.046 -2.317 -16.203 1.00 0.00 C ATOM 260 C GLN A 16 17.897 -1.376 -15.836 1.00 0.00 C ATOM 261 O GLN A 16 17.752 -1.050 -14.663 1.00 0.00 O ATOM 262 CB GLN A 16 19.458 -2.431 -17.696 1.00 0.00 C ATOM 263 CG GLN A 16 20.757 -1.684 -18.036 1.00 0.00 C ATOM 264 CD GLN A 16 22.033 -2.448 -17.659 1.00 0.00 C ATOM 265 OE1 GLN A 16 22.778 -2.044 -16.773 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.337 -3.542 -18.325 1.00 0.00 N ATOM 0 H GLN A 16 19.666 -4.049 -15.265 1.00 0.00 H new ATOM 0 HA GLN A 16 19.888 -1.817 -15.724 1.00 0.00 H new ATOM 0 HB2 GLN A 16 19.577 -3.484 -17.952 1.00 0.00 H new ATOM 0 HB3 GLN A 16 18.652 -2.041 -18.317 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.774 -1.474 -19.105 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.756 -0.723 -17.522 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.718 -3.879 -19.062 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.192 -4.053 -18.104 1.00 0.00 H new ATOM 275 N MET A 17 17.082 -0.930 -16.798 1.00 0.00 N ATOM 276 CA MET A 17 16.101 0.118 -16.548 1.00 0.00 C ATOM 277 C MET A 17 14.840 -0.360 -15.834 1.00 0.00 C ATOM 278 O MET A 17 14.028 0.486 -15.482 1.00 0.00 O ATOM 279 CB MET A 17 15.717 0.841 -17.859 1.00 0.00 C ATOM 280 CG MET A 17 16.702 1.940 -18.245 1.00 0.00 C ATOM 281 SD MET A 17 16.176 3.651 -17.934 1.00 0.00 S ATOM 282 CE MET A 17 16.148 3.729 -16.125 1.00 0.00 C ATOM 0 H MET A 17 17.086 -1.282 -17.755 1.00 0.00 H new ATOM 0 HA MET A 17 16.595 0.813 -15.869 1.00 0.00 H new ATOM 0 HB2 MET A 17 15.661 0.111 -18.667 1.00 0.00 H new ATOM 0 HB3 MET A 17 14.723 1.274 -17.751 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.634 1.767 -17.706 1.00 0.00 H new ATOM 0 HG3 MET A 17 16.925 1.840 -19.307 1.00 0.00 H new ATOM 0 HE1 MET A 17 16.355 4.749 -15.802 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.166 3.426 -15.763 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.906 3.059 -15.720 1.00 0.00 H new ATOM 292 N ALA A 18 14.632 -1.664 -15.643 1.00 0.00 N ATOM 293 CA ALA A 18 13.343 -2.176 -15.165 1.00 0.00 C ATOM 294 C ALA A 18 13.024 -1.647 -13.763 1.00 0.00 C ATOM 295 O ALA A 18 12.055 -0.912 -13.577 1.00 0.00 O ATOM 296 CB ALA A 18 13.339 -3.707 -15.238 1.00 0.00 C ATOM 0 H ALA A 18 15.335 -2.383 -15.811 1.00 0.00 H new ATOM 0 HA ALA A 18 12.545 -1.812 -15.812 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.381 -4.086 -14.883 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.494 -4.022 -16.270 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.140 -4.103 -14.614 1.00 0.00 H new ATOM 302 N GLU A 19 13.892 -1.925 -12.787 1.00 0.00 N ATOM 303 CA GLU A 19 13.712 -1.378 -11.440 1.00 0.00 C ATOM 304 C GLU A 19 13.928 0.147 -11.470 1.00 0.00 C ATOM 305 O GLU A 19 13.248 0.892 -10.751 1.00 0.00 O ATOM 306 CB GLU A 19 14.626 -2.120 -10.454 1.00 0.00 C ATOM 307 CG GLU A 19 16.089 -1.646 -10.371 1.00 0.00 C ATOM 308 CD GLU A 19 16.302 -0.502 -9.357 1.00 0.00 C ATOM 309 OE1 GLU A 19 16.017 -0.679 -8.151 1.00 0.00 O ATOM 310 OE2 GLU A 19 16.799 0.568 -9.772 1.00 0.00 O ATOM 0 H GLU A 19 14.715 -2.517 -12.901 1.00 0.00 H new ATOM 0 HA GLU A 19 12.693 -1.536 -11.087 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.187 -2.042 -9.459 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.626 -3.177 -10.721 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.722 -2.489 -10.095 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.413 -1.313 -11.357 1.00 0.00 H new ATOM 317 N GLY A 20 14.823 0.589 -12.373 1.00 0.00 N ATOM 318 CA GLY A 20 15.134 1.986 -12.637 1.00 0.00 C ATOM 319 C GLY A 20 13.877 2.812 -12.829 1.00 0.00 C ATOM 320 O GLY A 20 13.663 3.747 -12.074 1.00 0.00 O ATOM 0 H GLY A 20 15.364 -0.050 -12.955 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.714 2.393 -11.809 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.757 2.058 -13.528 1.00 0.00 H new ATOM 324 N PHE A 21 13.011 2.451 -13.774 1.00 0.00 N ATOM 325 CA PHE A 21 11.777 3.189 -14.004 1.00 0.00 C ATOM 326 C PHE A 21 10.735 2.936 -12.944 1.00 0.00 C ATOM 327 O PHE A 21 9.892 3.805 -12.732 1.00 0.00 O ATOM 328 CB PHE A 21 11.169 2.827 -15.354 1.00 0.00 C ATOM 329 CG PHE A 21 11.729 3.650 -16.471 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.578 5.051 -16.450 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.403 3.011 -17.514 1.00 0.00 C ATOM 332 CE1 PHE A 21 12.101 5.811 -17.511 1.00 0.00 C ATOM 333 CE2 PHE A 21 12.927 3.770 -18.564 1.00 0.00 C ATOM 334 CZ PHE A 21 12.768 5.168 -18.572 1.00 0.00 C ATOM 0 H PHE A 21 13.144 1.650 -14.392 1.00 0.00 H new ATOM 0 HA PHE A 21 12.057 4.242 -13.975 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.348 1.772 -15.559 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.089 2.964 -15.311 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.068 5.534 -15.630 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.519 1.937 -17.509 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.992 6.885 -17.512 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.455 3.283 -19.370 1.00 0.00 H new ATOM 0 HZ PHE A 21 13.158 5.750 -19.394 1.00 0.00 H new ATOM 344 N ALA A 22 10.729 1.771 -12.301 1.00 0.00 N ATOM 345 CA ALA A 22 9.632 1.457 -11.399 1.00 0.00 C ATOM 346 C ALA A 22 9.623 2.381 -10.184 1.00 0.00 C ATOM 347 O ALA A 22 8.542 2.747 -9.734 1.00 0.00 O ATOM 348 CB ALA A 22 9.688 -0.024 -11.035 1.00 0.00 C ATOM 0 H ALA A 22 11.447 1.052 -12.384 1.00 0.00 H new ATOM 0 HA ALA A 22 8.681 1.638 -11.901 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.867 -0.264 -10.359 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.600 -0.625 -11.940 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.637 -0.243 -10.546 1.00 0.00 H new ATOM 354 N LYS A 23 10.783 2.866 -9.716 1.00 0.00 N ATOM 355 CA LYS A 23 10.779 3.911 -8.672 1.00 0.00 C ATOM 356 C LYS A 23 10.129 5.214 -9.163 1.00 0.00 C ATOM 357 O LYS A 23 9.500 5.910 -8.375 1.00 0.00 O ATOM 358 CB LYS A 23 12.206 4.145 -8.127 1.00 0.00 C ATOM 359 CG LYS A 23 13.078 4.963 -9.100 1.00 0.00 C ATOM 360 CD LYS A 23 14.602 4.810 -8.976 1.00 0.00 C ATOM 361 CE LYS A 23 15.053 3.342 -9.078 1.00 0.00 C ATOM 362 NZ LYS A 23 16.529 3.170 -8.977 1.00 0.00 N ATOM 0 H LYS A 23 11.707 2.567 -10.028 1.00 0.00 H new ATOM 0 HA LYS A 23 10.163 3.553 -7.847 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.146 4.665 -7.171 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.682 3.183 -7.937 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.793 4.693 -10.117 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.833 6.017 -8.969 1.00 0.00 H new ATOM 0 HD2 LYS A 23 15.088 5.392 -9.759 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.930 5.223 -8.022 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.572 2.766 -8.287 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.710 2.929 -10.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.771 2.167 -9.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.996 3.735 -9.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.852 3.489 -8.041 1.00 0.00 H new ATOM 376 N THR A 24 10.272 5.535 -10.449 1.00 0.00 N ATOM 377 CA THR A 24 9.814 6.765 -11.057 1.00 0.00 C ATOM 378 C THR A 24 8.307 6.697 -11.320 1.00 0.00 C ATOM 379 O THR A 24 7.539 7.532 -10.841 1.00 0.00 O ATOM 380 CB THR A 24 10.696 6.993 -12.293 1.00 0.00 C ATOM 381 OG1 THR A 24 11.965 7.431 -11.857 1.00 0.00 O ATOM 382 CG2 THR A 24 10.115 7.944 -13.330 1.00 0.00 C ATOM 0 H THR A 24 10.730 4.913 -11.115 1.00 0.00 H new ATOM 0 HA THR A 24 9.922 7.635 -10.409 1.00 0.00 H new ATOM 0 HB THR A 24 10.765 6.040 -12.817 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.222 8.235 -12.355 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.810 8.041 -14.164 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.165 7.551 -13.692 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.954 8.922 -12.877 1.00 0.00 H new ATOM 390 N LEU A 25 7.880 5.668 -12.047 1.00 0.00 N ATOM 391 CA LEU A 25 6.498 5.499 -12.490 1.00 0.00 C ATOM 392 C LEU A 25 5.608 5.092 -11.313 1.00 0.00 C ATOM 393 O LEU A 25 4.440 5.469 -11.252 1.00 0.00 O ATOM 394 CB LEU A 25 6.454 4.416 -13.582 1.00 0.00 C ATOM 395 CG LEU A 25 7.243 4.747 -14.860 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.322 3.492 -15.726 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.612 5.898 -15.649 1.00 0.00 C ATOM 0 H LEU A 25 8.496 4.914 -12.351 1.00 0.00 H new ATOM 0 HA LEU A 25 6.127 6.443 -12.890 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.841 3.486 -13.165 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.413 4.236 -13.852 1.00 0.00 H new ATOM 0 HG LEU A 25 8.242 5.074 -14.572 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.879 3.713 -16.636 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.828 2.700 -15.174 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.315 3.166 -15.987 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.205 6.095 -16.542 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.597 5.627 -15.939 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.585 6.793 -15.028 1.00 0.00 H new ATOM 409 N GLY A 26 6.165 4.308 -10.385 1.00 0.00 N ATOM 410 CA GLY A 26 5.463 3.759 -9.236 1.00 0.00 C ATOM 411 C GLY A 26 5.531 4.645 -7.994 1.00 0.00 C ATOM 412 O GLY A 26 5.037 4.225 -6.949 1.00 0.00 O ATOM 0 H GLY A 26 7.147 4.034 -10.420 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.418 3.601 -9.502 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.883 2.782 -8.998 1.00 0.00 H new ATOM 416 N ALA A 27 6.151 5.827 -8.079 1.00 0.00 N ATOM 417 CA ALA A 27 6.439 6.703 -6.948 1.00 0.00 C ATOM 418 C ALA A 27 5.186 6.921 -6.092 1.00 0.00 C ATOM 419 O ALA A 27 4.152 7.373 -6.589 1.00 0.00 O ATOM 420 CB ALA A 27 6.970 8.050 -7.460 1.00 0.00 C ATOM 0 H ALA A 27 6.475 6.209 -8.968 1.00 0.00 H new ATOM 0 HA ALA A 27 7.197 6.228 -6.325 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.184 8.702 -6.613 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.883 7.887 -8.033 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.220 8.518 -8.098 1.00 0.00 H new ATOM 426 N GLY A 28 5.283 6.590 -4.801 1.00 0.00 N ATOM 427 CA GLY A 28 4.205 6.730 -3.823 1.00 0.00 C ATOM 428 C GLY A 28 3.121 5.650 -3.918 1.00 0.00 C ATOM 429 O GLY A 28 2.352 5.497 -2.970 1.00 0.00 O ATOM 0 H GLY A 28 6.138 6.207 -4.398 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.634 6.710 -2.821 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.740 7.707 -3.951 1.00 0.00 H new ATOM 433 N LYS A 29 3.068 4.872 -5.005 1.00 0.00 N ATOM 434 CA LYS A 29 2.089 3.795 -5.190 1.00 0.00 C ATOM 435 C LYS A 29 2.671 2.466 -4.735 1.00 0.00 C ATOM 436 O LYS A 29 2.002 1.708 -4.040 1.00 0.00 O ATOM 437 CB LYS A 29 1.625 3.702 -6.663 1.00 0.00 C ATOM 438 CG LYS A 29 1.210 5.046 -7.276 1.00 0.00 C ATOM 439 CD LYS A 29 0.647 4.853 -8.696 1.00 0.00 C ATOM 440 CE LYS A 29 0.381 6.192 -9.406 1.00 0.00 C ATOM 441 NZ LYS A 29 -0.747 6.963 -8.811 1.00 0.00 N ATOM 0 H LYS A 29 3.711 4.974 -5.790 1.00 0.00 H new ATOM 0 HA LYS A 29 1.217 4.027 -4.578 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.431 3.276 -7.260 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.784 3.012 -6.725 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.459 5.522 -6.645 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.069 5.716 -7.309 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.350 4.265 -9.286 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.280 4.282 -8.642 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.285 6.800 -9.371 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.166 6.001 -10.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.874 7.853 -9.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.620 6.401 -8.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.536 7.174 -7.815 1.00 0.00 H new ATOM 455 N ILE A 30 3.907 2.174 -5.147 1.00 0.00 N ATOM 456 CA ILE A 30 4.538 0.862 -4.997 1.00 0.00 C ATOM 457 C ILE A 30 6.027 1.032 -4.660 1.00 0.00 C ATOM 458 O ILE A 30 6.630 2.047 -5.005 1.00 0.00 O ATOM 459 CB ILE A 30 4.264 0.015 -6.270 1.00 0.00 C ATOM 460 CG1 ILE A 30 4.901 0.621 -7.539 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.751 -0.171 -6.493 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.637 -0.153 -8.838 1.00 0.00 C ATOM 0 H ILE A 30 4.509 2.859 -5.604 1.00 0.00 H new ATOM 0 HA ILE A 30 4.107 0.312 -4.160 1.00 0.00 H new ATOM 0 HB ILE A 30 4.730 -0.955 -6.095 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.532 1.639 -7.660 1.00 0.00 H new ATOM 0 HG13 ILE A 30 5.978 0.689 -7.388 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.586 -0.767 -7.390 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.317 -0.681 -5.633 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.278 0.804 -6.613 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.127 0.354 -9.670 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.033 -1.164 -8.746 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.564 -0.199 -9.022 1.00 0.00 H new ATOM 474 N ALA A 31 6.606 0.052 -3.957 1.00 0.00 N ATOM 475 CA ALA A 31 7.973 0.087 -3.435 1.00 0.00 C ATOM 476 C ALA A 31 8.803 -0.959 -4.169 1.00 0.00 C ATOM 477 O ALA A 31 8.578 -2.144 -3.955 1.00 0.00 O ATOM 478 CB ALA A 31 7.942 -0.225 -1.927 1.00 0.00 C ATOM 0 H ALA A 31 6.118 -0.815 -3.729 1.00 0.00 H new ATOM 0 HA ALA A 31 8.415 1.072 -3.587 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.957 -0.201 -1.530 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.334 0.520 -1.414 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.514 -1.215 -1.769 1.00 0.00 H new ATOM 484 N VAL A 32 9.732 -0.572 -5.037 1.00 0.00 N ATOM 485 CA VAL A 32 10.588 -1.533 -5.730 1.00 0.00 C ATOM 486 C VAL A 32 11.813 -1.860 -4.864 1.00 0.00 C ATOM 487 O VAL A 32 12.423 -0.975 -4.259 1.00 0.00 O ATOM 488 CB VAL A 32 10.894 -1.031 -7.156 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.648 0.308 -7.215 1.00 0.00 C ATOM 490 CG2 VAL A 32 11.666 -2.088 -7.949 1.00 0.00 C ATOM 0 H VAL A 32 9.913 0.402 -5.279 1.00 0.00 H new ATOM 0 HA VAL A 32 10.079 -2.487 -5.871 1.00 0.00 H new ATOM 0 HB VAL A 32 9.918 -0.853 -7.607 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.820 0.583 -8.256 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.054 1.082 -6.728 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.605 0.209 -6.703 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.871 -1.713 -8.952 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.607 -2.307 -7.444 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.071 -2.999 -8.017 1.00 0.00 H new ATOM 500 N THR A 33 12.184 -3.138 -4.847 1.00 0.00 N ATOM 501 CA THR A 33 13.384 -3.673 -4.245 1.00 0.00 C ATOM 502 C THR A 33 13.809 -4.810 -5.169 1.00 0.00 C ATOM 503 O THR A 33 13.132 -5.826 -5.228 1.00 0.00 O ATOM 504 CB THR A 33 13.057 -4.207 -2.837 1.00 0.00 C ATOM 505 OG1 THR A 33 12.183 -3.358 -2.105 1.00 0.00 O ATOM 506 CG2 THR A 33 14.317 -4.458 -2.007 1.00 0.00 C ATOM 0 H THR A 33 11.615 -3.864 -5.282 1.00 0.00 H new ATOM 0 HA THR A 33 14.172 -2.928 -4.133 1.00 0.00 H new ATOM 0 HB THR A 33 12.546 -5.154 -3.012 1.00 0.00 H new ATOM 0 HG1 THR A 33 11.698 -3.886 -1.437 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.036 -4.833 -1.023 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.944 -5.194 -2.511 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.871 -3.526 -1.895 1.00 0.00 H new ATOM 514 N SER A 34 14.877 -4.655 -5.944 1.00 0.00 N ATOM 515 CA SER A 34 15.347 -5.725 -6.824 1.00 0.00 C ATOM 516 C SER A 34 16.608 -6.341 -6.221 1.00 0.00 C ATOM 517 O SER A 34 17.729 -6.059 -6.643 1.00 0.00 O ATOM 518 CB SER A 34 15.447 -5.205 -8.254 1.00 0.00 C ATOM 519 OG SER A 34 14.124 -4.860 -8.653 1.00 0.00 O ATOM 0 H SER A 34 15.434 -3.802 -5.983 1.00 0.00 H new ATOM 0 HA SER A 34 14.642 -6.553 -6.896 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.106 -4.339 -8.306 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.866 -5.964 -8.914 1.00 0.00 H new ATOM 0 HG SER A 34 13.889 -3.983 -8.284 1.00 0.00 H new ATOM 525 N SER A 35 16.390 -7.146 -5.178 1.00 0.00 N ATOM 526 CA SER A 35 17.420 -7.688 -4.300 1.00 0.00 C ATOM 527 C SER A 35 18.428 -8.554 -5.062 1.00 0.00 C ATOM 528 O SER A 35 19.641 -8.373 -4.937 1.00 0.00 O ATOM 529 CB SER A 35 16.713 -8.463 -3.185 1.00 0.00 C ATOM 530 OG SER A 35 15.554 -7.760 -2.766 1.00 0.00 O ATOM 0 H SER A 35 15.452 -7.448 -4.915 1.00 0.00 H new ATOM 0 HA SER A 35 18.010 -6.879 -3.870 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.438 -9.456 -3.539 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.389 -8.601 -2.342 1.00 0.00 H new ATOM 0 HG SER A 35 15.542 -7.702 -1.788 1.00 0.00 H new ATOM 536 N GLY A 36 17.913 -9.432 -5.926 1.00 0.00 N ATOM 537 CA GLY A 36 18.717 -10.193 -6.865 1.00 0.00 C ATOM 538 C GLY A 36 19.187 -11.515 -6.278 1.00 0.00 C ATOM 539 O GLY A 36 19.158 -11.740 -5.064 1.00 0.00 O ATOM 0 H GLY A 36 16.915 -9.631 -5.988 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.136 -10.384 -7.767 1.00 0.00 H new ATOM 0 HA3 GLY A 36 19.583 -9.601 -7.163 1.00 0.00 H new ATOM 543 N LEU A 37 19.585 -12.402 -7.184 1.00 0.00 N ATOM 544 CA LEU A 37 20.183 -13.695 -6.960 1.00 0.00 C ATOM 545 C LEU A 37 21.387 -13.718 -7.868 1.00 0.00 C ATOM 546 O LEU A 37 21.288 -13.205 -8.983 1.00 0.00 O ATOM 547 CB LEU A 37 19.210 -14.793 -7.392 1.00 0.00 C ATOM 548 CG LEU A 37 18.100 -15.007 -6.359 1.00 0.00 C ATOM 549 CD1 LEU A 37 16.820 -15.381 -7.102 1.00 0.00 C ATOM 550 CD2 LEU A 37 18.498 -16.099 -5.360 1.00 0.00 C ATOM 0 H LEU A 37 19.484 -12.208 -8.180 1.00 0.00 H new ATOM 0 HA LEU A 37 20.437 -13.860 -5.913 1.00 0.00 H new ATOM 0 HB2 LEU A 37 18.767 -14.529 -8.352 1.00 0.00 H new ATOM 0 HB3 LEU A 37 19.755 -15.725 -7.538 1.00 0.00 H new ATOM 0 HG LEU A 37 17.937 -14.092 -5.789 1.00 0.00 H new ATOM 0 HD11 LEU A 37 16.015 -15.538 -6.384 1.00 0.00 H new ATOM 0 HD12 LEU A 37 16.546 -14.575 -7.783 1.00 0.00 H new ATOM 0 HD13 LEU A 37 16.983 -16.297 -7.670 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.697 -16.237 -4.634 1.00 0.00 H new ATOM 0 HD22 LEU A 37 18.670 -17.034 -5.893 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.410 -15.803 -4.842 1.00 0.00 H new ATOM 562 N GLU A 38 22.484 -14.315 -7.418 1.00 0.00 N ATOM 563 CA GLU A 38 23.795 -14.237 -8.071 1.00 0.00 C ATOM 564 C GLU A 38 24.186 -12.759 -8.181 1.00 0.00 C ATOM 565 O GLU A 38 24.734 -12.190 -7.233 1.00 0.00 O ATOM 566 CB GLU A 38 23.808 -14.994 -9.415 1.00 0.00 C ATOM 567 CG GLU A 38 23.341 -16.441 -9.255 1.00 0.00 C ATOM 568 CD GLU A 38 23.526 -17.302 -10.521 1.00 0.00 C ATOM 569 OE1 GLU A 38 24.595 -17.223 -11.176 1.00 0.00 O ATOM 570 OE2 GLU A 38 22.613 -18.107 -10.833 1.00 0.00 O ATOM 0 H GLU A 38 22.492 -14.881 -6.570 1.00 0.00 H new ATOM 0 HA GLU A 38 24.553 -14.742 -7.472 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.163 -14.480 -10.128 1.00 0.00 H new ATOM 0 HB3 GLU A 38 24.816 -14.981 -9.830 1.00 0.00 H new ATOM 0 HG2 GLU A 38 23.889 -16.900 -8.432 1.00 0.00 H new ATOM 0 HG3 GLU A 38 22.287 -16.443 -8.977 1.00 0.00 H new ATOM 577 N SER A 39 23.792 -12.136 -9.293 1.00 0.00 N ATOM 578 CA SER A 39 23.830 -10.717 -9.561 1.00 0.00 C ATOM 579 C SER A 39 25.223 -10.093 -9.619 1.00 0.00 C ATOM 580 O SER A 39 26.255 -10.717 -9.358 1.00 0.00 O ATOM 581 CB SER A 39 22.816 -10.007 -8.647 1.00 0.00 C ATOM 582 OG SER A 39 21.507 -10.445 -8.974 1.00 0.00 O ATOM 0 H SER A 39 23.411 -12.659 -10.082 1.00 0.00 H new ATOM 0 HA SER A 39 23.515 -10.561 -10.593 1.00 0.00 H new ATOM 0 HB2 SER A 39 23.035 -10.226 -7.602 1.00 0.00 H new ATOM 0 HB3 SER A 39 22.892 -8.927 -8.769 1.00 0.00 H new ATOM 0 HG SER A 39 21.457 -11.420 -8.889 1.00 0.00 H new ATOM 588 N SER A 40 25.194 -8.847 -10.083 1.00 0.00 N ATOM 589 CA SER A 40 26.306 -8.016 -10.488 1.00 0.00 C ATOM 590 C SER A 40 25.811 -6.567 -10.383 1.00 0.00 C ATOM 591 O SER A 40 24.631 -6.323 -10.114 1.00 0.00 O ATOM 592 CB SER A 40 26.604 -8.387 -11.953 1.00 0.00 C ATOM 593 OG SER A 40 27.125 -9.702 -12.082 1.00 0.00 O ATOM 0 H SER A 40 24.307 -8.356 -10.192 1.00 0.00 H new ATOM 0 HA SER A 40 27.205 -8.145 -9.885 1.00 0.00 H new ATOM 0 HB2 SER A 40 25.689 -8.302 -12.540 1.00 0.00 H new ATOM 0 HB3 SER A 40 27.317 -7.674 -12.368 1.00 0.00 H new ATOM 0 HG SER A 40 27.342 -9.877 -13.021 1.00 0.00 H new ATOM 599 N ARG A 41 26.676 -5.594 -10.653 1.00 0.00 N ATOM 600 CA ARG A 41 26.269 -4.197 -10.808 1.00 0.00 C ATOM 601 C ARG A 41 25.750 -4.013 -12.232 1.00 0.00 C ATOM 602 O ARG A 41 25.653 -4.963 -13.003 1.00 0.00 O ATOM 603 CB ARG A 41 27.455 -3.280 -10.435 1.00 0.00 C ATOM 604 CG ARG A 41 27.005 -2.008 -9.693 1.00 0.00 C ATOM 605 CD ARG A 41 28.187 -1.068 -9.419 1.00 0.00 C ATOM 606 NE ARG A 41 27.728 0.164 -8.752 1.00 0.00 N ATOM 607 CZ ARG A 41 27.712 0.417 -7.436 1.00 0.00 C ATOM 608 NH1 ARG A 41 28.116 -0.492 -6.551 1.00 0.00 N ATOM 609 NH2 ARG A 41 27.287 1.605 -7.019 1.00 0.00 N ATOM 0 H ARG A 41 27.677 -5.749 -10.771 1.00 0.00 H new ATOM 0 HA ARG A 41 25.457 -3.920 -10.135 1.00 0.00 H new ATOM 0 HB2 ARG A 41 28.155 -3.833 -9.809 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.991 -2.998 -11.341 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.254 -1.486 -10.286 1.00 0.00 H new ATOM 0 HG3 ARG A 41 26.532 -2.284 -8.750 1.00 0.00 H new ATOM 0 HD2 ARG A 41 28.923 -1.574 -8.794 1.00 0.00 H new ATOM 0 HD3 ARG A 41 28.684 -0.817 -10.356 1.00 0.00 H new ATOM 0 HE ARG A 41 27.384 0.907 -9.360 1.00 0.00 H new ATOM 0 HH11 ARG A 41 28.446 -1.403 -6.870 1.00 0.00 H new ATOM 0 HH12 ARG A 41 28.095 -0.278 -5.554 1.00 0.00 H new ATOM 0 HH21 ARG A 41 26.981 2.304 -7.696 1.00 0.00 H new ATOM 0 HH22 ARG A 41 27.267 1.818 -6.022 1.00 0.00 H new ATOM 623 N VAL A 42 25.359 -2.793 -12.558 1.00 0.00 N ATOM 624 CA VAL A 42 24.813 -2.440 -13.856 1.00 0.00 C ATOM 625 C VAL A 42 25.962 -2.222 -14.864 1.00 0.00 C ATOM 626 O VAL A 42 27.127 -2.146 -14.464 1.00 0.00 O ATOM 627 CB VAL A 42 23.903 -1.223 -13.654 1.00 0.00 C ATOM 628 CG1 VAL A 42 22.823 -1.485 -12.595 1.00 0.00 C ATOM 629 CG2 VAL A 42 24.681 0.039 -13.275 1.00 0.00 C ATOM 0 H VAL A 42 25.414 -2.004 -11.914 1.00 0.00 H new ATOM 0 HA VAL A 42 24.206 -3.237 -14.286 1.00 0.00 H new ATOM 0 HB VAL A 42 23.426 -1.055 -14.619 1.00 0.00 H new ATOM 0 HG11 VAL A 42 22.200 -0.597 -12.483 1.00 0.00 H new ATOM 0 HG12 VAL A 42 22.204 -2.326 -12.907 1.00 0.00 H new ATOM 0 HG13 VAL A 42 23.297 -1.718 -11.642 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.987 0.869 -13.145 1.00 0.00 H new ATOM 0 HG22 VAL A 42 25.221 -0.132 -12.344 1.00 0.00 H new ATOM 0 HG23 VAL A 42 25.390 0.280 -14.066 1.00 0.00 H new ATOM 639 N HIS A 43 25.647 -2.087 -16.155 1.00 0.00 N ATOM 640 CA HIS A 43 26.631 -1.712 -17.173 1.00 0.00 C ATOM 641 C HIS A 43 26.972 -0.215 -17.002 1.00 0.00 C ATOM 642 O HIS A 43 26.050 0.569 -16.781 1.00 0.00 O ATOM 643 CB HIS A 43 26.066 -2.064 -18.562 1.00 0.00 C ATOM 644 CG HIS A 43 26.988 -1.702 -19.694 1.00 0.00 C ATOM 645 ND1 HIS A 43 28.024 -2.458 -20.186 1.00 0.00 N ATOM 646 CD2 HIS A 43 26.988 -0.528 -20.392 1.00 0.00 C ATOM 647 CE1 HIS A 43 28.667 -1.738 -21.117 1.00 0.00 C ATOM 648 NE2 HIS A 43 28.060 -0.549 -21.286 1.00 0.00 N ATOM 0 H HIS A 43 24.707 -2.234 -16.522 1.00 0.00 H new ATOM 0 HA HIS A 43 27.564 -2.265 -17.063 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.858 -3.133 -18.601 1.00 0.00 H new ATOM 0 HB3 HIS A 43 25.115 -1.550 -18.700 1.00 0.00 H new ATOM 0 HD1 HIS A 43 28.263 -3.405 -19.893 1.00 0.00 H new ATOM 0 HD2 HIS A 43 26.280 0.279 -20.273 1.00 0.00 H new ATOM 0 HE1 HIS A 43 29.545 -2.065 -21.654 1.00 0.00 H new ATOM 656 N PRO A 44 28.234 0.242 -17.123 1.00 0.00 N ATOM 657 CA PRO A 44 28.613 1.634 -16.846 1.00 0.00 C ATOM 658 C PRO A 44 27.864 2.659 -17.697 1.00 0.00 C ATOM 659 O PRO A 44 27.299 3.607 -17.151 1.00 0.00 O ATOM 660 CB PRO A 44 30.124 1.721 -17.105 1.00 0.00 C ATOM 661 CG PRO A 44 30.433 0.485 -17.955 1.00 0.00 C ATOM 662 CD PRO A 44 29.428 -0.534 -17.429 1.00 0.00 C ATOM 0 HA PRO A 44 28.348 1.882 -15.818 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.386 2.640 -17.629 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.689 1.714 -16.173 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.296 0.679 -19.019 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.461 0.147 -17.822 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.220 -1.303 -18.172 1.00 0.00 H new ATOM 0 HD3 PRO A 44 29.807 -1.042 -16.542 1.00 0.00 H new ATOM 670 N THR A 45 27.792 2.455 -19.015 1.00 0.00 N ATOM 671 CA THR A 45 27.109 3.390 -19.911 1.00 0.00 C ATOM 672 C THR A 45 25.602 3.426 -19.621 1.00 0.00 C ATOM 673 O THR A 45 24.940 4.414 -19.941 1.00 0.00 O ATOM 674 CB THR A 45 27.468 3.045 -21.366 1.00 0.00 C ATOM 675 OG1 THR A 45 28.883 2.954 -21.491 1.00 0.00 O ATOM 676 CG2 THR A 45 26.926 4.042 -22.398 1.00 0.00 C ATOM 0 H THR A 45 28.200 1.647 -19.486 1.00 0.00 H new ATOM 0 HA THR A 45 27.451 4.410 -19.735 1.00 0.00 H new ATOM 0 HB THR A 45 26.988 2.091 -21.584 1.00 0.00 H new ATOM 0 HG1 THR A 45 29.116 2.732 -22.417 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.223 3.727 -23.399 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.838 4.075 -22.336 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.331 5.033 -22.194 1.00 0.00 H new ATOM 684 N ALA A 46 25.054 2.405 -18.937 1.00 0.00 N ATOM 685 CA ALA A 46 23.660 2.411 -18.529 1.00 0.00 C ATOM 686 C ALA A 46 23.418 3.595 -17.623 1.00 0.00 C ATOM 687 O ALA A 46 22.518 4.374 -17.886 1.00 0.00 O ATOM 688 CB ALA A 46 23.282 1.113 -17.795 1.00 0.00 C ATOM 0 H ALA A 46 25.567 1.568 -18.660 1.00 0.00 H new ATOM 0 HA ALA A 46 23.039 2.483 -19.422 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.232 1.152 -17.504 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.444 0.261 -18.455 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.901 1.005 -16.905 1.00 0.00 H new ATOM 694 N ILE A 47 24.248 3.763 -16.597 1.00 0.00 N ATOM 695 CA ILE A 47 24.038 4.775 -15.570 1.00 0.00 C ATOM 696 C ILE A 47 23.980 6.140 -16.246 1.00 0.00 C ATOM 697 O ILE A 47 23.103 6.934 -15.927 1.00 0.00 O ATOM 698 CB ILE A 47 25.191 4.729 -14.535 1.00 0.00 C ATOM 699 CG1 ILE A 47 25.230 3.362 -13.828 1.00 0.00 C ATOM 700 CG2 ILE A 47 25.059 5.856 -13.491 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.548 3.074 -13.096 1.00 0.00 C ATOM 0 H ILE A 47 25.086 3.199 -16.456 1.00 0.00 H new ATOM 0 HA ILE A 47 23.103 4.587 -15.042 1.00 0.00 H new ATOM 0 HB ILE A 47 26.124 4.877 -15.079 1.00 0.00 H new ATOM 0 HG12 ILE A 47 24.410 3.312 -13.112 1.00 0.00 H new ATOM 0 HG13 ILE A 47 25.057 2.578 -14.566 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.884 5.793 -12.781 1.00 0.00 H new ATOM 0 HG22 ILE A 47 25.086 6.823 -13.994 1.00 0.00 H new ATOM 0 HG23 ILE A 47 24.114 5.750 -12.959 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.495 2.093 -12.624 1.00 0.00 H new ATOM 0 HD12 ILE A 47 27.372 3.090 -13.810 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.714 3.835 -12.333 1.00 0.00 H new ATOM 713 N ALA A 48 24.857 6.385 -17.224 1.00 0.00 N ATOM 714 CA ALA A 48 24.894 7.662 -17.914 1.00 0.00 C ATOM 715 C ALA A 48 23.587 7.909 -18.675 1.00 0.00 C ATOM 716 O ALA A 48 22.999 8.977 -18.548 1.00 0.00 O ATOM 717 CB ALA A 48 26.109 7.726 -18.846 1.00 0.00 C ATOM 0 H ALA A 48 25.548 5.710 -17.550 1.00 0.00 H new ATOM 0 HA ALA A 48 24.995 8.457 -17.175 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.125 8.688 -19.357 1.00 0.00 H new ATOM 0 HB2 ALA A 48 27.022 7.610 -18.262 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.045 6.925 -19.582 1.00 0.00 H new ATOM 723 N MET A 49 23.092 6.915 -19.419 1.00 0.00 N ATOM 724 CA MET A 49 21.852 7.037 -20.193 1.00 0.00 C ATOM 725 C MET A 49 20.637 7.151 -19.263 1.00 0.00 C ATOM 726 O MET A 49 19.679 7.890 -19.512 1.00 0.00 O ATOM 727 CB MET A 49 21.723 5.795 -21.094 1.00 0.00 C ATOM 728 CG MET A 49 22.825 5.763 -22.156 1.00 0.00 C ATOM 729 SD MET A 49 22.676 7.078 -23.391 1.00 0.00 S ATOM 730 CE MET A 49 24.329 7.790 -23.213 1.00 0.00 C ATOM 0 H MET A 49 23.540 6.002 -19.502 1.00 0.00 H new ATOM 0 HA MET A 49 21.886 7.941 -20.801 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.776 4.893 -20.484 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.747 5.795 -21.579 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.795 5.845 -21.665 1.00 0.00 H new ATOM 0 HG3 MET A 49 22.804 4.797 -22.661 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.440 8.629 -23.900 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.467 8.139 -22.190 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.078 7.032 -23.442 1.00 0.00 H new ATOM 740 N MET A 50 20.685 6.435 -18.152 1.00 0.00 N ATOM 741 CA MET A 50 19.579 6.370 -17.226 1.00 0.00 C ATOM 742 C MET A 50 19.550 7.704 -16.473 1.00 0.00 C ATOM 743 O MET A 50 18.476 8.240 -16.217 1.00 0.00 O ATOM 744 CB MET A 50 19.679 5.118 -16.339 1.00 0.00 C ATOM 745 CG MET A 50 19.722 3.755 -17.086 1.00 0.00 C ATOM 746 SD MET A 50 19.401 3.708 -18.893 1.00 0.00 S ATOM 747 CE MET A 50 19.797 1.995 -19.397 1.00 0.00 C ATOM 0 H MET A 50 21.496 5.883 -17.871 1.00 0.00 H new ATOM 0 HA MET A 50 18.620 6.250 -17.730 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.576 5.202 -15.726 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.828 5.110 -15.659 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.707 3.320 -16.917 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.997 3.097 -16.608 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.095 1.670 -20.165 1.00 0.00 H new ATOM 0 HE2 MET A 50 20.811 1.958 -19.794 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.721 1.335 -18.533 1.00 0.00 H new ATOM 757 N GLU A 51 20.708 8.325 -16.250 1.00 0.00 N ATOM 758 CA GLU A 51 20.826 9.655 -15.695 1.00 0.00 C ATOM 759 C GLU A 51 20.392 10.699 -16.729 1.00 0.00 C ATOM 760 O GLU A 51 19.948 11.779 -16.334 1.00 0.00 O ATOM 761 CB GLU A 51 22.256 9.874 -15.179 1.00 0.00 C ATOM 762 CG GLU A 51 22.420 11.210 -14.446 1.00 0.00 C ATOM 763 CD GLU A 51 23.802 11.311 -13.777 1.00 0.00 C ATOM 764 OE1 GLU A 51 24.793 11.651 -14.469 1.00 0.00 O ATOM 765 OE2 GLU A 51 23.901 11.088 -12.546 1.00 0.00 O ATOM 0 H GLU A 51 21.610 7.897 -16.459 1.00 0.00 H new ATOM 0 HA GLU A 51 20.157 9.768 -14.842 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.524 9.059 -14.506 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.951 9.836 -16.018 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.293 12.032 -15.150 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.640 11.312 -13.692 1.00 0.00 H new ATOM 772 N GLU A 52 20.409 10.379 -18.030 1.00 0.00 N ATOM 773 CA GLU A 52 19.805 11.254 -19.028 1.00 0.00 C ATOM 774 C GLU A 52 18.282 11.283 -18.848 1.00 0.00 C ATOM 775 O GLU A 52 17.672 12.329 -19.090 1.00 0.00 O ATOM 776 CB GLU A 52 20.229 10.951 -20.479 1.00 0.00 C ATOM 777 CG GLU A 52 21.686 11.330 -20.770 1.00 0.00 C ATOM 778 CD GLU A 52 21.886 12.858 -20.817 1.00 0.00 C ATOM 779 OE1 GLU A 52 21.600 13.480 -21.869 1.00 0.00 O ATOM 780 OE2 GLU A 52 22.343 13.452 -19.810 1.00 0.00 O ATOM 0 H GLU A 52 20.830 9.530 -18.407 1.00 0.00 H new ATOM 0 HA GLU A 52 20.196 12.255 -18.848 1.00 0.00 H new ATOM 0 HB2 GLU A 52 20.089 9.888 -20.678 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.575 11.492 -21.163 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.332 10.903 -20.003 1.00 0.00 H new ATOM 0 HG3 GLU A 52 21.991 10.895 -21.722 1.00 0.00 H new ATOM 787 N VAL A 53 17.666 10.190 -18.366 1.00 0.00 N ATOM 788 CA VAL A 53 16.256 10.216 -17.939 1.00 0.00 C ATOM 789 C VAL A 53 16.124 10.587 -16.439 1.00 0.00 C ATOM 790 O VAL A 53 15.028 10.558 -15.876 1.00 0.00 O ATOM 791 CB VAL A 53 15.482 8.971 -18.437 1.00 0.00 C ATOM 792 CG1 VAL A 53 15.777 7.677 -17.666 1.00 0.00 C ATOM 793 CG2 VAL A 53 13.963 9.188 -18.491 1.00 0.00 C ATOM 0 H VAL A 53 18.119 9.282 -18.263 1.00 0.00 H new ATOM 0 HA VAL A 53 15.735 11.033 -18.438 1.00 0.00 H new ATOM 0 HB VAL A 53 15.864 8.840 -19.450 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.189 6.861 -18.086 1.00 0.00 H new ATOM 0 HG12 VAL A 53 16.838 7.439 -17.746 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.514 7.811 -16.617 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.478 8.279 -18.848 1.00 0.00 H new ATOM 0 HG22 VAL A 53 13.594 9.429 -17.494 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.737 10.010 -19.170 1.00 0.00 H new ATOM 803 N GLY A 54 17.219 11.000 -15.788 1.00 0.00 N ATOM 804 CA GLY A 54 17.232 11.482 -14.410 1.00 0.00 C ATOM 805 C GLY A 54 17.150 10.366 -13.364 1.00 0.00 C ATOM 806 O GLY A 54 16.737 10.626 -12.230 1.00 0.00 O ATOM 0 H GLY A 54 18.143 11.006 -16.221 1.00 0.00 H new ATOM 0 HA2 GLY A 54 18.144 12.056 -14.244 1.00 0.00 H new ATOM 0 HA3 GLY A 54 16.395 12.165 -14.266 1.00 0.00 H new ATOM 810 N ILE A 55 17.515 9.132 -13.725 1.00 0.00 N ATOM 811 CA ILE A 55 17.385 7.934 -12.894 1.00 0.00 C ATOM 812 C ILE A 55 18.765 7.327 -12.631 1.00 0.00 C ATOM 813 O ILE A 55 19.622 7.321 -13.513 1.00 0.00 O ATOM 814 CB ILE A 55 16.418 6.941 -13.569 1.00 0.00 C ATOM 815 CG1 ILE A 55 15.002 7.558 -13.651 1.00 0.00 C ATOM 816 CG2 ILE A 55 16.392 5.559 -12.885 1.00 0.00 C ATOM 817 CD1 ILE A 55 13.915 6.599 -14.145 1.00 0.00 C ATOM 0 H ILE A 55 17.924 8.934 -14.638 1.00 0.00 H new ATOM 0 HA ILE A 55 16.962 8.193 -11.923 1.00 0.00 H new ATOM 0 HB ILE A 55 16.790 6.762 -14.578 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.722 7.925 -12.663 1.00 0.00 H new ATOM 0 HG13 ILE A 55 15.035 8.422 -14.315 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.692 4.907 -13.408 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.389 5.119 -12.915 1.00 0.00 H new ATOM 0 HG23 ILE A 55 16.076 5.672 -11.848 1.00 0.00 H new ATOM 0 HD11 ILE A 55 12.956 7.117 -14.170 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.165 6.250 -15.147 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.848 5.746 -13.470 1.00 0.00 H new ATOM 829 N ASP A 56 18.972 6.764 -11.437 1.00 0.00 N ATOM 830 CA ASP A 56 20.146 5.945 -11.142 1.00 0.00 C ATOM 831 C ASP A 56 19.703 4.489 -11.039 1.00 0.00 C ATOM 832 O ASP A 56 18.586 4.202 -10.599 1.00 0.00 O ATOM 833 CB ASP A 56 20.893 6.372 -9.872 1.00 0.00 C ATOM 834 CG ASP A 56 22.058 5.393 -9.620 1.00 0.00 C ATOM 835 OD1 ASP A 56 22.823 5.135 -10.579 1.00 0.00 O ATOM 836 OD2 ASP A 56 22.132 4.791 -8.524 1.00 0.00 O ATOM 0 H ASP A 56 18.330 6.864 -10.651 1.00 0.00 H new ATOM 0 HA ASP A 56 20.858 6.081 -11.956 1.00 0.00 H new ATOM 0 HB2 ASP A 56 21.272 7.388 -9.982 1.00 0.00 H new ATOM 0 HB3 ASP A 56 20.214 6.376 -9.019 1.00 0.00 H new ATOM 841 N ILE A 57 20.589 3.579 -11.435 1.00 0.00 N ATOM 842 CA ILE A 57 20.473 2.134 -11.252 1.00 0.00 C ATOM 843 C ILE A 57 21.776 1.528 -10.689 1.00 0.00 C ATOM 844 O ILE A 57 21.739 0.383 -10.253 1.00 0.00 O ATOM 845 CB ILE A 57 20.026 1.460 -12.572 1.00 0.00 C ATOM 846 CG1 ILE A 57 20.876 1.927 -13.772 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.527 1.695 -12.821 1.00 0.00 C ATOM 848 CD1 ILE A 57 20.748 1.015 -14.992 1.00 0.00 C ATOM 0 H ILE A 57 21.449 3.842 -11.916 1.00 0.00 H new ATOM 0 HA ILE A 57 19.702 1.939 -10.507 1.00 0.00 H new ATOM 0 HB ILE A 57 20.189 0.387 -12.467 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.577 2.938 -14.049 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.922 1.975 -13.471 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.233 1.213 -13.754 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.951 1.273 -11.997 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.333 2.765 -12.889 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.370 1.399 -15.800 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.074 0.009 -14.730 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.708 0.986 -15.317 1.00 0.00 H new ATOM 860 N SER A 58 22.907 2.253 -10.666 1.00 0.00 N ATOM 861 CA SER A 58 24.146 1.852 -9.985 1.00 0.00 C ATOM 862 C SER A 58 23.871 1.324 -8.575 1.00 0.00 C ATOM 863 O SER A 58 24.350 0.250 -8.208 1.00 0.00 O ATOM 864 CB SER A 58 25.101 3.056 -9.924 1.00 0.00 C ATOM 865 OG SER A 58 26.434 2.629 -9.685 1.00 0.00 O ATOM 0 H SER A 58 22.985 3.157 -11.133 1.00 0.00 H new ATOM 0 HA SER A 58 24.604 1.042 -10.552 1.00 0.00 H new ATOM 0 HB2 SER A 58 25.054 3.611 -10.861 1.00 0.00 H new ATOM 0 HB3 SER A 58 24.785 3.737 -9.134 1.00 0.00 H new ATOM 0 HG SER A 58 27.026 3.409 -9.651 1.00 0.00 H new ATOM 871 N GLY A 59 23.050 2.042 -7.806 1.00 0.00 N ATOM 872 CA GLY A 59 22.710 1.726 -6.425 1.00 0.00 C ATOM 873 C GLY A 59 21.665 0.614 -6.275 1.00 0.00 C ATOM 874 O GLY A 59 20.893 0.660 -5.318 1.00 0.00 O ATOM 0 H GLY A 59 22.590 2.888 -8.143 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.617 1.431 -5.897 1.00 0.00 H new ATOM 0 HA3 GLY A 59 22.338 2.628 -5.939 1.00 0.00 H new ATOM 878 N GLN A 60 21.580 -0.351 -7.207 1.00 0.00 N ATOM 879 CA GLN A 60 20.537 -1.376 -7.175 1.00 0.00 C ATOM 880 C GLN A 60 20.618 -2.281 -5.943 1.00 0.00 C ATOM 881 O GLN A 60 19.589 -2.730 -5.436 1.00 0.00 O ATOM 882 CB GLN A 60 20.639 -2.267 -8.429 1.00 0.00 C ATOM 883 CG GLN A 60 19.277 -2.394 -9.116 1.00 0.00 C ATOM 884 CD GLN A 60 19.354 -3.338 -10.311 1.00 0.00 C ATOM 885 OE1 GLN A 60 19.223 -4.549 -10.175 1.00 0.00 O ATOM 886 NE2 GLN A 60 19.608 -2.809 -11.500 1.00 0.00 N ATOM 0 H GLN A 60 22.226 -0.438 -7.992 1.00 0.00 H new ATOM 0 HA GLN A 60 19.588 -0.842 -7.140 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.364 -1.843 -9.124 1.00 0.00 H new ATOM 0 HB3 GLN A 60 21.005 -3.255 -8.150 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.539 -2.763 -8.403 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.939 -1.412 -9.445 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.714 -1.799 -11.597 1.00 0.00 H new ATOM 0 HE22 GLN A 60 19.697 -3.412 -12.318 1.00 0.00 H new ATOM 895 N THR A 61 21.838 -2.606 -5.517 1.00 0.00 N ATOM 896 CA THR A 61 22.074 -3.623 -4.509 1.00 0.00 C ATOM 897 C THR A 61 21.853 -3.047 -3.111 1.00 0.00 C ATOM 898 O THR A 61 21.837 -1.828 -2.898 1.00 0.00 O ATOM 899 CB THR A 61 23.425 -4.339 -4.716 1.00 0.00 C ATOM 900 OG1 THR A 61 23.574 -5.410 -3.798 1.00 0.00 O ATOM 901 CG2 THR A 61 24.647 -3.415 -4.619 1.00 0.00 C ATOM 0 H THR A 61 22.689 -2.166 -5.866 1.00 0.00 H new ATOM 0 HA THR A 61 21.337 -4.419 -4.621 1.00 0.00 H new ATOM 0 HB THR A 61 23.394 -4.715 -5.738 1.00 0.00 H new ATOM 0 HG1 THR A 61 24.436 -5.851 -3.947 1.00 0.00 H new ATOM 0 HG21 THR A 61 25.556 -3.996 -4.776 1.00 0.00 H new ATOM 0 HG22 THR A 61 24.577 -2.638 -5.380 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.677 -2.954 -3.632 1.00 0.00 H new ATOM 909 N SER A 62 21.661 -3.959 -2.162 1.00 0.00 N ATOM 910 CA SER A 62 21.464 -3.688 -0.741 1.00 0.00 C ATOM 911 C SER A 62 21.571 -5.004 0.043 1.00 0.00 C ATOM 912 O SER A 62 22.358 -5.093 0.989 1.00 0.00 O ATOM 913 CB SER A 62 20.078 -3.051 -0.540 1.00 0.00 C ATOM 914 OG SER A 62 20.101 -1.657 -0.806 1.00 0.00 O ATOM 0 H SER A 62 21.637 -4.957 -2.374 1.00 0.00 H new ATOM 0 HA SER A 62 22.227 -2.999 -0.377 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.355 -3.536 -1.197 1.00 0.00 H new ATOM 0 HB3 SER A 62 19.743 -3.221 0.483 1.00 0.00 H new ATOM 0 HG SER A 62 20.768 -1.467 -1.498 1.00 0.00 H new ATOM 920 N ASP A 63 20.827 -6.037 -0.370 1.00 0.00 N ATOM 921 CA ASP A 63 20.800 -7.359 0.262 1.00 0.00 C ATOM 922 C ASP A 63 20.387 -8.387 -0.796 1.00 0.00 C ATOM 923 O ASP A 63 19.698 -8.009 -1.751 1.00 0.00 O ATOM 924 CB ASP A 63 19.780 -7.403 1.416 1.00 0.00 C ATOM 925 CG ASP A 63 20.400 -7.001 2.763 1.00 0.00 C ATOM 926 OD1 ASP A 63 21.275 -7.742 3.276 1.00 0.00 O ATOM 927 OD2 ASP A 63 19.998 -5.956 3.332 1.00 0.00 O ATOM 0 H ASP A 63 20.208 -5.973 -1.178 1.00 0.00 H new ATOM 0 HA ASP A 63 21.788 -7.578 0.666 1.00 0.00 H new ATOM 0 HB2 ASP A 63 18.949 -6.735 1.188 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.368 -8.409 1.495 1.00 0.00 H new ATOM 932 N PRO A 64 20.759 -9.674 -0.650 1.00 0.00 N ATOM 933 CA PRO A 64 20.264 -10.747 -1.502 1.00 0.00 C ATOM 934 C PRO A 64 18.763 -10.967 -1.272 1.00 0.00 C ATOM 935 O PRO A 64 18.246 -10.658 -0.198 1.00 0.00 O ATOM 936 CB PRO A 64 21.078 -11.983 -1.095 1.00 0.00 C ATOM 937 CG PRO A 64 21.374 -11.731 0.387 1.00 0.00 C ATOM 938 CD PRO A 64 21.585 -10.220 0.421 1.00 0.00 C ATOM 0 HA PRO A 64 20.379 -10.522 -2.562 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.514 -12.904 -1.243 1.00 0.00 H new ATOM 0 HB3 PRO A 64 21.994 -12.073 -1.679 1.00 0.00 H new ATOM 0 HG2 PRO A 64 20.547 -12.041 1.026 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.258 -12.273 0.724 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.294 -9.807 1.387 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.635 -9.969 0.270 1.00 0.00 H new ATOM 946 N ILE A 65 18.067 -11.586 -2.232 1.00 0.00 N ATOM 947 CA ILE A 65 16.628 -11.852 -2.109 1.00 0.00 C ATOM 948 C ILE A 65 16.318 -12.740 -0.894 1.00 0.00 C ATOM 949 O ILE A 65 15.229 -12.674 -0.326 1.00 0.00 O ATOM 950 CB ILE A 65 16.104 -12.453 -3.436 1.00 0.00 C ATOM 951 CG1 ILE A 65 14.642 -12.041 -3.675 1.00 0.00 C ATOM 952 CG2 ILE A 65 16.296 -13.978 -3.510 1.00 0.00 C ATOM 953 CD1 ILE A 65 14.091 -12.474 -5.039 1.00 0.00 C ATOM 0 H ILE A 65 18.478 -11.914 -3.106 1.00 0.00 H new ATOM 0 HA ILE A 65 16.103 -10.914 -1.930 1.00 0.00 H new ATOM 0 HB ILE A 65 16.707 -12.039 -4.244 1.00 0.00 H new ATOM 0 HG12 ILE A 65 14.020 -12.471 -2.890 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.561 -10.957 -3.588 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.912 -14.347 -4.461 1.00 0.00 H new ATOM 0 HG22 ILE A 65 17.357 -14.215 -3.431 1.00 0.00 H new ATOM 0 HG23 ILE A 65 15.756 -14.453 -2.691 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.055 -12.148 -5.133 1.00 0.00 H new ATOM 0 HD12 ILE A 65 14.687 -12.023 -5.832 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.138 -13.560 -5.122 1.00 0.00 H new ATOM 965 N GLU A 66 17.291 -13.552 -0.474 1.00 0.00 N ATOM 966 CA GLU A 66 17.145 -14.536 0.596 1.00 0.00 C ATOM 967 C GLU A 66 16.898 -13.840 1.938 1.00 0.00 C ATOM 968 O GLU A 66 16.315 -14.413 2.862 1.00 0.00 O ATOM 969 CB GLU A 66 18.424 -15.378 0.723 1.00 0.00 C ATOM 970 CG GLU A 66 19.005 -15.800 -0.628 1.00 0.00 C ATOM 971 CD GLU A 66 20.177 -16.780 -0.457 1.00 0.00 C ATOM 972 OE1 GLU A 66 19.945 -18.013 -0.423 1.00 0.00 O ATOM 973 OE2 GLU A 66 21.342 -16.327 -0.363 1.00 0.00 O ATOM 0 H GLU A 66 18.226 -13.541 -0.881 1.00 0.00 H new ATOM 0 HA GLU A 66 16.297 -15.174 0.347 1.00 0.00 H new ATOM 0 HB2 GLU A 66 19.174 -14.808 1.271 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.208 -16.269 1.312 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.225 -16.266 -1.231 1.00 0.00 H new ATOM 0 HG3 GLU A 66 19.344 -14.918 -1.171 1.00 0.00 H new ATOM 980 N ASN A 67 17.369 -12.592 2.028 1.00 0.00 N ATOM 981 CA ASN A 67 17.212 -11.729 3.191 1.00 0.00 C ATOM 982 C ASN A 67 15.744 -11.348 3.446 1.00 0.00 C ATOM 983 O ASN A 67 15.392 -10.958 4.562 1.00 0.00 O ATOM 984 CB ASN A 67 18.051 -10.461 2.987 1.00 0.00 C ATOM 985 CG ASN A 67 18.369 -9.801 4.322 1.00 0.00 C ATOM 986 OD1 ASN A 67 17.715 -8.850 4.745 1.00 0.00 O ATOM 987 ND2 ASN A 67 19.386 -10.303 5.012 1.00 0.00 N ATOM 0 H ASN A 67 17.884 -12.147 1.269 1.00 0.00 H new ATOM 0 HA ASN A 67 17.555 -12.280 4.067 1.00 0.00 H new ATOM 0 HB2 ASN A 67 18.978 -10.712 2.471 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.511 -9.761 2.350 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.639 -9.899 5.914 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.914 -11.093 4.640 1.00 0.00 H new ATOM 994 N PHE A 68 14.893 -11.450 2.420 1.00 0.00 N ATOM 995 CA PHE A 68 13.491 -11.045 2.415 1.00 0.00 C ATOM 996 C PHE A 68 12.587 -12.279 2.455 1.00 0.00 C ATOM 997 O PHE A 68 13.060 -13.413 2.587 1.00 0.00 O ATOM 998 CB PHE A 68 13.212 -10.225 1.142 1.00 0.00 C ATOM 999 CG PHE A 68 14.065 -8.991 1.005 1.00 0.00 C ATOM 1000 CD1 PHE A 68 15.348 -9.092 0.446 1.00 0.00 C ATOM 1001 CD2 PHE A 68 13.590 -7.757 1.470 1.00 0.00 C ATOM 1002 CE1 PHE A 68 16.171 -7.956 0.360 1.00 0.00 C ATOM 1003 CE2 PHE A 68 14.404 -6.614 1.374 1.00 0.00 C ATOM 1004 CZ PHE A 68 15.696 -6.714 0.822 1.00 0.00 C ATOM 0 H PHE A 68 15.184 -11.839 1.523 1.00 0.00 H new ATOM 0 HA PHE A 68 13.283 -10.436 3.295 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.370 -10.861 0.271 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.163 -9.931 1.135 1.00 0.00 H new ATOM 0 HD1 PHE A 68 15.704 -10.044 0.081 1.00 0.00 H new ATOM 0 HD2 PHE A 68 12.602 -7.684 1.901 1.00 0.00 H new ATOM 0 HE1 PHE A 68 17.163 -8.036 -0.059 1.00 0.00 H new ATOM 0 HE2 PHE A 68 14.038 -5.660 1.724 1.00 0.00 H new ATOM 0 HZ PHE A 68 16.323 -5.837 0.753 1.00 0.00 H new ATOM 1014 N ASN A 69 11.276 -12.058 2.319 1.00 0.00 N ATOM 1015 CA ASN A 69 10.306 -13.112 2.106 1.00 0.00 C ATOM 1016 C ASN A 69 9.356 -12.656 1.018 1.00 0.00 C ATOM 1017 O ASN A 69 8.931 -11.498 1.028 1.00 0.00 O ATOM 1018 CB ASN A 69 9.516 -13.412 3.383 1.00 0.00 C ATOM 1019 CG ASN A 69 8.687 -14.698 3.323 1.00 0.00 C ATOM 1020 OD1 ASN A 69 8.418 -15.247 2.258 1.00 0.00 O ATOM 1021 ND2 ASN A 69 8.235 -15.195 4.461 1.00 0.00 N ATOM 0 H ASN A 69 10.863 -11.126 2.356 1.00 0.00 H new ATOM 0 HA ASN A 69 10.825 -14.026 1.818 1.00 0.00 H new ATOM 0 HB2 ASN A 69 10.212 -13.481 4.219 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.851 -12.574 3.590 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.660 -16.038 4.457 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.461 -14.736 5.343 1.00 0.00 H new ATOM 1028 N ALA A 70 8.969 -13.553 0.114 1.00 0.00 N ATOM 1029 CA ALA A 70 8.104 -13.187 -0.968 1.00 0.00 C ATOM 1030 C ALA A 70 6.702 -12.956 -0.433 1.00 0.00 C ATOM 1031 O ALA A 70 5.954 -12.178 -1.017 1.00 0.00 O ATOM 1032 CB ALA A 70 8.118 -14.270 -2.046 1.00 0.00 C ATOM 0 H ALA A 70 9.249 -14.534 0.123 1.00 0.00 H new ATOM 0 HA ALA A 70 8.457 -12.263 -1.426 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.457 -13.979 -2.862 1.00 0.00 H new ATOM 0 HB2 ALA A 70 9.132 -14.392 -2.426 1.00 0.00 H new ATOM 0 HB3 ALA A 70 7.775 -15.213 -1.619 1.00 0.00 H new ATOM 1038 N ASP A 71 6.368 -13.604 0.689 1.00 0.00 N ATOM 1039 CA ASP A 71 5.060 -13.473 1.294 1.00 0.00 C ATOM 1040 C ASP A 71 4.805 -12.049 1.811 1.00 0.00 C ATOM 1041 O ASP A 71 3.652 -11.621 1.904 1.00 0.00 O ATOM 1042 CB ASP A 71 4.900 -14.494 2.425 1.00 0.00 C ATOM 1043 CG ASP A 71 3.500 -14.408 3.059 1.00 0.00 C ATOM 1044 OD1 ASP A 71 2.510 -14.809 2.401 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.391 -13.986 4.237 1.00 0.00 O ATOM 0 H ASP A 71 7.000 -14.227 1.192 1.00 0.00 H new ATOM 0 HA ASP A 71 4.316 -13.673 0.523 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.065 -15.499 2.037 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.659 -14.318 3.187 1.00 0.00 H new ATOM 1050 N ASP A 72 5.870 -11.294 2.116 1.00 0.00 N ATOM 1051 CA ASP A 72 5.772 -9.896 2.511 1.00 0.00 C ATOM 1052 C ASP A 72 5.559 -8.980 1.300 1.00 0.00 C ATOM 1053 O ASP A 72 4.949 -7.912 1.410 1.00 0.00 O ATOM 1054 CB ASP A 72 7.042 -9.474 3.247 1.00 0.00 C ATOM 1055 CG ASP A 72 6.889 -8.052 3.819 1.00 0.00 C ATOM 1056 OD1 ASP A 72 6.081 -7.859 4.759 1.00 0.00 O ATOM 1057 OD2 ASP A 72 7.596 -7.122 3.364 1.00 0.00 O ATOM 0 H ASP A 72 6.827 -11.646 2.093 1.00 0.00 H new ATOM 0 HA ASP A 72 4.909 -9.798 3.169 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.252 -10.176 4.054 1.00 0.00 H new ATOM 0 HB3 ASP A 72 7.892 -9.508 2.566 1.00 0.00 H new ATOM 1062 N TYR A 73 6.061 -9.413 0.141 1.00 0.00 N ATOM 1063 CA TYR A 73 5.976 -8.715 -1.128 1.00 0.00 C ATOM 1064 C TYR A 73 4.612 -8.945 -1.797 1.00 0.00 C ATOM 1065 O TYR A 73 3.825 -9.793 -1.367 1.00 0.00 O ATOM 1066 CB TYR A 73 7.184 -9.074 -2.020 1.00 0.00 C ATOM 1067 CG TYR A 73 8.402 -8.223 -1.704 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.016 -8.319 -0.441 1.00 0.00 C ATOM 1069 CD2 TYR A 73 8.850 -7.248 -2.620 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.005 -7.402 -0.057 1.00 0.00 C ATOM 1071 CE2 TYR A 73 9.855 -6.331 -2.247 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.409 -6.379 -0.943 1.00 0.00 C ATOM 1073 OH TYR A 73 11.291 -5.442 -0.504 1.00 0.00 O ATOM 0 H TYR A 73 6.559 -10.300 0.067 1.00 0.00 H new ATOM 0 HA TYR A 73 6.034 -7.640 -0.956 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.433 -10.127 -1.885 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.912 -8.942 -3.067 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.723 -9.106 0.238 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.422 -7.203 -3.611 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.459 -7.478 0.920 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.202 -5.593 -2.955 1.00 0.00 H new ATOM 0 HH TYR A 73 11.878 -5.838 0.174 1.00 0.00 H new ATOM 1083 N ASP A 74 4.313 -8.155 -2.835 1.00 0.00 N ATOM 1084 CA ASP A 74 3.042 -8.238 -3.566 1.00 0.00 C ATOM 1085 C ASP A 74 3.266 -8.641 -5.020 1.00 0.00 C ATOM 1086 O ASP A 74 2.522 -9.463 -5.552 1.00 0.00 O ATOM 1087 CB ASP A 74 2.302 -6.904 -3.499 1.00 0.00 C ATOM 1088 CG ASP A 74 0.954 -7.005 -4.239 1.00 0.00 C ATOM 1089 OD1 ASP A 74 -0.035 -7.447 -3.608 1.00 0.00 O ATOM 1090 OD2 ASP A 74 0.875 -6.599 -5.422 1.00 0.00 O ATOM 0 H ASP A 74 4.946 -7.439 -3.192 1.00 0.00 H new ATOM 0 HA ASP A 74 2.433 -9.007 -3.091 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.134 -6.625 -2.459 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.912 -6.119 -3.945 1.00 0.00 H new ATOM 1095 N VAL A 75 4.316 -8.107 -5.651 1.00 0.00 N ATOM 1096 CA VAL A 75 4.566 -8.269 -7.070 1.00 0.00 C ATOM 1097 C VAL A 75 6.043 -8.574 -7.295 1.00 0.00 C ATOM 1098 O VAL A 75 6.933 -7.913 -6.756 1.00 0.00 O ATOM 1099 CB VAL A 75 4.059 -7.032 -7.849 1.00 0.00 C ATOM 1100 CG1 VAL A 75 4.103 -5.680 -7.115 1.00 0.00 C ATOM 1101 CG2 VAL A 75 4.747 -6.911 -9.219 1.00 0.00 C ATOM 0 H VAL A 75 5.021 -7.544 -5.176 1.00 0.00 H new ATOM 0 HA VAL A 75 4.006 -9.119 -7.461 1.00 0.00 H new ATOM 0 HB VAL A 75 2.996 -7.241 -7.967 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.721 -4.897 -7.771 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.488 -5.733 -6.217 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.132 -5.450 -6.837 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.368 -6.032 -9.740 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.823 -6.813 -9.078 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.538 -7.802 -9.811 1.00 0.00 H new ATOM 1111 N VAL A 76 6.317 -9.574 -8.124 1.00 0.00 N ATOM 1112 CA VAL A 76 7.666 -10.016 -8.406 1.00 0.00 C ATOM 1113 C VAL A 76 7.696 -10.371 -9.887 1.00 0.00 C ATOM 1114 O VAL A 76 6.832 -11.095 -10.386 1.00 0.00 O ATOM 1115 CB VAL A 76 8.003 -11.208 -7.498 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.366 -11.815 -7.866 1.00 0.00 C ATOM 1117 CG2 VAL A 76 8.017 -10.860 -5.994 1.00 0.00 C ATOM 0 H VAL A 76 5.599 -10.102 -8.621 1.00 0.00 H new ATOM 0 HA VAL A 76 8.418 -9.253 -8.204 1.00 0.00 H new ATOM 0 HB VAL A 76 7.201 -11.927 -7.668 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.579 -12.657 -7.207 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.344 -12.160 -8.900 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.143 -11.059 -7.752 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.263 -11.751 -5.417 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.764 -10.089 -5.806 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.034 -10.494 -5.696 1.00 0.00 H new ATOM 1127 N ILE A 77 8.689 -9.837 -10.588 1.00 0.00 N ATOM 1128 CA ILE A 77 8.828 -9.927 -12.026 1.00 0.00 C ATOM 1129 C ILE A 77 10.134 -10.653 -12.285 1.00 0.00 C ATOM 1130 O ILE A 77 11.181 -10.231 -11.778 1.00 0.00 O ATOM 1131 CB ILE A 77 8.850 -8.506 -12.621 1.00 0.00 C ATOM 1132 CG1 ILE A 77 7.654 -7.638 -12.179 1.00 0.00 C ATOM 1133 CG2 ILE A 77 8.981 -8.525 -14.152 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.281 -8.157 -12.626 1.00 0.00 C ATOM 0 H ILE A 77 9.445 -9.311 -10.149 1.00 0.00 H new ATOM 0 HA ILE A 77 8.000 -10.464 -12.489 1.00 0.00 H new ATOM 0 HB ILE A 77 9.743 -8.034 -12.211 1.00 0.00 H new ATOM 0 HG12 ILE A 77 7.661 -7.561 -11.092 1.00 0.00 H new ATOM 0 HG13 ILE A 77 7.791 -6.630 -12.571 1.00 0.00 H new ATOM 0 HG21 ILE A 77 8.992 -7.502 -14.529 1.00 0.00 H new ATOM 0 HG22 ILE A 77 9.908 -9.025 -14.432 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.135 -9.061 -14.583 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.503 -7.482 -12.269 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.247 -8.206 -13.714 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.116 -9.152 -12.213 1.00 0.00 H new ATOM 1146 N SER A 78 10.075 -11.727 -13.053 1.00 0.00 N ATOM 1147 CA SER A 78 11.285 -12.339 -13.555 1.00 0.00 C ATOM 1148 C SER A 78 11.660 -11.563 -14.811 1.00 0.00 C ATOM 1149 O SER A 78 10.794 -11.085 -15.546 1.00 0.00 O ATOM 1150 CB SER A 78 11.090 -13.832 -13.828 1.00 0.00 C ATOM 1151 OG SER A 78 10.729 -14.504 -12.626 1.00 0.00 O ATOM 0 H SER A 78 9.210 -12.187 -13.338 1.00 0.00 H new ATOM 0 HA SER A 78 12.089 -12.291 -12.821 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.315 -13.974 -14.581 1.00 0.00 H new ATOM 0 HB3 SER A 78 12.008 -14.259 -14.231 1.00 0.00 H new ATOM 0 HG SER A 78 10.604 -15.459 -12.810 1.00 0.00 H new ATOM 1157 N LEU A 79 12.954 -11.396 -15.059 1.00 0.00 N ATOM 1158 CA LEU A 79 13.437 -10.827 -16.316 1.00 0.00 C ATOM 1159 C LEU A 79 14.167 -11.882 -17.143 1.00 0.00 C ATOM 1160 O LEU A 79 14.765 -11.550 -18.163 1.00 0.00 O ATOM 1161 CB LEU A 79 14.227 -9.535 -16.054 1.00 0.00 C ATOM 1162 CG LEU A 79 13.368 -8.389 -15.488 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.295 -7.208 -15.227 1.00 0.00 C ATOM 1164 CD2 LEU A 79 12.273 -7.939 -16.453 1.00 0.00 C ATOM 0 H LEU A 79 13.693 -11.648 -14.403 1.00 0.00 H new ATOM 0 HA LEU A 79 12.595 -10.522 -16.937 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.036 -9.750 -15.356 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.688 -9.206 -16.985 1.00 0.00 H new ATOM 0 HG LEU A 79 12.877 -8.745 -14.582 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.719 -6.375 -14.824 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.062 -7.499 -14.509 1.00 0.00 H new ATOM 0 HD13 LEU A 79 14.768 -6.904 -16.161 1.00 0.00 H new ATOM 0 HD21 LEU A 79 11.700 -7.130 -16.001 1.00 0.00 H new ATOM 0 HD22 LEU A 79 12.727 -7.589 -17.380 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.610 -8.777 -16.668 1.00 0.00 H new ATOM 1176 N CYS A 80 14.172 -13.136 -16.697 1.00 0.00 N ATOM 1177 CA CYS A 80 14.614 -14.279 -17.467 1.00 0.00 C ATOM 1178 C CYS A 80 13.931 -15.533 -16.914 1.00 0.00 C ATOM 1179 O CYS A 80 13.715 -15.623 -15.706 1.00 0.00 O ATOM 1180 CB CYS A 80 16.151 -14.385 -17.486 1.00 0.00 C ATOM 1181 SG CYS A 80 17.027 -14.347 -15.891 1.00 0.00 S ATOM 0 H CYS A 80 13.857 -13.384 -15.759 1.00 0.00 H new ATOM 0 HA CYS A 80 14.322 -14.163 -18.511 1.00 0.00 H new ATOM 0 HB2 CYS A 80 16.416 -15.314 -17.991 1.00 0.00 H new ATOM 0 HB3 CYS A 80 16.535 -13.569 -18.098 1.00 0.00 H new ATOM 1186 N GLY A 81 13.642 -16.505 -17.788 1.00 0.00 N ATOM 1187 CA GLY A 81 13.194 -17.851 -17.434 1.00 0.00 C ATOM 1188 C GLY A 81 11.972 -17.911 -16.504 1.00 0.00 C ATOM 1189 O GLY A 81 11.166 -16.979 -16.419 1.00 0.00 O ATOM 0 H GLY A 81 13.717 -16.368 -18.796 1.00 0.00 H new ATOM 0 HA2 GLY A 81 12.959 -18.391 -18.351 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.020 -18.378 -16.956 1.00 0.00 H new ATOM 1193 N SER A 82 11.868 -19.045 -15.805 1.00 0.00 N ATOM 1194 CA SER A 82 10.875 -19.339 -14.773 1.00 0.00 C ATOM 1195 C SER A 82 11.589 -20.219 -13.742 1.00 0.00 C ATOM 1196 O SER A 82 12.220 -21.206 -14.129 1.00 0.00 O ATOM 1197 CB SER A 82 9.663 -20.077 -15.377 1.00 0.00 C ATOM 1198 OG SER A 82 9.043 -19.329 -16.417 1.00 0.00 O ATOM 0 H SER A 82 12.510 -19.823 -15.954 1.00 0.00 H new ATOM 0 HA SER A 82 10.490 -18.426 -14.318 1.00 0.00 H new ATOM 0 HB2 SER A 82 9.985 -21.042 -15.768 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.934 -20.278 -14.592 1.00 0.00 H new ATOM 0 HG SER A 82 8.281 -19.833 -16.773 1.00 0.00 H new ATOM 1204 N GLY A 83 11.554 -19.850 -12.452 1.00 0.00 N ATOM 1205 CA GLY A 83 12.360 -20.525 -11.428 1.00 0.00 C ATOM 1206 C GLY A 83 13.843 -20.430 -11.793 1.00 0.00 C ATOM 1207 O GLY A 83 14.560 -21.427 -11.737 1.00 0.00 O ATOM 0 H GLY A 83 10.976 -19.089 -12.096 1.00 0.00 H new ATOM 0 HA2 GLY A 83 12.185 -20.068 -10.454 1.00 0.00 H new ATOM 0 HA3 GLY A 83 12.062 -21.570 -11.347 1.00 0.00 H new ATOM 1211 N VAL A 84 14.285 -19.239 -12.216 1.00 0.00 N ATOM 1212 CA VAL A 84 15.592 -18.974 -12.831 1.00 0.00 C ATOM 1213 C VAL A 84 16.738 -18.974 -11.792 1.00 0.00 C ATOM 1214 O VAL A 84 17.383 -17.961 -11.530 1.00 0.00 O ATOM 1215 CB VAL A 84 15.417 -17.735 -13.758 1.00 0.00 C ATOM 1216 CG1 VAL A 84 15.397 -16.365 -13.046 1.00 0.00 C ATOM 1217 CG2 VAL A 84 16.387 -17.737 -14.943 1.00 0.00 C ATOM 0 H VAL A 84 13.716 -18.396 -12.135 1.00 0.00 H new ATOM 0 HA VAL A 84 15.935 -19.780 -13.480 1.00 0.00 H new ATOM 0 HB VAL A 84 14.407 -17.860 -14.148 1.00 0.00 H new ATOM 0 HG11 VAL A 84 15.271 -15.573 -13.784 1.00 0.00 H new ATOM 0 HG12 VAL A 84 14.570 -16.336 -12.337 1.00 0.00 H new ATOM 0 HG13 VAL A 84 16.337 -16.218 -12.513 1.00 0.00 H new ATOM 0 HG21 VAL A 84 16.218 -16.850 -15.553 1.00 0.00 H new ATOM 0 HG22 VAL A 84 17.413 -17.733 -14.574 1.00 0.00 H new ATOM 0 HG23 VAL A 84 16.222 -18.629 -15.547 1.00 0.00 H new ATOM 1227 N ASN A 85 16.978 -20.138 -11.174 1.00 0.00 N ATOM 1228 CA ASN A 85 17.857 -20.331 -10.010 1.00 0.00 C ATOM 1229 C ASN A 85 17.361 -19.411 -8.890 1.00 0.00 C ATOM 1230 O ASN A 85 18.082 -18.566 -8.355 1.00 0.00 O ATOM 1231 CB ASN A 85 19.352 -20.168 -10.350 1.00 0.00 C ATOM 1232 CG ASN A 85 20.238 -20.509 -9.149 1.00 0.00 C ATOM 1233 OD1 ASN A 85 19.866 -21.290 -8.272 1.00 0.00 O ATOM 1234 ND2 ASN A 85 21.447 -19.973 -9.090 1.00 0.00 N ATOM 0 H ASN A 85 16.547 -21.009 -11.484 1.00 0.00 H new ATOM 0 HA ASN A 85 17.797 -21.363 -9.664 1.00 0.00 H new ATOM 0 HB2 ASN A 85 19.609 -20.815 -11.189 1.00 0.00 H new ATOM 0 HB3 ASN A 85 19.545 -19.143 -10.667 1.00 0.00 H new ATOM 0 HD21 ASN A 85 22.071 -20.207 -8.318 1.00 0.00 H new ATOM 0 HD22 ASN A 85 21.754 -19.326 -9.817 1.00 0.00 H new ATOM 1241 N LEU A 86 16.060 -19.553 -8.611 1.00 0.00 N ATOM 1242 CA LEU A 86 15.262 -18.672 -7.772 1.00 0.00 C ATOM 1243 C LEU A 86 14.246 -19.521 -6.990 1.00 0.00 C ATOM 1244 O LEU A 86 13.666 -20.430 -7.589 1.00 0.00 O ATOM 1245 CB LEU A 86 14.608 -17.656 -8.738 1.00 0.00 C ATOM 1246 CG LEU A 86 13.365 -16.914 -8.219 1.00 0.00 C ATOM 1247 CD1 LEU A 86 13.351 -15.469 -8.733 1.00 0.00 C ATOM 1248 CD2 LEU A 86 12.104 -17.604 -8.761 1.00 0.00 C ATOM 0 H LEU A 86 15.514 -20.328 -8.987 1.00 0.00 H new ATOM 0 HA LEU A 86 15.840 -18.131 -7.023 1.00 0.00 H new ATOM 0 HB2 LEU A 86 15.358 -16.914 -9.011 1.00 0.00 H new ATOM 0 HB3 LEU A 86 14.333 -18.183 -9.652 1.00 0.00 H new ATOM 0 HG LEU A 86 13.388 -16.925 -7.129 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.465 -14.958 -8.357 1.00 0.00 H new ATOM 0 HD12 LEU A 86 14.244 -14.950 -8.385 1.00 0.00 H new ATOM 0 HD13 LEU A 86 13.334 -15.471 -9.823 1.00 0.00 H new ATOM 0 HD21 LEU A 86 11.219 -17.083 -8.397 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.116 -17.580 -9.851 1.00 0.00 H new ATOM 0 HD23 LEU A 86 12.081 -18.639 -8.421 1.00 0.00 H new ATOM 1260 N PRO A 87 14.002 -19.250 -5.690 1.00 0.00 N ATOM 1261 CA PRO A 87 12.993 -19.974 -4.919 1.00 0.00 C ATOM 1262 C PRO A 87 11.574 -19.715 -5.459 1.00 0.00 C ATOM 1263 O PRO A 87 11.263 -18.575 -5.816 1.00 0.00 O ATOM 1264 CB PRO A 87 13.164 -19.534 -3.459 1.00 0.00 C ATOM 1265 CG PRO A 87 14.585 -18.975 -3.404 1.00 0.00 C ATOM 1266 CD PRO A 87 14.798 -18.408 -4.805 1.00 0.00 C ATOM 0 HA PRO A 87 13.129 -21.052 -5.002 1.00 0.00 H new ATOM 0 HB2 PRO A 87 12.428 -18.780 -3.181 1.00 0.00 H new ATOM 0 HB3 PRO A 87 13.038 -20.371 -2.773 1.00 0.00 H new ATOM 0 HG2 PRO A 87 14.684 -18.204 -2.640 1.00 0.00 H new ATOM 0 HG3 PRO A 87 15.313 -19.752 -3.170 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.478 -17.367 -4.860 1.00 0.00 H new ATOM 0 HD3 PRO A 87 15.852 -18.433 -5.083 1.00 0.00 H new ATOM 1274 N PRO A 88 10.696 -20.727 -5.533 1.00 0.00 N ATOM 1275 CA PRO A 88 9.422 -20.611 -6.230 1.00 0.00 C ATOM 1276 C PRO A 88 8.442 -19.633 -5.595 1.00 0.00 C ATOM 1277 O PRO A 88 7.647 -19.067 -6.338 1.00 0.00 O ATOM 1278 CB PRO A 88 8.852 -22.031 -6.297 1.00 0.00 C ATOM 1279 CG PRO A 88 9.492 -22.722 -5.093 1.00 0.00 C ATOM 1280 CD PRO A 88 10.879 -22.086 -5.044 1.00 0.00 C ATOM 0 HA PRO A 88 9.586 -20.187 -7.221 1.00 0.00 H new ATOM 0 HB2 PRO A 88 7.764 -22.032 -6.230 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.114 -22.526 -7.232 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.931 -22.542 -4.176 1.00 0.00 H new ATOM 0 HG3 PRO A 88 9.546 -23.802 -5.227 1.00 0.00 H new ATOM 0 HD2 PRO A 88 11.277 -22.089 -4.029 1.00 0.00 H new ATOM 0 HD3 PRO A 88 11.586 -22.636 -5.665 1.00 0.00 H new ATOM 1288 N GLU A 89 8.508 -19.332 -4.299 1.00 0.00 N ATOM 1289 CA GLU A 89 7.590 -18.369 -3.700 1.00 0.00 C ATOM 1290 C GLU A 89 7.735 -16.973 -4.326 1.00 0.00 C ATOM 1291 O GLU A 89 6.824 -16.150 -4.219 1.00 0.00 O ATOM 1292 CB GLU A 89 7.751 -18.323 -2.171 1.00 0.00 C ATOM 1293 CG GLU A 89 9.169 -17.999 -1.665 1.00 0.00 C ATOM 1294 CD GLU A 89 9.968 -19.266 -1.303 1.00 0.00 C ATOM 1295 OE1 GLU A 89 10.176 -20.134 -2.183 1.00 0.00 O ATOM 1296 OE2 GLU A 89 10.389 -19.401 -0.126 1.00 0.00 O ATOM 0 H GLU A 89 9.182 -19.738 -3.650 1.00 0.00 H new ATOM 0 HA GLU A 89 6.577 -18.709 -3.915 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.062 -17.578 -1.773 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.449 -19.287 -1.762 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.706 -17.441 -2.431 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.101 -17.353 -0.789 1.00 0.00 H new ATOM 1303 N TRP A 90 8.849 -16.702 -5.012 1.00 0.00 N ATOM 1304 CA TRP A 90 9.045 -15.468 -5.750 1.00 0.00 C ATOM 1305 C TRP A 90 8.296 -15.490 -7.082 1.00 0.00 C ATOM 1306 O TRP A 90 7.704 -14.485 -7.468 1.00 0.00 O ATOM 1307 CB TRP A 90 10.550 -15.249 -5.923 1.00 0.00 C ATOM 1308 CG TRP A 90 11.256 -14.971 -4.630 1.00 0.00 C ATOM 1309 CD1 TRP A 90 12.038 -15.832 -3.946 1.00 0.00 C ATOM 1310 CD2 TRP A 90 11.170 -13.783 -3.793 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.408 -15.274 -2.735 1.00 0.00 N ATOM 1312 CE2 TRP A 90 11.849 -14.025 -2.565 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.539 -12.535 -3.941 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 11.870 -13.081 -1.526 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.531 -11.588 -2.905 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.200 -11.857 -1.699 1.00 0.00 C ATOM 0 H TRP A 90 9.641 -17.342 -5.066 1.00 0.00 H new ATOM 0 HA TRP A 90 8.628 -14.627 -5.196 1.00 0.00 H new ATOM 0 HB2 TRP A 90 10.989 -16.132 -6.387 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.714 -14.416 -6.606 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.332 -16.812 -4.292 1.00 0.00 H new ATOM 0 HE1 TRP A 90 13.017 -15.729 -2.055 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.049 -12.300 -4.874 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.394 -13.292 -0.606 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.010 -10.651 -3.035 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.200 -11.124 -0.906 1.00 0.00 H new ATOM 1327 N VAL A 91 8.271 -16.630 -7.772 1.00 0.00 N ATOM 1328 CA VAL A 91 7.627 -16.755 -9.075 1.00 0.00 C ATOM 1329 C VAL A 91 6.103 -16.903 -8.943 1.00 0.00 C ATOM 1330 O VAL A 91 5.410 -16.895 -9.959 1.00 0.00 O ATOM 1331 CB VAL A 91 8.338 -17.831 -9.933 1.00 0.00 C ATOM 1332 CG1 VAL A 91 7.829 -19.267 -9.751 1.00 0.00 C ATOM 1333 CG2 VAL A 91 8.288 -17.484 -11.425 1.00 0.00 C ATOM 0 H VAL A 91 8.699 -17.494 -7.440 1.00 0.00 H new ATOM 0 HA VAL A 91 7.747 -15.827 -9.634 1.00 0.00 H new ATOM 0 HB VAL A 91 9.362 -17.813 -9.559 1.00 0.00 H new ATOM 0 HG11 VAL A 91 8.395 -19.938 -10.397 1.00 0.00 H new ATOM 0 HG12 VAL A 91 7.958 -19.570 -8.712 1.00 0.00 H new ATOM 0 HG13 VAL A 91 6.772 -19.315 -10.014 1.00 0.00 H new ATOM 0 HG21 VAL A 91 8.796 -18.261 -11.996 1.00 0.00 H new ATOM 0 HG22 VAL A 91 7.249 -17.417 -11.748 1.00 0.00 H new ATOM 0 HG23 VAL A 91 8.783 -16.527 -11.593 1.00 0.00 H new ATOM 1343 N THR A 92 5.558 -17.007 -7.724 1.00 0.00 N ATOM 1344 CA THR A 92 4.134 -17.243 -7.512 1.00 0.00 C ATOM 1345 C THR A 92 3.393 -16.083 -6.834 1.00 0.00 C ATOM 1346 O THR A 92 2.300 -16.291 -6.292 1.00 0.00 O ATOM 1347 CB THR A 92 3.981 -18.568 -6.741 1.00 0.00 C ATOM 1348 OG1 THR A 92 4.628 -18.479 -5.480 1.00 0.00 O ATOM 1349 CG2 THR A 92 4.595 -19.744 -7.502 1.00 0.00 C ATOM 0 H THR A 92 6.096 -16.929 -6.861 1.00 0.00 H new ATOM 0 HA THR A 92 3.652 -17.314 -8.487 1.00 0.00 H new ATOM 0 HB THR A 92 2.912 -18.740 -6.618 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.523 -19.326 -4.998 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.466 -20.659 -6.924 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.100 -19.851 -8.467 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.658 -19.561 -7.658 1.00 0.00 H new ATOM 1357 N GLN A 93 3.954 -14.864 -6.833 1.00 0.00 N ATOM 1358 CA GLN A 93 3.287 -13.723 -6.216 1.00 0.00 C ATOM 1359 C GLN A 93 2.020 -13.311 -6.991 1.00 0.00 C ATOM 1360 O GLN A 93 1.732 -13.869 -8.055 1.00 0.00 O ATOM 1361 CB GLN A 93 4.289 -12.585 -5.933 1.00 0.00 C ATOM 1362 CG GLN A 93 5.252 -12.962 -4.792 1.00 0.00 C ATOM 1363 CD GLN A 93 4.509 -13.407 -3.523 1.00 0.00 C ATOM 1364 OE1 GLN A 93 3.552 -12.770 -3.090 1.00 0.00 O ATOM 1365 NE2 GLN A 93 4.872 -14.546 -2.949 1.00 0.00 N ATOM 0 H GLN A 93 4.860 -14.651 -7.250 1.00 0.00 H new ATOM 0 HA GLN A 93 2.911 -14.017 -5.236 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.859 -12.366 -6.836 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.747 -11.677 -5.670 1.00 0.00 H new ATOM 0 HG2 GLN A 93 5.910 -13.765 -5.125 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.886 -12.107 -4.558 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.668 -15.070 -3.314 1.00 0.00 H new ATOM 0 HE22 GLN A 93 4.356 -14.898 -2.143 1.00 0.00 H new ATOM 1374 N GLU A 94 1.253 -12.350 -6.448 1.00 0.00 N ATOM 1375 CA GLU A 94 -0.096 -11.997 -6.921 1.00 0.00 C ATOM 1376 C GLU A 94 -0.136 -11.690 -8.424 1.00 0.00 C ATOM 1377 O GLU A 94 -1.137 -11.966 -9.090 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.662 -10.810 -6.119 1.00 0.00 C ATOM 1379 CG GLU A 94 -0.830 -11.095 -4.615 1.00 0.00 C ATOM 1380 CD GLU A 94 -1.812 -12.249 -4.344 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -3.045 -12.026 -4.407 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -1.362 -13.384 -4.056 1.00 0.00 O ATOM 0 H GLU A 94 1.559 -11.787 -5.654 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.723 -12.873 -6.756 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.002 -9.952 -6.244 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.630 -10.531 -6.536 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.141 -11.338 -4.183 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.185 -10.194 -4.114 1.00 0.00 H new ATOM 1389 N ILE A 95 0.960 -11.148 -8.955 1.00 0.00 N ATOM 1390 CA ILE A 95 1.215 -11.005 -10.374 1.00 0.00 C ATOM 1391 C ILE A 95 2.633 -11.549 -10.560 1.00 0.00 C ATOM 1392 O ILE A 95 3.569 -11.118 -9.877 1.00 0.00 O ATOM 1393 CB ILE A 95 0.994 -9.559 -10.887 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.542 -9.384 -12.325 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.607 -8.525 -9.930 1.00 0.00 C ATOM 1396 CD1 ILE A 95 1.009 -8.145 -13.067 1.00 0.00 C ATOM 0 H ILE A 95 1.720 -10.785 -8.379 1.00 0.00 H new ATOM 0 HA ILE A 95 0.507 -11.562 -10.987 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.081 -9.383 -10.917 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.629 -9.325 -12.281 1.00 0.00 H new ATOM 0 HG13 ILE A 95 1.294 -10.273 -12.905 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.434 -7.522 -10.319 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.143 -8.618 -8.948 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.679 -8.701 -9.843 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.446 -8.103 -14.065 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.076 -8.208 -13.148 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.280 -7.245 -12.514 1.00 0.00 H new ATOM 1408 N PHE A 96 2.761 -12.522 -11.458 1.00 0.00 N ATOM 1409 CA PHE A 96 4.027 -13.027 -11.956 1.00 0.00 C ATOM 1410 C PHE A 96 4.051 -12.627 -13.436 1.00 0.00 C ATOM 1411 O PHE A 96 3.055 -12.829 -14.142 1.00 0.00 O ATOM 1412 CB PHE A 96 4.159 -14.544 -11.758 1.00 0.00 C ATOM 1413 CG PHE A 96 5.124 -15.201 -12.736 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.470 -14.790 -12.792 1.00 0.00 C ATOM 1415 CD2 PHE A 96 4.658 -16.168 -13.650 1.00 0.00 C ATOM 1416 CE1 PHE A 96 7.329 -15.316 -13.774 1.00 0.00 C ATOM 1417 CE2 PHE A 96 5.529 -16.717 -14.610 1.00 0.00 C ATOM 1418 CZ PHE A 96 6.864 -16.285 -14.678 1.00 0.00 C ATOM 0 H PHE A 96 1.956 -12.993 -11.870 1.00 0.00 H new ATOM 0 HA PHE A 96 4.875 -12.610 -11.413 1.00 0.00 H new ATOM 0 HB2 PHE A 96 4.495 -14.742 -10.740 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.176 -15.004 -11.865 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.843 -14.069 -12.079 1.00 0.00 H new ATOM 0 HD2 PHE A 96 3.628 -16.489 -13.613 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.351 -14.973 -13.833 1.00 0.00 H new ATOM 0 HE2 PHE A 96 5.171 -17.471 -15.295 1.00 0.00 H new ATOM 0 HZ PHE A 96 7.530 -16.696 -15.422 1.00 0.00 H new ATOM 1428 N GLU A 97 5.167 -12.072 -13.903 1.00 0.00 N ATOM 1429 CA GLU A 97 5.435 -11.833 -15.313 1.00 0.00 C ATOM 1430 C GLU A 97 6.891 -12.229 -15.553 1.00 0.00 C ATOM 1431 O GLU A 97 7.719 -12.134 -14.637 1.00 0.00 O ATOM 1432 CB GLU A 97 5.250 -10.351 -15.703 1.00 0.00 C ATOM 1433 CG GLU A 97 3.838 -9.763 -15.535 1.00 0.00 C ATOM 1434 CD GLU A 97 2.833 -10.161 -16.641 1.00 0.00 C ATOM 1435 OE1 GLU A 97 2.964 -11.235 -17.277 1.00 0.00 O ATOM 1436 OE2 GLU A 97 1.867 -9.387 -16.861 1.00 0.00 O ATOM 0 H GLU A 97 5.927 -11.770 -13.293 1.00 0.00 H new ATOM 0 HA GLU A 97 4.735 -12.412 -15.916 1.00 0.00 H new ATOM 0 HB2 GLU A 97 5.940 -9.754 -15.107 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.545 -10.234 -16.746 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.440 -10.080 -14.571 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.914 -8.676 -15.507 1.00 0.00 H new ATOM 1443 N ASP A 98 7.195 -12.641 -16.780 1.00 0.00 N ATOM 1444 CA ASP A 98 8.553 -12.844 -17.261 1.00 0.00 C ATOM 1445 C ASP A 98 8.673 -12.131 -18.602 1.00 0.00 C ATOM 1446 O ASP A 98 7.769 -12.256 -19.437 1.00 0.00 O ATOM 1447 CB ASP A 98 8.941 -14.312 -17.404 1.00 0.00 C ATOM 1448 CG ASP A 98 10.304 -14.387 -18.121 1.00 0.00 C ATOM 1449 OD1 ASP A 98 11.292 -13.816 -17.600 1.00 0.00 O ATOM 1450 OD2 ASP A 98 10.367 -14.968 -19.235 1.00 0.00 O ATOM 0 H ASP A 98 6.485 -12.847 -17.483 1.00 0.00 H new ATOM 0 HA ASP A 98 9.243 -12.436 -16.522 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.001 -14.786 -16.424 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.183 -14.851 -17.972 1.00 0.00 H new ATOM 1455 N TRP A 99 9.761 -11.385 -18.814 1.00 0.00 N ATOM 1456 CA TRP A 99 9.944 -10.568 -20.005 1.00 0.00 C ATOM 1457 C TRP A 99 11.209 -11.004 -20.741 1.00 0.00 C ATOM 1458 O TRP A 99 12.262 -11.188 -20.125 1.00 0.00 O ATOM 1459 CB TRP A 99 10.014 -9.069 -19.651 1.00 0.00 C ATOM 1460 CG TRP A 99 8.846 -8.435 -18.939 1.00 0.00 C ATOM 1461 CD1 TRP A 99 8.966 -7.538 -17.933 1.00 0.00 C ATOM 1462 CD2 TRP A 99 7.404 -8.542 -19.185 1.00 0.00 C ATOM 1463 NE1 TRP A 99 7.722 -7.108 -17.526 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.720 -7.680 -18.273 1.00 0.00 C ATOM 1465 CE3 TRP A 99 6.597 -9.245 -20.108 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 5.325 -7.532 -18.268 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 5.194 -9.113 -20.105 1.00 0.00 C ATOM 1468 CH2 TRP A 99 4.556 -8.260 -19.189 1.00 0.00 C ATOM 0 H TRP A 99 10.540 -11.334 -18.158 1.00 0.00 H new ATOM 0 HA TRP A 99 9.082 -10.713 -20.657 1.00 0.00 H new ATOM 0 HB2 TRP A 99 10.899 -8.917 -19.033 1.00 0.00 H new ATOM 0 HB3 TRP A 99 10.174 -8.518 -20.578 1.00 0.00 H new ATOM 0 HD1 TRP A 99 9.903 -7.207 -17.510 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.564 -6.447 -16.765 1.00 0.00 H new ATOM 0 HE3 TRP A 99 7.065 -9.897 -20.831 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.849 -6.866 -17.564 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 4.603 -9.673 -20.814 1.00 0.00 H new ATOM 0 HH2 TRP A 99 3.480 -8.165 -19.194 1.00 0.00 H new ATOM 1479 N GLN A 100 11.138 -11.060 -22.074 1.00 0.00 N ATOM 1480 CA GLN A 100 12.302 -11.248 -22.933 1.00 0.00 C ATOM 1481 C GLN A 100 12.958 -9.873 -23.123 1.00 0.00 C ATOM 1482 O GLN A 100 12.944 -9.307 -24.217 1.00 0.00 O ATOM 1483 CB GLN A 100 11.874 -11.961 -24.235 1.00 0.00 C ATOM 1484 CG GLN A 100 13.051 -12.470 -25.091 1.00 0.00 C ATOM 1485 CD GLN A 100 13.801 -13.629 -24.428 1.00 0.00 C ATOM 1486 OE1 GLN A 100 14.686 -13.415 -23.600 1.00 0.00 O ATOM 1487 NE2 GLN A 100 13.455 -14.871 -24.735 1.00 0.00 N ATOM 0 H GLN A 100 10.261 -10.975 -22.588 1.00 0.00 H new ATOM 0 HA GLN A 100 13.055 -11.902 -22.494 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.233 -12.805 -23.980 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.275 -11.274 -24.833 1.00 0.00 H new ATOM 0 HG2 GLN A 100 12.677 -12.792 -26.063 1.00 0.00 H new ATOM 0 HG3 GLN A 100 13.745 -11.649 -25.273 1.00 0.00 H new ATOM 0 HE21 GLN A 100 12.721 -15.041 -25.422 1.00 0.00 H new ATOM 0 HE22 GLN A 100 13.923 -15.657 -24.284 1.00 0.00 H new ATOM 1496 N LEU A 101 13.446 -9.284 -22.023 1.00 0.00 N ATOM 1497 CA LEU A 101 13.970 -7.921 -22.016 1.00 0.00 C ATOM 1498 C LEU A 101 15.249 -7.878 -22.844 1.00 0.00 C ATOM 1499 O LEU A 101 16.173 -8.658 -22.616 1.00 0.00 O ATOM 1500 CB LEU A 101 14.224 -7.415 -20.578 1.00 0.00 C ATOM 1501 CG LEU A 101 13.707 -5.984 -20.340 1.00 0.00 C ATOM 1502 CD1 LEU A 101 12.173 -5.968 -20.243 1.00 0.00 C ATOM 1503 CD2 LEU A 101 14.290 -5.422 -19.040 1.00 0.00 C ATOM 0 H LEU A 101 13.486 -9.744 -21.114 1.00 0.00 H new ATOM 0 HA LEU A 101 13.228 -7.256 -22.456 1.00 0.00 H new ATOM 0 HB2 LEU A 101 13.743 -8.091 -19.871 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.294 -7.447 -20.372 1.00 0.00 H new ATOM 0 HG LEU A 101 14.021 -5.369 -21.184 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.830 -4.947 -20.075 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.746 -6.346 -21.172 1.00 0.00 H new ATOM 0 HD13 LEU A 101 11.854 -6.599 -19.414 1.00 0.00 H new ATOM 0 HD21 LEU A 101 13.918 -4.410 -18.882 1.00 0.00 H new ATOM 0 HD22 LEU A 101 13.990 -6.054 -18.204 1.00 0.00 H new ATOM 0 HD23 LEU A 101 15.378 -5.402 -19.108 1.00 0.00 H new ATOM 1515 N GLU A 102 15.297 -6.952 -23.795 1.00 0.00 N ATOM 1516 CA GLU A 102 16.503 -6.622 -24.527 1.00 0.00 C ATOM 1517 C GLU A 102 17.369 -5.759 -23.601 1.00 0.00 C ATOM 1518 O GLU A 102 16.857 -5.178 -22.639 1.00 0.00 O ATOM 1519 CB GLU A 102 16.150 -5.937 -25.856 1.00 0.00 C ATOM 1520 CG GLU A 102 15.497 -6.926 -26.834 1.00 0.00 C ATOM 1521 CD GLU A 102 15.056 -6.233 -28.133 1.00 0.00 C ATOM 1522 OE1 GLU A 102 15.869 -6.150 -29.086 1.00 0.00 O ATOM 1523 OE2 GLU A 102 13.890 -5.775 -28.202 1.00 0.00 O ATOM 0 H GLU A 102 14.485 -6.404 -24.079 1.00 0.00 H new ATOM 0 HA GLU A 102 17.069 -7.511 -24.805 1.00 0.00 H new ATOM 0 HB2 GLU A 102 15.472 -5.104 -25.670 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.052 -5.520 -26.304 1.00 0.00 H new ATOM 0 HG2 GLU A 102 16.201 -7.724 -27.068 1.00 0.00 H new ATOM 0 HG3 GLU A 102 14.634 -7.392 -26.359 1.00 0.00 H new ATOM 1530 N ASP A 103 18.675 -5.680 -23.856 1.00 0.00 N ATOM 1531 CA ASP A 103 19.620 -5.043 -22.953 1.00 0.00 C ATOM 1532 C ASP A 103 20.792 -4.419 -23.725 1.00 0.00 C ATOM 1533 O ASP A 103 21.272 -5.043 -24.677 1.00 0.00 O ATOM 1534 CB ASP A 103 20.129 -6.062 -21.939 1.00 0.00 C ATOM 1535 CG ASP A 103 21.029 -5.343 -20.939 1.00 0.00 C ATOM 1536 OD1 ASP A 103 20.501 -4.828 -19.930 1.00 0.00 O ATOM 1537 OD2 ASP A 103 22.246 -5.237 -21.192 1.00 0.00 O ATOM 0 H ASP A 103 19.104 -6.059 -24.700 1.00 0.00 H new ATOM 0 HA ASP A 103 19.107 -4.239 -22.426 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.292 -6.534 -21.424 1.00 0.00 H new ATOM 0 HB3 ASP A 103 20.681 -6.855 -22.444 1.00 0.00 H new ATOM 1542 N PRO A 104 21.244 -3.200 -23.370 1.00 0.00 N ATOM 1543 CA PRO A 104 22.236 -2.455 -24.139 1.00 0.00 C ATOM 1544 C PRO A 104 23.704 -2.691 -23.707 1.00 0.00 C ATOM 1545 O PRO A 104 24.578 -1.953 -24.166 1.00 0.00 O ATOM 1546 CB PRO A 104 21.793 -1.005 -23.963 1.00 0.00 C ATOM 1547 CG PRO A 104 21.336 -0.968 -22.508 1.00 0.00 C ATOM 1548 CD PRO A 104 20.645 -2.322 -22.369 1.00 0.00 C ATOM 0 HA PRO A 104 22.261 -2.779 -25.179 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.609 -0.307 -24.149 1.00 0.00 H new ATOM 0 HB3 PRO A 104 20.987 -0.742 -24.648 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.173 -0.862 -21.818 1.00 0.00 H new ATOM 0 HG3 PRO A 104 20.656 -0.139 -22.313 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.783 -2.726 -21.366 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.571 -2.227 -22.529 1.00 0.00 H new ATOM 1556 N ASP A 105 24.010 -3.658 -22.835 1.00 0.00 N ATOM 1557 CA ASP A 105 25.387 -3.958 -22.425 1.00 0.00 C ATOM 1558 C ASP A 105 26.293 -4.197 -23.641 1.00 0.00 C ATOM 1559 O ASP A 105 25.965 -5.001 -24.521 1.00 0.00 O ATOM 1560 CB ASP A 105 25.438 -5.197 -21.519 1.00 0.00 C ATOM 1561 CG ASP A 105 26.878 -5.724 -21.338 1.00 0.00 C ATOM 1562 OD1 ASP A 105 27.642 -5.157 -20.521 1.00 0.00 O ATOM 1563 OD2 ASP A 105 27.257 -6.711 -22.016 1.00 0.00 O ATOM 0 H ASP A 105 23.310 -4.255 -22.394 1.00 0.00 H new ATOM 0 HA ASP A 105 25.748 -3.090 -21.873 1.00 0.00 H new ATOM 0 HB2 ASP A 105 25.017 -4.951 -20.544 1.00 0.00 H new ATOM 0 HB3 ASP A 105 24.815 -5.983 -21.945 1.00 0.00 H new ATOM 1568 N GLY A 106 27.430 -3.492 -23.683 1.00 0.00 N ATOM 1569 CA GLY A 106 28.517 -3.736 -24.624 1.00 0.00 C ATOM 1570 C GLY A 106 28.173 -3.512 -26.100 1.00 0.00 C ATOM 1571 O GLY A 106 28.803 -4.136 -26.957 1.00 0.00 O ATOM 0 H GLY A 106 27.619 -2.718 -23.046 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.354 -3.089 -24.362 1.00 0.00 H new ATOM 0 HA3 GLY A 106 28.858 -4.764 -24.500 1.00 0.00 H new ATOM 1575 N GLN A 107 27.180 -2.671 -26.412 1.00 0.00 N ATOM 1576 CA GLN A 107 26.732 -2.411 -27.785 1.00 0.00 C ATOM 1577 C GLN A 107 26.362 -0.933 -27.982 1.00 0.00 C ATOM 1578 O GLN A 107 26.672 -0.088 -27.136 1.00 0.00 O ATOM 1579 CB GLN A 107 25.634 -3.420 -28.174 1.00 0.00 C ATOM 1580 CG GLN A 107 24.390 -3.347 -27.296 1.00 0.00 C ATOM 1581 CD GLN A 107 23.624 -4.669 -27.357 1.00 0.00 C ATOM 1582 OE1 GLN A 107 22.800 -4.901 -28.236 1.00 0.00 O ATOM 1583 NE2 GLN A 107 23.933 -5.594 -26.459 1.00 0.00 N ATOM 0 H GLN A 107 26.659 -2.146 -25.710 1.00 0.00 H new ATOM 0 HA GLN A 107 27.550 -2.575 -28.486 1.00 0.00 H new ATOM 0 HB2 GLN A 107 25.346 -3.247 -29.211 1.00 0.00 H new ATOM 0 HB3 GLN A 107 26.045 -4.428 -28.122 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.675 -3.130 -26.266 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.749 -2.531 -27.628 1.00 0.00 H new ATOM 0 HE21 GLN A 107 24.619 -5.390 -25.733 1.00 0.00 H new ATOM 0 HE22 GLN A 107 23.484 -6.509 -26.495 1.00 0.00 H new ATOM 1592 N SER A 108 25.720 -0.620 -29.110 1.00 0.00 N ATOM 1593 CA SER A 108 25.505 0.740 -29.581 1.00 0.00 C ATOM 1594 C SER A 108 24.542 1.597 -28.753 1.00 0.00 C ATOM 1595 O SER A 108 23.609 1.092 -28.125 1.00 0.00 O ATOM 1596 CB SER A 108 25.079 0.690 -31.063 1.00 0.00 C ATOM 1597 OG SER A 108 25.848 -0.274 -31.781 1.00 0.00 O ATOM 0 H SER A 108 25.328 -1.326 -29.733 1.00 0.00 H new ATOM 0 HA SER A 108 26.459 1.254 -29.459 1.00 0.00 H new ATOM 0 HB2 SER A 108 24.020 0.442 -31.133 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.207 1.673 -31.516 1.00 0.00 H new ATOM 0 HG SER A 108 25.560 -0.290 -32.718 1.00 0.00 H new ATOM 1603 N LEU A 109 24.718 2.923 -28.859 1.00 0.00 N ATOM 1604 CA LEU A 109 23.888 3.973 -28.263 1.00 0.00 C ATOM 1605 C LEU A 109 22.419 3.824 -28.653 1.00 0.00 C ATOM 1606 O LEU A 109 21.532 4.079 -27.843 1.00 0.00 O ATOM 1607 CB LEU A 109 24.466 5.317 -28.748 1.00 0.00 C ATOM 1608 CG LEU A 109 23.809 6.572 -28.148 1.00 0.00 C ATOM 1609 CD1 LEU A 109 23.904 6.589 -26.622 1.00 0.00 C ATOM 1610 CD2 LEU A 109 24.510 7.807 -28.718 1.00 0.00 C ATOM 0 H LEU A 109 25.493 3.311 -29.397 1.00 0.00 H new ATOM 0 HA LEU A 109 23.911 3.909 -27.175 1.00 0.00 H new ATOM 0 HB2 LEU A 109 25.531 5.340 -28.517 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.374 5.363 -29.833 1.00 0.00 H new ATOM 0 HG LEU A 109 22.751 6.569 -28.411 1.00 0.00 H new ATOM 0 HD11 LEU A 109 23.428 7.491 -26.238 1.00 0.00 H new ATOM 0 HD12 LEU A 109 23.400 5.712 -26.216 1.00 0.00 H new ATOM 0 HD13 LEU A 109 24.952 6.576 -26.323 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.056 8.707 -28.303 1.00 0.00 H new ATOM 0 HD22 LEU A 109 25.567 7.779 -28.455 1.00 0.00 H new ATOM 0 HD23 LEU A 109 24.406 7.816 -29.803 1.00 0.00 H new ATOM 1622 N GLU A 110 22.163 3.344 -29.869 1.00 0.00 N ATOM 1623 CA GLU A 110 20.820 3.070 -30.367 1.00 0.00 C ATOM 1624 C GLU A 110 20.105 2.061 -29.467 1.00 0.00 C ATOM 1625 O GLU A 110 18.908 2.193 -29.226 1.00 0.00 O ATOM 1626 CB GLU A 110 20.939 2.576 -31.819 1.00 0.00 C ATOM 1627 CG GLU A 110 19.584 2.263 -32.464 1.00 0.00 C ATOM 1628 CD GLU A 110 19.738 1.949 -33.963 1.00 0.00 C ATOM 1629 OE1 GLU A 110 20.003 0.772 -34.316 1.00 0.00 O ATOM 1630 OE2 GLU A 110 19.578 2.870 -34.800 1.00 0.00 O ATOM 0 H GLU A 110 22.896 3.132 -30.545 1.00 0.00 H new ATOM 0 HA GLU A 110 20.214 3.976 -30.351 1.00 0.00 H new ATOM 0 HB2 GLU A 110 21.450 3.334 -32.413 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.560 1.681 -31.841 1.00 0.00 H new ATOM 0 HG2 GLU A 110 19.125 1.414 -31.958 1.00 0.00 H new ATOM 0 HG3 GLU A 110 18.913 3.112 -32.335 1.00 0.00 H new ATOM 1637 N VAL A 111 20.825 1.086 -28.910 1.00 0.00 N ATOM 1638 CA VAL A 111 20.236 0.042 -28.087 1.00 0.00 C ATOM 1639 C VAL A 111 19.879 0.610 -26.714 1.00 0.00 C ATOM 1640 O VAL A 111 18.796 0.317 -26.226 1.00 0.00 O ATOM 1641 CB VAL A 111 21.126 -1.216 -28.019 1.00 0.00 C ATOM 1642 CG1 VAL A 111 20.311 -2.402 -27.482 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.717 -1.602 -29.391 1.00 0.00 C ATOM 0 H VAL A 111 21.836 1.003 -29.021 1.00 0.00 H new ATOM 0 HA VAL A 111 19.311 -0.297 -28.553 1.00 0.00 H new ATOM 0 HB VAL A 111 21.955 -0.980 -27.351 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.945 -3.288 -27.436 1.00 0.00 H new ATOM 0 HG12 VAL A 111 19.942 -2.168 -26.483 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.467 -2.593 -28.145 1.00 0.00 H new ATOM 0 HG21 VAL A 111 22.334 -2.494 -29.283 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.907 -1.804 -30.092 1.00 0.00 H new ATOM 0 HG23 VAL A 111 22.327 -0.781 -29.768 1.00 0.00 H new ATOM 1653 N PHE A 112 20.714 1.464 -26.106 1.00 0.00 N ATOM 1654 CA PHE A 112 20.350 2.178 -24.872 1.00 0.00 C ATOM 1655 C PHE A 112 19.077 2.984 -25.105 1.00 0.00 C ATOM 1656 O PHE A 112 18.116 2.851 -24.352 1.00 0.00 O ATOM 1657 CB PHE A 112 21.488 3.106 -24.415 1.00 0.00 C ATOM 1658 CG PHE A 112 22.729 2.398 -23.905 1.00 0.00 C ATOM 1659 CD1 PHE A 112 22.824 2.024 -22.550 1.00 0.00 C ATOM 1660 CD2 PHE A 112 23.782 2.093 -24.784 1.00 0.00 C ATOM 1661 CE1 PHE A 112 23.947 1.308 -22.095 1.00 0.00 C ATOM 1662 CE2 PHE A 112 24.915 1.405 -24.324 1.00 0.00 C ATOM 1663 CZ PHE A 112 24.989 0.998 -22.985 1.00 0.00 C ATOM 0 H PHE A 112 21.650 1.678 -26.450 1.00 0.00 H new ATOM 0 HA PHE A 112 20.177 1.444 -24.085 1.00 0.00 H new ATOM 0 HB2 PHE A 112 21.771 3.747 -25.250 1.00 0.00 H new ATOM 0 HB3 PHE A 112 21.110 3.758 -23.627 1.00 0.00 H new ATOM 0 HD1 PHE A 112 22.035 2.287 -21.861 1.00 0.00 H new ATOM 0 HD2 PHE A 112 23.719 2.390 -25.820 1.00 0.00 H new ATOM 0 HE1 PHE A 112 24.008 0.997 -21.063 1.00 0.00 H new ATOM 0 HE2 PHE A 112 25.729 1.189 -25.001 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.849 0.445 -22.637 1.00 0.00 H new ATOM 1673 N ARG A 113 19.035 3.766 -26.189 1.00 0.00 N ATOM 1674 CA ARG A 113 17.884 4.615 -26.514 1.00 0.00 C ATOM 1675 C ARG A 113 16.625 3.771 -26.737 1.00 0.00 C ATOM 1676 O ARG A 113 15.550 4.134 -26.256 1.00 0.00 O ATOM 1677 CB ARG A 113 18.227 5.454 -27.758 1.00 0.00 C ATOM 1678 CG ARG A 113 19.242 6.564 -27.428 1.00 0.00 C ATOM 1679 CD ARG A 113 19.848 7.150 -28.708 1.00 0.00 C ATOM 1680 NE ARG A 113 20.584 8.403 -28.435 1.00 0.00 N ATOM 1681 CZ ARG A 113 21.104 9.224 -29.360 1.00 0.00 C ATOM 1682 NH1 ARG A 113 21.051 8.911 -30.654 1.00 0.00 N ATOM 1683 NH2 ARG A 113 21.680 10.362 -28.983 1.00 0.00 N ATOM 0 H ARG A 113 19.797 3.828 -26.865 1.00 0.00 H new ATOM 0 HA ARG A 113 17.672 5.282 -25.679 1.00 0.00 H new ATOM 0 HB2 ARG A 113 18.634 4.806 -28.534 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.317 5.899 -28.160 1.00 0.00 H new ATOM 0 HG2 ARG A 113 18.751 7.353 -26.859 1.00 0.00 H new ATOM 0 HG3 ARG A 113 20.034 6.162 -26.797 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.522 6.422 -29.159 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.056 7.342 -29.432 1.00 0.00 H new ATOM 0 HE ARG A 113 20.707 8.666 -27.457 1.00 0.00 H new ATOM 0 HH11 ARG A 113 20.612 8.039 -30.950 1.00 0.00 H new ATOM 0 HH12 ARG A 113 21.450 9.543 -31.348 1.00 0.00 H new ATOM 0 HH21 ARG A 113 21.725 10.608 -27.994 1.00 0.00 H new ATOM 0 HH22 ARG A 113 22.077 10.989 -29.683 1.00 0.00 H new ATOM 1697 N THR A 114 16.759 2.623 -27.401 1.00 0.00 N ATOM 1698 CA THR A 114 15.680 1.694 -27.658 1.00 0.00 C ATOM 1699 C THR A 114 15.200 1.093 -26.340 1.00 0.00 C ATOM 1700 O THR A 114 14.025 1.215 -26.001 1.00 0.00 O ATOM 1701 CB THR A 114 16.242 0.645 -28.636 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.361 1.201 -29.932 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.429 -0.641 -28.706 1.00 0.00 C ATOM 0 H THR A 114 17.652 2.313 -27.783 1.00 0.00 H new ATOM 0 HA THR A 114 14.806 2.169 -28.104 1.00 0.00 H new ATOM 0 HB THR A 114 17.221 0.369 -28.243 1.00 0.00 H new ATOM 0 HG1 THR A 114 17.223 1.661 -30.013 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.892 -1.326 -29.417 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.399 -1.106 -27.721 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.414 -0.413 -29.031 1.00 0.00 H new ATOM 1711 N VAL A 115 16.090 0.472 -25.566 1.00 0.00 N ATOM 1712 CA VAL A 115 15.705 -0.319 -24.409 1.00 0.00 C ATOM 1713 C VAL A 115 15.146 0.585 -23.322 1.00 0.00 C ATOM 1714 O VAL A 115 14.177 0.203 -22.682 1.00 0.00 O ATOM 1715 CB VAL A 115 16.878 -1.225 -23.979 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.569 -1.988 -22.685 1.00 0.00 C ATOM 1717 CG2 VAL A 115 17.128 -2.283 -25.067 1.00 0.00 C ATOM 0 H VAL A 115 17.097 0.506 -25.728 1.00 0.00 H new ATOM 0 HA VAL A 115 14.891 -1.002 -24.654 1.00 0.00 H new ATOM 0 HB VAL A 115 17.742 -0.578 -23.825 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.421 -2.613 -22.419 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.375 -1.278 -21.881 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.691 -2.616 -22.834 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.956 -2.925 -24.767 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.230 -2.887 -25.200 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.375 -1.788 -26.006 1.00 0.00 H new ATOM 1727 N ARG A 116 15.646 1.810 -23.173 1.00 0.00 N ATOM 1728 CA ARG A 116 15.062 2.779 -22.252 1.00 0.00 C ATOM 1729 C ARG A 116 13.586 3.018 -22.611 1.00 0.00 C ATOM 1730 O ARG A 116 12.741 2.960 -21.727 1.00 0.00 O ATOM 1731 CB ARG A 116 15.963 4.031 -22.260 1.00 0.00 C ATOM 1732 CG ARG A 116 15.483 5.121 -21.296 1.00 0.00 C ATOM 1733 CD ARG A 116 16.617 6.059 -20.857 1.00 0.00 C ATOM 1734 NE ARG A 116 17.329 6.708 -21.980 1.00 0.00 N ATOM 1735 CZ ARG A 116 16.944 7.774 -22.699 1.00 0.00 C ATOM 1736 NH1 ARG A 116 15.737 8.311 -22.540 1.00 0.00 N ATOM 1737 NH2 ARG A 116 17.780 8.302 -23.586 1.00 0.00 N ATOM 0 H ARG A 116 16.459 2.155 -23.682 1.00 0.00 H new ATOM 0 HA ARG A 116 15.033 2.421 -21.223 1.00 0.00 H new ATOM 0 HB2 ARG A 116 16.980 3.742 -21.995 1.00 0.00 H new ATOM 0 HB3 ARG A 116 16.001 4.438 -23.270 1.00 0.00 H new ATOM 0 HG2 ARG A 116 14.698 5.705 -21.775 1.00 0.00 H new ATOM 0 HG3 ARG A 116 15.041 4.654 -20.416 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.205 6.831 -20.207 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.335 5.492 -20.264 1.00 0.00 H new ATOM 0 HE ARG A 116 18.224 6.294 -22.240 1.00 0.00 H new ATOM 0 HH11 ARG A 116 15.087 7.913 -21.863 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.462 9.121 -23.095 1.00 0.00 H new ATOM 0 HH21 ARG A 116 18.707 7.897 -23.717 1.00 0.00 H new ATOM 0 HH22 ARG A 116 17.495 9.112 -24.136 1.00 0.00 H new ATOM 1751 N GLY A 117 13.263 3.158 -23.895 1.00 0.00 N ATOM 1752 CA GLY A 117 11.883 3.289 -24.365 1.00 0.00 C ATOM 1753 C GLY A 117 11.066 2.025 -24.091 1.00 0.00 C ATOM 1754 O GLY A 117 10.017 2.098 -23.449 1.00 0.00 O ATOM 0 H GLY A 117 13.955 3.184 -24.644 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.411 4.140 -23.874 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.882 3.498 -25.435 1.00 0.00 H new ATOM 1758 N GLN A 118 11.553 0.856 -24.531 1.00 0.00 N ATOM 1759 CA GLN A 118 10.797 -0.397 -24.418 1.00 0.00 C ATOM 1760 C GLN A 118 10.509 -0.727 -22.957 1.00 0.00 C ATOM 1761 O GLN A 118 9.404 -1.131 -22.597 1.00 0.00 O ATOM 1762 CB GLN A 118 11.530 -1.579 -25.067 1.00 0.00 C ATOM 1763 CG GLN A 118 11.933 -1.364 -26.535 1.00 0.00 C ATOM 1764 CD GLN A 118 12.122 -2.681 -27.289 1.00 0.00 C ATOM 1765 OE1 GLN A 118 11.601 -2.862 -28.387 1.00 0.00 O ATOM 1766 NE2 GLN A 118 12.887 -3.608 -26.733 1.00 0.00 N ATOM 0 H GLN A 118 12.468 0.753 -24.969 1.00 0.00 H new ATOM 0 HA GLN A 118 9.860 -0.242 -24.952 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.427 -1.794 -24.487 1.00 0.00 H new ATOM 0 HB3 GLN A 118 10.892 -2.461 -25.006 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.169 -0.769 -27.035 1.00 0.00 H new ATOM 0 HG3 GLN A 118 12.859 -0.791 -26.574 1.00 0.00 H new ATOM 0 HE21 GLN A 118 13.311 -3.439 -25.821 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.052 -4.490 -27.217 1.00 0.00 H new ATOM 1775 N VAL A 119 11.518 -0.551 -22.111 1.00 0.00 N ATOM 1776 CA VAL A 119 11.422 -0.927 -20.707 1.00 0.00 C ATOM 1777 C VAL A 119 10.473 0.021 -19.977 1.00 0.00 C ATOM 1778 O VAL A 119 9.679 -0.461 -19.174 1.00 0.00 O ATOM 1779 CB VAL A 119 12.820 -1.004 -20.070 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.726 -1.258 -18.562 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.604 -2.161 -20.700 1.00 0.00 C ATOM 0 H VAL A 119 12.417 -0.148 -22.376 1.00 0.00 H new ATOM 0 HA VAL A 119 10.996 -1.927 -20.620 1.00 0.00 H new ATOM 0 HB VAL A 119 13.322 -0.052 -20.244 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.729 -1.308 -18.138 1.00 0.00 H new ATOM 0 HG12 VAL A 119 12.172 -0.446 -18.090 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.210 -2.201 -18.383 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.595 -2.217 -20.250 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.073 -3.097 -20.527 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.702 -1.993 -21.772 1.00 0.00 H new ATOM 1791 N LYS A 120 10.487 1.325 -20.282 1.00 0.00 N ATOM 1792 CA LYS A 120 9.536 2.260 -19.678 1.00 0.00 C ATOM 1793 C LYS A 120 8.122 1.747 -19.927 1.00 0.00 C ATOM 1794 O LYS A 120 7.338 1.650 -18.990 1.00 0.00 O ATOM 1795 CB LYS A 120 9.706 3.655 -20.303 1.00 0.00 C ATOM 1796 CG LYS A 120 8.931 4.730 -19.524 1.00 0.00 C ATOM 1797 CD LYS A 120 9.091 6.103 -20.191 1.00 0.00 C ATOM 1798 CE LYS A 120 8.281 7.165 -19.432 1.00 0.00 C ATOM 1799 NZ LYS A 120 8.355 8.501 -20.085 1.00 0.00 N ATOM 0 H LYS A 120 11.141 1.751 -20.938 1.00 0.00 H new ATOM 0 HA LYS A 120 9.719 2.334 -18.606 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.764 3.916 -20.327 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.359 3.635 -21.336 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.875 4.463 -19.478 1.00 0.00 H new ATOM 0 HG3 LYS A 120 9.293 4.774 -18.497 1.00 0.00 H new ATOM 0 HD2 LYS A 120 10.144 6.385 -20.210 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.756 6.052 -21.227 1.00 0.00 H new ATOM 0 HE2 LYS A 120 7.239 6.850 -19.370 1.00 0.00 H new ATOM 0 HE3 LYS A 120 8.652 7.241 -18.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 7.794 9.186 -19.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 9.346 8.815 -20.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.977 8.436 -21.052 1.00 0.00 H new ATOM 1813 N GLU A 121 7.827 1.349 -21.162 1.00 0.00 N ATOM 1814 CA GLU A 121 6.501 0.907 -21.553 1.00 0.00 C ATOM 1815 C GLU A 121 6.113 -0.397 -20.842 1.00 0.00 C ATOM 1816 O GLU A 121 4.990 -0.510 -20.347 1.00 0.00 O ATOM 1817 CB GLU A 121 6.477 0.807 -23.082 1.00 0.00 C ATOM 1818 CG GLU A 121 5.104 0.377 -23.605 1.00 0.00 C ATOM 1819 CD GLU A 121 5.047 0.421 -25.142 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.380 -0.598 -25.797 1.00 0.00 O ATOM 1821 OE2 GLU A 121 4.656 1.470 -25.710 1.00 0.00 O ATOM 0 H GLU A 121 8.509 1.326 -21.920 1.00 0.00 H new ATOM 0 HA GLU A 121 5.742 1.625 -21.241 1.00 0.00 H new ATOM 0 HB2 GLU A 121 6.744 1.772 -23.513 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.231 0.092 -23.411 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.882 -0.633 -23.260 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.335 1.031 -23.192 1.00 0.00 H new ATOM 1828 N ARG A 122 7.026 -1.372 -20.729 1.00 0.00 N ATOM 1829 CA ARG A 122 6.742 -2.615 -19.994 1.00 0.00 C ATOM 1830 C ARG A 122 6.439 -2.339 -18.523 1.00 0.00 C ATOM 1831 O ARG A 122 5.460 -2.856 -17.983 1.00 0.00 O ATOM 1832 CB ARG A 122 7.877 -3.639 -20.147 1.00 0.00 C ATOM 1833 CG ARG A 122 7.918 -4.232 -21.566 1.00 0.00 C ATOM 1834 CD ARG A 122 8.427 -5.675 -21.516 1.00 0.00 C ATOM 1835 NE ARG A 122 8.505 -6.258 -22.870 1.00 0.00 N ATOM 1836 CZ ARG A 122 7.568 -6.996 -23.488 1.00 0.00 C ATOM 1837 NH1 ARG A 122 6.437 -7.324 -22.868 1.00 0.00 N ATOM 1838 NH2 ARG A 122 7.773 -7.405 -24.735 1.00 0.00 N ATOM 0 H ARG A 122 7.961 -1.326 -21.134 1.00 0.00 H new ATOM 0 HA ARG A 122 5.848 -3.052 -20.438 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.831 -3.161 -19.924 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.745 -4.441 -19.421 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.923 -4.204 -22.010 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.568 -3.630 -22.202 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.411 -5.701 -21.048 1.00 0.00 H new ATOM 0 HD3 ARG A 122 7.763 -6.277 -20.895 1.00 0.00 H new ATOM 0 HE ARG A 122 9.363 -6.081 -23.393 1.00 0.00 H new ATOM 0 HH11 ARG A 122 6.272 -7.014 -21.910 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.735 -7.885 -23.351 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.637 -7.158 -25.217 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.066 -7.966 -25.211 1.00 0.00 H new ATOM 1852 N VAL A 123 7.260 -1.513 -17.878 1.00 0.00 N ATOM 1853 CA VAL A 123 7.065 -1.162 -16.474 1.00 0.00 C ATOM 1854 C VAL A 123 5.752 -0.367 -16.331 1.00 0.00 C ATOM 1855 O VAL A 123 4.990 -0.639 -15.404 1.00 0.00 O ATOM 1856 CB VAL A 123 8.317 -0.443 -15.949 1.00 0.00 C ATOM 1857 CG1 VAL A 123 8.172 -0.010 -14.484 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.577 -1.326 -16.018 1.00 0.00 C ATOM 0 H VAL A 123 8.072 -1.072 -18.310 1.00 0.00 H new ATOM 0 HA VAL A 123 6.950 -2.046 -15.847 1.00 0.00 H new ATOM 0 HB VAL A 123 8.422 0.426 -16.599 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.083 0.493 -14.161 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.327 0.672 -14.388 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.002 -0.888 -13.860 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.433 -0.770 -15.635 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.427 -2.222 -15.415 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.764 -1.613 -17.053 1.00 0.00 H new ATOM 1868 N GLU A 124 5.422 0.544 -17.255 1.00 0.00 N ATOM 1869 CA GLU A 124 4.161 1.284 -17.223 1.00 0.00 C ATOM 1870 C GLU A 124 2.973 0.331 -17.280 1.00 0.00 C ATOM 1871 O GLU A 124 2.028 0.501 -16.517 1.00 0.00 O ATOM 1872 CB GLU A 124 4.035 2.287 -18.388 1.00 0.00 C ATOM 1873 CG GLU A 124 4.734 3.627 -18.159 1.00 0.00 C ATOM 1874 CD GLU A 124 4.405 4.623 -19.290 1.00 0.00 C ATOM 1875 OE1 GLU A 124 4.996 4.528 -20.392 1.00 0.00 O ATOM 1876 OE2 GLU A 124 3.555 5.520 -19.073 1.00 0.00 O ATOM 0 H GLU A 124 6.023 0.786 -18.043 1.00 0.00 H new ATOM 0 HA GLU A 124 4.160 1.838 -16.284 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.444 1.829 -19.289 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.978 2.472 -18.576 1.00 0.00 H new ATOM 0 HG2 GLU A 124 4.424 4.044 -17.201 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.812 3.474 -18.106 1.00 0.00 H new ATOM 1883 N ASN A 125 3.019 -0.669 -18.159 1.00 0.00 N ATOM 1884 CA ASN A 125 1.930 -1.619 -18.349 1.00 0.00 C ATOM 1885 C ASN A 125 1.689 -2.425 -17.067 1.00 0.00 C ATOM 1886 O ASN A 125 0.555 -2.545 -16.609 1.00 0.00 O ATOM 1887 CB ASN A 125 2.258 -2.537 -19.537 1.00 0.00 C ATOM 1888 CG ASN A 125 1.148 -3.534 -19.865 1.00 0.00 C ATOM 1889 OD1 ASN A 125 -0.021 -3.350 -19.537 1.00 0.00 O ATOM 1890 ND2 ASN A 125 1.497 -4.600 -20.564 1.00 0.00 N ATOM 0 H ASN A 125 3.822 -0.842 -18.764 1.00 0.00 H new ATOM 0 HA ASN A 125 1.009 -1.079 -18.571 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.455 -1.923 -20.416 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.175 -3.085 -19.319 1.00 0.00 H new ATOM 0 HD21 ASN A 125 0.791 -5.283 -20.838 1.00 0.00 H new ATOM 0 HD22 ASN A 125 2.472 -4.739 -20.829 1.00 0.00 H new ATOM 1897 N LEU A 126 2.761 -2.912 -16.434 1.00 0.00 N ATOM 1898 CA LEU A 126 2.708 -3.612 -15.159 1.00 0.00 C ATOM 1899 C LEU A 126 2.069 -2.735 -14.077 1.00 0.00 C ATOM 1900 O LEU A 126 1.174 -3.192 -13.368 1.00 0.00 O ATOM 1901 CB LEU A 126 4.150 -4.002 -14.792 1.00 0.00 C ATOM 1902 CG LEU A 126 4.352 -4.424 -13.331 1.00 0.00 C ATOM 1903 CD1 LEU A 126 3.517 -5.657 -12.985 1.00 0.00 C ATOM 1904 CD2 LEU A 126 5.833 -4.707 -13.116 1.00 0.00 C ATOM 0 H LEU A 126 3.707 -2.826 -16.806 1.00 0.00 H new ATOM 0 HA LEU A 126 2.087 -4.504 -15.236 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.465 -4.821 -15.439 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.805 -3.157 -15.005 1.00 0.00 H new ATOM 0 HG LEU A 126 4.021 -3.619 -12.675 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.684 -5.929 -11.943 1.00 0.00 H new ATOM 0 HD12 LEU A 126 2.461 -5.436 -13.138 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.810 -6.487 -13.628 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.999 -5.009 -12.082 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.151 -5.508 -13.784 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.410 -3.807 -13.328 1.00 0.00 H new ATOM 1916 N ILE A 127 2.493 -1.482 -13.949 1.00 0.00 N ATOM 1917 CA ILE A 127 1.965 -0.543 -12.967 1.00 0.00 C ATOM 1918 C ILE A 127 0.486 -0.306 -13.275 1.00 0.00 C ATOM 1919 O ILE A 127 -0.335 -0.402 -12.371 1.00 0.00 O ATOM 1920 CB ILE A 127 2.836 0.724 -13.030 1.00 0.00 C ATOM 1921 CG1 ILE A 127 4.220 0.353 -12.453 1.00 0.00 C ATOM 1922 CG2 ILE A 127 2.212 1.882 -12.241 1.00 0.00 C ATOM 1923 CD1 ILE A 127 5.259 1.453 -12.609 1.00 0.00 C ATOM 0 H ILE A 127 3.226 -1.084 -14.536 1.00 0.00 H new ATOM 0 HA ILE A 127 2.008 -0.916 -11.944 1.00 0.00 H new ATOM 0 HB ILE A 127 2.921 1.067 -14.061 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.111 0.115 -11.395 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.581 -0.549 -12.947 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.857 2.758 -12.310 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.232 2.119 -12.656 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.103 1.593 -11.196 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.206 1.123 -12.182 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.397 1.676 -13.667 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.920 2.350 -12.090 1.00 0.00 H new ATOM 1935 N ALA A 128 0.130 -0.073 -14.538 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.251 0.122 -14.955 1.00 0.00 C ATOM 1937 C ALA A 128 -2.133 -1.100 -14.638 1.00 0.00 C ATOM 1938 O ALA A 128 -3.336 -0.930 -14.424 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.286 0.448 -16.452 1.00 0.00 C ATOM 0 H ALA A 128 0.801 -0.015 -15.304 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.664 0.957 -14.389 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.319 0.595 -16.768 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.716 1.358 -16.640 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.848 -0.377 -17.014 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.573 -2.319 -14.585 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.307 -3.490 -14.119 1.00 0.00 C ATOM 1947 C LYS A 129 -2.563 -3.388 -12.620 1.00 0.00 C ATOM 1948 O LYS A 129 -3.715 -3.468 -12.189 1.00 0.00 O ATOM 1949 CB LYS A 129 -1.593 -4.814 -14.444 1.00 0.00 C ATOM 1950 CG LYS A 129 -1.625 -5.200 -15.929 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.923 -6.556 -16.121 1.00 0.00 C ATOM 1952 CE LYS A 129 -0.949 -6.979 -17.599 1.00 0.00 C ATOM 1953 NZ LYS A 129 -0.537 -8.395 -17.793 1.00 0.00 N ATOM 0 H LYS A 129 -0.610 -2.512 -14.862 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.255 -3.501 -14.656 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.554 -4.742 -14.122 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -2.052 -5.613 -13.863 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.656 -5.259 -16.278 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -1.130 -4.434 -16.526 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.109 -6.489 -15.775 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.415 -7.315 -15.512 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -1.954 -6.839 -17.996 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.287 -6.329 -18.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.636 -8.651 -18.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.455 -8.511 -17.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -1.141 -9.015 -17.216 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.501 -3.246 -11.824 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.603 -3.368 -10.379 1.00 0.00 C ATOM 1969 C ILE A 130 -2.232 -2.160 -9.679 1.00 0.00 C ATOM 1970 O ILE A 130 -2.968 -2.348 -8.705 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.251 -3.774 -9.771 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.829 -2.690 -9.938 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.201 -5.125 -10.351 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.214 -3.083 -9.427 1.00 0.00 C ATOM 0 H ILE A 130 -0.560 -3.046 -12.163 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.315 -4.172 -10.192 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.392 -3.884 -8.696 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.906 -2.433 -10.995 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.505 -1.791 -9.414 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.160 -5.406 -9.915 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.541 -5.888 -10.117 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.305 -5.040 -11.433 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.908 -2.258 -9.587 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.158 -3.310 -8.362 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.565 -3.962 -9.967 1.00 0.00 H new ATOM 1986 N SER A 131 -1.932 -0.948 -10.132 1.00 0.00 N ATOM 1987 CA SER A 131 -2.251 0.304 -9.491 1.00 0.00 C ATOM 1988 C SER A 131 -3.460 0.931 -10.189 1.00 0.00 C ATOM 1989 O SER A 131 -4.566 0.885 -9.603 1.00 0.00 O ATOM 1990 CB SER A 131 -1.010 1.195 -9.486 1.00 0.00 C ATOM 1991 OG SER A 131 -0.016 0.603 -8.654 1.00 0.00 O ATOM 1992 OXT SER A 131 -3.320 1.449 -11.322 1.00 0.00 O ATOM 0 H SER A 131 -1.430 -0.815 -11.010 1.00 0.00 H new ATOM 0 HA SER A 131 -2.534 0.159 -8.448 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.629 1.315 -10.500 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.263 2.190 -9.120 1.00 0.00 H new ATOM 0 HG SER A 131 0.784 1.169 -8.647 1.00 0.00 H new TER 1998 SER A 131