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 5 MET CE :methyl -150:sc= -0.153 (180deg=-0.857) USER MOD Set 1.2: A 35 SER OG : rot -169:sc= 0.0548 USER MOD Set 2.1: A 33 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 73 TYR OH : rot 30:sc= -0.0287 USER MOD Set 3.1: A 11 ASN : amide:sc= 1.29 K(o=2.8,f=1.2) USER MOD Set 3.2: A 60 GLN : amide:sc= 1.48 K(o=2.8,f=-0.19) USER MOD Single : A 1 MET CE :methyl 162:sc= 0 (180deg=-0.303) USER MOD Single : A 1 MET N :NH3+ -112:sc= 0.0471 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -162:sc= 1.31 (180deg=1.14) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0.136 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot -170:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 1.7 K(o=1.7,f=-4.9!) USER MOD Single : A 17 MET CE :methyl 148:sc= -0.275 (180deg=-0.734) USER MOD Single : A 23 LYS NZ :NH3+ -139:sc= 0.817 (180deg=0.0507) USER MOD Single : A 24 THR OG1 : rot -110:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 165:sc= 1.34 (180deg=1.08) USER MOD Single : A 34 SER OG : rot 180:sc= 0.45 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -160:sc= 0.775 USER MOD Single : A 43 HIS : no HD1:sc= -0.375 K(o=-0.37,f=-2.6) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 141:sc= -0.384 (180deg=-1.68) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.118 USER MOD Single : A 62 SER OG : rot 180:sc= 0.0103 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.143 K(o=0.14,f=-7.4!) USER MOD Single : A 78 SER OG : rot -156:sc= 0.0442 USER MOD Single : A 82 SER OG : rot -83:sc= 0.165 USER MOD Single : A 85 ASN : amide:sc= -0.0137 K(o=-0.014,f=-0.93) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= 0.649 K(o=0.65,f=-0.59) USER MOD Single : A 100 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 107 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 87:sc= 0.35 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -173:sc= 1.33 (180deg=1.18) USER MOD Single : A 125 ASN : amide:sc= -0.459 K(o=-0.46,f=-2.9!) USER MOD Single : A 129 LYS NZ :NH3+ -166:sc= 1.26 (180deg=1.15) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.012 -0.698 1.254 1.00 0.00 N ATOM 2 CA MET A 1 2.203 -0.390 -0.198 1.00 0.00 C ATOM 3 C MET A 1 2.804 -1.599 -0.945 1.00 0.00 C ATOM 4 O MET A 1 3.484 -2.425 -0.338 1.00 0.00 O ATOM 5 CB MET A 1 2.980 0.940 -0.422 1.00 0.00 C ATOM 6 CG MET A 1 4.505 0.877 -0.217 1.00 0.00 C ATOM 7 SD MET A 1 5.310 2.468 0.146 1.00 0.00 S ATOM 8 CE MET A 1 5.353 3.239 -1.495 1.00 0.00 C ATOM 0 H1 MET A 1 0.995 -0.740 1.469 1.00 0.00 H new ATOM 0 H2 MET A 1 2.451 -1.615 1.475 1.00 0.00 H new ATOM 0 H3 MET A 1 2.457 0.046 1.828 1.00 0.00 H new ATOM 0 HA MET A 1 1.222 -0.216 -0.639 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.784 1.285 -1.437 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.574 1.693 0.254 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.717 0.187 0.600 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.958 0.456 -1.115 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.514 4.312 -1.389 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.165 2.806 -2.079 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.406 3.063 -2.005 1.00 0.00 H new ATOM 18 N LYS A 2 2.556 -1.732 -2.259 1.00 0.00 N ATOM 19 CA LYS A 2 2.986 -2.914 -3.035 1.00 0.00 C ATOM 20 C LYS A 2 4.498 -2.848 -3.177 1.00 0.00 C ATOM 21 O LYS A 2 4.985 -1.813 -3.621 1.00 0.00 O ATOM 22 CB LYS A 2 2.287 -2.995 -4.416 1.00 0.00 C ATOM 23 CG LYS A 2 0.801 -2.597 -4.382 1.00 0.00 C ATOM 24 CD LYS A 2 0.168 -2.629 -5.779 1.00 0.00 C ATOM 25 CE LYS A 2 -1.090 -1.746 -5.864 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.281 -2.337 -5.187 1.00 0.00 N ATOM 0 H LYS A 2 2.058 -1.033 -2.811 1.00 0.00 H new ATOM 0 HA LYS A 2 2.696 -3.823 -2.507 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.812 -2.346 -5.117 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.373 -4.012 -4.798 1.00 0.00 H new ATOM 0 HG2 LYS A 2 0.259 -3.274 -3.722 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.703 -1.596 -3.962 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.898 -2.292 -6.515 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.092 -3.656 -6.035 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.873 -0.775 -5.418 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.329 -1.569 -6.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.091 -1.691 -5.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.513 -3.250 -5.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.071 -2.482 -4.179 1.00 0.00 H new ATOM 40 N LYS A 3 5.243 -3.898 -2.827 1.00 0.00 N ATOM 41 CA LYS A 3 6.682 -3.934 -3.107 1.00 0.00 C ATOM 42 C LYS A 3 6.893 -4.730 -4.375 1.00 0.00 C ATOM 43 O LYS A 3 6.307 -5.807 -4.523 1.00 0.00 O ATOM 44 CB LYS A 3 7.535 -4.481 -1.954 1.00 0.00 C ATOM 45 CG LYS A 3 7.126 -3.948 -0.577 1.00 0.00 C ATOM 46 CD LYS A 3 8.117 -4.419 0.492 1.00 0.00 C ATOM 47 CE LYS A 3 7.643 -3.905 1.852 1.00 0.00 C ATOM 48 NZ LYS A 3 8.545 -4.337 2.952 1.00 0.00 N ATOM 0 H LYS A 3 4.881 -4.726 -2.355 1.00 0.00 H new ATOM 0 HA LYS A 3 7.024 -2.907 -3.231 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.466 -5.569 -1.948 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.580 -4.229 -2.136 1.00 0.00 H new ATOM 0 HG2 LYS A 3 7.092 -2.859 -0.597 1.00 0.00 H new ATOM 0 HG3 LYS A 3 6.122 -4.293 -0.329 1.00 0.00 H new ATOM 0 HD2 LYS A 3 8.178 -5.507 0.499 1.00 0.00 H new ATOM 0 HD3 LYS A 3 9.117 -4.045 0.273 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.591 -2.816 1.831 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.634 -4.268 2.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 8.052 -4.243 3.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 8.818 -5.330 2.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 9.397 -3.741 2.956 1.00 0.00 H new ATOM 62 N VAL A 4 7.716 -4.180 -5.255 1.00 0.00 N ATOM 63 CA VAL A 4 7.963 -4.614 -6.613 1.00 0.00 C ATOM 64 C VAL A 4 9.411 -5.107 -6.657 1.00 0.00 C ATOM 65 O VAL A 4 10.277 -4.609 -5.938 1.00 0.00 O ATOM 66 CB VAL A 4 7.731 -3.439 -7.586 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.689 -3.880 -9.055 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.445 -2.630 -7.357 1.00 0.00 C ATOM 0 H VAL A 4 8.268 -3.356 -5.015 1.00 0.00 H new ATOM 0 HA VAL A 4 7.287 -5.414 -6.915 1.00 0.00 H new ATOM 0 HB VAL A 4 8.593 -2.808 -7.371 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.523 -3.011 -9.691 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.636 -4.349 -9.321 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.878 -4.594 -9.198 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.382 -1.830 -8.095 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.580 -3.286 -7.458 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.459 -2.199 -6.356 1.00 0.00 H new ATOM 78 N MET A 5 9.685 -6.046 -7.544 1.00 0.00 N ATOM 79 CA MET A 5 11.008 -6.579 -7.830 1.00 0.00 C ATOM 80 C MET A 5 11.082 -6.935 -9.309 1.00 0.00 C ATOM 81 O MET A 5 10.107 -7.455 -9.847 1.00 0.00 O ATOM 82 CB MET A 5 11.203 -7.806 -6.936 1.00 0.00 C ATOM 83 CG MET A 5 12.530 -8.534 -7.139 1.00 0.00 C ATOM 84 SD MET A 5 12.842 -9.865 -5.951 1.00 0.00 S ATOM 85 CE MET A 5 13.040 -8.919 -4.411 1.00 0.00 C ATOM 0 H MET A 5 8.958 -6.480 -8.113 1.00 0.00 H new ATOM 0 HA MET A 5 11.799 -5.858 -7.625 1.00 0.00 H new ATOM 0 HB2 MET A 5 11.129 -7.496 -5.894 1.00 0.00 H new ATOM 0 HB3 MET A 5 10.388 -8.506 -7.119 1.00 0.00 H new ATOM 0 HG2 MET A 5 12.552 -8.950 -8.146 1.00 0.00 H new ATOM 0 HG3 MET A 5 13.342 -7.809 -7.076 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.721 -9.448 -3.744 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.447 -7.934 -4.639 1.00 0.00 H new ATOM 0 HE3 MET A 5 12.071 -8.808 -3.925 1.00 0.00 H new ATOM 95 N PHE A 6 12.222 -6.700 -9.961 1.00 0.00 N ATOM 96 CA PHE A 6 12.461 -7.083 -11.345 1.00 0.00 C ATOM 97 C PHE A 6 13.811 -7.779 -11.362 1.00 0.00 C ATOM 98 O PHE A 6 14.832 -7.106 -11.248 1.00 0.00 O ATOM 99 CB PHE A 6 12.470 -5.858 -12.275 1.00 0.00 C ATOM 100 CG PHE A 6 11.257 -4.962 -12.249 1.00 0.00 C ATOM 101 CD1 PHE A 6 11.108 -4.011 -11.228 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.320 -5.015 -13.297 1.00 0.00 C ATOM 103 CE1 PHE A 6 10.001 -3.154 -11.228 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.224 -4.137 -13.309 1.00 0.00 C ATOM 105 CZ PHE A 6 9.054 -3.220 -12.262 1.00 0.00 C ATOM 0 H PHE A 6 13.017 -6.229 -9.530 1.00 0.00 H new ATOM 0 HA PHE A 6 11.668 -7.736 -11.709 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.342 -5.253 -12.027 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.607 -6.211 -13.297 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.846 -3.940 -10.443 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.444 -5.733 -14.094 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.875 -2.439 -10.429 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.514 -4.168 -14.122 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.195 -2.565 -12.251 1.00 0.00 H new ATOM 115 N VAL A 7 13.843 -9.104 -11.455 1.00 0.00 N ATOM 116 CA VAL A 7 15.071 -9.857 -11.240 1.00 0.00 C ATOM 117 C VAL A 7 15.251 -10.921 -12.320 1.00 0.00 C ATOM 118 O VAL A 7 14.299 -11.589 -12.718 1.00 0.00 O ATOM 119 CB VAL A 7 15.031 -10.403 -9.789 1.00 0.00 C ATOM 120 CG1 VAL A 7 15.975 -11.582 -9.517 1.00 0.00 C ATOM 121 CG2 VAL A 7 15.389 -9.290 -8.788 1.00 0.00 C ATOM 0 H VAL A 7 13.030 -9.679 -11.678 1.00 0.00 H new ATOM 0 HA VAL A 7 15.957 -9.229 -11.335 1.00 0.00 H new ATOM 0 HB VAL A 7 14.010 -10.762 -9.663 1.00 0.00 H new ATOM 0 HG11 VAL A 7 15.877 -11.894 -8.477 1.00 0.00 H new ATOM 0 HG12 VAL A 7 15.716 -12.414 -10.172 1.00 0.00 H new ATOM 0 HG13 VAL A 7 17.004 -11.276 -9.708 1.00 0.00 H new ATOM 0 HG21 VAL A 7 15.357 -9.688 -7.774 1.00 0.00 H new ATOM 0 HG22 VAL A 7 16.392 -8.919 -9.000 1.00 0.00 H new ATOM 0 HG23 VAL A 7 14.673 -8.474 -8.880 1.00 0.00 H new ATOM 131 N CYS A 8 16.486 -11.046 -12.798 1.00 0.00 N ATOM 132 CA CYS A 8 16.991 -12.118 -13.650 1.00 0.00 C ATOM 133 C CYS A 8 18.158 -12.739 -12.845 1.00 0.00 C ATOM 134 O CYS A 8 18.321 -12.407 -11.669 1.00 0.00 O ATOM 135 CB CYS A 8 17.353 -11.542 -15.036 1.00 0.00 C ATOM 136 SG CYS A 8 18.101 -12.702 -16.232 1.00 0.00 S ATOM 0 H CYS A 8 17.207 -10.356 -12.587 1.00 0.00 H new ATOM 0 HA CYS A 8 16.274 -12.906 -13.880 1.00 0.00 H new ATOM 0 HB2 CYS A 8 16.447 -11.130 -15.481 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.043 -10.711 -14.890 1.00 0.00 H new ATOM 141 N LYS A 9 18.956 -13.652 -13.417 1.00 0.00 N ATOM 142 CA LYS A 9 19.957 -14.414 -12.654 1.00 0.00 C ATOM 143 C LYS A 9 20.940 -13.484 -11.940 1.00 0.00 C ATOM 144 O LYS A 9 20.897 -13.411 -10.719 1.00 0.00 O ATOM 145 CB LYS A 9 20.668 -15.465 -13.536 1.00 0.00 C ATOM 146 CG LYS A 9 19.722 -16.615 -13.927 1.00 0.00 C ATOM 147 CD LYS A 9 20.391 -17.676 -14.820 1.00 0.00 C ATOM 148 CE LYS A 9 21.522 -18.435 -14.101 1.00 0.00 C ATOM 149 NZ LYS A 9 22.139 -19.482 -14.961 1.00 0.00 N ATOM 0 H LYS A 9 18.928 -13.882 -14.410 1.00 0.00 H new ATOM 0 HA LYS A 9 19.431 -14.969 -11.878 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.050 -14.985 -14.437 1.00 0.00 H new ATOM 0 HB3 LYS A 9 21.528 -15.867 -13.001 1.00 0.00 H new ATOM 0 HG2 LYS A 9 19.350 -17.094 -13.021 1.00 0.00 H new ATOM 0 HG3 LYS A 9 18.857 -16.204 -14.448 1.00 0.00 H new ATOM 0 HD2 LYS A 9 19.638 -18.389 -15.156 1.00 0.00 H new ATOM 0 HD3 LYS A 9 20.793 -17.193 -15.711 1.00 0.00 H new ATOM 0 HE2 LYS A 9 22.289 -17.727 -13.788 1.00 0.00 H new ATOM 0 HE3 LYS A 9 21.127 -18.898 -13.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 22.894 -19.964 -14.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 21.414 -20.174 -15.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 22.540 -19.040 -15.812 1.00 0.00 H new ATOM 163 N ARG A 10 21.791 -12.753 -12.659 1.00 0.00 N ATOM 164 CA ARG A 10 22.784 -11.856 -12.054 1.00 0.00 C ATOM 165 C ARG A 10 22.388 -10.416 -12.379 1.00 0.00 C ATOM 166 O ARG A 10 22.100 -10.130 -13.538 1.00 0.00 O ATOM 167 CB ARG A 10 24.191 -12.279 -12.520 1.00 0.00 C ATOM 168 CG ARG A 10 25.336 -11.558 -11.786 1.00 0.00 C ATOM 169 CD ARG A 10 26.687 -12.245 -12.036 1.00 0.00 C ATOM 170 NE ARG A 10 26.814 -13.508 -11.273 1.00 0.00 N ATOM 171 CZ ARG A 10 27.582 -13.732 -10.195 1.00 0.00 C ATOM 172 NH1 ARG A 10 28.300 -12.767 -9.633 1.00 0.00 N ATOM 173 NH2 ARG A 10 27.612 -14.949 -9.661 1.00 0.00 N ATOM 0 H ARG A 10 21.814 -12.764 -13.679 1.00 0.00 H new ATOM 0 HA ARG A 10 22.810 -11.923 -10.966 1.00 0.00 H new ATOM 0 HB2 ARG A 10 24.302 -13.354 -12.378 1.00 0.00 H new ATOM 0 HB3 ARG A 10 24.281 -12.088 -13.589 1.00 0.00 H new ATOM 0 HG2 ARG A 10 25.387 -10.521 -12.119 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.129 -11.539 -10.716 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.798 -12.451 -13.101 1.00 0.00 H new ATOM 0 HD3 ARG A 10 27.495 -11.569 -11.756 1.00 0.00 H new ATOM 0 HE ARG A 10 26.256 -14.295 -11.603 1.00 0.00 H new ATOM 0 HH11 ARG A 10 28.278 -11.823 -10.020 1.00 0.00 H new ATOM 0 HH12 ARG A 10 28.874 -12.969 -8.814 1.00 0.00 H new ATOM 0 HH21 ARG A 10 27.056 -15.699 -10.070 1.00 0.00 H new ATOM 0 HH22 ARG A 10 28.191 -15.132 -8.842 1.00 0.00 H new ATOM 187 N ASN A 11 22.392 -9.517 -11.381 1.00 0.00 N ATOM 188 CA ASN A 11 21.821 -8.161 -11.520 1.00 0.00 C ATOM 189 C ASN A 11 22.384 -7.360 -12.702 1.00 0.00 C ATOM 190 O ASN A 11 21.652 -6.580 -13.308 1.00 0.00 O ATOM 191 CB ASN A 11 21.977 -7.338 -10.226 1.00 0.00 C ATOM 192 CG ASN A 11 21.272 -5.987 -10.391 1.00 0.00 C ATOM 193 OD1 ASN A 11 20.065 -5.885 -10.208 1.00 0.00 O ATOM 194 ND2 ASN A 11 21.982 -4.945 -10.792 1.00 0.00 N ATOM 0 H ASN A 11 22.788 -9.705 -10.460 1.00 0.00 H new ATOM 0 HA ASN A 11 20.764 -8.332 -11.722 1.00 0.00 H new ATOM 0 HB2 ASN A 11 21.551 -7.882 -9.383 1.00 0.00 H new ATOM 0 HB3 ASN A 11 23.033 -7.184 -10.005 1.00 0.00 H new ATOM 0 HD21 ASN A 11 21.525 -4.047 -10.951 1.00 0.00 H new ATOM 0 HD22 ASN A 11 22.987 -5.039 -10.942 1.00 0.00 H new ATOM 201 N SER A 12 23.670 -7.534 -13.023 1.00 0.00 N ATOM 202 CA SER A 12 24.389 -6.697 -13.985 1.00 0.00 C ATOM 203 C SER A 12 23.764 -6.670 -15.389 1.00 0.00 C ATOM 204 O SER A 12 24.012 -5.712 -16.124 1.00 0.00 O ATOM 205 CB SER A 12 25.837 -7.185 -14.054 1.00 0.00 C ATOM 206 OG SER A 12 26.355 -7.392 -12.746 1.00 0.00 O ATOM 0 H SER A 12 24.247 -8.270 -12.616 1.00 0.00 H new ATOM 0 HA SER A 12 24.331 -5.668 -13.630 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.887 -8.113 -14.623 1.00 0.00 H new ATOM 0 HB3 SER A 12 26.449 -6.454 -14.582 1.00 0.00 H new ATOM 0 HG SER A 12 27.282 -7.705 -12.807 1.00 0.00 H new ATOM 212 N SER A 13 22.941 -7.663 -15.743 1.00 0.00 N ATOM 213 CA SER A 13 22.228 -7.732 -17.013 1.00 0.00 C ATOM 214 C SER A 13 20.766 -8.118 -16.763 1.00 0.00 C ATOM 215 O SER A 13 20.443 -8.817 -15.803 1.00 0.00 O ATOM 216 CB SER A 13 22.922 -8.738 -17.946 1.00 0.00 C ATOM 217 OG SER A 13 24.299 -8.423 -18.107 1.00 0.00 O ATOM 0 H SER A 13 22.751 -8.459 -15.135 1.00 0.00 H new ATOM 0 HA SER A 13 22.243 -6.756 -17.499 1.00 0.00 H new ATOM 0 HB2 SER A 13 22.821 -9.744 -17.540 1.00 0.00 H new ATOM 0 HB3 SER A 13 22.429 -8.736 -18.918 1.00 0.00 H new ATOM 0 HG SER A 13 24.717 -9.079 -18.703 1.00 0.00 H new ATOM 223 N ARG A 14 19.880 -7.676 -17.659 1.00 0.00 N ATOM 224 CA ARG A 14 18.446 -7.986 -17.680 1.00 0.00 C ATOM 225 C ARG A 14 17.756 -7.639 -16.358 1.00 0.00 C ATOM 226 O ARG A 14 16.912 -8.386 -15.875 1.00 0.00 O ATOM 227 CB ARG A 14 18.195 -9.412 -18.228 1.00 0.00 C ATOM 228 CG ARG A 14 18.626 -9.508 -19.703 1.00 0.00 C ATOM 229 CD ARG A 14 18.261 -10.842 -20.367 1.00 0.00 C ATOM 230 NE ARG A 14 19.156 -11.936 -19.937 1.00 0.00 N ATOM 231 CZ ARG A 14 20.331 -12.281 -20.488 1.00 0.00 C ATOM 232 NH1 ARG A 14 20.822 -11.608 -21.526 1.00 0.00 N ATOM 233 NH2 ARG A 14 21.020 -13.302 -19.986 1.00 0.00 N ATOM 0 H ARG A 14 20.155 -7.063 -18.427 1.00 0.00 H new ATOM 0 HA ARG A 14 17.950 -7.328 -18.393 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.749 -10.139 -17.633 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.138 -9.663 -18.135 1.00 0.00 H new ATOM 0 HG2 ARG A 14 18.162 -8.695 -20.262 1.00 0.00 H new ATOM 0 HG3 ARG A 14 19.704 -9.363 -19.767 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.230 -11.099 -20.122 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.314 -10.734 -21.450 1.00 0.00 H new ATOM 0 HE ARG A 14 18.849 -12.488 -19.136 1.00 0.00 H new ATOM 0 HH11 ARG A 14 20.304 -10.819 -21.913 1.00 0.00 H new ATOM 0 HH12 ARG A 14 21.716 -11.881 -21.934 1.00 0.00 H new ATOM 0 HH21 ARG A 14 20.655 -13.819 -19.186 1.00 0.00 H new ATOM 0 HH22 ARG A 14 21.913 -13.568 -20.401 1.00 0.00 H new ATOM 247 N SER A 15 18.135 -6.492 -15.787 1.00 0.00 N ATOM 248 CA SER A 15 17.472 -5.840 -14.658 1.00 0.00 C ATOM 249 C SER A 15 17.435 -4.358 -15.053 1.00 0.00 C ATOM 250 O SER A 15 16.404 -3.879 -15.518 1.00 0.00 O ATOM 251 CB SER A 15 18.146 -6.190 -13.315 1.00 0.00 C ATOM 252 OG SER A 15 18.323 -7.595 -13.174 1.00 0.00 O ATOM 0 H SER A 15 18.948 -5.971 -16.115 1.00 0.00 H new ATOM 0 HA SER A 15 16.455 -6.185 -14.471 1.00 0.00 H new ATOM 0 HB2 SER A 15 19.113 -5.692 -13.251 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.538 -5.814 -12.492 1.00 0.00 H new ATOM 0 HG SER A 15 18.604 -7.799 -12.257 1.00 0.00 H new ATOM 258 N GLN A 16 18.588 -3.677 -14.994 1.00 0.00 N ATOM 259 CA GLN A 16 18.867 -2.356 -15.534 1.00 0.00 C ATOM 260 C GLN A 16 17.704 -1.385 -15.313 1.00 0.00 C ATOM 261 O GLN A 16 17.452 -1.002 -14.175 1.00 0.00 O ATOM 262 CB GLN A 16 19.410 -2.525 -16.984 1.00 0.00 C ATOM 263 CG GLN A 16 20.762 -1.836 -17.236 1.00 0.00 C ATOM 264 CD GLN A 16 21.977 -2.618 -16.714 1.00 0.00 C ATOM 265 OE1 GLN A 16 22.673 -2.175 -15.809 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.285 -3.773 -17.269 1.00 0.00 N ATOM 0 H GLN A 16 19.406 -4.073 -14.531 1.00 0.00 H new ATOM 0 HA GLN A 16 19.662 -1.851 -14.986 1.00 0.00 H new ATOM 0 HB2 GLN A 16 19.511 -3.589 -17.200 1.00 0.00 H new ATOM 0 HB3 GLN A 16 18.676 -2.126 -17.684 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.881 -1.676 -18.308 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.748 -0.852 -16.766 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.708 -4.146 -18.023 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.100 -4.294 -16.944 1.00 0.00 H new ATOM 275 N MET A 17 16.976 -0.986 -16.366 1.00 0.00 N ATOM 276 CA MET A 17 16.001 0.092 -16.265 1.00 0.00 C ATOM 277 C MET A 17 14.705 -0.315 -15.587 1.00 0.00 C ATOM 278 O MET A 17 13.930 0.571 -15.249 1.00 0.00 O ATOM 279 CB MET A 17 15.643 0.647 -17.665 1.00 0.00 C ATOM 280 CG MET A 17 16.585 1.736 -18.155 1.00 0.00 C ATOM 281 SD MET A 17 15.986 3.447 -18.034 1.00 0.00 S ATOM 282 CE MET A 17 15.947 3.718 -16.247 1.00 0.00 C ATOM 0 H MET A 17 17.050 -1.399 -17.296 1.00 0.00 H new ATOM 0 HA MET A 17 16.486 0.850 -15.650 1.00 0.00 H new ATOM 0 HB2 MET A 17 15.647 -0.174 -18.382 1.00 0.00 H new ATOM 0 HB3 MET A 17 14.628 1.043 -17.640 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.515 1.660 -17.592 1.00 0.00 H new ATOM 0 HG3 MET A 17 16.827 1.533 -19.198 1.00 0.00 H new ATOM 0 HE1 MET A 17 16.162 4.765 -16.033 1.00 0.00 H new ATOM 0 HE2 MET A 17 14.959 3.465 -15.862 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.696 3.088 -15.767 1.00 0.00 H new ATOM 292 N ALA A 18 14.430 -1.606 -15.415 1.00 0.00 N ATOM 293 CA ALA A 18 13.107 -2.060 -14.986 1.00 0.00 C ATOM 294 C ALA A 18 12.771 -1.554 -13.583 1.00 0.00 C ATOM 295 O ALA A 18 11.756 -0.887 -13.391 1.00 0.00 O ATOM 296 CB ALA A 18 13.040 -3.583 -15.133 1.00 0.00 C ATOM 0 H ALA A 18 15.104 -2.356 -15.566 1.00 0.00 H new ATOM 0 HA ALA A 18 12.333 -1.634 -15.624 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.059 -3.936 -14.817 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.205 -3.856 -16.175 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.809 -4.043 -14.512 1.00 0.00 H new ATOM 302 N GLU A 19 13.682 -1.757 -12.624 1.00 0.00 N ATOM 303 CA GLU A 19 13.518 -1.185 -11.283 1.00 0.00 C ATOM 304 C GLU A 19 13.618 0.333 -11.360 1.00 0.00 C ATOM 305 O GLU A 19 12.861 1.028 -10.684 1.00 0.00 O ATOM 306 CB GLU A 19 14.503 -1.834 -10.286 1.00 0.00 C ATOM 307 CG GLU A 19 15.395 -0.863 -9.503 1.00 0.00 C ATOM 308 CD GLU A 19 16.191 -1.547 -8.382 1.00 0.00 C ATOM 309 OE1 GLU A 19 15.636 -1.779 -7.283 1.00 0.00 O ATOM 310 OE2 GLU A 19 17.391 -1.812 -8.615 1.00 0.00 O ATOM 0 H GLU A 19 14.532 -2.307 -12.749 1.00 0.00 H new ATOM 0 HA GLU A 19 12.525 -1.412 -10.894 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.931 -2.428 -9.573 1.00 0.00 H new ATOM 0 HB3 GLU A 19 15.144 -2.525 -10.834 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.089 -0.381 -10.191 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.775 -0.076 -9.073 1.00 0.00 H new ATOM 317 N GLY A 20 14.514 0.850 -12.208 1.00 0.00 N ATOM 318 CA GLY A 20 14.757 2.280 -12.333 1.00 0.00 C ATOM 319 C GLY A 20 13.467 3.024 -12.650 1.00 0.00 C ATOM 320 O GLY A 20 13.046 3.884 -11.883 1.00 0.00 O ATOM 0 H GLY A 20 15.091 0.280 -12.827 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.184 2.663 -11.406 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.489 2.461 -13.120 1.00 0.00 H new ATOM 324 N PHE A 21 12.783 2.636 -13.724 1.00 0.00 N ATOM 325 CA PHE A 21 11.521 3.260 -14.096 1.00 0.00 C ATOM 326 C PHE A 21 10.444 2.994 -13.077 1.00 0.00 C ATOM 327 O PHE A 21 9.587 3.852 -12.891 1.00 0.00 O ATOM 328 CB PHE A 21 11.037 2.762 -15.456 1.00 0.00 C ATOM 329 CG PHE A 21 11.492 3.648 -16.580 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.127 5.012 -16.599 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.289 3.104 -17.592 1.00 0.00 C ATOM 332 CE1 PHE A 21 11.535 5.813 -17.679 1.00 0.00 C ATOM 333 CE2 PHE A 21 12.706 3.910 -18.655 1.00 0.00 C ATOM 334 CZ PHE A 21 12.314 5.258 -18.714 1.00 0.00 C ATOM 0 H PHE A 21 13.085 1.891 -14.351 1.00 0.00 H new ATOM 0 HA PHE A 21 11.711 4.332 -14.144 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.405 1.750 -15.622 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.948 2.709 -15.455 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.542 5.434 -15.795 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.581 2.065 -17.552 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.251 6.854 -17.716 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.331 3.496 -19.433 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.610 5.870 -19.554 1.00 0.00 H new ATOM 344 N ALA A 22 10.458 1.844 -12.411 1.00 0.00 N ATOM 345 CA ALA A 22 9.411 1.549 -11.459 1.00 0.00 C ATOM 346 C ALA A 22 9.517 2.461 -10.240 1.00 0.00 C ATOM 347 O ALA A 22 8.485 2.865 -9.718 1.00 0.00 O ATOM 348 CB ALA A 22 9.461 0.065 -11.119 1.00 0.00 C ATOM 0 H ALA A 22 11.169 1.120 -12.514 1.00 0.00 H new ATOM 0 HA ALA A 22 8.431 1.754 -11.890 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.675 -0.170 -10.401 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.312 -0.521 -12.026 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.432 -0.177 -10.687 1.00 0.00 H new ATOM 354 N LYS A 23 10.723 2.867 -9.823 1.00 0.00 N ATOM 355 CA LYS A 23 10.853 3.875 -8.763 1.00 0.00 C ATOM 356 C LYS A 23 10.279 5.217 -9.239 1.00 0.00 C ATOM 357 O LYS A 23 9.628 5.906 -8.461 1.00 0.00 O ATOM 358 CB LYS A 23 12.296 3.903 -8.195 1.00 0.00 C ATOM 359 CG LYS A 23 13.001 5.274 -8.074 1.00 0.00 C ATOM 360 CD LYS A 23 13.839 5.678 -9.302 1.00 0.00 C ATOM 361 CE LYS A 23 15.093 4.800 -9.514 1.00 0.00 C ATOM 362 NZ LYS A 23 16.185 5.088 -8.532 1.00 0.00 N ATOM 0 H LYS A 23 11.607 2.521 -10.195 1.00 0.00 H new ATOM 0 HA LYS A 23 10.245 3.608 -7.899 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.274 3.450 -7.204 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.915 3.263 -8.824 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.247 6.041 -7.898 1.00 0.00 H new ATOM 0 HG3 LYS A 23 13.650 5.258 -7.198 1.00 0.00 H new ATOM 0 HD2 LYS A 23 13.213 5.623 -10.192 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.148 6.718 -9.194 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.811 3.750 -9.437 1.00 0.00 H new ATOM 0 HE3 LYS A 23 15.471 4.955 -10.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 17.103 5.079 -9.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.029 6.023 -8.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.183 4.362 -7.787 1.00 0.00 H new ATOM 376 N THR A 24 10.458 5.570 -10.512 1.00 0.00 N ATOM 377 CA THR A 24 9.971 6.807 -11.092 1.00 0.00 C ATOM 378 C THR A 24 8.442 6.824 -11.226 1.00 0.00 C ATOM 379 O THR A 24 7.767 7.701 -10.691 1.00 0.00 O ATOM 380 CB THR A 24 10.747 6.972 -12.400 1.00 0.00 C ATOM 381 OG1 THR A 24 12.086 7.278 -12.078 1.00 0.00 O ATOM 382 CG2 THR A 24 10.155 7.986 -13.360 1.00 0.00 C ATOM 0 H THR A 24 10.959 4.984 -11.180 1.00 0.00 H new ATOM 0 HA THR A 24 10.151 7.671 -10.453 1.00 0.00 H new ATOM 0 HB THR A 24 10.685 6.030 -12.945 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.276 8.209 -12.320 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.769 8.037 -14.259 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.143 7.685 -13.629 1.00 0.00 H new ATOM 0 HG23 THR A 24 10.127 8.966 -12.883 1.00 0.00 H new ATOM 390 N LEU A 25 7.884 5.842 -11.929 1.00 0.00 N ATOM 391 CA LEU A 25 6.462 5.766 -12.278 1.00 0.00 C ATOM 392 C LEU A 25 5.647 5.358 -11.052 1.00 0.00 C ATOM 393 O LEU A 25 4.554 5.865 -10.801 1.00 0.00 O ATOM 394 CB LEU A 25 6.291 4.729 -13.405 1.00 0.00 C ATOM 395 CG LEU A 25 7.004 5.082 -14.721 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.109 3.824 -15.585 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.287 6.201 -15.480 1.00 0.00 C ATOM 0 H LEU A 25 8.422 5.052 -12.284 1.00 0.00 H new ATOM 0 HA LEU A 25 6.106 6.739 -12.617 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.663 3.767 -13.053 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.227 4.605 -13.607 1.00 0.00 H new ATOM 0 HG LEU A 25 8.001 5.453 -14.484 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.614 4.066 -16.520 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.679 3.063 -15.052 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.110 3.445 -15.799 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.825 6.418 -16.403 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.271 5.886 -15.718 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.254 7.097 -14.861 1.00 0.00 H new ATOM 409 N GLY A 26 6.208 4.450 -10.256 1.00 0.00 N ATOM 410 CA GLY A 26 5.624 3.918 -9.039 1.00 0.00 C ATOM 411 C GLY A 26 5.838 4.819 -7.826 1.00 0.00 C ATOM 412 O GLY A 26 5.427 4.438 -6.730 1.00 0.00 O ATOM 0 H GLY A 26 7.125 4.050 -10.456 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.555 3.772 -9.191 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.054 2.937 -8.836 1.00 0.00 H new ATOM 416 N ALA A 27 6.439 6.003 -8.000 1.00 0.00 N ATOM 417 CA ALA A 27 6.679 6.959 -6.927 1.00 0.00 C ATOM 418 C ALA A 27 5.358 7.253 -6.206 1.00 0.00 C ATOM 419 O ALA A 27 4.325 7.463 -6.851 1.00 0.00 O ATOM 420 CB ALA A 27 7.306 8.241 -7.500 1.00 0.00 C ATOM 0 H ALA A 27 6.775 6.323 -8.908 1.00 0.00 H new ATOM 0 HA ALA A 27 7.379 6.541 -6.204 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.483 8.952 -6.693 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.252 7.998 -7.984 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.628 8.683 -8.230 1.00 0.00 H new ATOM 426 N GLY A 28 5.390 7.224 -4.872 1.00 0.00 N ATOM 427 CA GLY A 28 4.241 7.523 -4.019 1.00 0.00 C ATOM 428 C GLY A 28 3.126 6.471 -4.043 1.00 0.00 C ATOM 429 O GLY A 28 2.060 6.733 -3.484 1.00 0.00 O ATOM 0 H GLY A 28 6.231 6.988 -4.346 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.590 7.638 -2.993 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.822 8.482 -4.323 1.00 0.00 H new ATOM 433 N LYS A 29 3.327 5.300 -4.673 1.00 0.00 N ATOM 434 CA LYS A 29 2.302 4.243 -4.730 1.00 0.00 C ATOM 435 C LYS A 29 2.868 2.848 -4.489 1.00 0.00 C ATOM 436 O LYS A 29 2.197 2.058 -3.831 1.00 0.00 O ATOM 437 CB LYS A 29 1.467 4.359 -6.032 1.00 0.00 C ATOM 438 CG LYS A 29 2.290 4.310 -7.332 1.00 0.00 C ATOM 439 CD LYS A 29 1.500 4.650 -8.608 1.00 0.00 C ATOM 440 CE LYS A 29 1.205 6.153 -8.796 1.00 0.00 C ATOM 441 NZ LYS A 29 2.420 6.991 -9.037 1.00 0.00 N ATOM 0 H LYS A 29 4.195 5.061 -5.152 1.00 0.00 H new ATOM 0 HA LYS A 29 1.617 4.402 -3.897 1.00 0.00 H new ATOM 0 HB2 LYS A 29 0.735 3.551 -6.051 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.909 5.295 -6.007 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.126 5.004 -7.243 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.715 3.312 -7.439 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.059 4.291 -9.473 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.555 4.106 -8.591 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.521 6.275 -9.636 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.691 6.525 -7.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.133 7.922 -9.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 2.940 7.113 -8.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 3.033 6.521 -9.733 1.00 0.00 H new ATOM 455 N ILE A 30 4.079 2.531 -4.961 1.00 0.00 N ATOM 456 CA ILE A 30 4.684 1.201 -4.826 1.00 0.00 C ATOM 457 C ILE A 30 6.190 1.342 -4.538 1.00 0.00 C ATOM 458 O ILE A 30 6.822 2.312 -4.956 1.00 0.00 O ATOM 459 CB ILE A 30 4.353 0.319 -6.063 1.00 0.00 C ATOM 460 CG1 ILE A 30 4.909 0.906 -7.374 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.833 0.101 -6.191 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.518 0.146 -8.647 1.00 0.00 C ATOM 0 H ILE A 30 4.673 3.198 -5.453 1.00 0.00 H new ATOM 0 HA ILE A 30 4.254 0.676 -3.973 1.00 0.00 H new ATOM 0 HB ILE A 30 4.844 -0.640 -5.898 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.567 1.937 -7.466 1.00 0.00 H new ATOM 0 HG13 ILE A 30 5.997 0.936 -7.308 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.627 -0.519 -7.064 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.460 -0.397 -5.296 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.336 1.064 -6.304 1.00 0.00 H new ATOM 0 HD11 ILE A 30 4.958 0.638 -9.514 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.885 -0.879 -8.586 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.433 0.138 -8.747 1.00 0.00 H new ATOM 474 N ALA A 31 6.750 0.390 -3.786 1.00 0.00 N ATOM 475 CA ALA A 31 8.176 0.302 -3.452 1.00 0.00 C ATOM 476 C ALA A 31 8.842 -0.635 -4.453 1.00 0.00 C ATOM 477 O ALA A 31 8.161 -1.469 -5.037 1.00 0.00 O ATOM 478 CB ALA A 31 8.355 -0.217 -2.020 1.00 0.00 C ATOM 0 H ALA A 31 6.204 -0.368 -3.378 1.00 0.00 H new ATOM 0 HA ALA A 31 8.638 1.288 -3.507 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.418 -0.277 -1.785 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.867 0.464 -1.323 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.907 -1.207 -1.933 1.00 0.00 H new ATOM 484 N VAL A 32 10.154 -0.552 -4.649 1.00 0.00 N ATOM 485 CA VAL A 32 10.870 -1.353 -5.640 1.00 0.00 C ATOM 486 C VAL A 32 12.209 -1.765 -5.031 1.00 0.00 C ATOM 487 O VAL A 32 12.924 -0.916 -4.487 1.00 0.00 O ATOM 488 CB VAL A 32 11.090 -0.519 -6.914 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.661 -1.388 -8.036 1.00 0.00 C ATOM 490 CG2 VAL A 32 9.810 0.165 -7.422 1.00 0.00 C ATOM 0 H VAL A 32 10.757 0.078 -4.120 1.00 0.00 H new ATOM 0 HA VAL A 32 10.297 -2.240 -5.909 1.00 0.00 H new ATOM 0 HB VAL A 32 11.797 0.263 -6.637 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.809 -0.779 -8.928 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.616 -1.808 -7.721 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.965 -2.197 -8.260 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.036 0.736 -8.322 1.00 0.00 H new ATOM 0 HG22 VAL A 32 9.059 -0.592 -7.651 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.426 0.836 -6.653 1.00 0.00 H new ATOM 500 N THR A 33 12.556 -3.039 -5.183 1.00 0.00 N ATOM 501 CA THR A 33 13.845 -3.577 -4.834 1.00 0.00 C ATOM 502 C THR A 33 14.138 -4.691 -5.826 1.00 0.00 C ATOM 503 O THR A 33 13.468 -5.725 -5.801 1.00 0.00 O ATOM 504 CB THR A 33 13.794 -4.159 -3.415 1.00 0.00 C ATOM 505 OG1 THR A 33 13.272 -3.239 -2.464 1.00 0.00 O ATOM 506 CG2 THR A 33 15.182 -4.632 -2.955 1.00 0.00 C ATOM 0 H THR A 33 11.920 -3.739 -5.565 1.00 0.00 H new ATOM 0 HA THR A 33 14.614 -2.805 -4.865 1.00 0.00 H new ATOM 0 HB THR A 33 13.118 -5.012 -3.466 1.00 0.00 H new ATOM 0 HG1 THR A 33 13.259 -3.657 -1.578 1.00 0.00 H new ATOM 0 HG21 THR A 33 15.112 -5.039 -1.946 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.547 -5.404 -3.633 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.873 -3.789 -2.959 1.00 0.00 H new ATOM 514 N SER A 34 15.138 -4.517 -6.677 1.00 0.00 N ATOM 515 CA SER A 34 15.640 -5.593 -7.507 1.00 0.00 C ATOM 516 C SER A 34 16.904 -6.155 -6.857 1.00 0.00 C ATOM 517 O SER A 34 17.991 -5.588 -6.972 1.00 0.00 O ATOM 518 CB SER A 34 15.818 -5.099 -8.937 1.00 0.00 C ATOM 519 OG SER A 34 14.523 -4.897 -9.486 1.00 0.00 O ATOM 0 H SER A 34 15.620 -3.628 -6.809 1.00 0.00 H new ATOM 0 HA SER A 34 14.934 -6.420 -7.577 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.390 -4.171 -8.953 1.00 0.00 H new ATOM 0 HB3 SER A 34 16.375 -5.827 -9.527 1.00 0.00 H new ATOM 0 HG SER A 34 14.605 -4.576 -10.408 1.00 0.00 H new ATOM 525 N SER A 35 16.732 -7.257 -6.121 1.00 0.00 N ATOM 526 CA SER A 35 17.766 -7.925 -5.340 1.00 0.00 C ATOM 527 C SER A 35 18.825 -8.563 -6.247 1.00 0.00 C ATOM 528 O SER A 35 19.977 -8.120 -6.282 1.00 0.00 O ATOM 529 CB SER A 35 17.070 -8.953 -4.442 1.00 0.00 C ATOM 530 OG SER A 35 16.111 -9.658 -5.227 1.00 0.00 O ATOM 0 H SER A 35 15.828 -7.724 -6.053 1.00 0.00 H new ATOM 0 HA SER A 35 18.306 -7.207 -4.722 1.00 0.00 H new ATOM 0 HB2 SER A 35 17.799 -9.645 -4.022 1.00 0.00 H new ATOM 0 HB3 SER A 35 16.582 -8.456 -3.603 1.00 0.00 H new ATOM 0 HG SER A 35 15.538 -10.194 -4.640 1.00 0.00 H new ATOM 536 N GLY A 36 18.412 -9.582 -7.006 1.00 0.00 N ATOM 537 CA GLY A 36 19.280 -10.437 -7.798 1.00 0.00 C ATOM 538 C GLY A 36 19.306 -11.820 -7.160 1.00 0.00 C ATOM 539 O GLY A 36 19.400 -11.948 -5.937 1.00 0.00 O ATOM 0 H GLY A 36 17.428 -9.838 -7.084 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.917 -10.500 -8.824 1.00 0.00 H new ATOM 0 HA3 GLY A 36 20.286 -10.020 -7.841 1.00 0.00 H new ATOM 543 N LEU A 37 19.185 -12.863 -7.983 1.00 0.00 N ATOM 544 CA LEU A 37 19.376 -14.241 -7.545 1.00 0.00 C ATOM 545 C LEU A 37 20.860 -14.471 -7.258 1.00 0.00 C ATOM 546 O LEU A 37 21.225 -15.146 -6.297 1.00 0.00 O ATOM 547 CB LEU A 37 18.832 -15.190 -8.621 1.00 0.00 C ATOM 548 CG LEU A 37 17.293 -15.228 -8.622 1.00 0.00 C ATOM 549 CD1 LEU A 37 16.764 -15.407 -10.048 1.00 0.00 C ATOM 550 CD2 LEU A 37 16.784 -16.385 -7.750 1.00 0.00 C ATOM 0 H LEU A 37 18.952 -12.773 -8.972 1.00 0.00 H new ATOM 0 HA LEU A 37 18.827 -14.440 -6.624 1.00 0.00 H new ATOM 0 HB2 LEU A 37 19.189 -14.872 -9.601 1.00 0.00 H new ATOM 0 HB3 LEU A 37 19.221 -16.194 -8.451 1.00 0.00 H new ATOM 0 HG LEU A 37 16.932 -14.283 -8.217 1.00 0.00 H new ATOM 0 HD11 LEU A 37 15.674 -15.432 -10.031 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.099 -14.575 -10.667 1.00 0.00 H new ATOM 0 HD13 LEU A 37 17.142 -16.342 -10.462 1.00 0.00 H new ATOM 0 HD21 LEU A 37 15.694 -16.397 -7.762 1.00 0.00 H new ATOM 0 HD22 LEU A 37 17.162 -17.329 -8.142 1.00 0.00 H new ATOM 0 HD23 LEU A 37 17.134 -16.251 -6.727 1.00 0.00 H new ATOM 562 N GLU A 38 21.699 -13.850 -8.081 1.00 0.00 N ATOM 563 CA GLU A 38 23.130 -13.677 -7.980 1.00 0.00 C ATOM 564 C GLU A 38 23.374 -12.184 -8.117 1.00 0.00 C ATOM 565 O GLU A 38 22.527 -11.458 -8.656 1.00 0.00 O ATOM 566 CB GLU A 38 23.855 -14.409 -9.112 1.00 0.00 C ATOM 567 CG GLU A 38 23.864 -15.910 -8.858 1.00 0.00 C ATOM 568 CD GLU A 38 24.361 -16.700 -10.083 1.00 0.00 C ATOM 569 OE1 GLU A 38 25.557 -16.578 -10.441 1.00 0.00 O ATOM 570 OE2 GLU A 38 23.563 -17.450 -10.696 1.00 0.00 O ATOM 0 H GLU A 38 21.343 -13.408 -8.929 1.00 0.00 H new ATOM 0 HA GLU A 38 23.503 -14.080 -7.038 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.364 -14.198 -10.062 1.00 0.00 H new ATOM 0 HB3 GLU A 38 24.878 -14.042 -9.193 1.00 0.00 H new ATOM 0 HG2 GLU A 38 24.502 -16.129 -8.002 1.00 0.00 H new ATOM 0 HG3 GLU A 38 22.858 -16.240 -8.598 1.00 0.00 H new ATOM 577 N SER A 39 24.537 -11.705 -7.683 1.00 0.00 N ATOM 578 CA SER A 39 24.748 -10.276 -7.659 1.00 0.00 C ATOM 579 C SER A 39 26.201 -9.862 -7.836 1.00 0.00 C ATOM 580 O SER A 39 27.134 -10.557 -7.423 1.00 0.00 O ATOM 581 CB SER A 39 24.085 -9.730 -6.382 1.00 0.00 C ATOM 582 OG SER A 39 24.557 -10.380 -5.205 1.00 0.00 O ATOM 0 H SER A 39 25.320 -12.271 -7.355 1.00 0.00 H new ATOM 0 HA SER A 39 24.275 -9.823 -8.530 1.00 0.00 H new ATOM 0 HB2 SER A 39 24.277 -8.660 -6.305 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.005 -9.855 -6.455 1.00 0.00 H new ATOM 0 HG SER A 39 24.110 -10.000 -4.420 1.00 0.00 H new ATOM 588 N SER A 40 26.342 -8.721 -8.515 1.00 0.00 N ATOM 589 CA SER A 40 27.611 -8.167 -8.952 1.00 0.00 C ATOM 590 C SER A 40 27.504 -6.641 -8.922 1.00 0.00 C ATOM 591 O SER A 40 27.902 -6.029 -7.930 1.00 0.00 O ATOM 592 CB SER A 40 27.940 -8.767 -10.325 1.00 0.00 C ATOM 593 OG SER A 40 28.616 -10.005 -10.186 1.00 0.00 O ATOM 0 H SER A 40 25.545 -8.143 -8.781 1.00 0.00 H new ATOM 0 HA SER A 40 28.443 -8.423 -8.297 1.00 0.00 H new ATOM 0 HB2 SER A 40 27.021 -8.911 -10.893 1.00 0.00 H new ATOM 0 HB3 SER A 40 28.559 -8.071 -10.892 1.00 0.00 H new ATOM 0 HG SER A 40 29.089 -10.214 -11.018 1.00 0.00 H new ATOM 599 N ARG A 41 26.943 -6.022 -9.971 1.00 0.00 N ATOM 600 CA ARG A 41 26.800 -4.566 -10.061 1.00 0.00 C ATOM 601 C ARG A 41 25.709 -4.228 -11.068 1.00 0.00 C ATOM 602 O ARG A 41 24.768 -4.991 -11.257 1.00 0.00 O ATOM 603 CB ARG A 41 28.192 -3.932 -10.361 1.00 0.00 C ATOM 604 CG ARG A 41 28.505 -2.809 -9.353 1.00 0.00 C ATOM 605 CD ARG A 41 29.855 -2.141 -9.633 1.00 0.00 C ATOM 606 NE ARG A 41 29.835 -1.363 -10.891 1.00 0.00 N ATOM 607 CZ ARG A 41 30.887 -1.114 -11.685 1.00 0.00 C ATOM 608 NH1 ARG A 41 32.101 -1.552 -11.365 1.00 0.00 N ATOM 609 NH2 ARG A 41 30.713 -0.417 -12.805 1.00 0.00 N ATOM 0 H ARG A 41 26.576 -6.520 -10.782 1.00 0.00 H new ATOM 0 HA ARG A 41 26.473 -4.131 -9.116 1.00 0.00 H new ATOM 0 HB2 ARG A 41 28.965 -4.699 -10.311 1.00 0.00 H new ATOM 0 HB3 ARG A 41 28.205 -3.532 -11.375 1.00 0.00 H new ATOM 0 HG2 ARG A 41 27.715 -2.059 -9.391 1.00 0.00 H new ATOM 0 HG3 ARG A 41 28.507 -3.219 -8.343 1.00 0.00 H new ATOM 0 HD2 ARG A 41 30.114 -1.483 -8.803 1.00 0.00 H new ATOM 0 HD3 ARG A 41 30.632 -2.903 -9.690 1.00 0.00 H new ATOM 0 HE ARG A 41 28.936 -0.979 -11.182 1.00 0.00 H new ATOM 0 HH11 ARG A 41 32.241 -2.085 -10.506 1.00 0.00 H new ATOM 0 HH12 ARG A 41 32.892 -1.355 -11.978 1.00 0.00 H new ATOM 0 HH21 ARG A 41 29.785 -0.076 -13.055 1.00 0.00 H new ATOM 0 HH22 ARG A 41 31.508 -0.224 -13.414 1.00 0.00 H new ATOM 623 N VAL A 42 25.813 -3.045 -11.650 1.00 0.00 N ATOM 624 CA VAL A 42 24.955 -2.467 -12.671 1.00 0.00 C ATOM 625 C VAL A 42 25.911 -1.899 -13.741 1.00 0.00 C ATOM 626 O VAL A 42 27.035 -1.511 -13.407 1.00 0.00 O ATOM 627 CB VAL A 42 24.001 -1.464 -11.983 1.00 0.00 C ATOM 628 CG1 VAL A 42 24.738 -0.457 -11.083 1.00 0.00 C ATOM 629 CG2 VAL A 42 23.092 -0.697 -12.947 1.00 0.00 C ATOM 0 H VAL A 42 26.568 -2.408 -11.397 1.00 0.00 H new ATOM 0 HA VAL A 42 24.289 -3.163 -13.181 1.00 0.00 H new ATOM 0 HB VAL A 42 23.368 -2.102 -11.366 1.00 0.00 H new ATOM 0 HG11 VAL A 42 24.016 0.221 -10.628 1.00 0.00 H new ATOM 0 HG12 VAL A 42 25.275 -0.993 -10.301 1.00 0.00 H new ATOM 0 HG13 VAL A 42 25.446 0.116 -11.682 1.00 0.00 H new ATOM 0 HG21 VAL A 42 22.456 -0.016 -12.383 1.00 0.00 H new ATOM 0 HG22 VAL A 42 23.703 -0.127 -13.647 1.00 0.00 H new ATOM 0 HG23 VAL A 42 22.470 -1.402 -13.499 1.00 0.00 H new ATOM 639 N HIS A 43 25.507 -1.886 -15.013 1.00 0.00 N ATOM 640 CA HIS A 43 26.409 -1.576 -16.125 1.00 0.00 C ATOM 641 C HIS A 43 26.734 -0.067 -16.153 1.00 0.00 C ATOM 642 O HIS A 43 25.816 0.737 -15.997 1.00 0.00 O ATOM 643 CB HIS A 43 25.771 -2.101 -17.425 1.00 0.00 C ATOM 644 CG HIS A 43 26.615 -1.912 -18.658 1.00 0.00 C ATOM 645 ND1 HIS A 43 27.696 -2.671 -19.038 1.00 0.00 N ATOM 646 CD2 HIS A 43 26.439 -0.959 -19.622 1.00 0.00 C ATOM 647 CE1 HIS A 43 28.176 -2.172 -20.189 1.00 0.00 C ATOM 648 NE2 HIS A 43 27.430 -1.127 -20.594 1.00 0.00 N ATOM 0 H HIS A 43 24.550 -2.089 -15.301 1.00 0.00 H new ATOM 0 HA HIS A 43 27.371 -2.075 -16.004 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.557 -3.163 -17.306 1.00 0.00 H new ATOM 0 HB3 HIS A 43 24.815 -1.598 -17.574 1.00 0.00 H new ATOM 0 HD2 HIS A 43 25.666 -0.205 -19.631 1.00 0.00 H new ATOM 0 HE1 HIS A 43 29.038 -2.555 -20.715 1.00 0.00 H new ATOM 0 HE2 HIS A 43 27.561 -0.571 -21.439 1.00 0.00 H new ATOM 656 N PRO A 44 27.994 0.363 -16.376 1.00 0.00 N ATOM 657 CA PRO A 44 28.393 1.769 -16.266 1.00 0.00 C ATOM 658 C PRO A 44 27.642 2.681 -17.240 1.00 0.00 C ATOM 659 O PRO A 44 27.075 3.693 -16.826 1.00 0.00 O ATOM 660 CB PRO A 44 29.903 1.799 -16.541 1.00 0.00 C ATOM 661 CG PRO A 44 30.166 0.498 -17.301 1.00 0.00 C ATOM 662 CD PRO A 44 29.168 -0.454 -16.659 1.00 0.00 C ATOM 0 HA PRO A 44 28.147 2.152 -15.275 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.184 2.671 -17.132 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.477 1.844 -15.615 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.993 0.609 -18.371 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.193 0.155 -17.178 1.00 0.00 H new ATOM 0 HD2 PRO A 44 28.923 -1.279 -17.328 1.00 0.00 H new ATOM 0 HD3 PRO A 44 29.572 -0.893 -15.747 1.00 0.00 H new ATOM 670 N THR A 45 27.581 2.311 -18.522 1.00 0.00 N ATOM 671 CA THR A 45 26.930 3.126 -19.547 1.00 0.00 C ATOM 672 C THR A 45 25.415 3.189 -19.303 1.00 0.00 C ATOM 673 O THR A 45 24.767 4.142 -19.732 1.00 0.00 O ATOM 674 CB THR A 45 27.321 2.597 -20.934 1.00 0.00 C ATOM 675 OG1 THR A 45 28.731 2.438 -20.987 1.00 0.00 O ATOM 676 CG2 THR A 45 26.867 3.499 -22.090 1.00 0.00 C ATOM 0 H THR A 45 27.980 1.442 -18.876 1.00 0.00 H new ATOM 0 HA THR A 45 27.274 4.159 -19.494 1.00 0.00 H new ATOM 0 HB THR A 45 26.807 1.645 -21.065 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.989 2.099 -21.869 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.179 3.060 -23.038 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.781 3.593 -22.073 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.318 4.485 -21.981 1.00 0.00 H new ATOM 684 N ALA A 46 24.849 2.239 -18.534 1.00 0.00 N ATOM 685 CA ALA A 46 23.449 2.302 -18.149 1.00 0.00 C ATOM 686 C ALA A 46 23.213 3.575 -17.380 1.00 0.00 C ATOM 687 O ALA A 46 22.348 4.347 -17.753 1.00 0.00 O ATOM 688 CB ALA A 46 23.027 1.108 -17.275 1.00 0.00 C ATOM 0 H ALA A 46 25.348 1.426 -18.174 1.00 0.00 H new ATOM 0 HA ALA A 46 22.853 2.273 -19.061 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.973 1.202 -17.014 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.183 0.181 -17.826 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.626 1.094 -16.364 1.00 0.00 H new ATOM 694 N ILE A 47 24.011 3.820 -16.350 1.00 0.00 N ATOM 695 CA ILE A 47 23.777 4.916 -15.425 1.00 0.00 C ATOM 696 C ILE A 47 23.726 6.222 -16.215 1.00 0.00 C ATOM 697 O ILE A 47 22.826 7.023 -15.995 1.00 0.00 O ATOM 698 CB ILE A 47 24.894 4.929 -14.353 1.00 0.00 C ATOM 699 CG1 ILE A 47 24.841 3.643 -13.497 1.00 0.00 C ATOM 700 CG2 ILE A 47 24.802 6.180 -13.462 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.161 3.343 -12.783 1.00 0.00 C ATOM 0 H ILE A 47 24.838 3.264 -16.134 1.00 0.00 H new ATOM 0 HA ILE A 47 22.825 4.793 -14.908 1.00 0.00 H new ATOM 0 HB ILE A 47 25.853 4.961 -14.871 1.00 0.00 H new ATOM 0 HG12 ILE A 47 24.048 3.739 -12.756 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.580 2.799 -14.136 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.600 6.158 -12.720 1.00 0.00 H new ATOM 0 HG22 ILE A 47 24.903 7.074 -14.078 1.00 0.00 H new ATOM 0 HG23 ILE A 47 23.837 6.196 -12.956 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.059 2.428 -12.199 1.00 0.00 H new ATOM 0 HD12 ILE A 47 26.953 3.216 -13.521 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.412 4.171 -12.120 1.00 0.00 H new ATOM 713 N ALA A 48 24.627 6.400 -17.183 1.00 0.00 N ATOM 714 CA ALA A 48 24.662 7.608 -17.985 1.00 0.00 C ATOM 715 C ALA A 48 23.388 7.762 -18.826 1.00 0.00 C ATOM 716 O ALA A 48 22.775 8.827 -18.813 1.00 0.00 O ATOM 717 CB ALA A 48 25.922 7.603 -18.861 1.00 0.00 C ATOM 0 H ALA A 48 25.342 5.715 -17.426 1.00 0.00 H new ATOM 0 HA ALA A 48 24.701 8.471 -17.321 1.00 0.00 H new ATOM 0 HB1 ALA A 48 25.949 8.510 -19.464 1.00 0.00 H new ATOM 0 HB2 ALA A 48 26.807 7.563 -18.226 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.906 6.732 -19.516 1.00 0.00 H new ATOM 723 N MET A 49 22.958 6.709 -19.528 1.00 0.00 N ATOM 724 CA MET A 49 21.771 6.761 -20.387 1.00 0.00 C ATOM 725 C MET A 49 20.496 6.890 -19.545 1.00 0.00 C ATOM 726 O MET A 49 19.533 7.579 -19.893 1.00 0.00 O ATOM 727 CB MET A 49 21.739 5.499 -21.269 1.00 0.00 C ATOM 728 CG MET A 49 22.953 5.422 -22.212 1.00 0.00 C ATOM 729 SD MET A 49 23.090 6.752 -23.438 1.00 0.00 S ATOM 730 CE MET A 49 24.501 7.644 -22.728 1.00 0.00 C ATOM 0 H MET A 49 23.421 5.800 -19.517 1.00 0.00 H new ATOM 0 HA MET A 49 21.820 7.641 -21.029 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.717 4.614 -20.634 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.822 5.492 -21.858 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.859 5.418 -21.606 1.00 0.00 H new ATOM 0 HG3 MET A 49 22.918 4.469 -22.740 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.737 8.506 -23.351 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.250 7.981 -21.722 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.365 6.981 -22.683 1.00 0.00 H new ATOM 740 N MET A 50 20.489 6.252 -18.391 1.00 0.00 N ATOM 741 CA MET A 50 19.346 6.237 -17.511 1.00 0.00 C ATOM 742 C MET A 50 19.258 7.625 -16.873 1.00 0.00 C ATOM 743 O MET A 50 18.161 8.167 -16.741 1.00 0.00 O ATOM 744 CB MET A 50 19.447 5.058 -16.530 1.00 0.00 C ATOM 745 CG MET A 50 19.511 3.655 -17.186 1.00 0.00 C ATOM 746 SD MET A 50 19.264 3.452 -18.987 1.00 0.00 S ATOM 747 CE MET A 50 19.676 1.695 -19.287 1.00 0.00 C ATOM 0 H MET A 50 21.288 5.725 -18.038 1.00 0.00 H new ATOM 0 HA MET A 50 18.406 6.060 -18.034 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.336 5.194 -15.914 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.588 5.089 -15.860 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.488 3.234 -16.947 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.766 3.034 -16.688 1.00 0.00 H new ATOM 0 HE1 MET A 50 18.986 1.280 -20.021 1.00 0.00 H new ATOM 0 HE2 MET A 50 20.696 1.620 -19.665 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.593 1.137 -18.354 1.00 0.00 H new ATOM 757 N GLU A 51 20.392 8.282 -16.631 1.00 0.00 N ATOM 758 CA GLU A 51 20.443 9.668 -16.213 1.00 0.00 C ATOM 759 C GLU A 51 20.028 10.600 -17.363 1.00 0.00 C ATOM 760 O GLU A 51 19.582 11.719 -17.099 1.00 0.00 O ATOM 761 CB GLU A 51 21.825 9.999 -15.631 1.00 0.00 C ATOM 762 CG GLU A 51 21.877 11.314 -14.843 1.00 0.00 C ATOM 763 CD GLU A 51 21.119 11.223 -13.504 1.00 0.00 C ATOM 764 OE1 GLU A 51 19.891 11.473 -13.478 1.00 0.00 O ATOM 765 OE2 GLU A 51 21.757 10.934 -12.461 1.00 0.00 O ATOM 0 H GLU A 51 21.312 7.852 -16.724 1.00 0.00 H new ATOM 0 HA GLU A 51 19.720 9.832 -15.414 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.136 9.184 -14.977 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.548 10.048 -16.446 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.917 11.580 -14.652 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.449 12.114 -15.447 1.00 0.00 H new ATOM 772 N GLU A 52 20.080 10.159 -18.631 1.00 0.00 N ATOM 773 CA GLU A 52 19.478 10.950 -19.709 1.00 0.00 C ATOM 774 C GLU A 52 17.967 11.032 -19.494 1.00 0.00 C ATOM 775 O GLU A 52 17.380 12.095 -19.705 1.00 0.00 O ATOM 776 CB GLU A 52 19.712 10.441 -21.140 1.00 0.00 C ATOM 777 CG GLU A 52 21.166 10.385 -21.600 1.00 0.00 C ATOM 778 CD GLU A 52 21.284 9.922 -23.066 1.00 0.00 C ATOM 779 OE1 GLU A 52 20.474 9.082 -23.537 1.00 0.00 O ATOM 780 OE2 GLU A 52 22.192 10.425 -23.767 1.00 0.00 O ATOM 0 H GLU A 52 20.519 9.287 -18.926 1.00 0.00 H new ATOM 0 HA GLU A 52 19.981 11.915 -19.644 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.287 9.441 -21.223 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.158 11.081 -21.827 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.620 11.370 -21.492 1.00 0.00 H new ATOM 0 HG3 GLU A 52 21.725 9.704 -20.958 1.00 0.00 H new ATOM 787 N VAL A 53 17.345 9.935 -19.040 1.00 0.00 N ATOM 788 CA VAL A 53 15.931 9.983 -18.625 1.00 0.00 C ATOM 789 C VAL A 53 15.776 10.484 -17.172 1.00 0.00 C ATOM 790 O VAL A 53 14.668 10.527 -16.634 1.00 0.00 O ATOM 791 CB VAL A 53 15.169 8.696 -19.026 1.00 0.00 C ATOM 792 CG1 VAL A 53 15.527 7.457 -18.196 1.00 0.00 C ATOM 793 CG2 VAL A 53 13.647 8.888 -19.044 1.00 0.00 C ATOM 0 H VAL A 53 17.786 9.019 -18.951 1.00 0.00 H new ATOM 0 HA VAL A 53 15.409 10.751 -19.195 1.00 0.00 H new ATOM 0 HB VAL A 53 15.513 8.505 -20.043 1.00 0.00 H new ATOM 0 HG11 VAL A 53 14.946 6.604 -18.546 1.00 0.00 H new ATOM 0 HG12 VAL A 53 16.590 7.241 -18.304 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.300 7.644 -17.146 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.166 7.953 -19.332 1.00 0.00 H new ATOM 0 HG22 VAL A 53 13.306 9.181 -18.051 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.387 9.666 -19.762 1.00 0.00 H new ATOM 803 N GLY A 54 16.861 10.941 -16.542 1.00 0.00 N ATOM 804 CA GLY A 54 16.849 11.520 -15.207 1.00 0.00 C ATOM 805 C GLY A 54 16.678 10.474 -14.102 1.00 0.00 C ATOM 806 O GLY A 54 16.175 10.811 -13.028 1.00 0.00 O ATOM 0 H GLY A 54 17.791 10.916 -16.960 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.780 12.063 -15.044 1.00 0.00 H new ATOM 0 HA3 GLY A 54 16.040 12.247 -15.140 1.00 0.00 H new ATOM 810 N ILE A 55 17.034 9.212 -14.366 1.00 0.00 N ATOM 811 CA ILE A 55 16.867 8.089 -13.448 1.00 0.00 C ATOM 812 C ILE A 55 18.246 7.537 -13.099 1.00 0.00 C ATOM 813 O ILE A 55 19.035 7.233 -13.992 1.00 0.00 O ATOM 814 CB ILE A 55 15.940 7.024 -14.055 1.00 0.00 C ATOM 815 CG1 ILE A 55 14.549 7.625 -14.362 1.00 0.00 C ATOM 816 CG2 ILE A 55 15.791 5.799 -13.133 1.00 0.00 C ATOM 817 CD1 ILE A 55 13.514 6.613 -14.860 1.00 0.00 C ATOM 0 H ILE A 55 17.459 8.940 -15.252 1.00 0.00 H new ATOM 0 HA ILE A 55 16.386 8.420 -12.527 1.00 0.00 H new ATOM 0 HB ILE A 55 16.400 6.689 -14.985 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.167 8.102 -13.460 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.663 8.407 -15.112 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.128 5.071 -13.600 1.00 0.00 H new ATOM 0 HG22 ILE A 55 16.769 5.346 -12.969 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.371 6.112 -12.177 1.00 0.00 H new ATOM 0 HD11 ILE A 55 12.569 7.122 -15.050 1.00 0.00 H new ATOM 0 HD12 ILE A 55 13.870 6.153 -15.782 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.365 5.843 -14.103 1.00 0.00 H new ATOM 829 N ASP A 56 18.514 7.322 -11.809 1.00 0.00 N ATOM 830 CA ASP A 56 19.716 6.617 -11.373 1.00 0.00 C ATOM 831 C ASP A 56 19.377 5.176 -11.000 1.00 0.00 C ATOM 832 O ASP A 56 18.288 4.889 -10.493 1.00 0.00 O ATOM 833 CB ASP A 56 20.439 7.364 -10.244 1.00 0.00 C ATOM 834 CG ASP A 56 21.779 6.692 -9.884 1.00 0.00 C ATOM 835 OD1 ASP A 56 22.406 6.070 -10.776 1.00 0.00 O ATOM 836 OD2 ASP A 56 22.193 6.786 -8.705 1.00 0.00 O ATOM 0 H ASP A 56 17.910 7.629 -11.047 1.00 0.00 H new ATOM 0 HA ASP A 56 20.418 6.586 -12.206 1.00 0.00 H new ATOM 0 HB2 ASP A 56 20.619 8.396 -10.547 1.00 0.00 H new ATOM 0 HB3 ASP A 56 19.800 7.397 -9.362 1.00 0.00 H new ATOM 841 N ILE A 57 20.324 4.281 -11.258 1.00 0.00 N ATOM 842 CA ILE A 57 20.301 2.855 -10.935 1.00 0.00 C ATOM 843 C ILE A 57 21.651 2.404 -10.355 1.00 0.00 C ATOM 844 O ILE A 57 21.735 1.272 -9.893 1.00 0.00 O ATOM 845 CB ILE A 57 19.896 2.004 -12.161 1.00 0.00 C ATOM 846 CG1 ILE A 57 20.661 2.457 -13.422 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.370 2.018 -12.367 1.00 0.00 C ATOM 848 CD1 ILE A 57 20.461 1.541 -14.624 1.00 0.00 C ATOM 0 H ILE A 57 21.188 4.549 -11.730 1.00 0.00 H new ATOM 0 HA ILE A 57 19.541 2.697 -10.170 1.00 0.00 H new ATOM 0 HB ILE A 57 20.179 0.969 -11.969 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.341 3.465 -13.687 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.725 2.511 -13.191 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.115 1.411 -13.236 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.880 1.610 -11.483 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.034 3.042 -12.528 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.029 1.924 -15.472 1.00 0.00 H new ATOM 0 HD12 ILE A 57 20.808 0.537 -14.378 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.403 1.506 -14.883 1.00 0.00 H new ATOM 860 N SER A 58 22.706 3.227 -10.384 1.00 0.00 N ATOM 861 CA SER A 58 23.946 2.968 -9.653 1.00 0.00 C ATOM 862 C SER A 58 23.607 2.468 -8.234 1.00 0.00 C ATOM 863 O SER A 58 22.760 3.047 -7.546 1.00 0.00 O ATOM 864 CB SER A 58 24.788 4.251 -9.588 1.00 0.00 C ATOM 865 OG SER A 58 26.124 3.945 -9.221 1.00 0.00 O ATOM 0 H SER A 58 22.721 4.095 -10.919 1.00 0.00 H new ATOM 0 HA SER A 58 24.525 2.201 -10.168 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.775 4.752 -10.556 1.00 0.00 H new ATOM 0 HB3 SER A 58 24.354 4.942 -8.865 1.00 0.00 H new ATOM 0 HG SER A 58 26.651 4.771 -9.185 1.00 0.00 H new ATOM 871 N GLY A 59 24.250 1.374 -7.809 1.00 0.00 N ATOM 872 CA GLY A 59 23.980 0.766 -6.513 1.00 0.00 C ATOM 873 C GLY A 59 22.626 0.052 -6.455 1.00 0.00 C ATOM 874 O GLY A 59 21.962 0.117 -5.419 1.00 0.00 O ATOM 0 H GLY A 59 24.966 0.893 -8.353 1.00 0.00 H new ATOM 0 HA2 GLY A 59 24.771 0.052 -6.281 1.00 0.00 H new ATOM 0 HA3 GLY A 59 24.011 1.537 -5.743 1.00 0.00 H new ATOM 878 N GLN A 60 22.206 -0.636 -7.535 1.00 0.00 N ATOM 879 CA GLN A 60 21.030 -1.521 -7.487 1.00 0.00 C ATOM 880 C GLN A 60 21.198 -2.575 -6.392 1.00 0.00 C ATOM 881 O GLN A 60 20.247 -2.937 -5.698 1.00 0.00 O ATOM 882 CB GLN A 60 20.830 -2.312 -8.795 1.00 0.00 C ATOM 883 CG GLN A 60 20.466 -1.482 -10.029 1.00 0.00 C ATOM 884 CD GLN A 60 19.815 -2.332 -11.115 1.00 0.00 C ATOM 885 OE1 GLN A 60 20.479 -2.804 -12.035 1.00 0.00 O ATOM 886 NE2 GLN A 60 18.521 -2.571 -11.017 1.00 0.00 N ATOM 0 H GLN A 60 22.663 -0.595 -8.446 1.00 0.00 H new ATOM 0 HA GLN A 60 20.179 -0.864 -7.307 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.747 -2.862 -9.008 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.045 -3.051 -8.634 1.00 0.00 H new ATOM 0 HG2 GLN A 60 19.787 -0.680 -9.740 1.00 0.00 H new ATOM 0 HG3 GLN A 60 21.364 -1.010 -10.427 1.00 0.00 H new ATOM 0 HE21 GLN A 60 17.985 -2.171 -10.247 1.00 0.00 H new ATOM 0 HE22 GLN A 60 18.056 -3.156 -11.712 1.00 0.00 H new ATOM 895 N THR A 61 22.418 -3.103 -6.292 1.00 0.00 N ATOM 896 CA THR A 61 22.742 -4.252 -5.474 1.00 0.00 C ATOM 897 C THR A 61 22.561 -3.891 -3.992 1.00 0.00 C ATOM 898 O THR A 61 22.977 -2.817 -3.543 1.00 0.00 O ATOM 899 CB THR A 61 24.157 -4.750 -5.849 1.00 0.00 C ATOM 900 OG1 THR A 61 25.007 -3.678 -6.243 1.00 0.00 O ATOM 901 CG2 THR A 61 24.073 -5.685 -7.061 1.00 0.00 C ATOM 0 H THR A 61 23.223 -2.727 -6.794 1.00 0.00 H new ATOM 0 HA THR A 61 22.065 -5.086 -5.659 1.00 0.00 H new ATOM 0 HB THR A 61 24.556 -5.248 -4.966 1.00 0.00 H new ATOM 0 HG1 THR A 61 25.893 -4.030 -6.471 1.00 0.00 H new ATOM 0 HG21 THR A 61 25.072 -6.033 -7.322 1.00 0.00 H new ATOM 0 HG22 THR A 61 23.442 -6.540 -6.818 1.00 0.00 H new ATOM 0 HG23 THR A 61 23.644 -5.147 -7.907 1.00 0.00 H new ATOM 909 N SER A 62 21.913 -4.786 -3.243 1.00 0.00 N ATOM 910 CA SER A 62 21.455 -4.532 -1.878 1.00 0.00 C ATOM 911 C SER A 62 21.692 -5.785 -1.034 1.00 0.00 C ATOM 912 O SER A 62 22.587 -5.815 -0.186 1.00 0.00 O ATOM 913 CB SER A 62 19.978 -4.093 -1.910 1.00 0.00 C ATOM 914 OG SER A 62 19.224 -4.823 -2.873 1.00 0.00 O ATOM 0 H SER A 62 21.689 -5.724 -3.575 1.00 0.00 H new ATOM 0 HA SER A 62 22.017 -3.720 -1.417 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.537 -4.233 -0.923 1.00 0.00 H new ATOM 0 HB3 SER A 62 19.921 -3.028 -2.137 1.00 0.00 H new ATOM 0 HG SER A 62 18.293 -4.516 -2.861 1.00 0.00 H new ATOM 920 N ASP A 63 20.934 -6.842 -1.327 1.00 0.00 N ATOM 921 CA ASP A 63 21.053 -8.174 -0.739 1.00 0.00 C ATOM 922 C ASP A 63 20.631 -9.186 -1.805 1.00 0.00 C ATOM 923 O ASP A 63 19.845 -8.825 -2.691 1.00 0.00 O ATOM 924 CB ASP A 63 20.151 -8.319 0.499 1.00 0.00 C ATOM 925 CG ASP A 63 20.876 -7.931 1.798 1.00 0.00 C ATOM 926 OD1 ASP A 63 21.815 -8.657 2.210 1.00 0.00 O ATOM 927 OD2 ASP A 63 20.495 -6.914 2.430 1.00 0.00 O ATOM 0 H ASP A 63 20.183 -6.788 -2.015 1.00 0.00 H new ATOM 0 HA ASP A 63 22.081 -8.344 -0.418 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.268 -7.692 0.377 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.803 -9.349 0.574 1.00 0.00 H new ATOM 932 N PRO A 64 21.107 -10.444 -1.747 1.00 0.00 N ATOM 933 CA PRO A 64 20.583 -11.503 -2.597 1.00 0.00 C ATOM 934 C PRO A 64 19.106 -11.731 -2.270 1.00 0.00 C ATOM 935 O PRO A 64 18.681 -11.560 -1.127 1.00 0.00 O ATOM 936 CB PRO A 64 21.437 -12.736 -2.285 1.00 0.00 C ATOM 937 CG PRO A 64 21.867 -12.511 -0.833 1.00 0.00 C ATOM 938 CD PRO A 64 22.024 -10.992 -0.754 1.00 0.00 C ATOM 0 HA PRO A 64 20.634 -11.263 -3.659 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.867 -13.658 -2.397 1.00 0.00 H new ATOM 0 HB3 PRO A 64 22.296 -12.809 -2.952 1.00 0.00 H new ATOM 0 HG2 PRO A 64 21.120 -12.877 -0.129 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.800 -13.026 -0.604 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.784 -10.626 0.244 1.00 0.00 H new ATOM 0 HD3 PRO A 64 23.051 -10.694 -0.964 1.00 0.00 H new ATOM 946 N ILE A 65 18.326 -12.193 -3.249 1.00 0.00 N ATOM 947 CA ILE A 65 16.890 -12.431 -3.087 1.00 0.00 C ATOM 948 C ILE A 65 16.600 -13.391 -1.923 1.00 0.00 C ATOM 949 O ILE A 65 15.564 -13.296 -1.272 1.00 0.00 O ATOM 950 CB ILE A 65 16.330 -12.947 -4.428 1.00 0.00 C ATOM 951 CG1 ILE A 65 14.795 -12.883 -4.480 1.00 0.00 C ATOM 952 CG2 ILE A 65 16.826 -14.361 -4.767 1.00 0.00 C ATOM 953 CD1 ILE A 65 14.223 -13.113 -5.888 1.00 0.00 C ATOM 0 H ILE A 65 18.674 -12.414 -4.182 1.00 0.00 H new ATOM 0 HA ILE A 65 16.389 -11.499 -2.827 1.00 0.00 H new ATOM 0 HB ILE A 65 16.718 -12.272 -5.191 1.00 0.00 H new ATOM 0 HG12 ILE A 65 14.384 -13.631 -3.802 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.467 -11.909 -4.117 1.00 0.00 H new ATOM 0 HG21 ILE A 65 16.402 -14.676 -5.720 1.00 0.00 H new ATOM 0 HG22 ILE A 65 17.914 -14.358 -4.837 1.00 0.00 H new ATOM 0 HG23 ILE A 65 16.514 -15.053 -3.985 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.135 -13.055 -5.853 1.00 0.00 H new ATOM 0 HD12 ILE A 65 14.606 -12.350 -6.565 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.522 -14.098 -6.246 1.00 0.00 H new ATOM 965 N GLU A 66 17.541 -14.291 -1.633 1.00 0.00 N ATOM 966 CA GLU A 66 17.397 -15.347 -0.638 1.00 0.00 C ATOM 967 C GLU A 66 17.304 -14.753 0.773 1.00 0.00 C ATOM 968 O GLU A 66 16.740 -15.358 1.689 1.00 0.00 O ATOM 969 CB GLU A 66 18.612 -16.293 -0.679 1.00 0.00 C ATOM 970 CG GLU A 66 19.125 -16.592 -2.092 1.00 0.00 C ATOM 971 CD GLU A 66 20.230 -17.665 -2.072 1.00 0.00 C ATOM 972 OE1 GLU A 66 21.417 -17.315 -1.851 1.00 0.00 O ATOM 973 OE2 GLU A 66 19.922 -18.863 -2.280 1.00 0.00 O ATOM 0 H GLU A 66 18.448 -14.303 -2.099 1.00 0.00 H new ATOM 0 HA GLU A 66 16.485 -15.896 -0.871 1.00 0.00 H new ATOM 0 HB2 GLU A 66 19.421 -15.853 -0.096 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.344 -17.232 -0.195 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.298 -16.930 -2.717 1.00 0.00 H new ATOM 0 HG3 GLU A 66 19.512 -15.677 -2.542 1.00 0.00 H new ATOM 980 N ASN A 67 17.897 -13.567 0.938 1.00 0.00 N ATOM 981 CA ASN A 67 17.905 -12.806 2.181 1.00 0.00 C ATOM 982 C ASN A 67 16.489 -12.378 2.591 1.00 0.00 C ATOM 983 O ASN A 67 16.201 -12.245 3.783 1.00 0.00 O ATOM 984 CB ASN A 67 18.765 -11.550 1.998 1.00 0.00 C ATOM 985 CG ASN A 67 19.110 -10.917 3.336 1.00 0.00 C ATOM 986 OD1 ASN A 67 18.432 -10.013 3.817 1.00 0.00 O ATOM 987 ND2 ASN A 67 20.178 -11.388 3.964 1.00 0.00 N ATOM 0 H ASN A 67 18.399 -13.099 0.183 1.00 0.00 H new ATOM 0 HA ASN A 67 18.313 -13.445 2.964 1.00 0.00 H new ATOM 0 HB2 ASN A 67 19.682 -11.809 1.468 1.00 0.00 H new ATOM 0 HB3 ASN A 67 18.232 -10.829 1.379 1.00 0.00 H new ATOM 0 HD21 ASN A 67 20.452 -10.999 4.866 1.00 0.00 H new ATOM 0 HD22 ASN A 67 20.726 -12.139 3.545 1.00 0.00 H new ATOM 994 N PHE A 68 15.621 -12.152 1.601 1.00 0.00 N ATOM 995 CA PHE A 68 14.257 -11.673 1.772 1.00 0.00 C ATOM 996 C PHE A 68 13.274 -12.837 1.881 1.00 0.00 C ATOM 997 O PHE A 68 13.653 -14.012 1.842 1.00 0.00 O ATOM 998 CB PHE A 68 13.892 -10.805 0.561 1.00 0.00 C ATOM 999 CG PHE A 68 14.697 -9.540 0.451 1.00 0.00 C ATOM 1000 CD1 PHE A 68 14.353 -8.441 1.251 1.00 0.00 C ATOM 1001 CD2 PHE A 68 15.779 -9.466 -0.439 1.00 0.00 C ATOM 1002 CE1 PHE A 68 15.091 -7.249 1.150 1.00 0.00 C ATOM 1003 CE2 PHE A 68 16.519 -8.276 -0.540 1.00 0.00 C ATOM 1004 CZ PHE A 68 16.173 -7.165 0.251 1.00 0.00 C ATOM 0 H PHE A 68 15.864 -12.305 0.622 1.00 0.00 H new ATOM 0 HA PHE A 68 14.196 -11.094 2.693 1.00 0.00 H new ATOM 0 HB2 PHE A 68 14.029 -11.391 -0.348 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.834 -10.547 0.617 1.00 0.00 H new ATOM 0 HD1 PHE A 68 13.525 -8.510 1.941 1.00 0.00 H new ATOM 0 HD2 PHE A 68 16.042 -10.321 -1.044 1.00 0.00 H new ATOM 0 HE1 PHE A 68 14.829 -6.398 1.761 1.00 0.00 H new ATOM 0 HE2 PHE A 68 17.352 -8.214 -1.224 1.00 0.00 H new ATOM 0 HZ PHE A 68 16.737 -6.248 0.169 1.00 0.00 H new ATOM 1014 N ASN A 69 11.988 -12.491 2.001 1.00 0.00 N ATOM 1015 CA ASN A 69 10.884 -13.413 1.883 1.00 0.00 C ATOM 1016 C ASN A 69 9.976 -12.870 0.802 1.00 0.00 C ATOM 1017 O ASN A 69 9.697 -11.668 0.798 1.00 0.00 O ATOM 1018 CB ASN A 69 10.102 -13.555 3.193 1.00 0.00 C ATOM 1019 CG ASN A 69 9.107 -14.716 3.199 1.00 0.00 C ATOM 1020 OD1 ASN A 69 8.743 -15.261 2.162 1.00 0.00 O ATOM 1021 ND2 ASN A 69 8.619 -15.101 4.367 1.00 0.00 N ATOM 0 H ASN A 69 11.692 -11.533 2.188 1.00 0.00 H new ATOM 0 HA ASN A 69 11.263 -14.406 1.640 1.00 0.00 H new ATOM 0 HB2 ASN A 69 10.808 -13.690 4.013 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.563 -12.627 3.385 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.935 -15.856 4.410 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.927 -14.643 5.225 1.00 0.00 H new ATOM 1028 N ALA A 70 9.462 -13.726 -0.076 1.00 0.00 N ATOM 1029 CA ALA A 70 8.629 -13.262 -1.146 1.00 0.00 C ATOM 1030 C ALA A 70 7.273 -12.872 -0.589 1.00 0.00 C ATOM 1031 O ALA A 70 6.575 -12.064 -1.191 1.00 0.00 O ATOM 1032 CB ALA A 70 8.483 -14.339 -2.216 1.00 0.00 C ATOM 0 H ALA A 70 9.614 -14.734 -0.057 1.00 0.00 H new ATOM 0 HA ALA A 70 9.090 -12.390 -1.611 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.847 -13.969 -3.020 1.00 0.00 H new ATOM 0 HB2 ALA A 70 9.465 -14.590 -2.616 1.00 0.00 H new ATOM 0 HB3 ALA A 70 8.032 -15.229 -1.777 1.00 0.00 H new ATOM 1038 N ASP A 71 6.887 -13.443 0.557 1.00 0.00 N ATOM 1039 CA ASP A 71 5.597 -13.151 1.143 1.00 0.00 C ATOM 1040 C ASP A 71 5.517 -11.693 1.632 1.00 0.00 C ATOM 1041 O ASP A 71 4.422 -11.147 1.790 1.00 0.00 O ATOM 1042 CB ASP A 71 5.314 -14.127 2.292 1.00 0.00 C ATOM 1043 CG ASP A 71 3.929 -13.885 2.912 1.00 0.00 C ATOM 1044 OD1 ASP A 71 2.910 -14.173 2.240 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.853 -13.464 4.093 1.00 0.00 O ATOM 0 H ASP A 71 7.454 -14.105 1.086 1.00 0.00 H new ATOM 0 HA ASP A 71 4.835 -13.277 0.374 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.374 -15.151 1.923 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.081 -14.019 3.059 1.00 0.00 H new ATOM 1050 N ASP A 72 6.672 -11.046 1.859 1.00 0.00 N ATOM 1051 CA ASP A 72 6.747 -9.638 2.225 1.00 0.00 C ATOM 1052 C ASP A 72 6.496 -8.726 1.017 1.00 0.00 C ATOM 1053 O ASP A 72 5.994 -7.606 1.161 1.00 0.00 O ATOM 1054 CB ASP A 72 8.124 -9.324 2.813 1.00 0.00 C ATOM 1055 CG ASP A 72 8.181 -7.877 3.329 1.00 0.00 C ATOM 1056 OD1 ASP A 72 7.460 -7.544 4.301 1.00 0.00 O ATOM 1057 OD2 ASP A 72 8.971 -7.066 2.791 1.00 0.00 O ATOM 0 H ASP A 72 7.584 -11.498 1.791 1.00 0.00 H new ATOM 0 HA ASP A 72 5.971 -9.449 2.966 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.342 -10.014 3.628 1.00 0.00 H new ATOM 0 HB3 ASP A 72 8.891 -9.474 2.054 1.00 0.00 H new ATOM 1062 N TYR A 73 6.842 -9.212 -0.179 1.00 0.00 N ATOM 1063 CA TYR A 73 6.623 -8.541 -1.446 1.00 0.00 C ATOM 1064 C TYR A 73 5.174 -8.727 -1.912 1.00 0.00 C ATOM 1065 O TYR A 73 4.415 -9.525 -1.353 1.00 0.00 O ATOM 1066 CB TYR A 73 7.659 -8.991 -2.493 1.00 0.00 C ATOM 1067 CG TYR A 73 9.019 -8.353 -2.272 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.823 -8.769 -1.195 1.00 0.00 C ATOM 1069 CD2 TYR A 73 9.443 -7.285 -3.090 1.00 0.00 C ATOM 1070 CE1 TYR A 73 11.019 -8.097 -0.900 1.00 0.00 C ATOM 1071 CE2 TYR A 73 10.641 -6.606 -2.801 1.00 0.00 C ATOM 1072 CZ TYR A 73 11.432 -7.008 -1.698 1.00 0.00 C ATOM 1073 OH TYR A 73 12.583 -6.341 -1.402 1.00 0.00 O ATOM 0 H TYR A 73 7.299 -10.118 -0.286 1.00 0.00 H new ATOM 0 HA TYR A 73 6.771 -7.470 -1.311 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.759 -10.076 -2.458 1.00 0.00 H new ATOM 0 HB3 TYR A 73 7.299 -8.736 -3.490 1.00 0.00 H new ATOM 0 HD1 TYR A 73 9.518 -9.611 -0.591 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.847 -6.988 -3.940 1.00 0.00 H new ATOM 0 HE1 TYR A 73 11.624 -8.413 -0.063 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.957 -5.779 -3.420 1.00 0.00 H new ATOM 0 HH TYR A 73 13.217 -6.956 -0.978 1.00 0.00 H new ATOM 1083 N ASP A 74 4.780 -7.943 -2.921 1.00 0.00 N ATOM 1084 CA ASP A 74 3.467 -8.057 -3.556 1.00 0.00 C ATOM 1085 C ASP A 74 3.598 -8.440 -5.029 1.00 0.00 C ATOM 1086 O ASP A 74 2.776 -9.211 -5.538 1.00 0.00 O ATOM 1087 CB ASP A 74 2.707 -6.740 -3.427 1.00 0.00 C ATOM 1088 CG ASP A 74 1.305 -6.858 -4.047 1.00 0.00 C ATOM 1089 OD1 ASP A 74 0.384 -7.343 -3.349 1.00 0.00 O ATOM 1090 OD2 ASP A 74 1.111 -6.418 -5.203 1.00 0.00 O ATOM 0 H ASP A 74 5.366 -7.210 -3.320 1.00 0.00 H new ATOM 0 HA ASP A 74 2.913 -8.845 -3.047 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.623 -6.464 -2.376 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.263 -5.944 -3.922 1.00 0.00 H new ATOM 1095 N VAL A 75 4.639 -7.943 -5.708 1.00 0.00 N ATOM 1096 CA VAL A 75 4.815 -8.106 -7.133 1.00 0.00 C ATOM 1097 C VAL A 75 6.291 -8.370 -7.416 1.00 0.00 C ATOM 1098 O VAL A 75 7.184 -7.677 -6.922 1.00 0.00 O ATOM 1099 CB VAL A 75 4.239 -6.887 -7.884 1.00 0.00 C ATOM 1100 CG1 VAL A 75 4.243 -5.552 -7.117 1.00 0.00 C ATOM 1101 CG2 VAL A 75 4.899 -6.721 -9.263 1.00 0.00 C ATOM 0 H VAL A 75 5.387 -7.410 -5.264 1.00 0.00 H new ATOM 0 HA VAL A 75 4.258 -8.967 -7.503 1.00 0.00 H new ATOM 0 HB VAL A 75 3.183 -7.130 -8.000 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.815 -4.770 -7.745 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.650 -5.653 -6.208 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.267 -5.286 -6.854 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.473 -5.854 -9.768 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.972 -6.577 -9.138 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.720 -7.614 -9.862 1.00 0.00 H new ATOM 1111 N VAL A 76 6.556 -9.354 -8.267 1.00 0.00 N ATOM 1112 CA VAL A 76 7.897 -9.724 -8.665 1.00 0.00 C ATOM 1113 C VAL A 76 7.801 -10.111 -10.136 1.00 0.00 C ATOM 1114 O VAL A 76 6.859 -10.795 -10.548 1.00 0.00 O ATOM 1115 CB VAL A 76 8.389 -10.896 -7.804 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.788 -11.386 -8.223 1.00 0.00 C ATOM 1117 CG2 VAL A 76 8.387 -10.627 -6.286 1.00 0.00 C ATOM 0 H VAL A 76 5.830 -9.922 -8.703 1.00 0.00 H new ATOM 0 HA VAL A 76 8.611 -8.912 -8.527 1.00 0.00 H new ATOM 0 HB VAL A 76 7.651 -11.676 -7.995 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.090 -12.215 -7.583 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.761 -11.719 -9.261 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.504 -10.571 -8.122 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.750 -11.510 -5.760 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.037 -9.780 -6.066 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.373 -10.400 -5.958 1.00 0.00 H new ATOM 1127 N ILE A 77 8.777 -9.670 -10.919 1.00 0.00 N ATOM 1128 CA ILE A 77 8.909 -9.969 -12.326 1.00 0.00 C ATOM 1129 C ILE A 77 10.154 -10.835 -12.450 1.00 0.00 C ATOM 1130 O ILE A 77 11.227 -10.426 -11.985 1.00 0.00 O ATOM 1131 CB ILE A 77 9.076 -8.665 -13.128 1.00 0.00 C ATOM 1132 CG1 ILE A 77 8.094 -7.528 -12.747 1.00 0.00 C ATOM 1133 CG2 ILE A 77 9.053 -8.956 -14.636 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.600 -7.826 -12.891 1.00 0.00 C ATOM 0 H ILE A 77 9.525 -9.071 -10.570 1.00 0.00 H new ATOM 0 HA ILE A 77 8.029 -10.480 -12.718 1.00 0.00 H new ATOM 0 HB ILE A 77 10.055 -8.274 -12.850 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.286 -7.247 -11.711 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.327 -6.658 -13.361 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.172 -8.024 -15.188 1.00 0.00 H new ATOM 0 HG22 ILE A 77 9.868 -9.634 -14.888 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.102 -9.417 -14.903 1.00 0.00 H new ATOM 0 HD11 ILE A 77 6.024 -6.950 -12.593 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.376 -8.071 -13.929 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.334 -8.669 -12.254 1.00 0.00 H new ATOM 1146 N SER A 78 10.031 -11.988 -13.091 1.00 0.00 N ATOM 1147 CA SER A 78 11.186 -12.766 -13.460 1.00 0.00 C ATOM 1148 C SER A 78 11.561 -12.246 -14.836 1.00 0.00 C ATOM 1149 O SER A 78 10.935 -12.619 -15.822 1.00 0.00 O ATOM 1150 CB SER A 78 10.857 -14.255 -13.504 1.00 0.00 C ATOM 1151 OG SER A 78 10.561 -14.739 -12.205 1.00 0.00 O ATOM 0 H SER A 78 9.138 -12.399 -13.363 1.00 0.00 H new ATOM 0 HA SER A 78 12.000 -12.667 -12.742 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.007 -14.426 -14.164 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.700 -14.807 -13.920 1.00 0.00 H new ATOM 0 HG SER A 78 10.722 -15.705 -12.171 1.00 0.00 H new ATOM 1157 N LEU A 79 12.559 -11.366 -14.936 1.00 0.00 N ATOM 1158 CA LEU A 79 12.952 -10.801 -16.228 1.00 0.00 C ATOM 1159 C LEU A 79 13.616 -11.836 -17.139 1.00 0.00 C ATOM 1160 O LEU A 79 13.971 -11.513 -18.274 1.00 0.00 O ATOM 1161 CB LEU A 79 13.844 -9.566 -16.043 1.00 0.00 C ATOM 1162 CG LEU A 79 13.063 -8.316 -15.631 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.053 -7.172 -15.439 1.00 0.00 C ATOM 1164 CD2 LEU A 79 12.011 -7.897 -16.659 1.00 0.00 C ATOM 0 H LEU A 79 13.107 -11.031 -14.143 1.00 0.00 H new ATOM 0 HA LEU A 79 12.036 -10.485 -16.728 1.00 0.00 H new ATOM 0 HB2 LEU A 79 14.599 -9.781 -15.287 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.374 -9.365 -16.974 1.00 0.00 H new ATOM 0 HG LEU A 79 12.530 -8.550 -14.710 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.515 -6.271 -15.145 1.00 0.00 H new ATOM 0 HD12 LEU A 79 14.769 -7.437 -14.661 1.00 0.00 H new ATOM 0 HD13 LEU A 79 14.583 -6.989 -16.374 1.00 0.00 H new ATOM 0 HD21 LEU A 79 11.493 -7.005 -16.307 1.00 0.00 H new ATOM 0 HD22 LEU A 79 12.497 -7.682 -17.611 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.292 -8.705 -16.793 1.00 0.00 H new ATOM 1176 N CYS A 80 13.790 -13.065 -16.654 1.00 0.00 N ATOM 1177 CA CYS A 80 14.207 -14.205 -17.431 1.00 0.00 C ATOM 1178 C CYS A 80 13.385 -15.396 -16.951 1.00 0.00 C ATOM 1179 O CYS A 80 13.274 -15.584 -15.737 1.00 0.00 O ATOM 1180 CB CYS A 80 15.716 -14.424 -17.226 1.00 0.00 C ATOM 1181 SG CYS A 80 16.740 -13.000 -17.721 1.00 0.00 S ATOM 0 H CYS A 80 13.636 -13.290 -15.671 1.00 0.00 H new ATOM 0 HA CYS A 80 14.042 -14.062 -18.499 1.00 0.00 H new ATOM 0 HB2 CYS A 80 15.902 -14.646 -16.175 1.00 0.00 H new ATOM 0 HB3 CYS A 80 16.027 -15.299 -17.796 1.00 0.00 H new ATOM 1186 N GLY A 81 12.861 -16.192 -17.890 1.00 0.00 N ATOM 1187 CA GLY A 81 12.133 -17.432 -17.631 1.00 0.00 C ATOM 1188 C GLY A 81 11.047 -17.281 -16.557 1.00 0.00 C ATOM 1189 O GLY A 81 10.376 -16.250 -16.478 1.00 0.00 O ATOM 0 H GLY A 81 12.937 -15.980 -18.885 1.00 0.00 H new ATOM 0 HA2 GLY A 81 11.674 -17.777 -18.557 1.00 0.00 H new ATOM 0 HA3 GLY A 81 12.839 -18.202 -17.320 1.00 0.00 H new ATOM 1193 N SER A 82 10.895 -18.319 -15.727 1.00 0.00 N ATOM 1194 CA SER A 82 9.973 -18.320 -14.596 1.00 0.00 C ATOM 1195 C SER A 82 10.767 -18.724 -13.353 1.00 0.00 C ATOM 1196 O SER A 82 11.312 -17.858 -12.668 1.00 0.00 O ATOM 1197 CB SER A 82 8.739 -19.198 -14.899 1.00 0.00 C ATOM 1198 OG SER A 82 8.167 -18.873 -16.161 1.00 0.00 O ATOM 0 H SER A 82 11.417 -19.190 -15.827 1.00 0.00 H new ATOM 0 HA SER A 82 9.555 -17.331 -14.408 1.00 0.00 H new ATOM 0 HB2 SER A 82 9.027 -20.249 -14.888 1.00 0.00 H new ATOM 0 HB3 SER A 82 7.994 -19.064 -14.115 1.00 0.00 H new ATOM 0 HG SER A 82 7.578 -18.096 -16.063 1.00 0.00 H new ATOM 1204 N GLY A 83 10.917 -20.029 -13.096 1.00 0.00 N ATOM 1205 CA GLY A 83 11.726 -20.568 -12.012 1.00 0.00 C ATOM 1206 C GLY A 83 13.180 -20.676 -12.447 1.00 0.00 C ATOM 1207 O GLY A 83 13.691 -21.786 -12.593 1.00 0.00 O ATOM 0 H GLY A 83 10.465 -20.753 -13.655 1.00 0.00 H new ATOM 0 HA2 GLY A 83 11.648 -19.925 -11.135 1.00 0.00 H new ATOM 0 HA3 GLY A 83 11.351 -21.550 -11.722 1.00 0.00 H new ATOM 1211 N VAL A 84 13.852 -19.543 -12.684 1.00 0.00 N ATOM 1212 CA VAL A 84 15.246 -19.494 -13.148 1.00 0.00 C ATOM 1213 C VAL A 84 16.221 -19.764 -11.987 1.00 0.00 C ATOM 1214 O VAL A 84 16.984 -18.890 -11.576 1.00 0.00 O ATOM 1215 CB VAL A 84 15.517 -18.196 -13.952 1.00 0.00 C ATOM 1216 CG1 VAL A 84 14.865 -18.286 -15.339 1.00 0.00 C ATOM 1217 CG2 VAL A 84 15.023 -16.909 -13.265 1.00 0.00 C ATOM 0 H VAL A 84 13.437 -18.620 -12.557 1.00 0.00 H new ATOM 0 HA VAL A 84 15.427 -20.302 -13.857 1.00 0.00 H new ATOM 0 HB VAL A 84 16.602 -18.125 -14.024 1.00 0.00 H new ATOM 0 HG11 VAL A 84 15.062 -17.369 -15.894 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.280 -19.135 -15.882 1.00 0.00 H new ATOM 0 HG13 VAL A 84 13.789 -18.418 -15.227 1.00 0.00 H new ATOM 0 HG21 VAL A 84 15.252 -16.049 -13.895 1.00 0.00 H new ATOM 0 HG22 VAL A 84 13.946 -16.969 -13.111 1.00 0.00 H new ATOM 0 HG23 VAL A 84 15.521 -16.797 -12.302 1.00 0.00 H new ATOM 1227 N ASN A 85 16.168 -20.991 -11.448 1.00 0.00 N ATOM 1228 CA ASN A 85 16.879 -21.447 -10.242 1.00 0.00 C ATOM 1229 C ASN A 85 16.537 -20.495 -9.096 1.00 0.00 C ATOM 1230 O ASN A 85 17.396 -19.865 -8.475 1.00 0.00 O ATOM 1231 CB ASN A 85 18.388 -21.628 -10.489 1.00 0.00 C ATOM 1232 CG ASN A 85 19.099 -22.251 -9.284 1.00 0.00 C ATOM 1233 OD1 ASN A 85 18.486 -22.863 -8.410 1.00 0.00 O ATOM 1234 ND2 ASN A 85 20.420 -22.150 -9.225 1.00 0.00 N ATOM 0 H ASN A 85 15.600 -21.730 -11.862 1.00 0.00 H new ATOM 0 HA ASN A 85 16.544 -22.445 -9.961 1.00 0.00 H new ATOM 0 HB2 ASN A 85 18.538 -22.260 -11.364 1.00 0.00 H new ATOM 0 HB3 ASN A 85 18.837 -20.660 -10.714 1.00 0.00 H new ATOM 0 HD21 ASN A 85 20.930 -22.580 -8.454 1.00 0.00 H new ATOM 0 HD22 ASN A 85 20.926 -21.642 -9.951 1.00 0.00 H new ATOM 1241 N LEU A 86 15.226 -20.350 -8.897 1.00 0.00 N ATOM 1242 CA LEU A 86 14.582 -19.359 -8.050 1.00 0.00 C ATOM 1243 C LEU A 86 13.523 -20.068 -7.187 1.00 0.00 C ATOM 1244 O LEU A 86 12.864 -20.974 -7.704 1.00 0.00 O ATOM 1245 CB LEU A 86 14.017 -18.285 -9.011 1.00 0.00 C ATOM 1246 CG LEU A 86 12.861 -17.426 -8.474 1.00 0.00 C ATOM 1247 CD1 LEU A 86 12.910 -16.017 -9.071 1.00 0.00 C ATOM 1248 CD2 LEU A 86 11.525 -18.053 -8.895 1.00 0.00 C ATOM 0 H LEU A 86 14.549 -20.961 -9.353 1.00 0.00 H new ATOM 0 HA LEU A 86 15.252 -18.867 -7.345 1.00 0.00 H new ATOM 0 HB2 LEU A 86 14.832 -17.620 -9.297 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.679 -18.784 -9.919 1.00 0.00 H new ATOM 0 HG LEU A 86 12.954 -17.376 -7.389 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.083 -15.426 -8.677 1.00 0.00 H new ATOM 0 HD12 LEU A 86 13.854 -15.542 -8.805 1.00 0.00 H new ATOM 0 HD13 LEU A 86 12.828 -16.079 -10.156 1.00 0.00 H new ATOM 0 HD21 LEU A 86 10.703 -17.446 -8.516 1.00 0.00 H new ATOM 0 HD22 LEU A 86 11.471 -18.098 -9.983 1.00 0.00 H new ATOM 0 HD23 LEU A 86 11.451 -19.061 -8.486 1.00 0.00 H new ATOM 1260 N PRO A 87 13.329 -19.688 -5.909 1.00 0.00 N ATOM 1261 CA PRO A 87 12.286 -20.284 -5.079 1.00 0.00 C ATOM 1262 C PRO A 87 10.889 -19.905 -5.608 1.00 0.00 C ATOM 1263 O PRO A 87 10.673 -18.732 -5.933 1.00 0.00 O ATOM 1264 CB PRO A 87 12.537 -19.791 -3.648 1.00 0.00 C ATOM 1265 CG PRO A 87 13.990 -19.319 -3.662 1.00 0.00 C ATOM 1266 CD PRO A 87 14.192 -18.838 -5.096 1.00 0.00 C ATOM 0 HA PRO A 87 12.318 -21.373 -5.102 1.00 0.00 H new ATOM 0 HB2 PRO A 87 11.858 -18.981 -3.381 1.00 0.00 H new ATOM 0 HB3 PRO A 87 12.384 -20.588 -2.920 1.00 0.00 H new ATOM 0 HG2 PRO A 87 14.159 -18.518 -2.942 1.00 0.00 H new ATOM 0 HG3 PRO A 87 14.677 -20.126 -3.408 1.00 0.00 H new ATOM 0 HD2 PRO A 87 13.922 -17.787 -5.201 1.00 0.00 H new ATOM 0 HD3 PRO A 87 15.235 -18.931 -5.399 1.00 0.00 H new ATOM 1274 N PRO A 88 9.931 -20.842 -5.705 1.00 0.00 N ATOM 1275 CA PRO A 88 8.665 -20.609 -6.395 1.00 0.00 C ATOM 1276 C PRO A 88 7.796 -19.517 -5.766 1.00 0.00 C ATOM 1277 O PRO A 88 7.016 -18.889 -6.486 1.00 0.00 O ATOM 1278 CB PRO A 88 7.953 -21.967 -6.426 1.00 0.00 C ATOM 1279 CG PRO A 88 8.563 -22.723 -5.245 1.00 0.00 C ATOM 1280 CD PRO A 88 10.003 -22.215 -5.233 1.00 0.00 C ATOM 0 HA PRO A 88 8.857 -20.224 -7.397 1.00 0.00 H new ATOM 0 HB2 PRO A 88 6.874 -21.856 -6.316 1.00 0.00 H new ATOM 0 HB3 PRO A 88 8.126 -22.488 -7.368 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.047 -22.501 -4.311 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.515 -23.803 -5.386 1.00 0.00 H new ATOM 0 HD2 PRO A 88 10.429 -22.264 -4.231 1.00 0.00 H new ATOM 0 HD3 PRO A 88 10.639 -22.820 -5.880 1.00 0.00 H new ATOM 1288 N GLU A 89 7.951 -19.215 -4.475 1.00 0.00 N ATOM 1289 CA GLU A 89 7.230 -18.132 -3.808 1.00 0.00 C ATOM 1290 C GLU A 89 7.446 -16.777 -4.504 1.00 0.00 C ATOM 1291 O GLU A 89 6.607 -15.879 -4.379 1.00 0.00 O ATOM 1292 CB GLU A 89 7.576 -18.073 -2.309 1.00 0.00 C ATOM 1293 CG GLU A 89 9.073 -17.960 -1.974 1.00 0.00 C ATOM 1294 CD GLU A 89 9.684 -19.329 -1.610 1.00 0.00 C ATOM 1295 OE1 GLU A 89 9.577 -20.282 -2.418 1.00 0.00 O ATOM 1296 OE2 GLU A 89 10.270 -19.452 -0.506 1.00 0.00 O ATOM 0 H GLU A 89 8.587 -19.721 -3.859 1.00 0.00 H new ATOM 0 HA GLU A 89 6.166 -18.353 -3.889 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.059 -17.221 -1.869 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.181 -18.968 -1.828 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.606 -17.540 -2.827 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.208 -17.269 -1.142 1.00 0.00 H new ATOM 1303 N TRP A 90 8.527 -16.627 -5.279 1.00 0.00 N ATOM 1304 CA TRP A 90 8.830 -15.392 -5.984 1.00 0.00 C ATOM 1305 C TRP A 90 8.079 -15.257 -7.309 1.00 0.00 C ATOM 1306 O TRP A 90 7.891 -14.133 -7.762 1.00 0.00 O ATOM 1307 CB TRP A 90 10.346 -15.257 -6.160 1.00 0.00 C ATOM 1308 CG TRP A 90 11.095 -15.040 -4.883 1.00 0.00 C ATOM 1309 CD1 TRP A 90 11.733 -15.989 -4.168 1.00 0.00 C ATOM 1310 CD2 TRP A 90 11.247 -13.811 -4.119 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.241 -15.441 -3.005 1.00 0.00 N ATOM 1312 CE2 TRP A 90 11.937 -14.099 -2.905 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.848 -12.480 -4.328 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 12.181 -13.114 -1.937 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 11.061 -11.487 -3.357 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.726 -11.803 -2.163 1.00 0.00 C ATOM 0 H TRP A 90 9.214 -17.366 -5.430 1.00 0.00 H new ATOM 0 HA TRP A 90 8.473 -14.563 -5.373 1.00 0.00 H new ATOM 0 HB2 TRP A 90 10.726 -16.158 -6.642 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.550 -14.424 -6.833 1.00 0.00 H new ATOM 0 HD1 TRP A 90 11.832 -17.024 -4.461 1.00 0.00 H new ATOM 0 HE1 TRP A 90 12.773 -15.963 -2.309 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.366 -12.214 -5.257 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.712 -13.359 -1.029 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.712 -10.480 -3.530 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.889 -11.039 -1.417 1.00 0.00 H new ATOM 1327 N VAL A 91 7.605 -16.343 -7.924 1.00 0.00 N ATOM 1328 CA VAL A 91 6.751 -16.270 -9.096 1.00 0.00 C ATOM 1329 C VAL A 91 5.282 -16.289 -8.702 1.00 0.00 C ATOM 1330 O VAL A 91 4.505 -15.558 -9.304 1.00 0.00 O ATOM 1331 CB VAL A 91 7.133 -17.339 -10.133 1.00 0.00 C ATOM 1332 CG1 VAL A 91 8.428 -16.930 -10.844 1.00 0.00 C ATOM 1333 CG2 VAL A 91 7.307 -18.759 -9.580 1.00 0.00 C ATOM 0 H VAL A 91 7.807 -17.295 -7.618 1.00 0.00 H new ATOM 0 HA VAL A 91 6.914 -15.313 -9.591 1.00 0.00 H new ATOM 0 HB VAL A 91 6.284 -17.382 -10.816 1.00 0.00 H new ATOM 0 HG11 VAL A 91 8.696 -17.690 -11.578 1.00 0.00 H new ATOM 0 HG12 VAL A 91 8.280 -15.975 -11.348 1.00 0.00 H new ATOM 0 HG13 VAL A 91 9.230 -16.834 -10.112 1.00 0.00 H new ATOM 0 HG21 VAL A 91 7.575 -19.435 -10.392 1.00 0.00 H new ATOM 0 HG22 VAL A 91 8.097 -18.763 -8.829 1.00 0.00 H new ATOM 0 HG23 VAL A 91 6.373 -19.090 -9.126 1.00 0.00 H new ATOM 1343 N THR A 92 4.881 -17.012 -7.655 1.00 0.00 N ATOM 1344 CA THR A 92 3.464 -17.151 -7.303 1.00 0.00 C ATOM 1345 C THR A 92 3.018 -15.990 -6.382 1.00 0.00 C ATOM 1346 O THR A 92 2.376 -16.156 -5.344 1.00 0.00 O ATOM 1347 CB THR A 92 3.209 -18.606 -6.843 1.00 0.00 C ATOM 1348 OG1 THR A 92 1.830 -18.947 -6.809 1.00 0.00 O ATOM 1349 CG2 THR A 92 3.852 -18.915 -5.485 1.00 0.00 C ATOM 0 H THR A 92 5.518 -17.512 -7.034 1.00 0.00 H new ATOM 0 HA THR A 92 2.795 -17.026 -8.154 1.00 0.00 H new ATOM 0 HB THR A 92 3.688 -19.225 -7.602 1.00 0.00 H new ATOM 0 HG1 THR A 92 1.730 -19.876 -6.513 1.00 0.00 H new ATOM 0 HG21 THR A 92 3.642 -19.949 -5.210 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.930 -18.769 -5.551 1.00 0.00 H new ATOM 0 HG23 THR A 92 3.441 -18.247 -4.728 1.00 0.00 H new ATOM 1357 N GLN A 93 3.413 -14.780 -6.776 1.00 0.00 N ATOM 1358 CA GLN A 93 3.003 -13.508 -6.218 1.00 0.00 C ATOM 1359 C GLN A 93 1.608 -13.140 -6.764 1.00 0.00 C ATOM 1360 O GLN A 93 1.028 -13.889 -7.558 1.00 0.00 O ATOM 1361 CB GLN A 93 4.082 -12.481 -6.600 1.00 0.00 C ATOM 1362 CG GLN A 93 5.427 -12.754 -5.910 1.00 0.00 C ATOM 1363 CD GLN A 93 5.417 -12.337 -4.439 1.00 0.00 C ATOM 1364 OE1 GLN A 93 5.323 -11.152 -4.135 1.00 0.00 O ATOM 1365 NE2 GLN A 93 5.512 -13.276 -3.507 1.00 0.00 N ATOM 0 H GLN A 93 4.072 -14.663 -7.546 1.00 0.00 H new ATOM 0 HA GLN A 93 2.915 -13.539 -5.132 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.223 -12.493 -7.681 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.738 -11.482 -6.334 1.00 0.00 H new ATOM 0 HG2 GLN A 93 5.662 -13.816 -5.983 1.00 0.00 H new ATOM 0 HG3 GLN A 93 6.218 -12.216 -6.433 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.589 -14.257 -3.777 1.00 0.00 H new ATOM 0 HE22 GLN A 93 5.508 -13.018 -2.520 1.00 0.00 H new ATOM 1374 N GLU A 94 1.069 -11.976 -6.376 1.00 0.00 N ATOM 1375 CA GLU A 94 -0.262 -11.550 -6.815 1.00 0.00 C ATOM 1376 C GLU A 94 -0.300 -11.253 -8.325 1.00 0.00 C ATOM 1377 O GLU A 94 -1.376 -11.251 -8.926 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.738 -10.333 -5.999 1.00 0.00 C ATOM 1379 CG GLU A 94 -0.966 -10.639 -4.510 1.00 0.00 C ATOM 1380 CD GLU A 94 -2.050 -11.711 -4.281 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -3.260 -11.393 -4.389 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -1.703 -12.879 -3.977 1.00 0.00 O ATOM 0 H GLU A 94 1.537 -11.313 -5.758 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.949 -12.377 -6.634 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.000 -9.536 -6.088 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.666 -9.958 -6.430 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.029 -10.975 -4.065 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.253 -9.722 -3.995 1.00 0.00 H new ATOM 1389 N ILE A 95 0.867 -11.043 -8.944 1.00 0.00 N ATOM 1390 CA ILE A 95 1.059 -10.952 -10.384 1.00 0.00 C ATOM 1391 C ILE A 95 2.406 -11.618 -10.697 1.00 0.00 C ATOM 1392 O ILE A 95 3.387 -11.377 -9.988 1.00 0.00 O ATOM 1393 CB ILE A 95 0.953 -9.476 -10.860 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.338 -9.332 -12.351 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.793 -8.518 -9.987 1.00 0.00 C ATOM 1396 CD1 ILE A 95 0.872 -8.019 -13.002 1.00 0.00 C ATOM 0 H ILE A 95 1.738 -10.928 -8.426 1.00 0.00 H new ATOM 0 HA ILE A 95 0.278 -11.474 -10.936 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.093 -9.189 -10.748 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.422 -9.405 -12.443 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.914 -10.169 -12.906 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.686 -7.499 -10.359 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.444 -8.566 -8.955 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.842 -8.812 -10.030 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.183 -8.000 -14.046 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.214 -7.951 -12.946 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.316 -7.174 -12.476 1.00 0.00 H new ATOM 1408 N PHE A 96 2.444 -12.455 -11.737 1.00 0.00 N ATOM 1409 CA PHE A 96 3.669 -12.999 -12.311 1.00 0.00 C ATOM 1410 C PHE A 96 3.827 -12.338 -13.687 1.00 0.00 C ATOM 1411 O PHE A 96 2.853 -12.276 -14.442 1.00 0.00 O ATOM 1412 CB PHE A 96 3.618 -14.526 -12.448 1.00 0.00 C ATOM 1413 CG PHE A 96 4.708 -15.077 -13.349 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.057 -14.982 -12.959 1.00 0.00 C ATOM 1415 CD2 PHE A 96 4.382 -15.616 -14.611 1.00 0.00 C ATOM 1416 CE1 PHE A 96 7.072 -15.416 -13.829 1.00 0.00 C ATOM 1417 CE2 PHE A 96 5.402 -16.045 -15.480 1.00 0.00 C ATOM 1418 CZ PHE A 96 6.748 -15.942 -15.089 1.00 0.00 C ATOM 0 H PHE A 96 1.601 -12.779 -12.212 1.00 0.00 H new ATOM 0 HA PHE A 96 4.517 -12.788 -11.659 1.00 0.00 H new ATOM 0 HB2 PHE A 96 3.708 -14.977 -11.460 1.00 0.00 H new ATOM 0 HB3 PHE A 96 2.645 -14.818 -12.844 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.312 -14.576 -11.991 1.00 0.00 H new ATOM 0 HD2 PHE A 96 3.348 -15.700 -14.911 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.106 -15.344 -13.526 1.00 0.00 H new ATOM 0 HE2 PHE A 96 5.151 -16.454 -16.448 1.00 0.00 H new ATOM 0 HZ PHE A 96 7.532 -16.267 -15.757 1.00 0.00 H new ATOM 1428 N GLU A 97 5.033 -11.882 -14.030 1.00 0.00 N ATOM 1429 CA GLU A 97 5.380 -11.421 -15.372 1.00 0.00 C ATOM 1430 C GLU A 97 6.833 -11.807 -15.663 1.00 0.00 C ATOM 1431 O GLU A 97 7.609 -12.142 -14.759 1.00 0.00 O ATOM 1432 CB GLU A 97 5.215 -9.904 -15.527 1.00 0.00 C ATOM 1433 CG GLU A 97 3.794 -9.324 -15.465 1.00 0.00 C ATOM 1434 CD GLU A 97 2.924 -9.599 -16.711 1.00 0.00 C ATOM 1435 OE1 GLU A 97 3.292 -10.414 -17.592 1.00 0.00 O ATOM 1436 OE2 GLU A 97 1.848 -8.959 -16.826 1.00 0.00 O ATOM 0 H GLU A 97 5.808 -11.822 -13.370 1.00 0.00 H new ATOM 0 HA GLU A 97 4.700 -11.896 -16.079 1.00 0.00 H new ATOM 0 HB2 GLU A 97 5.807 -9.422 -14.749 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.652 -9.616 -16.483 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.289 -9.732 -14.590 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.863 -8.246 -15.319 1.00 0.00 H new ATOM 1443 N ASP A 98 7.164 -11.746 -16.948 1.00 0.00 N ATOM 1444 CA ASP A 98 8.381 -12.218 -17.579 1.00 0.00 C ATOM 1445 C ASP A 98 8.375 -11.687 -19.001 1.00 0.00 C ATOM 1446 O ASP A 98 7.363 -11.811 -19.700 1.00 0.00 O ATOM 1447 CB ASP A 98 8.460 -13.750 -17.627 1.00 0.00 C ATOM 1448 CG ASP A 98 9.416 -14.249 -18.737 1.00 0.00 C ATOM 1449 OD1 ASP A 98 10.596 -13.823 -18.811 1.00 0.00 O ATOM 1450 OD2 ASP A 98 8.960 -15.058 -19.585 1.00 0.00 O ATOM 0 H ASP A 98 6.530 -11.328 -17.629 1.00 0.00 H new ATOM 0 HA ASP A 98 9.238 -11.869 -17.003 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.799 -14.126 -16.661 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.464 -14.159 -17.796 1.00 0.00 H new ATOM 1455 N TRP A 99 9.487 -11.081 -19.415 1.00 0.00 N ATOM 1456 CA TRP A 99 9.602 -10.355 -20.668 1.00 0.00 C ATOM 1457 C TRP A 99 11.047 -10.462 -21.142 1.00 0.00 C ATOM 1458 O TRP A 99 11.967 -10.356 -20.327 1.00 0.00 O ATOM 1459 CB TRP A 99 9.238 -8.878 -20.451 1.00 0.00 C ATOM 1460 CG TRP A 99 7.890 -8.554 -19.871 1.00 0.00 C ATOM 1461 CD1 TRP A 99 6.675 -8.918 -20.348 1.00 0.00 C ATOM 1462 CD2 TRP A 99 7.612 -7.774 -18.675 1.00 0.00 C ATOM 1463 NE1 TRP A 99 5.683 -8.424 -19.522 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.201 -7.660 -18.506 1.00 0.00 C ATOM 1465 CE3 TRP A 99 8.421 -7.142 -17.715 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 5.622 -6.919 -17.466 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 7.852 -6.455 -16.632 1.00 0.00 C ATOM 1468 CH2 TRP A 99 6.461 -6.322 -16.514 1.00 0.00 C ATOM 0 H TRP A 99 10.350 -11.084 -18.872 1.00 0.00 H new ATOM 0 HA TRP A 99 8.924 -10.775 -21.411 1.00 0.00 H new ATOM 0 HB2 TRP A 99 9.994 -8.442 -19.798 1.00 0.00 H new ATOM 0 HB3 TRP A 99 9.316 -8.371 -21.413 1.00 0.00 H new ATOM 0 HD1 TRP A 99 6.507 -9.505 -21.239 1.00 0.00 H new ATOM 0 HE1 TRP A 99 4.688 -8.605 -19.652 1.00 0.00 H new ATOM 0 HE3 TRP A 99 9.496 -7.186 -17.812 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.550 -6.810 -17.399 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 8.494 -6.023 -15.879 1.00 0.00 H new ATOM 0 HH2 TRP A 99 6.038 -5.762 -15.693 1.00 0.00 H new ATOM 1479 N GLN A 100 11.263 -10.618 -22.452 1.00 0.00 N ATOM 1480 CA GLN A 100 12.596 -10.714 -23.037 1.00 0.00 C ATOM 1481 C GLN A 100 13.145 -9.291 -23.217 1.00 0.00 C ATOM 1482 O GLN A 100 13.113 -8.736 -24.318 1.00 0.00 O ATOM 1483 CB GLN A 100 12.526 -11.553 -24.329 1.00 0.00 C ATOM 1484 CG GLN A 100 13.917 -11.898 -24.887 1.00 0.00 C ATOM 1485 CD GLN A 100 13.872 -12.751 -26.162 1.00 0.00 C ATOM 1486 OE1 GLN A 100 12.813 -13.108 -26.679 1.00 0.00 O ATOM 1487 NE2 GLN A 100 15.028 -13.111 -26.704 1.00 0.00 N ATOM 0 H GLN A 100 10.510 -10.681 -23.137 1.00 0.00 H new ATOM 0 HA GLN A 100 13.299 -11.238 -22.390 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.980 -12.475 -24.130 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.962 -11.005 -25.084 1.00 0.00 H new ATOM 0 HG2 GLN A 100 14.455 -10.973 -25.097 1.00 0.00 H new ATOM 0 HG3 GLN A 100 14.484 -12.430 -24.123 1.00 0.00 H new ATOM 0 HE21 GLN A 100 15.906 -12.816 -26.276 1.00 0.00 H new ATOM 0 HE22 GLN A 100 15.039 -13.683 -27.548 1.00 0.00 H new ATOM 1496 N LEU A 101 13.617 -8.683 -22.124 1.00 0.00 N ATOM 1497 CA LEU A 101 14.340 -7.413 -22.171 1.00 0.00 C ATOM 1498 C LEU A 101 15.706 -7.700 -22.779 1.00 0.00 C ATOM 1499 O LEU A 101 16.481 -8.469 -22.210 1.00 0.00 O ATOM 1500 CB LEU A 101 14.476 -6.775 -20.768 1.00 0.00 C ATOM 1501 CG LEU A 101 13.320 -5.838 -20.374 1.00 0.00 C ATOM 1502 CD1 LEU A 101 11.962 -6.547 -20.393 1.00 0.00 C ATOM 1503 CD2 LEU A 101 13.595 -5.280 -18.972 1.00 0.00 C ATOM 0 H LEU A 101 13.507 -9.060 -21.182 1.00 0.00 H new ATOM 0 HA LEU A 101 13.791 -6.691 -22.775 1.00 0.00 H new ATOM 0 HB2 LEU A 101 14.549 -7.571 -20.027 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.410 -6.215 -20.727 1.00 0.00 H new ATOM 0 HG LEU A 101 13.270 -5.034 -21.108 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.180 -5.843 -20.108 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.763 -6.924 -21.396 1.00 0.00 H new ATOM 0 HD13 LEU A 101 11.976 -7.379 -19.689 1.00 0.00 H new ATOM 0 HD21 LEU A 101 12.783 -4.614 -18.680 1.00 0.00 H new ATOM 0 HD22 LEU A 101 13.664 -6.103 -18.260 1.00 0.00 H new ATOM 0 HD23 LEU A 101 14.534 -4.726 -18.978 1.00 0.00 H new ATOM 1515 N GLU A 102 16.013 -7.077 -23.916 1.00 0.00 N ATOM 1516 CA GLU A 102 17.342 -7.091 -24.492 1.00 0.00 C ATOM 1517 C GLU A 102 18.153 -6.057 -23.711 1.00 0.00 C ATOM 1518 O GLU A 102 17.844 -4.866 -23.752 1.00 0.00 O ATOM 1519 CB GLU A 102 17.300 -6.795 -25.999 1.00 0.00 C ATOM 1520 CG GLU A 102 16.583 -7.902 -26.789 1.00 0.00 C ATOM 1521 CD GLU A 102 16.624 -7.620 -28.302 1.00 0.00 C ATOM 1522 OE1 GLU A 102 15.721 -6.917 -28.820 1.00 0.00 O ATOM 1523 OE2 GLU A 102 17.552 -8.111 -28.991 1.00 0.00 O ATOM 0 H GLU A 102 15.335 -6.546 -24.462 1.00 0.00 H new ATOM 0 HA GLU A 102 17.806 -8.074 -24.411 1.00 0.00 H new ATOM 0 HB2 GLU A 102 16.793 -5.845 -26.167 1.00 0.00 H new ATOM 0 HB3 GLU A 102 18.317 -6.684 -26.374 1.00 0.00 H new ATOM 0 HG2 GLU A 102 17.054 -8.863 -26.582 1.00 0.00 H new ATOM 0 HG3 GLU A 102 15.547 -7.976 -26.458 1.00 0.00 H new ATOM 1530 N ASP A 103 19.148 -6.501 -22.945 1.00 0.00 N ATOM 1531 CA ASP A 103 19.941 -5.606 -22.111 1.00 0.00 C ATOM 1532 C ASP A 103 20.941 -4.830 -22.983 1.00 0.00 C ATOM 1533 O ASP A 103 21.591 -5.444 -23.840 1.00 0.00 O ATOM 1534 CB ASP A 103 20.654 -6.375 -21.001 1.00 0.00 C ATOM 1535 CG ASP A 103 21.189 -5.402 -19.957 1.00 0.00 C ATOM 1536 OD1 ASP A 103 22.199 -4.720 -20.206 1.00 0.00 O ATOM 1537 OD2 ASP A 103 20.568 -5.310 -18.876 1.00 0.00 O ATOM 0 H ASP A 103 19.424 -7.481 -22.886 1.00 0.00 H new ATOM 0 HA ASP A 103 19.272 -4.892 -21.630 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.966 -7.080 -20.535 1.00 0.00 H new ATOM 0 HB3 ASP A 103 21.473 -6.959 -21.420 1.00 0.00 H new ATOM 1542 N PRO A 104 21.079 -3.505 -22.808 1.00 0.00 N ATOM 1543 CA PRO A 104 21.960 -2.686 -23.624 1.00 0.00 C ATOM 1544 C PRO A 104 23.451 -2.782 -23.229 1.00 0.00 C ATOM 1545 O PRO A 104 24.260 -2.081 -23.832 1.00 0.00 O ATOM 1546 CB PRO A 104 21.396 -1.279 -23.490 1.00 0.00 C ATOM 1547 CG PRO A 104 20.883 -1.255 -22.053 1.00 0.00 C ATOM 1548 CD PRO A 104 20.295 -2.656 -21.917 1.00 0.00 C ATOM 0 HA PRO A 104 21.974 -3.028 -24.659 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.159 -0.520 -23.660 1.00 0.00 H new ATOM 0 HB3 PRO A 104 20.597 -1.094 -24.208 1.00 0.00 H new ATOM 0 HG2 PRO A 104 21.683 -1.074 -21.335 1.00 0.00 H new ATOM 0 HG3 PRO A 104 20.134 -0.479 -21.898 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.357 -3.008 -20.887 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.241 -2.666 -22.194 1.00 0.00 H new ATOM 1556 N ASP A 105 23.834 -3.617 -22.256 1.00 0.00 N ATOM 1557 CA ASP A 105 25.216 -3.940 -21.886 1.00 0.00 C ATOM 1558 C ASP A 105 26.133 -4.013 -23.116 1.00 0.00 C ATOM 1559 O ASP A 105 25.995 -4.907 -23.963 1.00 0.00 O ATOM 1560 CB ASP A 105 25.250 -5.285 -21.143 1.00 0.00 C ATOM 1561 CG ASP A 105 26.646 -5.941 -21.160 1.00 0.00 C ATOM 1562 OD1 ASP A 105 27.635 -5.303 -20.732 1.00 0.00 O ATOM 1563 OD2 ASP A 105 26.754 -7.122 -21.573 1.00 0.00 O ATOM 0 H ASP A 105 23.154 -4.110 -21.677 1.00 0.00 H new ATOM 0 HA ASP A 105 25.583 -3.143 -21.239 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.938 -5.132 -20.110 1.00 0.00 H new ATOM 0 HB3 ASP A 105 24.529 -5.964 -21.597 1.00 0.00 H new ATOM 1568 N GLY A 106 27.070 -3.062 -23.212 1.00 0.00 N ATOM 1569 CA GLY A 106 28.095 -3.022 -24.250 1.00 0.00 C ATOM 1570 C GLY A 106 27.575 -2.730 -25.667 1.00 0.00 C ATOM 1571 O GLY A 106 28.366 -2.783 -26.614 1.00 0.00 O ATOM 0 H GLY A 106 27.134 -2.285 -22.554 1.00 0.00 H new ATOM 0 HA2 GLY A 106 28.829 -2.261 -23.985 1.00 0.00 H new ATOM 0 HA3 GLY A 106 28.617 -3.979 -24.261 1.00 0.00 H new ATOM 1575 N GLN A 107 26.284 -2.432 -25.844 1.00 0.00 N ATOM 1576 CA GLN A 107 25.689 -2.105 -27.139 1.00 0.00 C ATOM 1577 C GLN A 107 25.971 -0.637 -27.505 1.00 0.00 C ATOM 1578 O GLN A 107 26.492 0.142 -26.700 1.00 0.00 O ATOM 1579 CB GLN A 107 24.167 -2.349 -27.117 1.00 0.00 C ATOM 1580 CG GLN A 107 23.680 -3.717 -26.610 1.00 0.00 C ATOM 1581 CD GLN A 107 24.019 -4.930 -27.469 1.00 0.00 C ATOM 1582 OE1 GLN A 107 24.680 -4.857 -28.505 1.00 0.00 O ATOM 1583 NE2 GLN A 107 23.530 -6.084 -27.041 1.00 0.00 N ATOM 0 H GLN A 107 25.613 -2.412 -25.076 1.00 0.00 H new ATOM 0 HA GLN A 107 26.140 -2.754 -27.890 1.00 0.00 H new ATOM 0 HB2 GLN A 107 23.710 -1.577 -26.497 1.00 0.00 H new ATOM 0 HB3 GLN A 107 23.788 -2.210 -28.130 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.096 -3.878 -25.616 1.00 0.00 H new ATOM 0 HG3 GLN A 107 22.597 -3.672 -26.499 1.00 0.00 H new ATOM 0 HE21 GLN A 107 22.985 -6.119 -26.179 1.00 0.00 H new ATOM 0 HE22 GLN A 107 23.698 -6.938 -27.573 1.00 0.00 H new ATOM 1592 N SER A 108 25.580 -0.245 -28.719 1.00 0.00 N ATOM 1593 CA SER A 108 25.566 1.146 -29.155 1.00 0.00 C ATOM 1594 C SER A 108 24.474 1.921 -28.398 1.00 0.00 C ATOM 1595 O SER A 108 23.495 1.338 -27.925 1.00 0.00 O ATOM 1596 CB SER A 108 25.371 1.194 -30.680 1.00 0.00 C ATOM 1597 OG SER A 108 26.313 0.350 -31.333 1.00 0.00 O ATOM 0 H SER A 108 25.260 -0.897 -29.435 1.00 0.00 H new ATOM 0 HA SER A 108 26.516 1.628 -28.925 1.00 0.00 H new ATOM 0 HB2 SER A 108 24.358 0.881 -30.932 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.486 2.218 -31.035 1.00 0.00 H new ATOM 0 HG SER A 108 26.173 0.392 -32.302 1.00 0.00 H new ATOM 1603 N LEU A 109 24.613 3.250 -28.303 1.00 0.00 N ATOM 1604 CA LEU A 109 23.743 4.098 -27.476 1.00 0.00 C ATOM 1605 C LEU A 109 22.304 4.096 -27.987 1.00 0.00 C ATOM 1606 O LEU A 109 21.376 4.255 -27.200 1.00 0.00 O ATOM 1607 CB LEU A 109 24.289 5.536 -27.355 1.00 0.00 C ATOM 1608 CG LEU A 109 25.632 5.737 -26.616 1.00 0.00 C ATOM 1609 CD1 LEU A 109 25.777 4.871 -25.357 1.00 0.00 C ATOM 1610 CD2 LEU A 109 26.853 5.504 -27.514 1.00 0.00 C ATOM 0 H LEU A 109 25.336 3.770 -28.800 1.00 0.00 H new ATOM 0 HA LEU A 109 23.739 3.666 -26.475 1.00 0.00 H new ATOM 0 HB2 LEU A 109 24.397 5.939 -28.362 1.00 0.00 H new ATOM 0 HB3 LEU A 109 23.535 6.139 -26.849 1.00 0.00 H new ATOM 0 HG LEU A 109 25.605 6.784 -26.315 1.00 0.00 H new ATOM 0 HD11 LEU A 109 26.743 5.065 -24.891 1.00 0.00 H new ATOM 0 HD12 LEU A 109 24.980 5.114 -24.654 1.00 0.00 H new ATOM 0 HD13 LEU A 109 25.711 3.818 -25.630 1.00 0.00 H new ATOM 0 HD21 LEU A 109 27.764 5.660 -26.937 1.00 0.00 H new ATOM 0 HD22 LEU A 109 26.835 4.483 -27.894 1.00 0.00 H new ATOM 0 HD23 LEU A 109 26.829 6.203 -28.350 1.00 0.00 H new ATOM 1622 N GLU A 110 22.098 3.847 -29.282 1.00 0.00 N ATOM 1623 CA GLU A 110 20.768 3.672 -29.864 1.00 0.00 C ATOM 1624 C GLU A 110 19.998 2.557 -29.161 1.00 0.00 C ATOM 1625 O GLU A 110 18.786 2.667 -28.987 1.00 0.00 O ATOM 1626 CB GLU A 110 20.862 3.391 -31.378 1.00 0.00 C ATOM 1627 CG GLU A 110 21.893 2.341 -31.811 1.00 0.00 C ATOM 1628 CD GLU A 110 21.891 2.147 -33.338 1.00 0.00 C ATOM 1629 OE1 GLU A 110 21.108 1.305 -33.846 1.00 0.00 O ATOM 1630 OE2 GLU A 110 22.682 2.821 -34.042 1.00 0.00 O ATOM 0 H GLU A 110 22.855 3.761 -29.960 1.00 0.00 H new ATOM 0 HA GLU A 110 20.221 4.603 -29.720 1.00 0.00 H new ATOM 0 HB2 GLU A 110 19.880 3.072 -31.728 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.093 4.327 -31.886 1.00 0.00 H new ATOM 0 HG2 GLU A 110 22.886 2.648 -31.483 1.00 0.00 H new ATOM 0 HG3 GLU A 110 21.675 1.392 -31.322 1.00 0.00 H new ATOM 1637 N VAL A 111 20.682 1.501 -28.722 1.00 0.00 N ATOM 1638 CA VAL A 111 20.049 0.351 -28.102 1.00 0.00 C ATOM 1639 C VAL A 111 19.670 0.706 -26.670 1.00 0.00 C ATOM 1640 O VAL A 111 18.521 0.497 -26.306 1.00 0.00 O ATOM 1641 CB VAL A 111 20.925 -0.906 -28.240 1.00 0.00 C ATOM 1642 CG1 VAL A 111 20.156 -2.171 -27.840 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.444 -1.061 -29.684 1.00 0.00 C ATOM 0 H VAL A 111 21.697 1.425 -28.790 1.00 0.00 H new ATOM 0 HA VAL A 111 19.124 0.097 -28.619 1.00 0.00 H new ATOM 0 HB VAL A 111 21.772 -0.781 -27.565 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.804 -3.041 -27.949 1.00 0.00 H new ATOM 0 HG12 VAL A 111 19.833 -2.087 -26.802 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.284 -2.285 -28.484 1.00 0.00 H new ATOM 0 HG21 VAL A 111 22.061 -1.957 -29.755 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.599 -1.147 -30.367 1.00 0.00 H new ATOM 0 HG23 VAL A 111 22.040 -0.189 -29.952 1.00 0.00 H new ATOM 1653 N PHE A 112 20.554 1.342 -25.887 1.00 0.00 N ATOM 1654 CA PHE A 112 20.178 1.906 -24.585 1.00 0.00 C ATOM 1655 C PHE A 112 18.931 2.780 -24.728 1.00 0.00 C ATOM 1656 O PHE A 112 17.952 2.576 -24.018 1.00 0.00 O ATOM 1657 CB PHE A 112 21.313 2.775 -24.016 1.00 0.00 C ATOM 1658 CG PHE A 112 22.506 2.030 -23.452 1.00 0.00 C ATOM 1659 CD1 PHE A 112 23.598 1.698 -24.275 1.00 0.00 C ATOM 1660 CD2 PHE A 112 22.534 1.683 -22.089 1.00 0.00 C ATOM 1661 CE1 PHE A 112 24.702 1.016 -23.740 1.00 0.00 C ATOM 1662 CE2 PHE A 112 23.626 0.967 -21.565 1.00 0.00 C ATOM 1663 CZ PHE A 112 24.713 0.637 -22.390 1.00 0.00 C ATOM 0 H PHE A 112 21.534 1.478 -26.134 1.00 0.00 H new ATOM 0 HA PHE A 112 19.980 1.074 -23.909 1.00 0.00 H new ATOM 0 HB2 PHE A 112 21.665 3.439 -24.806 1.00 0.00 H new ATOM 0 HB3 PHE A 112 20.900 3.406 -23.229 1.00 0.00 H new ATOM 0 HD1 PHE A 112 23.587 1.969 -25.321 1.00 0.00 H new ATOM 0 HD2 PHE A 112 21.716 1.967 -21.444 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.547 0.782 -24.371 1.00 0.00 H new ATOM 0 HE2 PHE A 112 23.628 0.671 -20.526 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.554 0.093 -21.986 1.00 0.00 H new ATOM 1673 N ARG A 113 18.927 3.711 -25.683 1.00 0.00 N ATOM 1674 CA ARG A 113 17.852 4.698 -25.822 1.00 0.00 C ATOM 1675 C ARG A 113 16.553 4.030 -26.288 1.00 0.00 C ATOM 1676 O ARG A 113 15.483 4.394 -25.802 1.00 0.00 O ATOM 1677 CB ARG A 113 18.338 5.814 -26.758 1.00 0.00 C ATOM 1678 CG ARG A 113 19.442 6.650 -26.080 1.00 0.00 C ATOM 1679 CD ARG A 113 20.177 7.546 -27.079 1.00 0.00 C ATOM 1680 NE ARG A 113 21.166 8.408 -26.403 1.00 0.00 N ATOM 1681 CZ ARG A 113 22.219 8.989 -26.992 1.00 0.00 C ATOM 1682 NH1 ARG A 113 22.466 8.825 -28.292 1.00 0.00 N ATOM 1683 NH2 ARG A 113 23.033 9.740 -26.265 1.00 0.00 N ATOM 0 H ARG A 113 19.666 3.803 -26.380 1.00 0.00 H new ATOM 0 HA ARG A 113 17.614 5.148 -24.858 1.00 0.00 H new ATOM 0 HB2 ARG A 113 18.719 5.380 -27.682 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.502 6.458 -27.029 1.00 0.00 H new ATOM 0 HG2 ARG A 113 19.001 7.266 -25.297 1.00 0.00 H new ATOM 0 HG3 ARG A 113 20.156 5.983 -25.597 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.679 6.928 -27.823 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.457 8.166 -27.613 1.00 0.00 H new ATOM 0 HE ARG A 113 21.037 8.575 -25.405 1.00 0.00 H new ATOM 0 HH11 ARG A 113 21.847 8.247 -28.860 1.00 0.00 H new ATOM 0 HH12 ARG A 113 23.274 9.278 -28.719 1.00 0.00 H new ATOM 0 HH21 ARG A 113 22.854 9.870 -25.269 1.00 0.00 H new ATOM 0 HH22 ARG A 113 23.839 10.188 -26.701 1.00 0.00 H new ATOM 1697 N THR A 114 16.634 2.999 -27.129 1.00 0.00 N ATOM 1698 CA THR A 114 15.515 2.148 -27.484 1.00 0.00 C ATOM 1699 C THR A 114 14.989 1.448 -26.227 1.00 0.00 C ATOM 1700 O THR A 114 13.788 1.475 -25.956 1.00 0.00 O ATOM 1701 CB THR A 114 16.035 1.156 -28.542 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.107 1.783 -29.808 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.225 -0.133 -28.641 1.00 0.00 C ATOM 0 H THR A 114 17.504 2.732 -27.590 1.00 0.00 H new ATOM 0 HA THR A 114 14.678 2.710 -27.898 1.00 0.00 H new ATOM 0 HB THR A 114 17.030 0.861 -28.209 1.00 0.00 H new ATOM 0 HG1 THR A 114 16.971 2.237 -29.900 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.657 -0.776 -29.408 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.244 -0.650 -27.681 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.194 0.104 -28.904 1.00 0.00 H new ATOM 1711 N VAL A 115 15.868 0.830 -25.436 1.00 0.00 N ATOM 1712 CA VAL A 115 15.457 -0.022 -24.330 1.00 0.00 C ATOM 1713 C VAL A 115 14.855 0.833 -23.215 1.00 0.00 C ATOM 1714 O VAL A 115 13.937 0.364 -22.551 1.00 0.00 O ATOM 1715 CB VAL A 115 16.619 -0.960 -23.930 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.293 -1.794 -22.682 1.00 0.00 C ATOM 1717 CG2 VAL A 115 16.916 -1.948 -25.073 1.00 0.00 C ATOM 0 H VAL A 115 16.879 0.908 -25.547 1.00 0.00 H new ATOM 0 HA VAL A 115 14.652 -0.699 -24.617 1.00 0.00 H new ATOM 0 HB VAL A 115 17.475 -0.318 -23.721 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.140 -2.436 -22.442 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.093 -1.129 -21.842 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.414 -2.410 -22.875 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.736 -2.605 -24.782 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.028 -2.545 -25.278 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.195 -1.394 -25.969 1.00 0.00 H new ATOM 1727 N ARG A 116 15.240 2.109 -23.077 1.00 0.00 N ATOM 1728 CA ARG A 116 14.540 3.025 -22.171 1.00 0.00 C ATOM 1729 C ARG A 116 13.055 3.086 -22.546 1.00 0.00 C ATOM 1730 O ARG A 116 12.206 2.889 -21.684 1.00 0.00 O ATOM 1731 CB ARG A 116 15.159 4.442 -22.181 1.00 0.00 C ATOM 1732 CG ARG A 116 16.580 4.509 -21.600 1.00 0.00 C ATOM 1733 CD ARG A 116 16.940 5.900 -21.051 1.00 0.00 C ATOM 1734 NE ARG A 116 17.558 6.818 -22.042 1.00 0.00 N ATOM 1735 CZ ARG A 116 16.976 7.775 -22.784 1.00 0.00 C ATOM 1736 NH1 ARG A 116 15.651 7.878 -22.868 1.00 0.00 N ATOM 1737 NH2 ARG A 116 17.727 8.643 -23.453 1.00 0.00 N ATOM 0 H ARG A 116 16.025 2.526 -23.577 1.00 0.00 H new ATOM 0 HA ARG A 116 14.646 2.638 -21.157 1.00 0.00 H new ATOM 0 HB2 ARG A 116 15.179 4.811 -23.206 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.514 5.113 -21.614 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.675 3.773 -20.801 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.296 4.233 -22.374 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.036 6.366 -20.659 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.625 5.778 -20.212 1.00 0.00 H new ATOM 0 HE ARG A 116 18.563 6.706 -22.178 1.00 0.00 H new ATOM 0 HH11 ARG A 116 15.055 7.222 -22.363 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.232 8.613 -23.438 1.00 0.00 H new ATOM 0 HH21 ARG A 116 18.744 8.582 -23.403 1.00 0.00 H new ATOM 0 HH22 ARG A 116 17.287 9.370 -24.017 1.00 0.00 H new ATOM 1751 N GLY A 117 12.741 3.284 -23.826 1.00 0.00 N ATOM 1752 CA GLY A 117 11.366 3.346 -24.316 1.00 0.00 C ATOM 1753 C GLY A 117 10.633 2.024 -24.103 1.00 0.00 C ATOM 1754 O GLY A 117 9.534 2.015 -23.546 1.00 0.00 O ATOM 0 H GLY A 117 13.441 3.407 -24.558 1.00 0.00 H new ATOM 0 HA2 GLY A 117 10.832 4.146 -23.803 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.368 3.594 -25.377 1.00 0.00 H new ATOM 1758 N GLN A 118 11.256 0.898 -24.482 1.00 0.00 N ATOM 1759 CA GLN A 118 10.613 -0.412 -24.375 1.00 0.00 C ATOM 1760 C GLN A 118 10.297 -0.748 -22.919 1.00 0.00 C ATOM 1761 O GLN A 118 9.189 -1.176 -22.596 1.00 0.00 O ATOM 1762 CB GLN A 118 11.457 -1.518 -25.027 1.00 0.00 C ATOM 1763 CG GLN A 118 11.740 -1.260 -26.518 1.00 0.00 C ATOM 1764 CD GLN A 118 11.863 -2.560 -27.314 1.00 0.00 C ATOM 1765 OE1 GLN A 118 11.114 -2.813 -28.255 1.00 0.00 O ATOM 1766 NE2 GLN A 118 12.804 -3.420 -26.951 1.00 0.00 N ATOM 0 H GLN A 118 12.202 0.872 -24.864 1.00 0.00 H new ATOM 0 HA GLN A 118 9.672 -0.358 -24.923 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.403 -1.607 -24.494 1.00 0.00 H new ATOM 0 HB3 GLN A 118 10.940 -2.472 -24.921 1.00 0.00 H new ATOM 0 HG2 GLN A 118 10.939 -0.652 -26.939 1.00 0.00 H new ATOM 0 HG3 GLN A 118 12.661 -0.686 -26.618 1.00 0.00 H new ATOM 0 HE21 GLN A 118 13.421 -3.201 -26.169 1.00 0.00 H new ATOM 0 HE22 GLN A 118 12.911 -4.301 -27.454 1.00 0.00 H new ATOM 1775 N VAL A 119 11.263 -0.514 -22.032 1.00 0.00 N ATOM 1776 CA VAL A 119 11.107 -0.810 -20.608 1.00 0.00 C ATOM 1777 C VAL A 119 10.069 0.117 -19.978 1.00 0.00 C ATOM 1778 O VAL A 119 9.235 -0.374 -19.219 1.00 0.00 O ATOM 1779 CB VAL A 119 12.463 -0.759 -19.881 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.288 -0.948 -18.371 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.366 -1.897 -20.375 1.00 0.00 C ATOM 0 H VAL A 119 12.170 -0.117 -22.277 1.00 0.00 H new ATOM 0 HA VAL A 119 10.734 -1.829 -20.501 1.00 0.00 H new ATOM 0 HB VAL A 119 12.904 0.216 -20.089 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.262 -0.907 -17.884 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.652 -0.156 -17.976 1.00 0.00 H new ATOM 0 HG13 VAL A 119 11.825 -1.916 -18.177 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.323 -1.853 -19.856 1.00 0.00 H new ATOM 0 HG22 VAL A 119 12.887 -2.855 -20.173 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.530 -1.792 -21.447 1.00 0.00 H new ATOM 1791 N LYS A 120 10.068 1.416 -20.302 1.00 0.00 N ATOM 1792 CA LYS A 120 9.100 2.360 -19.737 1.00 0.00 C ATOM 1793 C LYS A 120 7.693 1.838 -19.971 1.00 0.00 C ATOM 1794 O LYS A 120 6.898 1.807 -19.040 1.00 0.00 O ATOM 1795 CB LYS A 120 9.256 3.730 -20.414 1.00 0.00 C ATOM 1796 CG LYS A 120 8.327 4.803 -19.820 1.00 0.00 C ATOM 1797 CD LYS A 120 8.643 6.167 -20.457 1.00 0.00 C ATOM 1798 CE LYS A 120 7.716 7.298 -19.974 1.00 0.00 C ATOM 1799 NZ LYS A 120 6.370 7.263 -20.611 1.00 0.00 N ATOM 0 H LYS A 120 10.729 1.837 -20.955 1.00 0.00 H new ATOM 0 HA LYS A 120 9.279 2.465 -18.667 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.290 4.060 -20.320 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.050 3.628 -21.479 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.285 4.538 -20.001 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.459 4.855 -18.739 1.00 0.00 H new ATOM 0 HD2 LYS A 120 9.676 6.434 -20.233 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.564 6.080 -21.541 1.00 0.00 H new ATOM 0 HE2 LYS A 120 7.601 7.229 -18.892 1.00 0.00 H new ATOM 0 HE3 LYS A 120 8.186 8.259 -20.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 5.835 8.112 -20.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 6.476 7.238 -21.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 5.858 6.415 -20.295 1.00 0.00 H new ATOM 1813 N GLU A 121 7.407 1.395 -21.191 1.00 0.00 N ATOM 1814 CA GLU A 121 6.083 0.949 -21.578 1.00 0.00 C ATOM 1815 C GLU A 121 5.675 -0.313 -20.803 1.00 0.00 C ATOM 1816 O GLU A 121 4.555 -0.377 -20.289 1.00 0.00 O ATOM 1817 CB GLU A 121 6.093 0.760 -23.097 1.00 0.00 C ATOM 1818 CG GLU A 121 4.734 0.305 -23.636 1.00 0.00 C ATOM 1819 CD GLU A 121 4.732 0.252 -25.175 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.074 -0.808 -25.753 1.00 0.00 O ATOM 1821 OE2 GLU A 121 4.372 1.268 -25.818 1.00 0.00 O ATOM 0 H GLU A 121 8.096 1.337 -21.941 1.00 0.00 H new ATOM 0 HA GLU A 121 5.324 1.688 -21.322 1.00 0.00 H new ATOM 0 HB2 GLU A 121 6.375 1.698 -23.576 1.00 0.00 H new ATOM 0 HB3 GLU A 121 6.852 0.025 -23.364 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.493 -0.680 -23.236 1.00 0.00 H new ATOM 0 HG3 GLU A 121 3.957 0.988 -23.292 1.00 0.00 H new ATOM 1828 N ARG A 122 6.576 -1.293 -20.648 1.00 0.00 N ATOM 1829 CA ARG A 122 6.268 -2.514 -19.893 1.00 0.00 C ATOM 1830 C ARG A 122 6.035 -2.209 -18.418 1.00 0.00 C ATOM 1831 O ARG A 122 5.067 -2.698 -17.835 1.00 0.00 O ATOM 1832 CB ARG A 122 7.355 -3.580 -20.076 1.00 0.00 C ATOM 1833 CG ARG A 122 7.398 -4.103 -21.524 1.00 0.00 C ATOM 1834 CD ARG A 122 7.857 -5.558 -21.540 1.00 0.00 C ATOM 1835 NE ARG A 122 7.987 -6.068 -22.919 1.00 0.00 N ATOM 1836 CZ ARG A 122 7.064 -6.743 -23.622 1.00 0.00 C ATOM 1837 NH1 ARG A 122 5.883 -7.045 -23.088 1.00 0.00 N ATOM 1838 NH2 ARG A 122 7.329 -7.117 -24.871 1.00 0.00 N ATOM 0 H ARG A 122 7.520 -1.264 -21.034 1.00 0.00 H new ATOM 0 HA ARG A 122 5.341 -2.921 -20.297 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.325 -3.160 -19.811 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.170 -4.410 -19.394 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.411 -4.019 -21.979 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.076 -3.492 -22.120 1.00 0.00 H new ATOM 0 HD2 ARG A 122 8.815 -5.644 -21.027 1.00 0.00 H new ATOM 0 HD3 ARG A 122 7.144 -6.172 -20.989 1.00 0.00 H new ATOM 0 HE ARG A 122 8.874 -5.888 -23.389 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.669 -6.763 -22.131 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.192 -7.558 -23.635 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.231 -6.891 -25.291 1.00 0.00 H new ATOM 0 HH22 ARG A 122 6.631 -7.630 -25.409 1.00 0.00 H new ATOM 1852 N VAL A 123 6.884 -1.382 -17.819 1.00 0.00 N ATOM 1853 CA VAL A 123 6.744 -1.005 -16.419 1.00 0.00 C ATOM 1854 C VAL A 123 5.460 -0.178 -16.244 1.00 0.00 C ATOM 1855 O VAL A 123 4.725 -0.408 -15.286 1.00 0.00 O ATOM 1856 CB VAL A 123 8.024 -0.288 -15.964 1.00 0.00 C ATOM 1857 CG1 VAL A 123 7.920 0.222 -14.525 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.272 -1.186 -16.035 1.00 0.00 C ATOM 0 H VAL A 123 7.684 -0.957 -18.287 1.00 0.00 H new ATOM 0 HA VAL A 123 6.634 -1.877 -15.775 1.00 0.00 H new ATOM 0 HB VAL A 123 8.129 0.545 -16.659 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.848 0.722 -14.248 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.092 0.926 -14.448 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.746 -0.618 -13.853 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.144 -0.624 -15.701 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.132 -2.055 -15.392 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.425 -1.516 -17.062 1.00 0.00 H new ATOM 1868 N GLU A 124 5.125 0.730 -17.166 1.00 0.00 N ATOM 1869 CA GLU A 124 3.879 1.488 -17.100 1.00 0.00 C ATOM 1870 C GLU A 124 2.679 0.547 -17.137 1.00 0.00 C ATOM 1871 O GLU A 124 1.748 0.723 -16.355 1.00 0.00 O ATOM 1872 CB GLU A 124 3.763 2.523 -18.237 1.00 0.00 C ATOM 1873 CG GLU A 124 4.392 3.873 -17.888 1.00 0.00 C ATOM 1874 CD GLU A 124 3.957 4.963 -18.881 1.00 0.00 C ATOM 1875 OE1 GLU A 124 2.900 5.601 -18.664 1.00 0.00 O ATOM 1876 OE2 GLU A 124 4.683 5.210 -19.873 1.00 0.00 O ATOM 0 H GLU A 124 5.707 0.957 -17.972 1.00 0.00 H new ATOM 0 HA GLU A 124 3.889 2.032 -16.156 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.243 2.126 -19.132 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.711 2.671 -18.479 1.00 0.00 H new ATOM 0 HG2 GLU A 124 4.102 4.162 -16.878 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.478 3.784 -17.895 1.00 0.00 H new ATOM 1883 N ASN A 125 2.714 -0.471 -17.998 1.00 0.00 N ATOM 1884 CA ASN A 125 1.638 -1.446 -18.108 1.00 0.00 C ATOM 1885 C ASN A 125 1.466 -2.224 -16.799 1.00 0.00 C ATOM 1886 O ASN A 125 0.344 -2.368 -16.318 1.00 0.00 O ATOM 1887 CB ASN A 125 1.885 -2.402 -19.284 1.00 0.00 C ATOM 1888 CG ASN A 125 0.747 -3.411 -19.397 1.00 0.00 C ATOM 1889 OD1 ASN A 125 0.857 -4.536 -18.920 1.00 0.00 O ATOM 1890 ND2 ASN A 125 -0.370 -3.027 -20.000 1.00 0.00 N ATOM 0 H ASN A 125 3.491 -0.639 -18.637 1.00 0.00 H new ATOM 0 HA ASN A 125 0.712 -0.904 -18.301 1.00 0.00 H new ATOM 0 HB2 ASN A 125 1.970 -1.834 -20.211 1.00 0.00 H new ATOM 0 HB3 ASN A 125 2.831 -2.925 -19.143 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -1.157 -3.671 -20.074 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.442 -2.087 -20.390 1.00 0.00 H new ATOM 1897 N LEU A 126 2.562 -2.672 -16.187 1.00 0.00 N ATOM 1898 CA LEU A 126 2.560 -3.369 -14.910 1.00 0.00 C ATOM 1899 C LEU A 126 1.918 -2.509 -13.825 1.00 0.00 C ATOM 1900 O LEU A 126 1.045 -2.983 -13.104 1.00 0.00 O ATOM 1901 CB LEU A 126 4.019 -3.706 -14.560 1.00 0.00 C ATOM 1902 CG LEU A 126 4.239 -4.191 -13.120 1.00 0.00 C ATOM 1903 CD1 LEU A 126 3.485 -5.497 -12.870 1.00 0.00 C ATOM 1904 CD2 LEU A 126 5.731 -4.369 -12.850 1.00 0.00 C ATOM 0 H LEU A 126 3.497 -2.555 -16.579 1.00 0.00 H new ATOM 0 HA LEU A 126 1.972 -4.284 -14.978 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.374 -4.475 -15.246 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.632 -2.821 -14.728 1.00 0.00 H new ATOM 0 HG LEU A 126 3.848 -3.439 -12.434 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.654 -5.824 -11.844 1.00 0.00 H new ATOM 0 HD12 LEU A 126 2.419 -5.338 -13.029 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.844 -6.262 -13.558 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.877 -4.713 -11.826 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.141 -5.105 -13.542 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.242 -3.416 -12.989 1.00 0.00 H new ATOM 1916 N ILE A 127 2.334 -1.251 -13.709 1.00 0.00 N ATOM 1917 CA ILE A 127 1.827 -0.311 -12.719 1.00 0.00 C ATOM 1918 C ILE A 127 0.343 -0.080 -13.002 1.00 0.00 C ATOM 1919 O ILE A 127 -0.460 -0.157 -12.078 1.00 0.00 O ATOM 1920 CB ILE A 127 2.695 0.954 -12.814 1.00 0.00 C ATOM 1921 CG1 ILE A 127 4.109 0.585 -12.321 1.00 0.00 C ATOM 1922 CG2 ILE A 127 2.121 2.102 -11.973 1.00 0.00 C ATOM 1923 CD1 ILE A 127 5.127 1.700 -12.512 1.00 0.00 C ATOM 0 H ILE A 127 3.049 -0.850 -14.315 1.00 0.00 H new ATOM 0 HA ILE A 127 1.891 -0.675 -11.693 1.00 0.00 H new ATOM 0 HB ILE A 127 2.719 1.303 -13.846 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.060 0.325 -11.264 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.450 -0.303 -12.852 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.763 2.978 -12.067 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.119 2.347 -12.327 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.072 1.798 -10.927 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.099 1.372 -12.144 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.204 1.945 -13.571 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.808 2.583 -11.958 1.00 0.00 H new ATOM 1935 N ALA A 128 -0.045 0.119 -14.265 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.436 0.297 -14.654 1.00 0.00 C ATOM 1937 C ALA A 128 -2.298 -0.932 -14.310 1.00 0.00 C ATOM 1938 O ALA A 128 -3.497 -0.769 -14.065 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.510 0.620 -16.149 1.00 0.00 C ATOM 0 H ALA A 128 0.607 0.160 -15.048 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.845 1.131 -14.083 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.552 0.753 -16.441 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.956 1.537 -16.351 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -1.075 -0.200 -16.720 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.728 -2.146 -14.271 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.435 -3.320 -13.772 1.00 0.00 C ATOM 1947 C LYS A 129 -2.636 -3.227 -12.263 1.00 0.00 C ATOM 1948 O LYS A 129 -3.773 -3.331 -11.792 1.00 0.00 O ATOM 1949 CB LYS A 129 -1.726 -4.643 -14.125 1.00 0.00 C ATOM 1950 CG LYS A 129 -1.797 -5.022 -15.611 1.00 0.00 C ATOM 1951 CD LYS A 129 -1.075 -6.356 -15.847 1.00 0.00 C ATOM 1952 CE LYS A 129 -1.180 -6.774 -17.323 1.00 0.00 C ATOM 1953 NZ LYS A 129 -0.686 -8.155 -17.568 1.00 0.00 N ATOM 0 H LYS A 129 -0.775 -2.334 -14.582 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.404 -3.329 -14.271 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.679 -4.570 -13.830 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -2.168 -5.447 -13.536 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.838 -5.102 -15.925 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -1.340 -4.239 -16.217 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.027 -6.264 -15.563 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.510 -7.128 -15.213 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -2.220 -6.703 -17.643 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.610 -6.075 -17.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.556 -8.301 -18.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.223 -8.290 -17.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -1.379 -8.841 -17.205 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.551 -3.063 -11.503 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.597 -3.198 -10.057 1.00 0.00 C ATOM 1969 C ILE A 130 -2.179 -1.988 -9.311 1.00 0.00 C ATOM 1970 O ILE A 130 -2.963 -2.174 -8.378 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.228 -3.659 -9.518 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.856 -2.571 -9.663 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.189 -4.989 -10.181 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.259 -2.998 -9.240 1.00 0.00 C ATOM 0 H ILE A 130 -0.628 -2.835 -11.873 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.324 -3.981 -9.842 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.332 -3.834 -8.447 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.889 -2.249 -10.704 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.562 -1.705 -9.070 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.157 -5.302 -9.791 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.555 -5.754 -9.961 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.260 -4.851 -11.260 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.950 -2.166 -9.379 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.249 -3.291 -8.190 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.581 -3.843 -9.849 1.00 0.00 H new ATOM 1986 N SER A 131 -1.784 -0.776 -9.683 1.00 0.00 N ATOM 1987 CA SER A 131 -2.052 0.461 -8.978 1.00 0.00 C ATOM 1988 C SER A 131 -3.415 1.015 -9.396 1.00 0.00 C ATOM 1989 O SER A 131 -4.267 1.230 -8.504 1.00 0.00 O ATOM 1990 CB SER A 131 -0.901 1.435 -9.229 1.00 0.00 C ATOM 1991 OG SER A 131 0.298 0.882 -8.693 1.00 0.00 O ATOM 1992 OXT SER A 131 -3.640 1.234 -10.611 1.00 0.00 O ATOM 0 H SER A 131 -1.238 -0.628 -10.532 1.00 0.00 H new ATOM 0 HA SER A 131 -2.107 0.292 -7.903 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.787 1.616 -10.298 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.113 2.397 -8.763 1.00 0.00 H new ATOM 0 HG SER A 131 1.042 1.500 -8.851 1.00 0.00 H new