USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 990 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 125 ASN : amide:sc= 0.127 K(o=1.6,f=-1.6) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -152:sc= 1.47 (180deg=1.17) USER MOD Set 2.1: A 13 SER OG : rot -101:sc= 2.12 USER MOD Set 2.2: A 15 SER OG : rot 89:sc= 0.513 USER MOD Set 3.1: A 11 ASN : amide:sc= 0.914 K(o=0.62,f=-0.65) USER MOD Set 3.2: A 43 HIS : no HE2:sc= -0.29 K(o=0.62,f=-1.9) USER MOD Set 4.1: A 5 MET CE :methyl -169:sc= -0.435 (180deg=-0.697) USER MOD Set 4.2: A 35 SER OG : rot -112:sc= 1.78 USER MOD Single : A 1 MET CE :methyl 161:sc= 0 (180deg=-0.203) USER MOD Single : A 1 MET N :NH3+ 156:sc= 0.00185 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -161:sc= 1.3 (180deg=1.09) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot -90:sc= 0.616 USER MOD Single : A 16 GLN : amide:sc= -0.328 K(o=-0.33,f=-2.3!) USER MOD Single : A 17 MET CE :methyl -168:sc= -0.943 (180deg=-1.45) USER MOD Single : A 23 LYS NZ :NH3+ 179:sc= 1.91 (180deg=1.84!) USER MOD Single : A 24 THR OG1 : rot -130:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 120:sc= 0.495 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -150:sc= -0.0247 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.00467 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 139:sc= -0.242 (180deg=-1.95) USER MOD Single : A 58 SER OG : rot 180:sc= 0.149 USER MOD Single : A 60 GLN : amide:sc= 0.189 X(o=0.19,f=-0.29) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.127 USER MOD Single : A 62 SER OG : rot 180:sc= 0.0384 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.125 K(o=0.13,f=-7.4!) USER MOD Single : A 73 TYR OH : rot 130:sc= -0.13 USER MOD Single : A 78 SER OG : rot 170:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.205 K(o=-0.21,f=-1.2) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0252 USER MOD Single : A 93 GLN : amide:sc= 0.371 K(o=0.37,f=-0.64) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 GLN : amide:sc= 1.12 K(o=1.1,f=-0.84) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 89:sc= 0.445 USER MOD Single : A 118 GLN : amide:sc= 0.634 K(o=0.63,f=-3.9!) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.692 -0.720 0.865 1.00 0.00 N ATOM 2 CA MET A 1 2.443 -0.600 -0.423 1.00 0.00 C ATOM 3 C MET A 1 2.612 -1.983 -1.081 1.00 0.00 C ATOM 4 O MET A 1 2.875 -2.963 -0.386 1.00 0.00 O ATOM 5 CB MET A 1 3.831 0.081 -0.229 1.00 0.00 C ATOM 6 CG MET A 1 4.025 1.359 -1.055 1.00 0.00 C ATOM 7 SD MET A 1 5.355 2.434 -0.444 1.00 0.00 S ATOM 8 CE MET A 1 5.677 3.398 -1.943 1.00 0.00 C ATOM 0 H1 MET A 1 1.925 0.086 1.479 1.00 0.00 H new ATOM 0 H2 MET A 1 0.670 -0.724 0.672 1.00 0.00 H new ATOM 0 H3 MET A 1 1.958 -1.606 1.341 1.00 0.00 H new ATOM 0 HA MET A 1 1.855 0.038 -1.082 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.961 0.321 0.826 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.613 -0.631 -0.493 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.239 1.084 -2.088 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.091 1.921 -1.062 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.207 4.313 -1.680 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.286 2.810 -2.630 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.732 3.651 -2.423 1.00 0.00 H new ATOM 18 N LYS A 2 2.519 -2.077 -2.417 1.00 0.00 N ATOM 19 CA LYS A 2 2.801 -3.329 -3.144 1.00 0.00 C ATOM 20 C LYS A 2 4.311 -3.418 -3.259 1.00 0.00 C ATOM 21 O LYS A 2 4.904 -2.526 -3.860 1.00 0.00 O ATOM 22 CB LYS A 2 2.087 -3.367 -4.520 1.00 0.00 C ATOM 23 CG LYS A 2 0.622 -2.889 -4.461 1.00 0.00 C ATOM 24 CD LYS A 2 -0.036 -2.835 -5.849 1.00 0.00 C ATOM 25 CE LYS A 2 -1.222 -1.854 -5.881 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.448 -2.387 -5.217 1.00 0.00 N ATOM 0 H LYS A 2 2.250 -1.299 -3.019 1.00 0.00 H new ATOM 0 HA LYS A 2 2.412 -4.196 -2.611 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.637 -2.743 -5.224 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.114 -4.385 -4.908 1.00 0.00 H new ATOM 0 HG2 LYS A 2 0.051 -3.558 -3.817 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.584 -1.899 -4.006 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.704 -2.535 -6.591 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.380 -3.831 -6.127 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.929 -0.924 -5.394 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.455 -1.611 -6.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.208 -1.680 -5.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.751 -3.259 -5.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.240 -2.594 -4.219 1.00 0.00 H new ATOM 40 N LYS A 3 4.958 -4.421 -2.665 1.00 0.00 N ATOM 41 CA LYS A 3 6.408 -4.552 -2.813 1.00 0.00 C ATOM 42 C LYS A 3 6.692 -5.232 -4.125 1.00 0.00 C ATOM 43 O LYS A 3 6.073 -6.259 -4.412 1.00 0.00 O ATOM 44 CB LYS A 3 7.084 -5.299 -1.667 1.00 0.00 C ATOM 45 CG LYS A 3 6.774 -4.642 -0.327 1.00 0.00 C ATOM 46 CD LYS A 3 7.596 -5.286 0.787 1.00 0.00 C ATOM 47 CE LYS A 3 7.180 -4.590 2.080 1.00 0.00 C ATOM 48 NZ LYS A 3 7.900 -5.144 3.256 1.00 0.00 N ATOM 0 H LYS A 3 4.515 -5.138 -2.091 1.00 0.00 H new ATOM 0 HA LYS A 3 6.831 -3.548 -2.790 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.746 -6.335 -1.655 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.162 -5.317 -1.826 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.993 -3.576 -0.379 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.711 -4.739 -0.105 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.404 -6.358 0.843 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.663 -5.162 0.604 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.381 -3.522 2.000 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.105 -4.702 2.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.386 -4.897 4.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.959 -6.179 3.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.859 -4.745 3.295 1.00 0.00 H new ATOM 62 N VAL A 4 7.611 -4.654 -4.878 1.00 0.00 N ATOM 63 CA VAL A 4 7.930 -4.997 -6.247 1.00 0.00 C ATOM 64 C VAL A 4 9.369 -5.495 -6.261 1.00 0.00 C ATOM 65 O VAL A 4 10.220 -4.973 -5.544 1.00 0.00 O ATOM 66 CB VAL A 4 7.773 -3.773 -7.173 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.412 -4.184 -8.606 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.732 -2.740 -6.733 1.00 0.00 C ATOM 0 H VAL A 4 8.186 -3.888 -4.527 1.00 0.00 H new ATOM 0 HA VAL A 4 7.250 -5.765 -6.615 1.00 0.00 H new ATOM 0 HB VAL A 4 8.756 -3.306 -7.117 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.311 -3.293 -9.225 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.199 -4.820 -9.011 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.469 -4.731 -8.601 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.703 -1.923 -7.454 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.751 -3.212 -6.680 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.000 -2.349 -5.751 1.00 0.00 H new ATOM 78 N MET A 5 9.652 -6.437 -7.142 1.00 0.00 N ATOM 79 CA MET A 5 10.989 -6.916 -7.457 1.00 0.00 C ATOM 80 C MET A 5 11.078 -7.094 -8.969 1.00 0.00 C ATOM 81 O MET A 5 10.081 -7.460 -9.590 1.00 0.00 O ATOM 82 CB MET A 5 11.223 -8.219 -6.686 1.00 0.00 C ATOM 83 CG MET A 5 12.544 -8.899 -7.050 1.00 0.00 C ATOM 84 SD MET A 5 13.090 -10.247 -5.970 1.00 0.00 S ATOM 85 CE MET A 5 13.247 -9.402 -4.368 1.00 0.00 C ATOM 0 H MET A 5 8.927 -6.910 -7.681 1.00 0.00 H new ATOM 0 HA MET A 5 11.768 -6.214 -7.158 1.00 0.00 H new ATOM 0 HB2 MET A 5 11.211 -8.009 -5.616 1.00 0.00 H new ATOM 0 HB3 MET A 5 10.400 -8.906 -6.885 1.00 0.00 H new ATOM 0 HG2 MET A 5 12.458 -9.289 -8.064 1.00 0.00 H new ATOM 0 HG3 MET A 5 13.325 -8.139 -7.066 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.758 -10.055 -3.661 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.822 -8.485 -4.495 1.00 0.00 H new ATOM 0 HE3 MET A 5 12.255 -9.159 -3.986 1.00 0.00 H new ATOM 95 N PHE A 6 12.252 -6.872 -9.558 1.00 0.00 N ATOM 96 CA PHE A 6 12.528 -7.043 -10.976 1.00 0.00 C ATOM 97 C PHE A 6 13.869 -7.747 -11.046 1.00 0.00 C ATOM 98 O PHE A 6 14.857 -7.222 -10.539 1.00 0.00 O ATOM 99 CB PHE A 6 12.603 -5.701 -11.725 1.00 0.00 C ATOM 100 CG PHE A 6 11.354 -4.849 -11.732 1.00 0.00 C ATOM 101 CD1 PHE A 6 11.040 -4.074 -10.605 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.543 -4.772 -12.881 1.00 0.00 C ATOM 103 CE1 PHE A 6 9.894 -3.266 -10.599 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.412 -3.938 -12.881 1.00 0.00 C ATOM 105 CZ PHE A 6 9.071 -3.208 -11.734 1.00 0.00 C ATOM 0 H PHE A 6 13.068 -6.555 -9.035 1.00 0.00 H new ATOM 0 HA PHE A 6 11.727 -7.609 -11.452 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.411 -5.114 -11.289 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.880 -5.905 -12.759 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.684 -4.100 -9.738 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.789 -5.352 -13.758 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.645 -2.688 -9.721 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.803 -3.859 -13.769 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.177 -2.602 -11.724 1.00 0.00 H new ATOM 115 N VAL A 7 13.912 -8.933 -11.642 1.00 0.00 N ATOM 116 CA VAL A 7 15.091 -9.775 -11.557 1.00 0.00 C ATOM 117 C VAL A 7 15.163 -10.640 -12.808 1.00 0.00 C ATOM 118 O VAL A 7 14.175 -11.252 -13.210 1.00 0.00 O ATOM 119 CB VAL A 7 15.037 -10.537 -10.208 1.00 0.00 C ATOM 120 CG1 VAL A 7 13.662 -11.149 -9.880 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.128 -11.600 -10.080 1.00 0.00 C ATOM 0 H VAL A 7 13.146 -9.329 -12.186 1.00 0.00 H new ATOM 0 HA VAL A 7 16.026 -9.215 -11.545 1.00 0.00 H new ATOM 0 HB VAL A 7 15.223 -9.760 -9.467 1.00 0.00 H new ATOM 0 HG11 VAL A 7 13.712 -11.663 -8.920 1.00 0.00 H new ATOM 0 HG12 VAL A 7 12.914 -10.358 -9.829 1.00 0.00 H new ATOM 0 HG13 VAL A 7 13.385 -11.860 -10.659 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.038 -12.099 -9.115 1.00 0.00 H new ATOM 0 HG22 VAL A 7 16.017 -12.333 -10.879 1.00 0.00 H new ATOM 0 HG23 VAL A 7 17.107 -11.127 -10.154 1.00 0.00 H new ATOM 131 N CYS A 8 16.330 -10.643 -13.448 1.00 0.00 N ATOM 132 CA CYS A 8 16.705 -11.543 -14.533 1.00 0.00 C ATOM 133 C CYS A 8 17.792 -12.489 -13.977 1.00 0.00 C ATOM 134 O CYS A 8 18.155 -12.410 -12.806 1.00 0.00 O ATOM 135 CB CYS A 8 17.165 -10.686 -15.730 1.00 0.00 C ATOM 136 SG CYS A 8 16.482 -11.019 -17.378 1.00 0.00 S ATOM 0 H CYS A 8 17.074 -9.986 -13.212 1.00 0.00 H new ATOM 0 HA CYS A 8 15.883 -12.161 -14.895 1.00 0.00 H new ATOM 0 HB2 CYS A 8 16.948 -9.645 -15.490 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.249 -10.777 -15.800 1.00 0.00 H new ATOM 141 N LYS A 9 18.321 -13.398 -14.806 1.00 0.00 N ATOM 142 CA LYS A 9 19.230 -14.459 -14.342 1.00 0.00 C ATOM 143 C LYS A 9 20.610 -13.910 -13.936 1.00 0.00 C ATOM 144 O LYS A 9 21.293 -14.526 -13.119 1.00 0.00 O ATOM 145 CB LYS A 9 19.331 -15.518 -15.460 1.00 0.00 C ATOM 146 CG LYS A 9 20.047 -16.812 -15.037 1.00 0.00 C ATOM 147 CD LYS A 9 20.054 -17.831 -16.188 1.00 0.00 C ATOM 148 CE LYS A 9 20.852 -19.083 -15.788 1.00 0.00 C ATOM 149 NZ LYS A 9 20.946 -20.072 -16.896 1.00 0.00 N ATOM 0 H LYS A 9 18.135 -13.421 -15.809 1.00 0.00 H new ATOM 0 HA LYS A 9 18.828 -14.915 -13.437 1.00 0.00 H new ATOM 0 HB2 LYS A 9 18.326 -15.767 -15.802 1.00 0.00 H new ATOM 0 HB3 LYS A 9 19.859 -15.085 -16.310 1.00 0.00 H new ATOM 0 HG2 LYS A 9 21.071 -16.586 -14.739 1.00 0.00 H new ATOM 0 HG3 LYS A 9 19.549 -17.241 -14.168 1.00 0.00 H new ATOM 0 HD2 LYS A 9 19.031 -18.109 -16.442 1.00 0.00 H new ATOM 0 HD3 LYS A 9 20.493 -17.381 -17.078 1.00 0.00 H new ATOM 0 HE2 LYS A 9 21.856 -18.789 -15.481 1.00 0.00 H new ATOM 0 HE3 LYS A 9 20.379 -19.552 -14.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 21.493 -20.898 -16.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 19.990 -20.375 -17.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 21.421 -19.635 -17.712 1.00 0.00 H new ATOM 163 N ARG A 10 21.034 -12.780 -14.517 1.00 0.00 N ATOM 164 CA ARG A 10 22.399 -12.255 -14.404 1.00 0.00 C ATOM 165 C ARG A 10 22.336 -10.751 -14.162 1.00 0.00 C ATOM 166 O ARG A 10 21.329 -10.135 -14.491 1.00 0.00 O ATOM 167 CB ARG A 10 23.121 -12.646 -15.712 1.00 0.00 C ATOM 168 CG ARG A 10 24.656 -12.615 -15.646 1.00 0.00 C ATOM 169 CD ARG A 10 25.267 -13.129 -16.959 1.00 0.00 C ATOM 170 NE ARG A 10 24.910 -12.257 -18.096 1.00 0.00 N ATOM 171 CZ ARG A 10 24.575 -12.621 -19.340 1.00 0.00 C ATOM 172 NH1 ARG A 10 24.639 -13.895 -19.720 1.00 0.00 N ATOM 173 NH2 ARG A 10 24.167 -11.690 -20.195 1.00 0.00 N ATOM 0 H ARG A 10 20.425 -12.195 -15.089 1.00 0.00 H new ATOM 0 HA ARG A 10 22.954 -12.668 -13.562 1.00 0.00 H new ATOM 0 HB2 ARG A 10 22.806 -13.650 -15.996 1.00 0.00 H new ATOM 0 HB3 ARG A 10 22.794 -11.973 -16.504 1.00 0.00 H new ATOM 0 HG2 ARG A 10 24.996 -11.597 -15.455 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.002 -13.228 -14.814 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.352 -13.178 -16.863 1.00 0.00 H new ATOM 0 HD3 ARG A 10 24.918 -14.143 -17.152 1.00 0.00 H new ATOM 0 HE ARG A 10 24.920 -11.254 -17.911 1.00 0.00 H new ATOM 0 HH11 ARG A 10 24.947 -14.609 -19.060 1.00 0.00 H new ATOM 0 HH12 ARG A 10 24.380 -14.157 -20.671 1.00 0.00 H new ATOM 0 HH21 ARG A 10 24.113 -10.715 -19.900 1.00 0.00 H new ATOM 0 HH22 ARG A 10 23.908 -11.950 -21.147 1.00 0.00 H new ATOM 187 N ASN A 11 23.406 -10.141 -13.649 1.00 0.00 N ATOM 188 CA ASN A 11 23.477 -8.684 -13.464 1.00 0.00 C ATOM 189 C ASN A 11 23.543 -7.969 -14.823 1.00 0.00 C ATOM 190 O ASN A 11 22.907 -6.936 -15.008 1.00 0.00 O ATOM 191 CB ASN A 11 24.686 -8.320 -12.564 1.00 0.00 C ATOM 192 CG ASN A 11 25.932 -7.905 -13.352 1.00 0.00 C ATOM 193 OD1 ASN A 11 26.719 -8.748 -13.772 1.00 0.00 O ATOM 194 ND2 ASN A 11 26.096 -6.618 -13.602 1.00 0.00 N ATOM 0 H ASN A 11 24.246 -10.637 -13.350 1.00 0.00 H new ATOM 0 HA ASN A 11 22.571 -8.344 -12.962 1.00 0.00 H new ATOM 0 HB2 ASN A 11 24.400 -7.507 -11.897 1.00 0.00 H new ATOM 0 HB3 ASN A 11 24.932 -9.176 -11.936 1.00 0.00 H new ATOM 0 HD21 ASN A 11 26.892 -6.304 -14.157 1.00 0.00 H new ATOM 0 HD22 ASN A 11 25.426 -5.939 -13.240 1.00 0.00 H new ATOM 201 N SER A 12 24.279 -8.540 -15.778 1.00 0.00 N ATOM 202 CA SER A 12 24.507 -8.006 -17.113 1.00 0.00 C ATOM 203 C SER A 12 23.335 -8.410 -18.005 1.00 0.00 C ATOM 204 O SER A 12 23.465 -9.278 -18.873 1.00 0.00 O ATOM 205 CB SER A 12 25.885 -8.493 -17.592 1.00 0.00 C ATOM 206 OG SER A 12 26.122 -9.839 -17.196 1.00 0.00 O ATOM 0 H SER A 12 24.753 -9.431 -15.630 1.00 0.00 H new ATOM 0 HA SER A 12 24.539 -6.917 -17.138 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.944 -8.415 -18.678 1.00 0.00 H new ATOM 0 HB3 SER A 12 26.663 -7.849 -17.183 1.00 0.00 H new ATOM 0 HG SER A 12 26.557 -9.850 -16.318 1.00 0.00 H new ATOM 212 N SER A 13 22.152 -7.866 -17.708 1.00 0.00 N ATOM 213 CA SER A 13 20.914 -8.255 -18.358 1.00 0.00 C ATOM 214 C SER A 13 19.904 -7.107 -18.285 1.00 0.00 C ATOM 215 O SER A 13 20.211 -5.999 -17.839 1.00 0.00 O ATOM 216 CB SER A 13 20.398 -9.508 -17.640 1.00 0.00 C ATOM 217 OG SER A 13 19.832 -9.087 -16.417 1.00 0.00 O ATOM 0 H SER A 13 22.034 -7.138 -17.003 1.00 0.00 H new ATOM 0 HA SER A 13 21.071 -8.475 -19.414 1.00 0.00 H new ATOM 0 HB2 SER A 13 19.656 -10.022 -18.250 1.00 0.00 H new ATOM 0 HB3 SER A 13 21.211 -10.213 -17.465 1.00 0.00 H new ATOM 0 HG SER A 13 20.464 -9.257 -15.688 1.00 0.00 H new ATOM 223 N ARG A 14 18.645 -7.428 -18.603 1.00 0.00 N ATOM 224 CA ARG A 14 17.465 -6.578 -18.417 1.00 0.00 C ATOM 225 C ARG A 14 17.331 -6.089 -16.966 1.00 0.00 C ATOM 226 O ARG A 14 16.712 -5.048 -16.757 1.00 0.00 O ATOM 227 CB ARG A 14 16.212 -7.387 -18.829 1.00 0.00 C ATOM 228 CG ARG A 14 16.252 -7.979 -20.235 1.00 0.00 C ATOM 229 CD ARG A 14 15.169 -9.056 -20.359 1.00 0.00 C ATOM 230 NE ARG A 14 15.234 -9.613 -21.705 1.00 0.00 N ATOM 231 CZ ARG A 14 14.898 -10.836 -22.132 1.00 0.00 C ATOM 232 NH1 ARG A 14 14.214 -11.665 -21.355 1.00 0.00 N ATOM 233 NH2 ARG A 14 15.238 -11.212 -23.360 1.00 0.00 N ATOM 0 H ARG A 14 18.411 -8.330 -19.017 1.00 0.00 H new ATOM 0 HA ARG A 14 17.569 -5.690 -19.041 1.00 0.00 H new ATOM 0 HB2 ARG A 14 16.072 -8.198 -18.115 1.00 0.00 H new ATOM 0 HB3 ARG A 14 15.339 -6.739 -18.750 1.00 0.00 H new ATOM 0 HG2 ARG A 14 16.090 -7.197 -20.977 1.00 0.00 H new ATOM 0 HG3 ARG A 14 17.234 -8.409 -20.434 1.00 0.00 H new ATOM 0 HD2 ARG A 14 15.324 -9.838 -19.616 1.00 0.00 H new ATOM 0 HD3 ARG A 14 14.184 -8.628 -20.171 1.00 0.00 H new ATOM 0 HE ARG A 14 15.586 -8.980 -22.424 1.00 0.00 H new ATOM 0 HH11 ARG A 14 13.937 -11.374 -20.418 1.00 0.00 H new ATOM 0 HH12 ARG A 14 13.965 -12.594 -21.695 1.00 0.00 H new ATOM 0 HH21 ARG A 14 15.750 -10.571 -23.966 1.00 0.00 H new ATOM 0 HH22 ARG A 14 14.987 -12.142 -23.696 1.00 0.00 H new ATOM 247 N SER A 15 17.913 -6.781 -15.970 1.00 0.00 N ATOM 248 CA SER A 15 17.884 -6.385 -14.553 1.00 0.00 C ATOM 249 C SER A 15 18.319 -4.930 -14.328 1.00 0.00 C ATOM 250 O SER A 15 17.919 -4.318 -13.343 1.00 0.00 O ATOM 251 CB SER A 15 18.818 -7.308 -13.761 1.00 0.00 C ATOM 252 OG SER A 15 18.436 -8.651 -13.974 1.00 0.00 O ATOM 0 H SER A 15 18.426 -7.648 -16.132 1.00 0.00 H new ATOM 0 HA SER A 15 16.852 -6.472 -14.214 1.00 0.00 H new ATOM 0 HB2 SER A 15 19.851 -7.157 -14.076 1.00 0.00 H new ATOM 0 HB3 SER A 15 18.770 -7.068 -12.699 1.00 0.00 H new ATOM 0 HG SER A 15 18.902 -9.003 -14.761 1.00 0.00 H new ATOM 258 N GLN A 16 19.140 -4.358 -15.218 1.00 0.00 N ATOM 259 CA GLN A 16 19.730 -3.039 -15.004 1.00 0.00 C ATOM 260 C GLN A 16 18.741 -1.874 -15.059 1.00 0.00 C ATOM 261 O GLN A 16 19.031 -0.865 -14.436 1.00 0.00 O ATOM 262 CB GLN A 16 20.905 -2.844 -15.987 1.00 0.00 C ATOM 263 CG GLN A 16 20.466 -2.676 -17.456 1.00 0.00 C ATOM 264 CD GLN A 16 21.631 -2.804 -18.435 1.00 0.00 C ATOM 265 OE1 GLN A 16 22.147 -1.814 -18.930 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.051 -4.014 -18.741 1.00 0.00 N ATOM 0 H GLN A 16 19.410 -4.796 -16.099 1.00 0.00 H new ATOM 0 HA GLN A 16 20.094 -3.020 -13.977 1.00 0.00 H new ATOM 0 HB2 GLN A 16 21.477 -1.966 -15.686 1.00 0.00 H new ATOM 0 HB3 GLN A 16 21.574 -3.701 -15.913 1.00 0.00 H new ATOM 0 HG2 GLN A 16 19.712 -3.426 -17.694 1.00 0.00 H new ATOM 0 HG3 GLN A 16 19.996 -1.701 -17.582 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.608 -4.830 -18.318 1.00 0.00 H new ATOM 0 HE22 GLN A 16 22.819 -4.136 -19.401 1.00 0.00 H new ATOM 275 N MET A 17 17.615 -1.965 -15.781 1.00 0.00 N ATOM 276 CA MET A 17 16.753 -0.806 -16.051 1.00 0.00 C ATOM 277 C MET A 17 15.355 -0.883 -15.438 1.00 0.00 C ATOM 278 O MET A 17 14.802 0.156 -15.094 1.00 0.00 O ATOM 279 CB MET A 17 16.691 -0.626 -17.579 1.00 0.00 C ATOM 280 CG MET A 17 15.936 0.604 -18.120 1.00 0.00 C ATOM 281 SD MET A 17 16.531 2.305 -17.895 1.00 0.00 S ATOM 282 CE MET A 17 16.289 2.744 -16.153 1.00 0.00 C ATOM 0 H MET A 17 17.278 -2.836 -16.191 1.00 0.00 H new ATOM 0 HA MET A 17 17.195 0.062 -15.561 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.713 -0.585 -17.955 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.230 -1.518 -18.004 1.00 0.00 H new ATOM 0 HG2 MET A 17 15.828 0.453 -19.194 1.00 0.00 H new ATOM 0 HG3 MET A 17 14.935 0.567 -17.690 1.00 0.00 H new ATOM 0 HE1 MET A 17 16.433 3.817 -16.025 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.278 2.475 -15.847 1.00 0.00 H new ATOM 0 HE3 MET A 17 17.010 2.205 -15.538 1.00 0.00 H new ATOM 292 N ALA A 18 14.756 -2.068 -15.303 1.00 0.00 N ATOM 293 CA ALA A 18 13.334 -2.176 -14.941 1.00 0.00 C ATOM 294 C ALA A 18 13.044 -1.725 -13.509 1.00 0.00 C ATOM 295 O ALA A 18 12.133 -0.924 -13.312 1.00 0.00 O ATOM 296 CB ALA A 18 12.822 -3.582 -15.289 1.00 0.00 C ATOM 0 H ALA A 18 15.226 -2.963 -15.437 1.00 0.00 H new ATOM 0 HA ALA A 18 12.761 -1.469 -15.541 1.00 0.00 H new ATOM 0 HB1 ALA A 18 11.769 -3.662 -15.021 1.00 0.00 H new ATOM 0 HB2 ALA A 18 12.939 -3.757 -16.358 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.395 -4.325 -14.735 1.00 0.00 H new ATOM 302 N GLU A 19 13.864 -2.112 -12.521 1.00 0.00 N ATOM 303 CA GLU A 19 13.710 -1.551 -11.168 1.00 0.00 C ATOM 304 C GLU A 19 13.984 -0.041 -11.204 1.00 0.00 C ATOM 305 O GLU A 19 13.318 0.733 -10.509 1.00 0.00 O ATOM 306 CB GLU A 19 14.595 -2.293 -10.148 1.00 0.00 C ATOM 307 CG GLU A 19 16.100 -1.973 -10.163 1.00 0.00 C ATOM 308 CD GLU A 19 16.481 -0.626 -9.517 1.00 0.00 C ATOM 309 OE1 GLU A 19 16.027 -0.297 -8.399 1.00 0.00 O ATOM 310 OE2 GLU A 19 17.268 0.130 -10.123 1.00 0.00 O ATOM 0 H GLU A 19 14.619 -2.790 -12.625 1.00 0.00 H new ATOM 0 HA GLU A 19 12.683 -1.696 -10.832 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.213 -2.079 -9.150 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.475 -3.364 -10.312 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.632 -2.771 -9.646 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.447 -1.976 -11.196 1.00 0.00 H new ATOM 317 N GLY A 20 14.918 0.355 -12.080 1.00 0.00 N ATOM 318 CA GLY A 20 15.284 1.728 -12.346 1.00 0.00 C ATOM 319 C GLY A 20 14.061 2.569 -12.634 1.00 0.00 C ATOM 320 O GLY A 20 13.882 3.586 -11.987 1.00 0.00 O ATOM 0 H GLY A 20 15.453 -0.310 -12.639 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.818 2.138 -11.489 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.966 1.768 -13.196 1.00 0.00 H new ATOM 324 N PHE A 21 13.175 2.133 -13.529 1.00 0.00 N ATOM 325 CA PHE A 21 11.963 2.896 -13.808 1.00 0.00 C ATOM 326 C PHE A 21 10.904 2.776 -12.737 1.00 0.00 C ATOM 327 O PHE A 21 10.138 3.720 -12.557 1.00 0.00 O ATOM 328 CB PHE A 21 11.363 2.503 -15.153 1.00 0.00 C ATOM 329 CG PHE A 21 11.854 3.407 -16.243 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.497 4.770 -16.239 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.733 2.893 -17.203 1.00 0.00 C ATOM 332 CE1 PHE A 21 11.973 5.600 -17.272 1.00 0.00 C ATOM 333 CE2 PHE A 21 13.234 3.730 -18.204 1.00 0.00 C ATOM 334 CZ PHE A 21 12.832 5.077 -18.260 1.00 0.00 C ATOM 0 H PHE A 21 13.272 1.270 -14.064 1.00 0.00 H new ATOM 0 HA PHE A 21 12.283 3.938 -13.829 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.626 1.471 -15.385 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.275 2.550 -15.098 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.869 5.171 -15.457 1.00 0.00 H new ATOM 0 HD2 PHE A 21 13.023 1.853 -17.171 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.680 6.639 -17.308 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.929 3.343 -18.934 1.00 0.00 H new ATOM 0 HZ PHE A 21 13.182 5.711 -19.061 1.00 0.00 H new ATOM 344 N ALA A 22 10.798 1.644 -12.047 1.00 0.00 N ATOM 345 CA ALA A 22 9.653 1.443 -11.171 1.00 0.00 C ATOM 346 C ALA A 22 9.690 2.388 -9.973 1.00 0.00 C ATOM 347 O ALA A 22 8.639 2.879 -9.570 1.00 0.00 O ATOM 348 CB ALA A 22 9.586 -0.026 -10.769 1.00 0.00 C ATOM 0 H ALA A 22 11.468 0.876 -12.075 1.00 0.00 H new ATOM 0 HA ALA A 22 8.736 1.690 -11.705 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.731 -0.185 -10.112 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.478 -0.643 -11.661 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.501 -0.302 -10.246 1.00 0.00 H new ATOM 354 N LYS A 23 10.884 2.741 -9.471 1.00 0.00 N ATOM 355 CA LYS A 23 10.996 3.774 -8.427 1.00 0.00 C ATOM 356 C LYS A 23 10.465 5.128 -8.912 1.00 0.00 C ATOM 357 O LYS A 23 9.983 5.909 -8.100 1.00 0.00 O ATOM 358 CB LYS A 23 12.460 3.896 -7.941 1.00 0.00 C ATOM 359 CG LYS A 23 13.353 4.588 -8.997 1.00 0.00 C ATOM 360 CD LYS A 23 14.869 4.316 -8.982 1.00 0.00 C ATOM 361 CE LYS A 23 15.198 2.823 -8.793 1.00 0.00 C ATOM 362 NZ LYS A 23 16.639 2.515 -8.861 1.00 0.00 N ATOM 0 H LYS A 23 11.772 2.335 -9.764 1.00 0.00 H new ATOM 0 HA LYS A 23 10.376 3.465 -7.585 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.489 4.463 -7.011 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.856 2.904 -7.722 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.977 4.308 -9.981 1.00 0.00 H new ATOM 0 HG3 LYS A 23 13.210 5.664 -8.896 1.00 0.00 H new ATOM 0 HD2 LYS A 23 15.307 4.666 -9.917 1.00 0.00 H new ATOM 0 HD3 LYS A 23 15.330 4.891 -8.179 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.812 2.495 -7.828 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.677 2.247 -9.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.784 1.496 -8.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 17.007 2.781 -9.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 17.143 3.050 -8.126 1.00 0.00 H new ATOM 376 N THR A 24 10.544 5.409 -10.214 1.00 0.00 N ATOM 377 CA THR A 24 10.139 6.656 -10.817 1.00 0.00 C ATOM 378 C THR A 24 8.632 6.648 -11.060 1.00 0.00 C ATOM 379 O THR A 24 7.902 7.500 -10.555 1.00 0.00 O ATOM 380 CB THR A 24 11.024 6.856 -12.055 1.00 0.00 C ATOM 381 OG1 THR A 24 12.329 7.192 -11.622 1.00 0.00 O ATOM 382 CG2 THR A 24 10.479 7.883 -13.034 1.00 0.00 C ATOM 0 H THR A 24 10.907 4.741 -10.894 1.00 0.00 H new ATOM 0 HA THR A 24 10.292 7.523 -10.174 1.00 0.00 H new ATOM 0 HB THR A 24 11.040 5.921 -12.615 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.637 7.989 -12.101 1.00 0.00 H new ATOM 0 HG21 THR A 24 11.156 7.971 -13.883 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.497 7.566 -13.385 1.00 0.00 H new ATOM 0 HG23 THR A 24 10.392 8.849 -12.537 1.00 0.00 H new ATOM 390 N LEU A 25 8.157 5.656 -11.810 1.00 0.00 N ATOM 391 CA LEU A 25 6.782 5.611 -12.307 1.00 0.00 C ATOM 392 C LEU A 25 5.805 5.279 -11.181 1.00 0.00 C ATOM 393 O LEU A 25 4.690 5.797 -11.156 1.00 0.00 O ATOM 394 CB LEU A 25 6.679 4.558 -13.423 1.00 0.00 C ATOM 395 CG LEU A 25 7.534 4.865 -14.666 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.562 3.624 -15.558 1.00 0.00 C ATOM 397 CD2 LEU A 25 7.036 6.079 -15.458 1.00 0.00 C ATOM 0 H LEU A 25 8.720 4.854 -12.093 1.00 0.00 H new ATOM 0 HA LEU A 25 6.519 6.592 -12.703 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.978 3.590 -13.021 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.636 4.469 -13.727 1.00 0.00 H new ATOM 0 HG LEU A 25 8.537 5.120 -14.325 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.164 3.826 -16.444 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.995 2.789 -15.007 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.546 3.370 -15.860 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.682 6.241 -16.321 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.016 5.899 -15.797 1.00 0.00 H new ATOM 0 HD23 LEU A 25 7.055 6.962 -14.820 1.00 0.00 H new ATOM 409 N GLY A 26 6.221 4.406 -10.256 1.00 0.00 N ATOM 410 CA GLY A 26 5.384 3.879 -9.184 1.00 0.00 C ATOM 411 C GLY A 26 5.680 4.513 -7.829 1.00 0.00 C ATOM 412 O GLY A 26 5.213 3.979 -6.827 1.00 0.00 O ATOM 0 H GLY A 26 7.173 4.041 -10.236 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.336 4.044 -9.435 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.529 2.801 -9.114 1.00 0.00 H new ATOM 416 N ALA A 27 6.431 5.622 -7.788 1.00 0.00 N ATOM 417 CA ALA A 27 7.000 6.241 -6.589 1.00 0.00 C ATOM 418 C ALA A 27 6.058 6.280 -5.379 1.00 0.00 C ATOM 419 O ALA A 27 6.415 5.811 -4.297 1.00 0.00 O ATOM 420 CB ALA A 27 7.476 7.662 -6.940 1.00 0.00 C ATOM 0 H ALA A 27 6.669 6.136 -8.636 1.00 0.00 H new ATOM 0 HA ALA A 27 7.833 5.609 -6.279 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.902 8.132 -6.054 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.233 7.609 -7.722 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.630 8.252 -7.293 1.00 0.00 H new ATOM 426 N GLY A 28 4.860 6.834 -5.564 1.00 0.00 N ATOM 427 CA GLY A 28 3.876 7.023 -4.498 1.00 0.00 C ATOM 428 C GLY A 28 2.903 5.851 -4.350 1.00 0.00 C ATOM 429 O GLY A 28 1.891 5.992 -3.658 1.00 0.00 O ATOM 0 H GLY A 28 4.541 7.169 -6.473 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.399 7.172 -3.554 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.309 7.933 -4.695 1.00 0.00 H new ATOM 433 N LYS A 29 3.156 4.721 -5.028 1.00 0.00 N ATOM 434 CA LYS A 29 2.202 3.614 -5.159 1.00 0.00 C ATOM 435 C LYS A 29 2.788 2.294 -4.673 1.00 0.00 C ATOM 436 O LYS A 29 2.160 1.593 -3.881 1.00 0.00 O ATOM 437 CB LYS A 29 1.731 3.494 -6.629 1.00 0.00 C ATOM 438 CG LYS A 29 1.313 4.840 -7.242 1.00 0.00 C ATOM 439 CD LYS A 29 0.698 4.668 -8.642 1.00 0.00 C ATOM 440 CE LYS A 29 0.371 6.023 -9.299 1.00 0.00 C ATOM 441 NZ LYS A 29 -0.781 6.731 -8.671 1.00 0.00 N ATOM 0 H LYS A 29 4.041 4.550 -5.506 1.00 0.00 H new ATOM 0 HA LYS A 29 1.345 3.836 -4.524 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.534 3.063 -7.227 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.890 2.802 -6.679 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.592 5.329 -6.587 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.182 5.495 -7.305 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.390 4.115 -9.277 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.212 4.072 -8.568 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.251 6.664 -9.248 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.155 5.862 -10.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.944 7.633 -9.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.633 6.139 -8.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.571 6.916 -7.669 1.00 0.00 H new ATOM 455 N ILE A 30 3.982 1.936 -5.155 1.00 0.00 N ATOM 456 CA ILE A 30 4.578 0.611 -4.977 1.00 0.00 C ATOM 457 C ILE A 30 6.063 0.744 -4.617 1.00 0.00 C ATOM 458 O ILE A 30 6.715 1.716 -4.994 1.00 0.00 O ATOM 459 CB ILE A 30 4.291 -0.239 -6.243 1.00 0.00 C ATOM 460 CG1 ILE A 30 4.966 0.316 -7.520 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.774 -0.355 -6.482 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.709 -0.505 -8.795 1.00 0.00 C ATOM 0 H ILE A 30 4.572 2.573 -5.690 1.00 0.00 H new ATOM 0 HA ILE A 30 4.129 0.080 -4.137 1.00 0.00 H new ATOM 0 HB ILE A 30 4.721 -1.221 -6.048 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.617 1.335 -7.685 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.041 0.371 -7.351 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.591 -0.954 -7.374 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.306 -0.833 -5.621 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.350 0.640 -6.620 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.221 -0.040 -9.637 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.085 -1.519 -8.657 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.638 -0.539 -8.996 1.00 0.00 H new ATOM 474 N ALA A 31 6.583 -0.224 -3.858 1.00 0.00 N ATOM 475 CA ALA A 31 7.899 -0.177 -3.231 1.00 0.00 C ATOM 476 C ALA A 31 8.823 -1.180 -3.913 1.00 0.00 C ATOM 477 O ALA A 31 8.697 -2.378 -3.674 1.00 0.00 O ATOM 478 CB ALA A 31 7.726 -0.500 -1.742 1.00 0.00 C ATOM 0 H ALA A 31 6.080 -1.089 -3.659 1.00 0.00 H new ATOM 0 HA ALA A 31 8.348 0.811 -3.334 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.697 -0.472 -1.248 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.065 0.236 -1.285 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.293 -1.494 -1.633 1.00 0.00 H new ATOM 484 N VAL A 32 9.722 -0.730 -4.785 1.00 0.00 N ATOM 485 CA VAL A 32 10.635 -1.635 -5.472 1.00 0.00 C ATOM 486 C VAL A 32 11.860 -1.899 -4.590 1.00 0.00 C ATOM 487 O VAL A 32 12.512 -0.962 -4.119 1.00 0.00 O ATOM 488 CB VAL A 32 10.930 -1.121 -6.891 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.593 0.263 -6.972 1.00 0.00 C ATOM 490 CG2 VAL A 32 11.789 -2.133 -7.652 1.00 0.00 C ATOM 0 H VAL A 32 9.836 0.253 -5.031 1.00 0.00 H new ATOM 0 HA VAL A 32 10.179 -2.613 -5.627 1.00 0.00 H new ATOM 0 HB VAL A 32 9.947 -1.004 -7.348 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.756 0.528 -8.017 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.944 1.005 -6.507 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.550 0.239 -6.450 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.991 -1.757 -8.655 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.731 -2.281 -7.124 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.258 -3.083 -7.720 1.00 0.00 H new ATOM 500 N THR A 33 12.187 -3.180 -4.430 1.00 0.00 N ATOM 501 CA THR A 33 13.397 -3.682 -3.813 1.00 0.00 C ATOM 502 C THR A 33 13.727 -4.948 -4.602 1.00 0.00 C ATOM 503 O THR A 33 12.929 -5.881 -4.599 1.00 0.00 O ATOM 504 CB THR A 33 13.141 -4.006 -2.327 1.00 0.00 C ATOM 505 OG1 THR A 33 12.494 -2.933 -1.650 1.00 0.00 O ATOM 506 CG2 THR A 33 14.444 -4.341 -1.586 1.00 0.00 C ATOM 0 H THR A 33 11.575 -3.932 -4.748 1.00 0.00 H new ATOM 0 HA THR A 33 14.215 -2.962 -3.835 1.00 0.00 H new ATOM 0 HB THR A 33 12.486 -4.877 -2.320 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.348 -3.178 -0.712 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.222 -4.563 -0.542 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.914 -5.208 -2.050 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.122 -3.489 -1.639 1.00 0.00 H new ATOM 514 N SER A 34 14.857 -4.973 -5.318 1.00 0.00 N ATOM 515 CA SER A 34 15.169 -6.108 -6.191 1.00 0.00 C ATOM 516 C SER A 34 16.363 -6.964 -5.756 1.00 0.00 C ATOM 517 O SER A 34 16.740 -7.885 -6.486 1.00 0.00 O ATOM 518 CB SER A 34 15.209 -5.669 -7.652 1.00 0.00 C ATOM 519 OG SER A 34 13.946 -5.100 -7.987 1.00 0.00 O ATOM 0 H SER A 34 15.559 -4.233 -5.311 1.00 0.00 H new ATOM 0 HA SER A 34 14.342 -6.810 -6.083 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.006 -4.941 -7.807 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.424 -6.520 -8.298 1.00 0.00 H new ATOM 0 HG SER A 34 14.071 -4.170 -8.268 1.00 0.00 H new ATOM 525 N SER A 35 16.906 -6.714 -4.559 1.00 0.00 N ATOM 526 CA SER A 35 17.897 -7.581 -3.924 1.00 0.00 C ATOM 527 C SER A 35 19.085 -7.853 -4.870 1.00 0.00 C ATOM 528 O SER A 35 19.597 -6.920 -5.500 1.00 0.00 O ATOM 529 CB SER A 35 17.183 -8.852 -3.421 1.00 0.00 C ATOM 530 OG SER A 35 15.899 -8.571 -2.887 1.00 0.00 O ATOM 0 H SER A 35 16.665 -5.895 -4.001 1.00 0.00 H new ATOM 0 HA SER A 35 18.342 -7.092 -3.058 1.00 0.00 H new ATOM 0 HB2 SER A 35 17.085 -9.561 -4.243 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.795 -9.332 -2.657 1.00 0.00 H new ATOM 0 HG SER A 35 15.902 -8.739 -1.922 1.00 0.00 H new ATOM 536 N GLY A 36 19.525 -9.110 -4.998 1.00 0.00 N ATOM 537 CA GLY A 36 20.481 -9.546 -5.989 1.00 0.00 C ATOM 538 C GLY A 36 20.548 -11.064 -5.947 1.00 0.00 C ATOM 539 O GLY A 36 20.224 -11.667 -4.920 1.00 0.00 O ATOM 0 H GLY A 36 19.208 -9.865 -4.390 1.00 0.00 H new ATOM 0 HA2 GLY A 36 20.183 -9.206 -6.981 1.00 0.00 H new ATOM 0 HA3 GLY A 36 21.462 -9.116 -5.786 1.00 0.00 H new ATOM 543 N LEU A 37 20.936 -11.686 -7.059 1.00 0.00 N ATOM 544 CA LEU A 37 21.218 -13.107 -7.139 1.00 0.00 C ATOM 545 C LEU A 37 22.724 -13.309 -7.153 1.00 0.00 C ATOM 546 O LEU A 37 23.265 -14.031 -6.318 1.00 0.00 O ATOM 547 CB LEU A 37 20.517 -13.713 -8.367 1.00 0.00 C ATOM 548 CG LEU A 37 19.000 -13.891 -8.178 1.00 0.00 C ATOM 549 CD1 LEU A 37 18.349 -14.195 -9.531 1.00 0.00 C ATOM 550 CD2 LEU A 37 18.686 -15.035 -7.209 1.00 0.00 C ATOM 0 H LEU A 37 21.064 -11.199 -7.946 1.00 0.00 H new ATOM 0 HA LEU A 37 20.823 -13.631 -6.268 1.00 0.00 H new ATOM 0 HB2 LEU A 37 20.695 -13.073 -9.231 1.00 0.00 H new ATOM 0 HB3 LEU A 37 20.964 -14.682 -8.590 1.00 0.00 H new ATOM 0 HG LEU A 37 18.603 -12.965 -7.761 1.00 0.00 H new ATOM 0 HD11 LEU A 37 17.275 -14.321 -9.398 1.00 0.00 H new ATOM 0 HD12 LEU A 37 18.535 -13.369 -10.218 1.00 0.00 H new ATOM 0 HD13 LEU A 37 18.774 -15.111 -9.941 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.606 -15.133 -7.099 1.00 0.00 H new ATOM 0 HD22 LEU A 37 19.096 -15.966 -7.600 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.132 -14.822 -6.238 1.00 0.00 H new ATOM 562 N GLU A 38 23.395 -12.585 -8.050 1.00 0.00 N ATOM 563 CA GLU A 38 24.839 -12.447 -8.110 1.00 0.00 C ATOM 564 C GLU A 38 25.140 -10.967 -8.214 1.00 0.00 C ATOM 565 O GLU A 38 25.476 -10.402 -9.255 1.00 0.00 O ATOM 566 CB GLU A 38 25.436 -13.277 -9.229 1.00 0.00 C ATOM 567 CG GLU A 38 25.637 -14.691 -8.693 1.00 0.00 C ATOM 568 CD GLU A 38 26.350 -15.600 -9.708 1.00 0.00 C ATOM 569 OE1 GLU A 38 27.604 -15.644 -9.710 1.00 0.00 O ATOM 570 OE2 GLU A 38 25.662 -16.288 -10.501 1.00 0.00 O ATOM 0 H GLU A 38 22.920 -12.059 -8.783 1.00 0.00 H new ATOM 0 HA GLU A 38 25.311 -12.841 -7.210 1.00 0.00 H new ATOM 0 HB2 GLU A 38 24.774 -13.286 -10.095 1.00 0.00 H new ATOM 0 HB3 GLU A 38 26.385 -12.853 -9.557 1.00 0.00 H new ATOM 0 HG2 GLU A 38 26.220 -14.650 -7.773 1.00 0.00 H new ATOM 0 HG3 GLU A 38 24.669 -15.122 -8.438 1.00 0.00 H new ATOM 577 N SER A 39 24.896 -10.374 -7.059 1.00 0.00 N ATOM 578 CA SER A 39 24.931 -8.974 -6.670 1.00 0.00 C ATOM 579 C SER A 39 24.051 -8.012 -7.444 1.00 0.00 C ATOM 580 O SER A 39 23.565 -7.049 -6.855 1.00 0.00 O ATOM 581 CB SER A 39 26.371 -8.474 -6.610 1.00 0.00 C ATOM 582 OG SER A 39 27.206 -9.361 -5.866 1.00 0.00 O ATOM 0 H SER A 39 24.631 -10.947 -6.258 1.00 0.00 H new ATOM 0 HA SER A 39 24.476 -8.973 -5.680 1.00 0.00 H new ATOM 0 HB2 SER A 39 26.762 -8.368 -7.622 1.00 0.00 H new ATOM 0 HB3 SER A 39 26.394 -7.484 -6.154 1.00 0.00 H new ATOM 0 HG SER A 39 28.121 -9.011 -5.849 1.00 0.00 H new ATOM 588 N SER A 40 23.806 -8.261 -8.727 1.00 0.00 N ATOM 589 CA SER A 40 22.797 -7.561 -9.497 1.00 0.00 C ATOM 590 C SER A 40 22.985 -6.038 -9.625 1.00 0.00 C ATOM 591 O SER A 40 22.032 -5.306 -9.898 1.00 0.00 O ATOM 592 CB SER A 40 21.471 -8.002 -8.898 1.00 0.00 C ATOM 593 OG SER A 40 21.338 -9.418 -9.045 1.00 0.00 O ATOM 0 H SER A 40 24.313 -8.965 -9.263 1.00 0.00 H new ATOM 0 HA SER A 40 22.865 -7.831 -10.551 1.00 0.00 H new ATOM 0 HB2 SER A 40 21.425 -7.728 -7.844 1.00 0.00 H new ATOM 0 HB3 SER A 40 20.646 -7.493 -9.396 1.00 0.00 H new ATOM 0 HG SER A 40 20.389 -9.651 -9.124 1.00 0.00 H new ATOM 599 N ARG A 41 24.221 -5.551 -9.466 1.00 0.00 N ATOM 600 CA ARG A 41 24.570 -4.163 -9.793 1.00 0.00 C ATOM 601 C ARG A 41 24.569 -4.033 -11.326 1.00 0.00 C ATOM 602 O ARG A 41 24.328 -4.994 -12.052 1.00 0.00 O ATOM 603 CB ARG A 41 25.914 -3.721 -9.174 1.00 0.00 C ATOM 604 CG ARG A 41 25.806 -2.317 -8.549 1.00 0.00 C ATOM 605 CD ARG A 41 27.091 -1.902 -7.828 1.00 0.00 C ATOM 606 NE ARG A 41 26.936 -0.568 -7.224 1.00 0.00 N ATOM 607 CZ ARG A 41 27.845 0.080 -6.486 1.00 0.00 C ATOM 608 NH1 ARG A 41 29.047 -0.452 -6.271 1.00 0.00 N ATOM 609 NH2 ARG A 41 27.548 1.270 -5.969 1.00 0.00 N ATOM 0 H ARG A 41 25.002 -6.102 -9.110 1.00 0.00 H new ATOM 0 HA ARG A 41 23.831 -3.491 -9.357 1.00 0.00 H new ATOM 0 HB2 ARG A 41 26.220 -4.438 -8.412 1.00 0.00 H new ATOM 0 HB3 ARG A 41 26.688 -3.722 -9.941 1.00 0.00 H new ATOM 0 HG2 ARG A 41 25.579 -1.591 -9.329 1.00 0.00 H new ATOM 0 HG3 ARG A 41 24.974 -2.298 -7.845 1.00 0.00 H new ATOM 0 HD2 ARG A 41 27.333 -2.632 -7.055 1.00 0.00 H new ATOM 0 HD3 ARG A 41 27.924 -1.895 -8.532 1.00 0.00 H new ATOM 0 HE ARG A 41 26.049 -0.091 -7.384 1.00 0.00 H new ATOM 0 HH11 ARG A 41 29.281 -1.361 -6.670 1.00 0.00 H new ATOM 0 HH12 ARG A 41 29.733 0.050 -5.707 1.00 0.00 H new ATOM 0 HH21 ARG A 41 26.631 1.684 -6.136 1.00 0.00 H new ATOM 0 HH22 ARG A 41 28.237 1.768 -5.406 1.00 0.00 H new ATOM 623 N VAL A 42 24.883 -2.850 -11.835 1.00 0.00 N ATOM 624 CA VAL A 42 24.716 -2.485 -13.236 1.00 0.00 C ATOM 625 C VAL A 42 26.046 -2.007 -13.852 1.00 0.00 C ATOM 626 O VAL A 42 27.097 -2.103 -13.215 1.00 0.00 O ATOM 627 CB VAL A 42 23.576 -1.453 -13.265 1.00 0.00 C ATOM 628 CG1 VAL A 42 22.316 -1.956 -12.543 1.00 0.00 C ATOM 629 CG2 VAL A 42 24.009 -0.126 -12.639 1.00 0.00 C ATOM 0 H VAL A 42 25.272 -2.096 -11.269 1.00 0.00 H new ATOM 0 HA VAL A 42 24.442 -3.332 -13.865 1.00 0.00 H new ATOM 0 HB VAL A 42 23.336 -1.300 -14.317 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.540 -1.192 -12.591 1.00 0.00 H new ATOM 0 HG12 VAL A 42 21.959 -2.866 -13.025 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.554 -2.167 -11.500 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.180 0.581 -12.676 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.300 -0.291 -11.602 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.856 0.279 -13.193 1.00 0.00 H new ATOM 639 N HIS A 43 25.986 -1.494 -15.090 1.00 0.00 N ATOM 640 CA HIS A 43 27.143 -1.140 -15.913 1.00 0.00 C ATOM 641 C HIS A 43 27.230 0.380 -16.116 1.00 0.00 C ATOM 642 O HIS A 43 26.199 1.056 -16.042 1.00 0.00 O ATOM 643 CB HIS A 43 27.039 -1.938 -17.226 1.00 0.00 C ATOM 644 CG HIS A 43 27.210 -3.416 -16.968 1.00 0.00 C ATOM 645 ND1 HIS A 43 28.408 -4.084 -16.838 1.00 0.00 N ATOM 646 CD2 HIS A 43 26.215 -4.300 -16.649 1.00 0.00 C ATOM 647 CE1 HIS A 43 28.140 -5.339 -16.443 1.00 0.00 C ATOM 648 NE2 HIS A 43 26.815 -5.513 -16.293 1.00 0.00 N ATOM 0 H HIS A 43 25.099 -1.309 -15.558 1.00 0.00 H new ATOM 0 HA HIS A 43 28.078 -1.408 -15.420 1.00 0.00 H new ATOM 0 HB2 HIS A 43 26.071 -1.755 -17.693 1.00 0.00 H new ATOM 0 HB3 HIS A 43 27.801 -1.596 -17.927 1.00 0.00 H new ATOM 0 HD1 HIS A 43 29.335 -3.694 -17.011 1.00 0.00 H new ATOM 0 HD2 HIS A 43 25.154 -4.097 -16.669 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.884 -6.102 -16.270 1.00 0.00 H new ATOM 656 N PRO A 44 28.422 0.936 -16.408 1.00 0.00 N ATOM 657 CA PRO A 44 28.653 2.383 -16.499 1.00 0.00 C ATOM 658 C PRO A 44 27.743 3.060 -17.521 1.00 0.00 C ATOM 659 O PRO A 44 27.087 4.055 -17.208 1.00 0.00 O ATOM 660 CB PRO A 44 30.129 2.536 -16.898 1.00 0.00 C ATOM 661 CG PRO A 44 30.462 1.196 -17.558 1.00 0.00 C ATOM 662 CD PRO A 44 29.678 0.238 -16.672 1.00 0.00 C ATOM 0 HA PRO A 44 28.426 2.868 -15.549 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.274 3.369 -17.586 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.762 2.724 -16.031 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.138 1.156 -18.598 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.531 0.986 -17.549 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.506 -0.715 -17.172 1.00 0.00 H new ATOM 0 HD3 PRO A 44 30.214 0.021 -15.748 1.00 0.00 H new ATOM 670 N THR A 45 27.655 2.504 -18.729 1.00 0.00 N ATOM 671 CA THR A 45 26.873 3.093 -19.808 1.00 0.00 C ATOM 672 C THR A 45 25.380 3.022 -19.477 1.00 0.00 C ATOM 673 O THR A 45 24.648 3.944 -19.835 1.00 0.00 O ATOM 674 CB THR A 45 27.252 2.432 -21.140 1.00 0.00 C ATOM 675 OG1 THR A 45 28.656 2.202 -21.185 1.00 0.00 O ATOM 676 CG2 THR A 45 26.832 3.288 -22.340 1.00 0.00 C ATOM 0 H THR A 45 28.124 1.635 -18.984 1.00 0.00 H new ATOM 0 HA THR A 45 27.103 4.153 -19.915 1.00 0.00 H new ATOM 0 HB THR A 45 26.719 1.483 -21.201 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.891 1.778 -22.037 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.118 2.785 -23.264 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.752 3.431 -22.325 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.327 4.258 -22.286 1.00 0.00 H new ATOM 684 N ALA A 46 24.940 2.010 -18.707 1.00 0.00 N ATOM 685 CA ALA A 46 23.577 1.988 -18.200 1.00 0.00 C ATOM 686 C ALA A 46 23.370 3.219 -17.359 1.00 0.00 C ATOM 687 O ALA A 46 22.494 4.009 -17.665 1.00 0.00 O ATOM 688 CB ALA A 46 23.260 0.719 -17.385 1.00 0.00 C ATOM 0 H ALA A 46 25.510 1.210 -18.431 1.00 0.00 H new ATOM 0 HA ALA A 46 22.894 1.977 -19.050 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.229 0.760 -17.034 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.394 -0.161 -18.015 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.933 0.658 -16.530 1.00 0.00 H new ATOM 694 N ILE A 47 24.205 3.421 -16.345 1.00 0.00 N ATOM 695 CA ILE A 47 23.976 4.507 -15.398 1.00 0.00 C ATOM 696 C ILE A 47 23.978 5.823 -16.162 1.00 0.00 C ATOM 697 O ILE A 47 23.129 6.657 -15.887 1.00 0.00 O ATOM 698 CB ILE A 47 25.044 4.500 -14.283 1.00 0.00 C ATOM 699 CG1 ILE A 47 24.965 3.203 -13.452 1.00 0.00 C ATOM 700 CG2 ILE A 47 24.882 5.717 -13.355 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.268 2.887 -12.708 1.00 0.00 C ATOM 0 H ILE A 47 25.034 2.857 -16.159 1.00 0.00 H new ATOM 0 HA ILE A 47 23.010 4.375 -14.910 1.00 0.00 H new ATOM 0 HB ILE A 47 26.020 4.552 -14.766 1.00 0.00 H new ATOM 0 HG12 ILE A 47 24.153 3.290 -12.730 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.718 2.370 -14.111 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.647 5.687 -12.579 1.00 0.00 H new ATOM 0 HG22 ILE A 47 24.989 6.634 -13.935 1.00 0.00 H new ATOM 0 HG23 ILE A 47 23.895 5.693 -12.893 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.149 1.963 -12.142 1.00 0.00 H new ATOM 0 HD12 ILE A 47 27.078 2.770 -13.427 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.504 3.703 -12.025 1.00 0.00 H new ATOM 713 N ALA A 48 24.853 5.998 -17.154 1.00 0.00 N ATOM 714 CA ALA A 48 24.910 7.230 -17.920 1.00 0.00 C ATOM 715 C ALA A 48 23.598 7.475 -18.670 1.00 0.00 C ATOM 716 O ALA A 48 23.032 8.560 -18.566 1.00 0.00 O ATOM 717 CB ALA A 48 26.102 7.193 -18.883 1.00 0.00 C ATOM 0 H ALA A 48 25.533 5.294 -17.442 1.00 0.00 H new ATOM 0 HA ALA A 48 25.049 8.063 -17.230 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.138 8.121 -19.454 1.00 0.00 H new ATOM 0 HB2 ALA A 48 27.025 7.081 -18.315 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.992 6.351 -19.566 1.00 0.00 H new ATOM 723 N MET A 49 23.086 6.480 -19.398 1.00 0.00 N ATOM 724 CA MET A 49 21.869 6.642 -20.195 1.00 0.00 C ATOM 725 C MET A 49 20.647 6.741 -19.278 1.00 0.00 C ATOM 726 O MET A 49 19.692 7.486 -19.516 1.00 0.00 O ATOM 727 CB MET A 49 21.755 5.480 -21.188 1.00 0.00 C ATOM 728 CG MET A 49 22.938 5.442 -22.172 1.00 0.00 C ATOM 729 SD MET A 49 23.131 6.882 -23.247 1.00 0.00 S ATOM 730 CE MET A 49 24.611 7.580 -22.473 1.00 0.00 C ATOM 0 H MET A 49 23.499 5.549 -19.452 1.00 0.00 H new ATOM 0 HA MET A 49 21.916 7.569 -20.766 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.709 4.539 -20.640 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.823 5.570 -21.746 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.856 5.318 -21.598 1.00 0.00 H new ATOM 0 HG3 MET A 49 22.832 4.558 -22.800 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.900 8.491 -22.997 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.400 7.813 -21.429 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.425 6.857 -22.526 1.00 0.00 H new ATOM 740 N MET A 50 20.687 6.025 -18.169 1.00 0.00 N ATOM 741 CA MET A 50 19.594 6.002 -17.231 1.00 0.00 C ATOM 742 C MET A 50 19.593 7.346 -16.496 1.00 0.00 C ATOM 743 O MET A 50 18.529 7.889 -16.235 1.00 0.00 O ATOM 744 CB MET A 50 19.690 4.760 -16.341 1.00 0.00 C ATOM 745 CG MET A 50 19.677 3.393 -17.079 1.00 0.00 C ATOM 746 SD MET A 50 19.496 3.264 -18.898 1.00 0.00 S ATOM 747 CE MET A 50 19.565 1.449 -19.137 1.00 0.00 C ATOM 0 H MET A 50 21.481 5.445 -17.899 1.00 0.00 H new ATOM 0 HA MET A 50 18.623 5.905 -17.716 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.607 4.826 -15.756 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.860 4.778 -15.635 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.608 2.889 -16.821 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.867 2.809 -16.642 1.00 0.00 H new ATOM 0 HE1 MET A 50 18.825 1.151 -19.880 1.00 0.00 H new ATOM 0 HE2 MET A 50 20.559 1.165 -19.481 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.351 0.949 -18.192 1.00 0.00 H new ATOM 757 N GLU A 51 20.752 7.969 -16.296 1.00 0.00 N ATOM 758 CA GLU A 51 20.870 9.330 -15.812 1.00 0.00 C ATOM 759 C GLU A 51 20.471 10.332 -16.894 1.00 0.00 C ATOM 760 O GLU A 51 20.154 11.472 -16.551 1.00 0.00 O ATOM 761 CB GLU A 51 22.276 9.622 -15.272 1.00 0.00 C ATOM 762 CG GLU A 51 22.500 9.017 -13.878 1.00 0.00 C ATOM 763 CD GLU A 51 21.976 9.932 -12.751 1.00 0.00 C ATOM 764 OE1 GLU A 51 20.768 10.261 -12.712 1.00 0.00 O ATOM 765 OE2 GLU A 51 22.789 10.334 -11.882 1.00 0.00 O ATOM 0 H GLU A 51 21.653 7.525 -16.472 1.00 0.00 H new ATOM 0 HA GLU A 51 20.177 9.442 -14.978 1.00 0.00 H new ATOM 0 HB2 GLU A 51 23.019 9.223 -15.963 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.429 10.700 -15.227 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.000 8.050 -13.820 1.00 0.00 H new ATOM 0 HG3 GLU A 51 23.565 8.835 -13.730 1.00 0.00 H new ATOM 772 N GLU A 52 20.420 9.944 -18.177 1.00 0.00 N ATOM 773 CA GLU A 52 19.810 10.821 -19.178 1.00 0.00 C ATOM 774 C GLU A 52 18.319 10.964 -18.864 1.00 0.00 C ATOM 775 O GLU A 52 17.770 12.059 -19.005 1.00 0.00 O ATOM 776 CB GLU A 52 19.954 10.388 -20.648 1.00 0.00 C ATOM 777 CG GLU A 52 21.380 10.354 -21.186 1.00 0.00 C ATOM 778 CD GLU A 52 21.418 9.995 -22.683 1.00 0.00 C ATOM 779 OE1 GLU A 52 20.606 9.159 -23.159 1.00 0.00 O ATOM 780 OE2 GLU A 52 22.270 10.569 -23.402 1.00 0.00 O ATOM 0 H GLU A 52 20.781 9.059 -18.534 1.00 0.00 H new ATOM 0 HA GLU A 52 20.362 11.757 -19.099 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.518 9.395 -20.760 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.367 11.066 -21.267 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.849 11.326 -21.033 1.00 0.00 H new ATOM 0 HG3 GLU A 52 21.964 9.626 -20.623 1.00 0.00 H new ATOM 787 N VAL A 53 17.678 9.883 -18.393 1.00 0.00 N ATOM 788 CA VAL A 53 16.310 9.975 -17.854 1.00 0.00 C ATOM 789 C VAL A 53 16.313 10.353 -16.350 1.00 0.00 C ATOM 790 O VAL A 53 15.264 10.394 -15.709 1.00 0.00 O ATOM 791 CB VAL A 53 15.448 8.769 -18.298 1.00 0.00 C ATOM 792 CG1 VAL A 53 15.841 7.443 -17.641 1.00 0.00 C ATOM 793 CG2 VAL A 53 13.937 8.993 -18.132 1.00 0.00 C ATOM 0 H VAL A 53 18.078 8.945 -18.374 1.00 0.00 H new ATOM 0 HA VAL A 53 15.783 10.818 -18.301 1.00 0.00 H new ATOM 0 HB VAL A 53 15.667 8.693 -19.363 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.189 6.649 -18.005 1.00 0.00 H new ATOM 0 HG12 VAL A 53 16.875 7.206 -17.890 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.739 7.529 -16.559 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.399 8.105 -18.464 1.00 0.00 H new ATOM 0 HG22 VAL A 53 13.711 9.184 -17.083 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.628 9.849 -18.731 1.00 0.00 H new ATOM 803 N GLY A 54 17.478 10.691 -15.784 1.00 0.00 N ATOM 804 CA GLY A 54 17.637 11.154 -14.412 1.00 0.00 C ATOM 805 C GLY A 54 17.429 10.048 -13.372 1.00 0.00 C ATOM 806 O GLY A 54 17.051 10.346 -12.237 1.00 0.00 O ATOM 0 H GLY A 54 18.362 10.646 -16.291 1.00 0.00 H new ATOM 0 HA2 GLY A 54 18.635 11.574 -14.291 1.00 0.00 H new ATOM 0 HA3 GLY A 54 16.927 11.959 -14.223 1.00 0.00 H new ATOM 810 N ILE A 55 17.607 8.782 -13.759 1.00 0.00 N ATOM 811 CA ILE A 55 17.291 7.620 -12.937 1.00 0.00 C ATOM 812 C ILE A 55 18.548 6.981 -12.341 1.00 0.00 C ATOM 813 O ILE A 55 19.544 6.741 -13.027 1.00 0.00 O ATOM 814 CB ILE A 55 16.405 6.638 -13.728 1.00 0.00 C ATOM 815 CG1 ILE A 55 14.977 7.229 -13.810 1.00 0.00 C ATOM 816 CG2 ILE A 55 16.409 5.210 -13.159 1.00 0.00 C ATOM 817 CD1 ILE A 55 13.901 6.232 -14.233 1.00 0.00 C ATOM 0 H ILE A 55 17.984 8.535 -14.674 1.00 0.00 H new ATOM 0 HA ILE A 55 16.710 7.943 -12.073 1.00 0.00 H new ATOM 0 HB ILE A 55 16.821 6.529 -14.729 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.711 7.639 -12.836 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.982 8.060 -14.515 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.764 4.575 -13.766 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.425 4.815 -13.174 1.00 0.00 H new ATOM 0 HG23 ILE A 55 16.041 5.226 -12.133 1.00 0.00 H new ATOM 0 HD11 ILE A 55 12.933 6.732 -14.264 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.138 5.839 -15.222 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.863 5.412 -13.516 1.00 0.00 H new ATOM 829 N ASP A 56 18.436 6.631 -11.055 1.00 0.00 N ATOM 830 CA ASP A 56 19.398 5.807 -10.332 1.00 0.00 C ATOM 831 C ASP A 56 19.182 4.341 -10.709 1.00 0.00 C ATOM 832 O ASP A 56 18.041 3.881 -10.752 1.00 0.00 O ATOM 833 CB ASP A 56 19.200 5.951 -8.809 1.00 0.00 C ATOM 834 CG ASP A 56 19.594 4.665 -8.046 1.00 0.00 C ATOM 835 OD1 ASP A 56 20.807 4.357 -7.976 1.00 0.00 O ATOM 836 OD2 ASP A 56 18.676 3.941 -7.584 1.00 0.00 O ATOM 0 H ASP A 56 17.649 6.924 -10.476 1.00 0.00 H new ATOM 0 HA ASP A 56 20.404 6.132 -10.597 1.00 0.00 H new ATOM 0 HB2 ASP A 56 19.798 6.786 -8.444 1.00 0.00 H new ATOM 0 HB3 ASP A 56 18.157 6.190 -8.601 1.00 0.00 H new ATOM 841 N ILE A 57 20.272 3.609 -10.933 1.00 0.00 N ATOM 842 CA ILE A 57 20.294 2.149 -11.062 1.00 0.00 C ATOM 843 C ILE A 57 21.580 1.611 -10.419 1.00 0.00 C ATOM 844 O ILE A 57 21.607 0.492 -9.917 1.00 0.00 O ATOM 845 CB ILE A 57 20.127 1.675 -12.520 1.00 0.00 C ATOM 846 CG1 ILE A 57 21.084 2.371 -13.502 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.682 1.845 -12.999 1.00 0.00 C ATOM 848 CD1 ILE A 57 21.315 1.511 -14.742 1.00 0.00 C ATOM 0 H ILE A 57 21.196 4.028 -11.033 1.00 0.00 H new ATOM 0 HA ILE A 57 19.433 1.741 -10.533 1.00 0.00 H new ATOM 0 HB ILE A 57 20.386 0.616 -12.513 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.671 3.336 -13.796 1.00 0.00 H new ATOM 0 HG13 ILE A 57 22.036 2.569 -13.009 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.598 1.502 -14.030 1.00 0.00 H new ATOM 0 HG22 ILE A 57 18.017 1.258 -12.366 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.401 2.897 -12.943 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.995 2.026 -15.420 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.751 0.556 -14.447 1.00 0.00 H new ATOM 0 HD13 ILE A 57 20.364 1.336 -15.245 1.00 0.00 H new ATOM 860 N SER A 58 22.633 2.430 -10.399 1.00 0.00 N ATOM 861 CA SER A 58 23.900 2.293 -9.691 1.00 0.00 C ATOM 862 C SER A 58 23.739 1.732 -8.269 1.00 0.00 C ATOM 863 O SER A 58 24.519 0.877 -7.848 1.00 0.00 O ATOM 864 CB SER A 58 24.546 3.701 -9.642 1.00 0.00 C ATOM 865 OG SER A 58 23.886 4.634 -10.501 1.00 0.00 O ATOM 0 H SER A 58 22.613 3.296 -10.937 1.00 0.00 H new ATOM 0 HA SER A 58 24.527 1.576 -10.221 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.521 4.074 -8.618 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.595 3.627 -9.929 1.00 0.00 H new ATOM 0 HG SER A 58 24.326 5.507 -10.436 1.00 0.00 H new ATOM 871 N GLY A 59 22.717 2.184 -7.543 1.00 0.00 N ATOM 872 CA GLY A 59 22.436 1.810 -6.162 1.00 0.00 C ATOM 873 C GLY A 59 21.581 0.547 -6.010 1.00 0.00 C ATOM 874 O GLY A 59 20.951 0.384 -4.963 1.00 0.00 O ATOM 0 H GLY A 59 22.037 2.846 -7.917 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.381 1.660 -5.640 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.928 2.639 -5.670 1.00 0.00 H new ATOM 878 N GLN A 60 21.502 -0.333 -7.024 1.00 0.00 N ATOM 879 CA GLN A 60 20.666 -1.536 -6.942 1.00 0.00 C ATOM 880 C GLN A 60 21.076 -2.456 -5.791 1.00 0.00 C ATOM 881 O GLN A 60 20.228 -3.141 -5.218 1.00 0.00 O ATOM 882 CB GLN A 60 20.723 -2.366 -8.244 1.00 0.00 C ATOM 883 CG GLN A 60 19.310 -2.509 -8.813 1.00 0.00 C ATOM 884 CD GLN A 60 19.203 -3.538 -9.938 1.00 0.00 C ATOM 885 OE1 GLN A 60 18.885 -4.700 -9.707 1.00 0.00 O ATOM 886 NE2 GLN A 60 19.399 -3.127 -11.182 1.00 0.00 N ATOM 0 H GLN A 60 22.006 -0.231 -7.905 1.00 0.00 H new ATOM 0 HA GLN A 60 19.654 -1.167 -6.773 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.373 -1.879 -8.971 1.00 0.00 H new ATOM 0 HB3 GLN A 60 21.148 -3.349 -8.044 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.631 -2.791 -8.009 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.978 -1.540 -9.186 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.663 -2.159 -11.364 1.00 0.00 H new ATOM 0 HE22 GLN A 60 19.286 -3.779 -11.958 1.00 0.00 H new ATOM 895 N THR A 61 22.376 -2.520 -5.518 1.00 0.00 N ATOM 896 CA THR A 61 22.964 -3.470 -4.595 1.00 0.00 C ATOM 897 C THR A 61 22.496 -3.163 -3.162 1.00 0.00 C ATOM 898 O THR A 61 22.531 -2.004 -2.732 1.00 0.00 O ATOM 899 CB THR A 61 24.498 -3.436 -4.755 1.00 0.00 C ATOM 900 OG1 THR A 61 24.953 -2.183 -5.245 1.00 0.00 O ATOM 901 CG2 THR A 61 24.974 -4.505 -5.730 1.00 0.00 C ATOM 0 H THR A 61 23.061 -1.896 -5.945 1.00 0.00 H new ATOM 0 HA THR A 61 22.635 -4.485 -4.816 1.00 0.00 H new ATOM 0 HB THR A 61 24.906 -3.615 -3.760 1.00 0.00 H new ATOM 0 HG1 THR A 61 25.929 -2.200 -5.331 1.00 0.00 H new ATOM 0 HG21 THR A 61 26.059 -4.456 -5.822 1.00 0.00 H new ATOM 0 HG22 THR A 61 24.685 -5.489 -5.361 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.519 -4.336 -6.706 1.00 0.00 H new ATOM 909 N SER A 62 22.066 -4.192 -2.422 1.00 0.00 N ATOM 910 CA SER A 62 21.549 -4.044 -1.065 1.00 0.00 C ATOM 911 C SER A 62 21.812 -5.322 -0.263 1.00 0.00 C ATOM 912 O SER A 62 22.671 -5.335 0.624 1.00 0.00 O ATOM 913 CB SER A 62 20.054 -3.671 -1.115 1.00 0.00 C ATOM 914 OG SER A 62 19.320 -4.519 -1.995 1.00 0.00 O ATOM 0 H SER A 62 22.069 -5.156 -2.755 1.00 0.00 H new ATOM 0 HA SER A 62 22.067 -3.233 -0.553 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.631 -3.736 -0.113 1.00 0.00 H new ATOM 0 HB3 SER A 62 19.950 -2.635 -1.439 1.00 0.00 H new ATOM 0 HG SER A 62 18.377 -4.251 -1.997 1.00 0.00 H new ATOM 920 N ASP A 63 21.124 -6.408 -0.617 1.00 0.00 N ATOM 921 CA ASP A 63 21.177 -7.708 0.048 1.00 0.00 C ATOM 922 C ASP A 63 20.873 -8.797 -0.985 1.00 0.00 C ATOM 923 O ASP A 63 20.202 -8.511 -1.983 1.00 0.00 O ATOM 924 CB ASP A 63 20.143 -7.785 1.185 1.00 0.00 C ATOM 925 CG ASP A 63 20.714 -7.310 2.530 1.00 0.00 C ATOM 926 OD1 ASP A 63 21.599 -8.000 3.093 1.00 0.00 O ATOM 927 OD2 ASP A 63 20.264 -6.257 3.045 1.00 0.00 O ATOM 0 H ASP A 63 20.485 -6.404 -1.412 1.00 0.00 H new ATOM 0 HA ASP A 63 22.170 -7.849 0.476 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.277 -7.176 0.926 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.793 -8.812 1.285 1.00 0.00 H new ATOM 932 N PRO A 64 21.325 -10.046 -0.773 1.00 0.00 N ATOM 933 CA PRO A 64 20.926 -11.169 -1.610 1.00 0.00 C ATOM 934 C PRO A 64 19.422 -11.427 -1.468 1.00 0.00 C ATOM 935 O PRO A 64 18.828 -11.130 -0.430 1.00 0.00 O ATOM 936 CB PRO A 64 21.761 -12.356 -1.117 1.00 0.00 C ATOM 937 CG PRO A 64 21.985 -12.031 0.362 1.00 0.00 C ATOM 938 CD PRO A 64 22.132 -10.510 0.348 1.00 0.00 C ATOM 0 HA PRO A 64 21.100 -10.985 -2.670 1.00 0.00 H new ATOM 0 HB2 PRO A 64 21.234 -13.301 -1.247 1.00 0.00 H new ATOM 0 HB3 PRO A 64 22.703 -12.439 -1.659 1.00 0.00 H new ATOM 0 HG2 PRO A 64 21.146 -12.352 0.980 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.876 -12.521 0.755 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.787 -10.075 1.286 1.00 0.00 H new ATOM 0 HD3 PRO A 64 23.175 -10.219 0.226 1.00 0.00 H new ATOM 946 N ILE A 65 18.811 -12.056 -2.475 1.00 0.00 N ATOM 947 CA ILE A 65 17.383 -12.390 -2.463 1.00 0.00 C ATOM 948 C ILE A 65 17.018 -13.265 -1.252 1.00 0.00 C ATOM 949 O ILE A 65 15.901 -13.212 -0.742 1.00 0.00 O ATOM 950 CB ILE A 65 17.018 -13.057 -3.809 1.00 0.00 C ATOM 951 CG1 ILE A 65 15.514 -12.902 -4.095 1.00 0.00 C ATOM 952 CG2 ILE A 65 17.476 -14.529 -3.888 1.00 0.00 C ATOM 953 CD1 ILE A 65 15.095 -13.346 -5.503 1.00 0.00 C ATOM 0 H ILE A 65 19.293 -12.349 -3.325 1.00 0.00 H new ATOM 0 HA ILE A 65 16.794 -11.480 -2.355 1.00 0.00 H new ATOM 0 HB ILE A 65 17.568 -12.536 -4.593 1.00 0.00 H new ATOM 0 HG12 ILE A 65 14.954 -13.482 -3.361 1.00 0.00 H new ATOM 0 HG13 ILE A 65 15.235 -11.858 -3.957 1.00 0.00 H new ATOM 0 HG21 ILE A 65 17.193 -14.947 -4.854 1.00 0.00 H new ATOM 0 HG22 ILE A 65 18.559 -14.580 -3.773 1.00 0.00 H new ATOM 0 HG23 ILE A 65 17.000 -15.101 -3.092 1.00 0.00 H new ATOM 0 HD11 ILE A 65 14.021 -13.205 -5.624 1.00 0.00 H new ATOM 0 HD12 ILE A 65 15.626 -12.750 -6.245 1.00 0.00 H new ATOM 0 HD13 ILE A 65 15.340 -14.399 -5.641 1.00 0.00 H new ATOM 965 N GLU A 66 17.987 -14.050 -0.772 1.00 0.00 N ATOM 966 CA GLU A 66 17.857 -15.012 0.288 1.00 0.00 C ATOM 967 C GLU A 66 17.557 -14.310 1.628 1.00 0.00 C ATOM 968 O GLU A 66 16.957 -14.897 2.532 1.00 0.00 O ATOM 969 CB GLU A 66 19.215 -15.732 0.283 1.00 0.00 C ATOM 970 CG GLU A 66 19.460 -16.541 1.540 1.00 0.00 C ATOM 971 CD GLU A 66 20.708 -17.435 1.429 1.00 0.00 C ATOM 972 OE1 GLU A 66 21.830 -16.957 1.733 1.00 0.00 O ATOM 973 OE2 GLU A 66 20.576 -18.625 1.056 1.00 0.00 O ATOM 0 H GLU A 66 18.935 -14.016 -1.147 1.00 0.00 H new ATOM 0 HA GLU A 66 17.030 -15.708 0.152 1.00 0.00 H new ATOM 0 HB2 GLU A 66 19.267 -16.392 -0.583 1.00 0.00 H new ATOM 0 HB3 GLU A 66 20.010 -14.995 0.171 1.00 0.00 H new ATOM 0 HG2 GLU A 66 19.575 -15.865 2.387 1.00 0.00 H new ATOM 0 HG3 GLU A 66 18.588 -17.163 1.744 1.00 0.00 H new ATOM 980 N ASN A 67 17.967 -13.040 1.742 1.00 0.00 N ATOM 981 CA ASN A 67 17.715 -12.197 2.904 1.00 0.00 C ATOM 982 C ASN A 67 16.214 -11.929 3.111 1.00 0.00 C ATOM 983 O ASN A 67 15.798 -11.590 4.221 1.00 0.00 O ATOM 984 CB ASN A 67 18.457 -10.864 2.724 1.00 0.00 C ATOM 985 CG ASN A 67 18.639 -10.149 4.057 1.00 0.00 C ATOM 986 OD1 ASN A 67 17.881 -9.254 4.423 1.00 0.00 O ATOM 987 ND2 ASN A 67 19.656 -10.542 4.813 1.00 0.00 N ATOM 0 H ASN A 67 18.494 -12.565 1.009 1.00 0.00 H new ATOM 0 HA ASN A 67 18.077 -12.722 3.788 1.00 0.00 H new ATOM 0 HB2 ASN A 67 19.431 -11.046 2.270 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.900 -10.225 2.039 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.820 -10.099 5.717 1.00 0.00 H new ATOM 0 HD22 ASN A 67 20.273 -11.287 4.490 1.00 0.00 H new ATOM 994 N PHE A 68 15.405 -12.083 2.057 1.00 0.00 N ATOM 995 CA PHE A 68 13.979 -11.771 2.016 1.00 0.00 C ATOM 996 C PHE A 68 13.147 -13.048 1.914 1.00 0.00 C ATOM 997 O PHE A 68 13.671 -14.166 1.931 1.00 0.00 O ATOM 998 CB PHE A 68 13.697 -10.862 0.808 1.00 0.00 C ATOM 999 CG PHE A 68 14.532 -9.612 0.820 1.00 0.00 C ATOM 1000 CD1 PHE A 68 14.165 -8.541 1.648 1.00 0.00 C ATOM 1001 CD2 PHE A 68 15.720 -9.566 0.076 1.00 0.00 C ATOM 1002 CE1 PHE A 68 14.995 -7.410 1.730 1.00 0.00 C ATOM 1003 CE2 PHE A 68 16.568 -8.449 0.180 1.00 0.00 C ATOM 1004 CZ PHE A 68 16.200 -7.365 1.003 1.00 0.00 C ATOM 0 H PHE A 68 15.747 -12.447 1.168 1.00 0.00 H new ATOM 0 HA PHE A 68 13.701 -11.259 2.937 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.890 -11.415 -0.111 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.642 -10.590 0.801 1.00 0.00 H new ATOM 0 HD1 PHE A 68 13.250 -8.585 2.219 1.00 0.00 H new ATOM 0 HD2 PHE A 68 15.983 -10.386 -0.575 1.00 0.00 H new ATOM 0 HE1 PHE A 68 14.708 -6.574 2.351 1.00 0.00 H new ATOM 0 HE2 PHE A 68 17.498 -8.422 -0.369 1.00 0.00 H new ATOM 0 HZ PHE A 68 16.842 -6.500 1.076 1.00 0.00 H new ATOM 1014 N ASN A 69 11.829 -12.873 1.786 1.00 0.00 N ATOM 1015 CA ASN A 69 10.896 -13.926 1.456 1.00 0.00 C ATOM 1016 C ASN A 69 9.933 -13.366 0.430 1.00 0.00 C ATOM 1017 O ASN A 69 9.505 -12.220 0.578 1.00 0.00 O ATOM 1018 CB ASN A 69 10.112 -14.360 2.699 1.00 0.00 C ATOM 1019 CG ASN A 69 9.248 -15.606 2.511 1.00 0.00 C ATOM 1020 OD1 ASN A 69 8.996 -16.065 1.399 1.00 0.00 O ATOM 1021 ND2 ASN A 69 8.736 -16.159 3.599 1.00 0.00 N ATOM 0 H ASN A 69 11.380 -11.966 1.915 1.00 0.00 H new ATOM 0 HA ASN A 69 11.430 -14.794 1.070 1.00 0.00 H new ATOM 0 HB2 ASN A 69 10.817 -14.543 3.510 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.472 -13.536 3.013 1.00 0.00 H new ATOM 0 HD21 ASN A 69 8.127 -16.973 3.519 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.951 -15.771 4.518 1.00 0.00 H new ATOM 1028 N ALA A 70 9.537 -14.156 -0.565 1.00 0.00 N ATOM 1029 CA ALA A 70 8.645 -13.662 -1.572 1.00 0.00 C ATOM 1030 C ALA A 70 7.255 -13.501 -0.989 1.00 0.00 C ATOM 1031 O ALA A 70 6.489 -12.682 -1.486 1.00 0.00 O ATOM 1032 CB ALA A 70 8.595 -14.613 -2.763 1.00 0.00 C ATOM 0 H ALA A 70 9.824 -15.128 -0.682 1.00 0.00 H new ATOM 0 HA ALA A 70 9.012 -12.695 -1.916 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.912 -14.218 -3.515 1.00 0.00 H new ATOM 0 HB2 ALA A 70 9.592 -14.710 -3.193 1.00 0.00 H new ATOM 0 HB3 ALA A 70 8.245 -15.591 -2.433 1.00 0.00 H new ATOM 1038 N ASP A 71 6.940 -14.264 0.063 1.00 0.00 N ATOM 1039 CA ASP A 71 5.638 -14.202 0.691 1.00 0.00 C ATOM 1040 C ASP A 71 5.367 -12.817 1.297 1.00 0.00 C ATOM 1041 O ASP A 71 4.208 -12.417 1.449 1.00 0.00 O ATOM 1042 CB ASP A 71 5.509 -15.286 1.768 1.00 0.00 C ATOM 1043 CG ASP A 71 4.111 -15.270 2.410 1.00 0.00 C ATOM 1044 OD1 ASP A 71 3.130 -15.662 1.732 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.996 -14.922 3.612 1.00 0.00 O ATOM 0 H ASP A 71 7.581 -14.932 0.491 1.00 0.00 H new ATOM 0 HA ASP A 71 4.891 -14.380 -0.083 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.698 -16.265 1.327 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.267 -15.131 2.536 1.00 0.00 H new ATOM 1050 N ASP A 72 6.429 -12.065 1.626 1.00 0.00 N ATOM 1051 CA ASP A 72 6.316 -10.702 2.121 1.00 0.00 C ATOM 1052 C ASP A 72 5.967 -9.713 0.999 1.00 0.00 C ATOM 1053 O ASP A 72 5.351 -8.672 1.242 1.00 0.00 O ATOM 1054 CB ASP A 72 7.636 -10.271 2.763 1.00 0.00 C ATOM 1055 CG ASP A 72 7.463 -8.927 3.491 1.00 0.00 C ATOM 1056 OD1 ASP A 72 6.726 -8.876 4.505 1.00 0.00 O ATOM 1057 OD2 ASP A 72 8.083 -7.919 3.077 1.00 0.00 O ATOM 0 H ASP A 72 7.391 -12.396 1.552 1.00 0.00 H new ATOM 0 HA ASP A 72 5.511 -10.689 2.856 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.972 -11.033 3.467 1.00 0.00 H new ATOM 0 HB3 ASP A 72 8.408 -10.181 1.998 1.00 0.00 H new ATOM 1062 N TYR A 73 6.372 -10.040 -0.230 1.00 0.00 N ATOM 1063 CA TYR A 73 6.198 -9.225 -1.414 1.00 0.00 C ATOM 1064 C TYR A 73 4.794 -9.384 -1.998 1.00 0.00 C ATOM 1065 O TYR A 73 4.062 -10.322 -1.670 1.00 0.00 O ATOM 1066 CB TYR A 73 7.295 -9.512 -2.458 1.00 0.00 C ATOM 1067 CG TYR A 73 8.640 -8.876 -2.149 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.350 -9.243 -0.990 1.00 0.00 C ATOM 1069 CD2 TYR A 73 9.178 -7.903 -3.014 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.574 -8.630 -0.680 1.00 0.00 C ATOM 1071 CE2 TYR A 73 10.408 -7.292 -2.713 1.00 0.00 C ATOM 1072 CZ TYR A 73 11.120 -7.660 -1.547 1.00 0.00 C ATOM 1073 OH TYR A 73 12.322 -7.082 -1.260 1.00 0.00 O ATOM 0 H TYR A 73 6.850 -10.920 -0.426 1.00 0.00 H new ATOM 0 HA TYR A 73 6.304 -8.181 -1.118 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.428 -10.591 -2.540 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.955 -9.158 -3.431 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.950 -10.002 -0.334 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.644 -7.626 -3.911 1.00 0.00 H new ATOM 0 HE1 TYR A 73 11.099 -8.901 0.224 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.811 -6.539 -3.374 1.00 0.00 H new ATOM 0 HH TYR A 73 12.904 -7.128 -2.047 1.00 0.00 H new ATOM 1083 N ASP A 74 4.418 -8.453 -2.884 1.00 0.00 N ATOM 1084 CA ASP A 74 3.167 -8.532 -3.636 1.00 0.00 C ATOM 1085 C ASP A 74 3.435 -8.883 -5.098 1.00 0.00 C ATOM 1086 O ASP A 74 2.692 -9.675 -5.679 1.00 0.00 O ATOM 1087 CB ASP A 74 2.399 -7.216 -3.535 1.00 0.00 C ATOM 1088 CG ASP A 74 1.071 -7.310 -4.307 1.00 0.00 C ATOM 1089 OD1 ASP A 74 0.090 -7.841 -3.737 1.00 0.00 O ATOM 1090 OD2 ASP A 74 0.995 -6.814 -5.455 1.00 0.00 O ATOM 0 H ASP A 74 4.975 -7.625 -3.097 1.00 0.00 H new ATOM 0 HA ASP A 74 2.557 -9.324 -3.201 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.203 -6.981 -2.489 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.004 -6.403 -3.936 1.00 0.00 H new ATOM 1095 N VAL A 75 4.512 -8.350 -5.688 1.00 0.00 N ATOM 1096 CA VAL A 75 4.761 -8.448 -7.112 1.00 0.00 C ATOM 1097 C VAL A 75 6.240 -8.717 -7.370 1.00 0.00 C ATOM 1098 O VAL A 75 7.125 -8.109 -6.764 1.00 0.00 O ATOM 1099 CB VAL A 75 4.222 -7.183 -7.828 1.00 0.00 C ATOM 1100 CG1 VAL A 75 4.232 -5.864 -7.027 1.00 0.00 C ATOM 1101 CG2 VAL A 75 4.901 -6.964 -9.191 1.00 0.00 C ATOM 0 H VAL A 75 5.233 -7.838 -5.179 1.00 0.00 H new ATOM 0 HA VAL A 75 4.221 -9.296 -7.534 1.00 0.00 H new ATOM 0 HB VAL A 75 3.166 -7.423 -7.954 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.830 -5.061 -7.644 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.619 -5.977 -6.133 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.255 -5.622 -6.738 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.495 -6.068 -9.660 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.975 -6.844 -9.047 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.715 -7.825 -9.833 1.00 0.00 H new ATOM 1111 N VAL A 76 6.507 -9.603 -8.324 1.00 0.00 N ATOM 1112 CA VAL A 76 7.848 -9.954 -8.735 1.00 0.00 C ATOM 1113 C VAL A 76 7.799 -10.122 -10.250 1.00 0.00 C ATOM 1114 O VAL A 76 6.922 -10.805 -10.786 1.00 0.00 O ATOM 1115 CB VAL A 76 8.287 -11.244 -8.028 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.719 -11.637 -8.433 1.00 0.00 C ATOM 1117 CG2 VAL A 76 8.190 -11.183 -6.486 1.00 0.00 C ATOM 0 H VAL A 76 5.780 -10.102 -8.838 1.00 0.00 H new ATOM 0 HA VAL A 76 8.576 -9.189 -8.466 1.00 0.00 H new ATOM 0 HB VAL A 76 7.580 -12.004 -8.361 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.004 -12.554 -7.917 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.761 -11.798 -9.510 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.407 -10.837 -8.158 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.518 -12.133 -6.063 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.826 -10.381 -6.113 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.157 -10.993 -6.194 1.00 0.00 H new ATOM 1127 N ILE A 77 8.735 -9.480 -10.936 1.00 0.00 N ATOM 1128 CA ILE A 77 8.907 -9.565 -12.367 1.00 0.00 C ATOM 1129 C ILE A 77 10.138 -10.424 -12.572 1.00 0.00 C ATOM 1130 O ILE A 77 11.209 -10.127 -12.031 1.00 0.00 O ATOM 1131 CB ILE A 77 9.110 -8.166 -12.958 1.00 0.00 C ATOM 1132 CG1 ILE A 77 8.072 -7.119 -12.487 1.00 0.00 C ATOM 1133 CG2 ILE A 77 9.203 -8.223 -14.490 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.595 -7.463 -12.697 1.00 0.00 C ATOM 0 H ILE A 77 9.416 -8.866 -10.489 1.00 0.00 H new ATOM 0 HA ILE A 77 8.036 -9.992 -12.863 1.00 0.00 H new ATOM 0 HB ILE A 77 10.063 -7.815 -12.563 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.230 -6.939 -11.424 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.278 -6.181 -13.003 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.347 -7.217 -14.883 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.046 -8.850 -14.780 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.282 -8.643 -14.895 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.975 -6.648 -12.324 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.403 -7.608 -13.760 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.354 -8.378 -12.156 1.00 0.00 H new ATOM 1146 N SER A 78 9.991 -11.443 -13.395 1.00 0.00 N ATOM 1147 CA SER A 78 11.002 -12.425 -13.674 1.00 0.00 C ATOM 1148 C SER A 78 11.439 -12.161 -15.106 1.00 0.00 C ATOM 1149 O SER A 78 11.060 -12.864 -16.039 1.00 0.00 O ATOM 1150 CB SER A 78 10.378 -13.804 -13.478 1.00 0.00 C ATOM 1151 OG SER A 78 9.828 -13.918 -12.170 1.00 0.00 O ATOM 0 H SER A 78 9.124 -11.610 -13.906 1.00 0.00 H new ATOM 0 HA SER A 78 11.873 -12.376 -13.020 1.00 0.00 H new ATOM 0 HB2 SER A 78 9.599 -13.967 -14.223 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.132 -14.576 -13.631 1.00 0.00 H new ATOM 0 HG SER A 78 9.294 -14.737 -12.110 1.00 0.00 H new ATOM 1157 N LEU A 79 12.231 -11.102 -15.280 1.00 0.00 N ATOM 1158 CA LEU A 79 12.599 -10.511 -16.568 1.00 0.00 C ATOM 1159 C LEU A 79 13.186 -11.493 -17.591 1.00 0.00 C ATOM 1160 O LEU A 79 13.285 -11.114 -18.754 1.00 0.00 O ATOM 1161 CB LEU A 79 13.635 -9.398 -16.309 1.00 0.00 C ATOM 1162 CG LEU A 79 13.118 -8.112 -15.646 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.322 -7.321 -15.136 1.00 0.00 C ATOM 1164 CD2 LEU A 79 12.339 -7.251 -16.639 1.00 0.00 C ATOM 0 H LEU A 79 12.652 -10.611 -14.492 1.00 0.00 H new ATOM 0 HA LEU A 79 11.673 -10.140 -17.007 1.00 0.00 H new ATOM 0 HB2 LEU A 79 14.426 -9.809 -15.682 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.091 -9.129 -17.262 1.00 0.00 H new ATOM 0 HG LEU A 79 12.447 -8.379 -14.829 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.979 -6.402 -14.661 1.00 0.00 H new ATOM 0 HD12 LEU A 79 14.871 -7.922 -14.411 1.00 0.00 H new ATOM 0 HD13 LEU A 79 14.976 -7.074 -15.972 1.00 0.00 H new ATOM 0 HD21 LEU A 79 11.986 -6.349 -16.140 1.00 0.00 H new ATOM 0 HD22 LEU A 79 12.989 -6.976 -17.470 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.485 -7.814 -17.017 1.00 0.00 H new ATOM 1176 N CYS A 80 13.645 -12.684 -17.185 1.00 0.00 N ATOM 1177 CA CYS A 80 14.267 -13.655 -18.082 1.00 0.00 C ATOM 1178 C CYS A 80 13.439 -14.936 -18.298 1.00 0.00 C ATOM 1179 O CYS A 80 13.853 -15.755 -19.122 1.00 0.00 O ATOM 1180 CB CYS A 80 15.672 -14.012 -17.550 1.00 0.00 C ATOM 1181 SG CYS A 80 17.041 -12.885 -17.959 1.00 0.00 S ATOM 0 H CYS A 80 13.593 -12.999 -16.216 1.00 0.00 H new ATOM 0 HA CYS A 80 14.331 -13.179 -19.060 1.00 0.00 H new ATOM 0 HB2 CYS A 80 15.611 -14.086 -16.464 1.00 0.00 H new ATOM 0 HB3 CYS A 80 15.930 -15.003 -17.923 1.00 0.00 H new ATOM 1186 N GLY A 81 12.337 -15.166 -17.574 1.00 0.00 N ATOM 1187 CA GLY A 81 11.545 -16.388 -17.717 1.00 0.00 C ATOM 1188 C GLY A 81 11.004 -16.863 -16.377 1.00 0.00 C ATOM 1189 O GLY A 81 10.489 -16.058 -15.602 1.00 0.00 O ATOM 0 H GLY A 81 11.973 -14.514 -16.879 1.00 0.00 H new ATOM 0 HA2 GLY A 81 10.716 -16.207 -18.402 1.00 0.00 H new ATOM 0 HA3 GLY A 81 12.160 -17.171 -18.160 1.00 0.00 H new ATOM 1193 N SER A 82 11.152 -18.161 -16.096 1.00 0.00 N ATOM 1194 CA SER A 82 10.506 -18.823 -14.957 1.00 0.00 C ATOM 1195 C SER A 82 11.516 -19.546 -14.053 1.00 0.00 C ATOM 1196 O SER A 82 11.276 -19.662 -12.851 1.00 0.00 O ATOM 1197 CB SER A 82 9.438 -19.793 -15.485 1.00 0.00 C ATOM 1198 OG SER A 82 8.583 -19.157 -16.433 1.00 0.00 O ATOM 0 H SER A 82 11.728 -18.788 -16.657 1.00 0.00 H new ATOM 0 HA SER A 82 10.035 -18.062 -14.335 1.00 0.00 H new ATOM 0 HB2 SER A 82 9.922 -20.653 -15.948 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.844 -20.171 -14.653 1.00 0.00 H new ATOM 0 HG SER A 82 7.915 -19.799 -16.753 1.00 0.00 H new ATOM 1204 N GLY A 83 12.655 -20.006 -14.595 1.00 0.00 N ATOM 1205 CA GLY A 83 13.737 -20.575 -13.792 1.00 0.00 C ATOM 1206 C GLY A 83 14.501 -19.451 -13.100 1.00 0.00 C ATOM 1207 O GLY A 83 14.502 -19.344 -11.876 1.00 0.00 O ATOM 0 H GLY A 83 12.846 -19.992 -15.597 1.00 0.00 H new ATOM 0 HA2 GLY A 83 13.331 -21.263 -13.051 1.00 0.00 H new ATOM 0 HA3 GLY A 83 14.411 -21.151 -14.426 1.00 0.00 H new ATOM 1211 N VAL A 84 15.126 -18.576 -13.902 1.00 0.00 N ATOM 1212 CA VAL A 84 15.752 -17.315 -13.466 1.00 0.00 C ATOM 1213 C VAL A 84 16.829 -17.529 -12.372 1.00 0.00 C ATOM 1214 O VAL A 84 17.226 -16.590 -11.688 1.00 0.00 O ATOM 1215 CB VAL A 84 14.669 -16.236 -13.240 1.00 0.00 C ATOM 1216 CG1 VAL A 84 15.183 -14.797 -13.068 1.00 0.00 C ATOM 1217 CG2 VAL A 84 13.706 -16.189 -14.444 1.00 0.00 C ATOM 0 H VAL A 84 15.213 -18.730 -14.906 1.00 0.00 H new ATOM 0 HA VAL A 84 16.367 -16.893 -14.261 1.00 0.00 H new ATOM 0 HB VAL A 84 14.198 -16.543 -12.306 1.00 0.00 H new ATOM 0 HG11 VAL A 84 14.339 -14.125 -12.916 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.846 -14.748 -12.204 1.00 0.00 H new ATOM 0 HG13 VAL A 84 15.730 -14.497 -13.962 1.00 0.00 H new ATOM 0 HG21 VAL A 84 12.947 -15.425 -14.273 1.00 0.00 H new ATOM 0 HG22 VAL A 84 14.265 -15.949 -15.348 1.00 0.00 H new ATOM 0 HG23 VAL A 84 13.224 -17.159 -14.562 1.00 0.00 H new ATOM 1227 N ASN A 85 17.341 -18.761 -12.234 1.00 0.00 N ATOM 1228 CA ASN A 85 18.240 -19.196 -11.159 1.00 0.00 C ATOM 1229 C ASN A 85 17.768 -18.721 -9.771 1.00 0.00 C ATOM 1230 O ASN A 85 18.586 -18.320 -8.938 1.00 0.00 O ATOM 1231 CB ASN A 85 19.699 -18.816 -11.480 1.00 0.00 C ATOM 1232 CG ASN A 85 20.704 -19.503 -10.551 1.00 0.00 C ATOM 1233 OD1 ASN A 85 20.451 -20.577 -10.008 1.00 0.00 O ATOM 1234 ND2 ASN A 85 21.887 -18.930 -10.384 1.00 0.00 N ATOM 0 H ASN A 85 17.131 -19.509 -12.895 1.00 0.00 H new ATOM 0 HA ASN A 85 18.205 -20.284 -11.108 1.00 0.00 H new ATOM 0 HB2 ASN A 85 19.922 -19.085 -12.513 1.00 0.00 H new ATOM 0 HB3 ASN A 85 19.815 -17.735 -11.400 1.00 0.00 H new ATOM 0 HD21 ASN A 85 22.594 -19.380 -9.802 1.00 0.00 H new ATOM 0 HD22 ASN A 85 22.091 -18.039 -10.837 1.00 0.00 H new ATOM 1241 N LEU A 86 16.447 -18.718 -9.523 1.00 0.00 N ATOM 1242 CA LEU A 86 15.862 -18.297 -8.248 1.00 0.00 C ATOM 1243 C LEU A 86 14.745 -19.253 -7.786 1.00 0.00 C ATOM 1244 O LEU A 86 14.206 -19.997 -8.611 1.00 0.00 O ATOM 1245 CB LEU A 86 15.468 -16.802 -8.280 1.00 0.00 C ATOM 1246 CG LEU A 86 14.466 -16.221 -9.298 1.00 0.00 C ATOM 1247 CD1 LEU A 86 13.187 -17.025 -9.528 1.00 0.00 C ATOM 1248 CD2 LEU A 86 14.068 -14.804 -8.861 1.00 0.00 C ATOM 0 H LEU A 86 15.753 -19.011 -10.211 1.00 0.00 H new ATOM 0 HA LEU A 86 16.623 -18.374 -7.472 1.00 0.00 H new ATOM 0 HB2 LEU A 86 15.078 -16.563 -7.291 1.00 0.00 H new ATOM 0 HB3 LEU A 86 16.394 -16.240 -8.402 1.00 0.00 H new ATOM 0 HG LEU A 86 15.000 -16.245 -10.248 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.564 -16.516 -10.263 1.00 0.00 H new ATOM 0 HD12 LEU A 86 13.443 -18.019 -9.895 1.00 0.00 H new ATOM 0 HD13 LEU A 86 12.640 -17.115 -8.589 1.00 0.00 H new ATOM 0 HD21 LEU A 86 13.359 -14.388 -9.577 1.00 0.00 H new ATOM 0 HD22 LEU A 86 13.606 -14.844 -7.875 1.00 0.00 H new ATOM 0 HD23 LEU A 86 14.956 -14.173 -8.821 1.00 0.00 H new ATOM 1260 N PRO A 87 14.408 -19.278 -6.477 1.00 0.00 N ATOM 1261 CA PRO A 87 13.295 -20.068 -5.951 1.00 0.00 C ATOM 1262 C PRO A 87 11.988 -19.729 -6.681 1.00 0.00 C ATOM 1263 O PRO A 87 11.653 -18.546 -6.767 1.00 0.00 O ATOM 1264 CB PRO A 87 13.236 -19.756 -4.452 1.00 0.00 C ATOM 1265 CG PRO A 87 14.683 -19.404 -4.116 1.00 0.00 C ATOM 1266 CD PRO A 87 15.144 -18.670 -5.371 1.00 0.00 C ATOM 0 HA PRO A 87 13.438 -21.137 -6.110 1.00 0.00 H new ATOM 0 HB2 PRO A 87 12.560 -18.928 -4.239 1.00 0.00 H new ATOM 0 HB3 PRO A 87 12.885 -20.612 -3.875 1.00 0.00 H new ATOM 0 HG2 PRO A 87 14.752 -18.774 -3.229 1.00 0.00 H new ATOM 0 HG3 PRO A 87 15.283 -20.293 -3.923 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.933 -17.603 -5.300 1.00 0.00 H new ATOM 0 HD3 PRO A 87 16.220 -18.774 -5.512 1.00 0.00 H new ATOM 1274 N PRO A 88 11.204 -20.716 -7.158 1.00 0.00 N ATOM 1275 CA PRO A 88 9.971 -20.441 -7.898 1.00 0.00 C ATOM 1276 C PRO A 88 8.946 -19.687 -7.050 1.00 0.00 C ATOM 1277 O PRO A 88 8.097 -18.994 -7.598 1.00 0.00 O ATOM 1278 CB PRO A 88 9.455 -21.806 -8.366 1.00 0.00 C ATOM 1279 CG PRO A 88 10.053 -22.785 -7.356 1.00 0.00 C ATOM 1280 CD PRO A 88 11.406 -22.153 -7.032 1.00 0.00 C ATOM 0 HA PRO A 88 10.156 -19.783 -8.747 1.00 0.00 H new ATOM 0 HB2 PRO A 88 8.366 -21.844 -8.364 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.780 -22.030 -9.382 1.00 0.00 H new ATOM 0 HG2 PRO A 88 9.429 -22.881 -6.468 1.00 0.00 H new ATOM 0 HG3 PRO A 88 10.164 -23.784 -7.778 1.00 0.00 H new ATOM 0 HD2 PRO A 88 11.732 -22.417 -6.026 1.00 0.00 H new ATOM 0 HD3 PRO A 88 12.177 -22.503 -7.718 1.00 0.00 H new ATOM 1288 N GLU A 89 9.091 -19.727 -5.723 1.00 0.00 N ATOM 1289 CA GLU A 89 8.320 -18.963 -4.751 1.00 0.00 C ATOM 1290 C GLU A 89 8.284 -17.455 -5.077 1.00 0.00 C ATOM 1291 O GLU A 89 7.326 -16.757 -4.735 1.00 0.00 O ATOM 1292 CB GLU A 89 8.918 -19.277 -3.358 1.00 0.00 C ATOM 1293 CG GLU A 89 9.883 -18.241 -2.762 1.00 0.00 C ATOM 1294 CD GLU A 89 10.572 -18.765 -1.482 1.00 0.00 C ATOM 1295 OE1 GLU A 89 9.880 -19.289 -0.576 1.00 0.00 O ATOM 1296 OE2 GLU A 89 11.816 -18.641 -1.364 1.00 0.00 O ATOM 0 H GLU A 89 9.787 -20.326 -5.279 1.00 0.00 H new ATOM 0 HA GLU A 89 7.271 -19.257 -4.776 1.00 0.00 H new ATOM 0 HB2 GLU A 89 8.093 -19.413 -2.658 1.00 0.00 H new ATOM 0 HB3 GLU A 89 9.442 -20.230 -3.422 1.00 0.00 H new ATOM 0 HG2 GLU A 89 10.640 -17.982 -3.502 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.337 -17.326 -2.532 1.00 0.00 H new ATOM 1303 N TRP A 90 9.304 -16.952 -5.776 1.00 0.00 N ATOM 1304 CA TRP A 90 9.365 -15.575 -6.242 1.00 0.00 C ATOM 1305 C TRP A 90 8.438 -15.336 -7.426 1.00 0.00 C ATOM 1306 O TRP A 90 7.752 -14.322 -7.481 1.00 0.00 O ATOM 1307 CB TRP A 90 10.818 -15.256 -6.579 1.00 0.00 C ATOM 1308 CG TRP A 90 11.631 -14.997 -5.346 1.00 0.00 C ATOM 1309 CD1 TRP A 90 12.444 -15.875 -4.724 1.00 0.00 C ATOM 1310 CD2 TRP A 90 11.587 -13.824 -4.481 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.854 -15.354 -3.512 1.00 0.00 N ATOM 1312 CE2 TRP A 90 12.317 -14.101 -3.290 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.946 -12.576 -4.567 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 12.378 -13.187 -2.226 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.978 -11.659 -3.504 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.692 -11.962 -2.334 1.00 0.00 C ATOM 0 H TRP A 90 10.122 -17.504 -6.036 1.00 0.00 H new ATOM 0 HA TRP A 90 9.016 -14.904 -5.457 1.00 0.00 H new ATOM 0 HB2 TRP A 90 11.253 -16.087 -7.134 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.857 -14.383 -7.230 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.731 -16.840 -5.115 1.00 0.00 H new ATOM 0 HE1 TRP A 90 13.476 -15.835 -2.862 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.417 -12.316 -5.472 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.944 -13.420 -1.336 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.452 -10.719 -3.587 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.715 -11.256 -1.517 1.00 0.00 H new ATOM 1327 N VAL A 91 8.380 -16.282 -8.354 1.00 0.00 N ATOM 1328 CA VAL A 91 7.538 -16.209 -9.531 1.00 0.00 C ATOM 1329 C VAL A 91 6.072 -16.253 -9.096 1.00 0.00 C ATOM 1330 O VAL A 91 5.255 -15.510 -9.634 1.00 0.00 O ATOM 1331 CB VAL A 91 7.895 -17.357 -10.483 1.00 0.00 C ATOM 1332 CG1 VAL A 91 7.242 -17.199 -11.861 1.00 0.00 C ATOM 1333 CG2 VAL A 91 9.409 -17.550 -10.688 1.00 0.00 C ATOM 0 H VAL A 91 8.931 -17.139 -8.304 1.00 0.00 H new ATOM 0 HA VAL A 91 7.701 -15.275 -10.068 1.00 0.00 H new ATOM 0 HB VAL A 91 7.500 -18.241 -9.982 1.00 0.00 H new ATOM 0 HG11 VAL A 91 7.527 -18.037 -12.497 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.158 -17.180 -11.750 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.577 -16.268 -12.318 1.00 0.00 H new ATOM 0 HG21 VAL A 91 9.580 -18.380 -11.374 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.839 -16.640 -11.106 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.881 -17.767 -9.730 1.00 0.00 H new ATOM 1343 N THR A 92 5.733 -17.032 -8.074 1.00 0.00 N ATOM 1344 CA THR A 92 4.349 -17.327 -7.735 1.00 0.00 C ATOM 1345 C THR A 92 3.662 -16.274 -6.856 1.00 0.00 C ATOM 1346 O THR A 92 2.707 -16.600 -6.140 1.00 0.00 O ATOM 1347 CB THR A 92 4.292 -18.752 -7.158 1.00 0.00 C ATOM 1348 OG1 THR A 92 5.110 -18.859 -6.006 1.00 0.00 O ATOM 1349 CG2 THR A 92 4.817 -19.761 -8.178 1.00 0.00 C ATOM 0 H THR A 92 6.413 -17.477 -7.457 1.00 0.00 H new ATOM 0 HA THR A 92 3.754 -17.280 -8.647 1.00 0.00 H new ATOM 0 HB THR A 92 3.251 -18.959 -6.909 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.060 -19.772 -5.653 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.770 -20.764 -7.755 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.206 -19.719 -9.079 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.850 -19.521 -8.429 1.00 0.00 H new ATOM 1357 N GLN A 93 4.116 -15.016 -6.898 1.00 0.00 N ATOM 1358 CA GLN A 93 3.405 -13.939 -6.233 1.00 0.00 C ATOM 1359 C GLN A 93 2.134 -13.556 -7.014 1.00 0.00 C ATOM 1360 O GLN A 93 1.812 -14.176 -8.035 1.00 0.00 O ATOM 1361 CB GLN A 93 4.358 -12.782 -5.860 1.00 0.00 C ATOM 1362 CG GLN A 93 5.449 -13.255 -4.875 1.00 0.00 C ATOM 1363 CD GLN A 93 4.866 -14.014 -3.671 1.00 0.00 C ATOM 1364 OE1 GLN A 93 3.919 -13.562 -3.027 1.00 0.00 O ATOM 1365 NE2 GLN A 93 5.346 -15.217 -3.380 1.00 0.00 N ATOM 0 H GLN A 93 4.966 -14.729 -7.383 1.00 0.00 H new ATOM 0 HA GLN A 93 3.030 -14.280 -5.268 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.825 -12.386 -6.762 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.788 -11.968 -5.413 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.154 -13.900 -5.400 1.00 0.00 H new ATOM 0 HG3 GLN A 93 6.011 -12.392 -4.519 1.00 0.00 H new ATOM 0 HE21 GLN A 93 6.130 -15.595 -3.911 1.00 0.00 H new ATOM 0 HE22 GLN A 93 4.930 -15.763 -2.625 1.00 0.00 H new ATOM 1374 N GLU A 94 1.382 -12.560 -6.528 1.00 0.00 N ATOM 1375 CA GLU A 94 0.039 -12.245 -7.028 1.00 0.00 C ATOM 1376 C GLU A 94 0.019 -11.835 -8.512 1.00 0.00 C ATOM 1377 O GLU A 94 -1.031 -11.897 -9.154 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.603 -11.148 -6.158 1.00 0.00 C ATOM 1379 CG GLU A 94 -0.828 -11.551 -4.692 1.00 0.00 C ATOM 1380 CD GLU A 94 -1.812 -12.730 -4.553 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -3.048 -12.509 -4.614 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -1.359 -13.884 -4.366 1.00 0.00 O ATOM 0 H GLU A 94 1.690 -11.947 -5.773 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.545 -13.163 -6.958 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.031 -10.262 -6.185 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.561 -10.868 -6.596 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.127 -11.823 -4.242 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.210 -10.694 -4.137 1.00 0.00 H new ATOM 1389 N ILE A 95 1.171 -11.456 -9.069 1.00 0.00 N ATOM 1390 CA ILE A 95 1.384 -11.236 -10.485 1.00 0.00 C ATOM 1391 C ILE A 95 2.778 -11.790 -10.817 1.00 0.00 C ATOM 1392 O ILE A 95 3.743 -11.528 -10.091 1.00 0.00 O ATOM 1393 CB ILE A 95 1.190 -9.739 -10.845 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.708 -9.436 -12.272 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.846 -8.810 -9.807 1.00 0.00 C ATOM 1396 CD1 ILE A 95 1.292 -8.067 -12.831 1.00 0.00 C ATOM 0 H ILE A 95 2.011 -11.289 -8.515 1.00 0.00 H new ATOM 0 HA ILE A 95 0.649 -11.759 -11.097 1.00 0.00 H new ATOM 0 HB ILE A 95 0.119 -9.539 -10.826 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.796 -9.496 -12.269 1.00 0.00 H new ATOM 0 HG13 ILE A 95 1.348 -10.213 -12.947 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.687 -7.771 -10.096 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.400 -8.986 -8.828 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.916 -9.014 -9.761 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.701 -7.944 -13.834 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.204 -8.006 -12.872 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.675 -7.278 -12.184 1.00 0.00 H new ATOM 1408 N PHE A 96 2.856 -12.555 -11.908 1.00 0.00 N ATOM 1409 CA PHE A 96 4.094 -12.999 -12.537 1.00 0.00 C ATOM 1410 C PHE A 96 4.173 -12.217 -13.858 1.00 0.00 C ATOM 1411 O PHE A 96 3.171 -12.119 -14.576 1.00 0.00 O ATOM 1412 CB PHE A 96 4.094 -14.526 -12.759 1.00 0.00 C ATOM 1413 CG PHE A 96 4.854 -15.010 -13.985 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.242 -14.793 -14.094 1.00 0.00 C ATOM 1415 CD2 PHE A 96 4.173 -15.679 -15.021 1.00 0.00 C ATOM 1416 CE1 PHE A 96 6.943 -15.253 -15.219 1.00 0.00 C ATOM 1417 CE2 PHE A 96 4.875 -16.134 -16.152 1.00 0.00 C ATOM 1418 CZ PHE A 96 6.261 -15.923 -16.250 1.00 0.00 C ATOM 0 H PHE A 96 2.025 -12.893 -12.393 1.00 0.00 H new ATOM 0 HA PHE A 96 4.966 -12.806 -11.912 1.00 0.00 H new ATOM 0 HB2 PHE A 96 4.520 -15.004 -11.877 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.061 -14.864 -12.837 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.768 -14.271 -13.309 1.00 0.00 H new ATOM 0 HD2 PHE A 96 3.108 -15.843 -14.947 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.008 -15.092 -15.293 1.00 0.00 H new ATOM 0 HE2 PHE A 96 4.349 -16.645 -16.945 1.00 0.00 H new ATOM 0 HZ PHE A 96 6.802 -16.275 -17.116 1.00 0.00 H new ATOM 1428 N GLU A 97 5.344 -11.674 -14.189 1.00 0.00 N ATOM 1429 CA GLU A 97 5.637 -11.061 -15.483 1.00 0.00 C ATOM 1430 C GLU A 97 7.041 -11.486 -15.898 1.00 0.00 C ATOM 1431 O GLU A 97 7.825 -11.966 -15.077 1.00 0.00 O ATOM 1432 CB GLU A 97 5.540 -9.533 -15.427 1.00 0.00 C ATOM 1433 CG GLU A 97 4.130 -8.941 -15.275 1.00 0.00 C ATOM 1434 CD GLU A 97 3.296 -8.926 -16.575 1.00 0.00 C ATOM 1435 OE1 GLU A 97 3.496 -9.773 -17.480 1.00 0.00 O ATOM 1436 OE2 GLU A 97 2.411 -8.041 -16.691 1.00 0.00 O ATOM 0 H GLU A 97 6.136 -11.648 -13.547 1.00 0.00 H new ATOM 0 HA GLU A 97 4.900 -11.397 -16.212 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.149 -9.183 -14.593 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.983 -9.129 -16.337 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.590 -9.511 -14.519 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.217 -7.920 -14.903 1.00 0.00 H new ATOM 1443 N ASP A 98 7.342 -11.307 -17.178 1.00 0.00 N ATOM 1444 CA ASP A 98 8.517 -11.812 -17.882 1.00 0.00 C ATOM 1445 C ASP A 98 8.455 -11.189 -19.269 1.00 0.00 C ATOM 1446 O ASP A 98 7.405 -11.271 -19.920 1.00 0.00 O ATOM 1447 CB ASP A 98 8.479 -13.344 -18.039 1.00 0.00 C ATOM 1448 CG ASP A 98 9.369 -13.827 -19.205 1.00 0.00 C ATOM 1449 OD1 ASP A 98 10.532 -13.375 -19.338 1.00 0.00 O ATOM 1450 OD2 ASP A 98 8.893 -14.675 -20.001 1.00 0.00 O ATOM 0 H ASP A 98 6.732 -10.770 -17.794 1.00 0.00 H new ATOM 0 HA ASP A 98 9.423 -11.563 -17.329 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.810 -13.812 -17.112 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.452 -13.666 -18.209 1.00 0.00 H new ATOM 1455 N TRP A 99 9.542 -10.549 -19.711 1.00 0.00 N ATOM 1456 CA TRP A 99 9.493 -9.733 -20.932 1.00 0.00 C ATOM 1457 C TRP A 99 10.773 -9.827 -21.756 1.00 0.00 C ATOM 1458 O TRP A 99 11.872 -9.764 -21.207 1.00 0.00 O ATOM 1459 CB TRP A 99 9.208 -8.263 -20.575 1.00 0.00 C ATOM 1460 CG TRP A 99 7.902 -7.966 -19.895 1.00 0.00 C ATOM 1461 CD1 TRP A 99 6.668 -8.343 -20.306 1.00 0.00 C ATOM 1462 CD2 TRP A 99 7.682 -7.228 -18.661 1.00 0.00 C ATOM 1463 NE1 TRP A 99 5.717 -7.908 -19.401 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.285 -7.173 -18.392 1.00 0.00 C ATOM 1465 CE3 TRP A 99 8.536 -6.602 -17.737 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 5.755 -6.504 -17.282 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 8.014 -5.967 -16.598 1.00 0.00 C ATOM 1468 CH2 TRP A 99 6.633 -5.903 -16.371 1.00 0.00 C ATOM 0 H TRP A 99 10.453 -10.577 -19.252 1.00 0.00 H new ATOM 0 HA TRP A 99 8.685 -10.130 -21.546 1.00 0.00 H new ATOM 0 HB2 TRP A 99 10.013 -7.909 -19.931 1.00 0.00 H new ATOM 0 HB3 TRP A 99 9.253 -7.677 -21.493 1.00 0.00 H new ATOM 0 HD1 TRP A 99 6.458 -8.901 -21.207 1.00 0.00 H new ATOM 0 HE1 TRP A 99 4.720 -8.108 -19.475 1.00 0.00 H new ATOM 0 HE3 TRP A 99 9.603 -6.609 -17.904 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.687 -6.452 -17.131 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 8.690 -5.520 -15.884 1.00 0.00 H new ATOM 0 HH2 TRP A 99 6.248 -5.394 -15.500 1.00 0.00 H new ATOM 1479 N GLN A 100 10.628 -9.833 -23.085 1.00 0.00 N ATOM 1480 CA GLN A 100 11.728 -9.805 -24.053 1.00 0.00 C ATOM 1481 C GLN A 100 12.248 -8.369 -24.264 1.00 0.00 C ATOM 1482 O GLN A 100 12.352 -7.881 -25.390 1.00 0.00 O ATOM 1483 CB GLN A 100 11.333 -10.564 -25.339 1.00 0.00 C ATOM 1484 CG GLN A 100 10.069 -10.061 -26.058 1.00 0.00 C ATOM 1485 CD GLN A 100 9.853 -10.794 -27.385 1.00 0.00 C ATOM 1486 OE1 GLN A 100 10.165 -10.279 -28.457 1.00 0.00 O ATOM 1487 NE2 GLN A 100 9.329 -12.014 -27.353 1.00 0.00 N ATOM 0 H GLN A 100 9.711 -9.858 -23.531 1.00 0.00 H new ATOM 0 HA GLN A 100 12.587 -10.346 -23.656 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.168 -10.514 -26.038 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.190 -11.615 -25.087 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.201 -10.206 -25.415 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.155 -8.990 -26.242 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.072 -12.436 -26.460 1.00 0.00 H new ATOM 0 HE22 GLN A 100 9.183 -12.529 -28.221 1.00 0.00 H new ATOM 1496 N LEU A 101 12.543 -7.672 -23.161 1.00 0.00 N ATOM 1497 CA LEU A 101 13.187 -6.357 -23.182 1.00 0.00 C ATOM 1498 C LEU A 101 14.589 -6.535 -23.766 1.00 0.00 C ATOM 1499 O LEU A 101 15.254 -7.519 -23.439 1.00 0.00 O ATOM 1500 CB LEU A 101 13.244 -5.786 -21.741 1.00 0.00 C ATOM 1501 CG LEU A 101 11.892 -5.274 -21.221 1.00 0.00 C ATOM 1502 CD1 LEU A 101 11.923 -5.126 -19.693 1.00 0.00 C ATOM 1503 CD2 LEU A 101 11.471 -4.013 -21.979 1.00 0.00 C ATOM 0 H LEU A 101 12.339 -8.010 -22.220 1.00 0.00 H new ATOM 0 HA LEU A 101 12.626 -5.651 -23.795 1.00 0.00 H new ATOM 0 HB2 LEU A 101 13.611 -6.561 -21.068 1.00 0.00 H new ATOM 0 HB3 LEU A 101 13.966 -4.970 -21.712 1.00 0.00 H new ATOM 0 HG LEU A 101 11.111 -6.007 -21.423 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.957 -4.762 -19.343 1.00 0.00 H new ATOM 0 HD12 LEU A 101 12.133 -6.094 -19.238 1.00 0.00 H new ATOM 0 HD13 LEU A 101 12.701 -4.416 -19.412 1.00 0.00 H new ATOM 0 HD21 LEU A 101 10.511 -3.663 -21.599 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.222 -3.236 -21.838 1.00 0.00 H new ATOM 0 HD23 LEU A 101 11.379 -4.241 -23.041 1.00 0.00 H new ATOM 1515 N GLU A 102 15.081 -5.614 -24.591 1.00 0.00 N ATOM 1516 CA GLU A 102 16.480 -5.653 -24.980 1.00 0.00 C ATOM 1517 C GLU A 102 17.349 -5.356 -23.752 1.00 0.00 C ATOM 1518 O GLU A 102 17.006 -4.522 -22.914 1.00 0.00 O ATOM 1519 CB GLU A 102 16.785 -4.680 -26.135 1.00 0.00 C ATOM 1520 CG GLU A 102 16.506 -5.265 -27.520 1.00 0.00 C ATOM 1521 CD GLU A 102 17.431 -6.454 -27.842 1.00 0.00 C ATOM 1522 OE1 GLU A 102 18.639 -6.233 -28.101 1.00 0.00 O ATOM 1523 OE2 GLU A 102 16.952 -7.615 -27.836 1.00 0.00 O ATOM 0 H GLU A 102 14.541 -4.848 -24.994 1.00 0.00 H new ATOM 0 HA GLU A 102 16.712 -6.650 -25.353 1.00 0.00 H new ATOM 0 HB2 GLU A 102 16.189 -3.777 -26.005 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.832 -4.382 -26.080 1.00 0.00 H new ATOM 0 HG2 GLU A 102 15.467 -5.589 -27.574 1.00 0.00 H new ATOM 0 HG3 GLU A 102 16.637 -4.489 -28.274 1.00 0.00 H new ATOM 1530 N ASP A 103 18.482 -6.046 -23.645 1.00 0.00 N ATOM 1531 CA ASP A 103 19.537 -5.762 -22.694 1.00 0.00 C ATOM 1532 C ASP A 103 20.570 -4.934 -23.466 1.00 0.00 C ATOM 1533 O ASP A 103 21.121 -5.435 -24.451 1.00 0.00 O ATOM 1534 CB ASP A 103 20.167 -7.058 -22.167 1.00 0.00 C ATOM 1535 CG ASP A 103 21.604 -6.831 -21.657 1.00 0.00 C ATOM 1536 OD1 ASP A 103 21.848 -5.792 -21.002 1.00 0.00 O ATOM 1537 OD2 ASP A 103 22.464 -7.707 -21.906 1.00 0.00 O ATOM 0 H ASP A 103 18.692 -6.846 -24.243 1.00 0.00 H new ATOM 0 HA ASP A 103 19.157 -5.228 -21.823 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.554 -7.458 -21.359 1.00 0.00 H new ATOM 0 HB3 ASP A 103 20.177 -7.806 -22.960 1.00 0.00 H new ATOM 1542 N PRO A 104 20.812 -3.670 -23.092 1.00 0.00 N ATOM 1543 CA PRO A 104 21.693 -2.786 -23.832 1.00 0.00 C ATOM 1544 C PRO A 104 23.169 -2.967 -23.463 1.00 0.00 C ATOM 1545 O PRO A 104 24.009 -2.334 -24.100 1.00 0.00 O ATOM 1546 CB PRO A 104 21.175 -1.391 -23.511 1.00 0.00 C ATOM 1547 CG PRO A 104 20.720 -1.522 -22.058 1.00 0.00 C ATOM 1548 CD PRO A 104 20.171 -2.946 -22.006 1.00 0.00 C ATOM 0 HA PRO A 104 21.675 -2.996 -24.901 1.00 0.00 H new ATOM 0 HB2 PRO A 104 21.952 -0.635 -23.624 1.00 0.00 H new ATOM 0 HB3 PRO A 104 20.353 -1.104 -24.167 1.00 0.00 H new ATOM 0 HG2 PRO A 104 21.546 -1.381 -21.361 1.00 0.00 H new ATOM 0 HG3 PRO A 104 19.958 -0.785 -21.804 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.390 -3.412 -21.045 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.087 -2.949 -22.123 1.00 0.00 H new ATOM 1556 N ASP A 105 23.519 -3.793 -22.465 1.00 0.00 N ATOM 1557 CA ASP A 105 24.918 -3.960 -22.083 1.00 0.00 C ATOM 1558 C ASP A 105 25.726 -4.463 -23.284 1.00 0.00 C ATOM 1559 O ASP A 105 25.357 -5.453 -23.926 1.00 0.00 O ATOM 1560 CB ASP A 105 25.104 -4.913 -20.902 1.00 0.00 C ATOM 1561 CG ASP A 105 26.608 -5.157 -20.680 1.00 0.00 C ATOM 1562 OD1 ASP A 105 27.353 -4.167 -20.481 1.00 0.00 O ATOM 1563 OD2 ASP A 105 27.051 -6.330 -20.742 1.00 0.00 O ATOM 0 H ASP A 105 22.859 -4.346 -21.918 1.00 0.00 H new ATOM 0 HA ASP A 105 25.279 -2.982 -21.764 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.656 -4.489 -20.003 1.00 0.00 H new ATOM 0 HB3 ASP A 105 24.595 -5.857 -21.097 1.00 0.00 H new ATOM 1568 N GLY A 106 26.821 -3.765 -23.603 1.00 0.00 N ATOM 1569 CA GLY A 106 27.686 -4.088 -24.730 1.00 0.00 C ATOM 1570 C GLY A 106 27.093 -3.720 -26.099 1.00 0.00 C ATOM 1571 O GLY A 106 27.757 -3.952 -27.112 1.00 0.00 O ATOM 0 H GLY A 106 27.131 -2.949 -23.075 1.00 0.00 H new ATOM 0 HA2 GLY A 106 28.636 -3.569 -24.606 1.00 0.00 H new ATOM 0 HA3 GLY A 106 27.902 -5.156 -24.714 1.00 0.00 H new ATOM 1575 N GLN A 107 25.884 -3.148 -26.152 1.00 0.00 N ATOM 1576 CA GLN A 107 25.276 -2.628 -27.376 1.00 0.00 C ATOM 1577 C GLN A 107 25.506 -1.108 -27.469 1.00 0.00 C ATOM 1578 O GLN A 107 25.961 -0.472 -26.513 1.00 0.00 O ATOM 1579 CB GLN A 107 23.779 -2.993 -27.467 1.00 0.00 C ATOM 1580 CG GLN A 107 23.450 -4.469 -27.180 1.00 0.00 C ATOM 1581 CD GLN A 107 22.243 -5.008 -27.962 1.00 0.00 C ATOM 1582 OE1 GLN A 107 22.188 -4.929 -29.187 1.00 0.00 O ATOM 1583 NE2 GLN A 107 21.263 -5.573 -27.276 1.00 0.00 N ATOM 0 H GLN A 107 25.293 -3.033 -25.329 1.00 0.00 H new ATOM 0 HA GLN A 107 25.759 -3.099 -28.232 1.00 0.00 H new ATOM 0 HB2 GLN A 107 23.225 -2.370 -26.765 1.00 0.00 H new ATOM 0 HB3 GLN A 107 23.420 -2.744 -28.466 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.323 -5.077 -27.417 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.260 -4.586 -26.113 1.00 0.00 H new ATOM 0 HE21 GLN A 107 21.320 -5.632 -26.259 1.00 0.00 H new ATOM 0 HE22 GLN A 107 20.450 -5.949 -27.764 1.00 0.00 H new ATOM 1592 N SER A 108 25.207 -0.525 -28.633 1.00 0.00 N ATOM 1593 CA SER A 108 25.367 0.900 -28.908 1.00 0.00 C ATOM 1594 C SER A 108 24.335 1.744 -28.138 1.00 0.00 C ATOM 1595 O SER A 108 23.319 1.221 -27.671 1.00 0.00 O ATOM 1596 CB SER A 108 25.285 1.115 -30.427 1.00 0.00 C ATOM 1597 OG SER A 108 26.176 0.233 -31.105 1.00 0.00 O ATOM 0 H SER A 108 24.838 -1.046 -29.428 1.00 0.00 H new ATOM 0 HA SER A 108 26.342 1.237 -28.557 1.00 0.00 H new ATOM 0 HB2 SER A 108 24.264 0.945 -30.770 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.534 2.149 -30.668 1.00 0.00 H new ATOM 0 HG SER A 108 26.111 0.381 -32.072 1.00 0.00 H new ATOM 1603 N LEU A 109 24.551 3.066 -28.045 1.00 0.00 N ATOM 1604 CA LEU A 109 23.698 3.979 -27.262 1.00 0.00 C ATOM 1605 C LEU A 109 22.265 4.010 -27.779 1.00 0.00 C ATOM 1606 O LEU A 109 21.346 4.218 -26.993 1.00 0.00 O ATOM 1607 CB LEU A 109 24.279 5.408 -27.225 1.00 0.00 C ATOM 1608 CG LEU A 109 25.691 5.550 -26.621 1.00 0.00 C ATOM 1609 CD1 LEU A 109 26.022 7.036 -26.450 1.00 0.00 C ATOM 1610 CD2 LEU A 109 25.850 4.840 -25.271 1.00 0.00 C ATOM 0 H LEU A 109 25.326 3.535 -28.513 1.00 0.00 H new ATOM 0 HA LEU A 109 23.681 3.586 -26.245 1.00 0.00 H new ATOM 0 HB2 LEU A 109 24.301 5.796 -28.243 1.00 0.00 H new ATOM 0 HB3 LEU A 109 23.597 6.041 -26.657 1.00 0.00 H new ATOM 0 HG LEU A 109 26.380 5.070 -27.316 1.00 0.00 H new ATOM 0 HD11 LEU A 109 27.020 7.140 -26.023 1.00 0.00 H new ATOM 0 HD12 LEU A 109 25.990 7.530 -27.421 1.00 0.00 H new ATOM 0 HD13 LEU A 109 25.293 7.497 -25.784 1.00 0.00 H new ATOM 0 HD21 LEU A 109 26.867 4.980 -24.904 1.00 0.00 H new ATOM 0 HD22 LEU A 109 25.144 5.259 -24.554 1.00 0.00 H new ATOM 0 HD23 LEU A 109 25.653 3.775 -25.394 1.00 0.00 H new ATOM 1622 N GLU A 110 22.053 3.733 -29.067 1.00 0.00 N ATOM 1623 CA GLU A 110 20.720 3.594 -29.648 1.00 0.00 C ATOM 1624 C GLU A 110 19.908 2.520 -28.921 1.00 0.00 C ATOM 1625 O GLU A 110 18.710 2.693 -28.716 1.00 0.00 O ATOM 1626 CB GLU A 110 20.802 3.289 -31.157 1.00 0.00 C ATOM 1627 CG GLU A 110 21.856 2.256 -31.581 1.00 0.00 C ATOM 1628 CD GLU A 110 21.795 1.978 -33.095 1.00 0.00 C ATOM 1629 OE1 GLU A 110 21.017 1.092 -33.525 1.00 0.00 O ATOM 1630 OE2 GLU A 110 22.537 2.631 -33.869 1.00 0.00 O ATOM 0 H GLU A 110 22.808 3.598 -29.739 1.00 0.00 H new ATOM 0 HA GLU A 110 20.205 4.546 -29.523 1.00 0.00 H new ATOM 0 HB2 GLU A 110 19.825 2.939 -31.490 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.003 4.221 -31.685 1.00 0.00 H new ATOM 0 HG2 GLU A 110 22.849 2.618 -31.316 1.00 0.00 H new ATOM 0 HG3 GLU A 110 21.698 1.327 -31.033 1.00 0.00 H new ATOM 1637 N VAL A 111 20.552 1.439 -28.481 1.00 0.00 N ATOM 1638 CA VAL A 111 19.895 0.335 -27.800 1.00 0.00 C ATOM 1639 C VAL A 111 19.594 0.750 -26.371 1.00 0.00 C ATOM 1640 O VAL A 111 18.458 0.573 -25.953 1.00 0.00 O ATOM 1641 CB VAL A 111 20.728 -0.954 -27.917 1.00 0.00 C ATOM 1642 CG1 VAL A 111 19.992 -2.181 -27.358 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.109 -1.208 -29.388 1.00 0.00 C ATOM 0 H VAL A 111 21.558 1.309 -28.591 1.00 0.00 H new ATOM 0 HA VAL A 111 18.943 0.101 -28.276 1.00 0.00 H new ATOM 0 HB VAL A 111 21.627 -0.807 -27.318 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.623 -3.063 -27.465 1.00 0.00 H new ATOM 0 HG12 VAL A 111 19.767 -2.021 -26.304 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.063 -2.330 -27.909 1.00 0.00 H new ATOM 0 HG21 VAL A 111 21.698 -2.122 -29.459 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.203 -1.313 -29.986 1.00 0.00 H new ATOM 0 HG23 VAL A 111 21.695 -0.369 -29.762 1.00 0.00 H new ATOM 1653 N PHE A 112 20.516 1.391 -25.641 1.00 0.00 N ATOM 1654 CA PHE A 112 20.200 1.930 -24.312 1.00 0.00 C ATOM 1655 C PHE A 112 18.993 2.869 -24.391 1.00 0.00 C ATOM 1656 O PHE A 112 18.042 2.722 -23.629 1.00 0.00 O ATOM 1657 CB PHE A 112 21.406 2.686 -23.729 1.00 0.00 C ATOM 1658 CG PHE A 112 22.538 1.837 -23.180 1.00 0.00 C ATOM 1659 CD1 PHE A 112 22.478 1.365 -21.854 1.00 0.00 C ATOM 1660 CD2 PHE A 112 23.654 1.507 -23.975 1.00 0.00 C ATOM 1661 CE1 PHE A 112 23.503 0.546 -21.344 1.00 0.00 C ATOM 1662 CE2 PHE A 112 24.692 0.716 -23.451 1.00 0.00 C ATOM 1663 CZ PHE A 112 24.618 0.231 -22.135 1.00 0.00 C ATOM 0 H PHE A 112 21.477 1.548 -25.944 1.00 0.00 H new ATOM 0 HA PHE A 112 19.960 1.093 -23.656 1.00 0.00 H new ATOM 0 HB2 PHE A 112 21.811 3.333 -24.507 1.00 0.00 H new ATOM 0 HB3 PHE A 112 21.048 3.335 -22.930 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.641 1.633 -21.226 1.00 0.00 H new ATOM 0 HD2 PHE A 112 23.712 1.864 -24.993 1.00 0.00 H new ATOM 0 HE1 PHE A 112 23.431 0.158 -20.339 1.00 0.00 H new ATOM 0 HE2 PHE A 112 25.550 0.480 -24.063 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.414 -0.380 -21.735 1.00 0.00 H new ATOM 1673 N ARG A 113 18.987 3.797 -25.348 1.00 0.00 N ATOM 1674 CA ARG A 113 17.932 4.806 -25.466 1.00 0.00 C ATOM 1675 C ARG A 113 16.611 4.169 -25.915 1.00 0.00 C ATOM 1676 O ARG A 113 15.560 4.534 -25.394 1.00 0.00 O ATOM 1677 CB ARG A 113 18.431 5.931 -26.392 1.00 0.00 C ATOM 1678 CG ARG A 113 19.560 6.733 -25.711 1.00 0.00 C ATOM 1679 CD ARG A 113 20.283 7.655 -26.691 1.00 0.00 C ATOM 1680 NE ARG A 113 21.288 8.488 -26.002 1.00 0.00 N ATOM 1681 CZ ARG A 113 22.364 9.042 -26.577 1.00 0.00 C ATOM 1682 NH1 ARG A 113 22.634 8.852 -27.871 1.00 0.00 N ATOM 1683 NH2 ARG A 113 23.175 9.796 -25.850 1.00 0.00 N ATOM 0 H ARG A 113 19.711 3.871 -26.062 1.00 0.00 H new ATOM 0 HA ARG A 113 17.714 5.252 -24.496 1.00 0.00 H new ATOM 0 HB2 ARG A 113 18.793 5.505 -27.328 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.605 6.596 -26.643 1.00 0.00 H new ATOM 0 HG2 ARG A 113 19.143 7.326 -24.897 1.00 0.00 H new ATOM 0 HG3 ARG A 113 20.277 6.043 -25.267 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.769 7.059 -27.463 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.558 8.296 -27.193 1.00 0.00 H new ATOM 0 HE ARG A 113 21.152 8.656 -25.005 1.00 0.00 H new ATOM 0 HH11 ARG A 113 22.016 8.276 -28.442 1.00 0.00 H new ATOM 0 HH12 ARG A 113 23.459 9.283 -28.289 1.00 0.00 H new ATOM 0 HH21 ARG A 113 22.978 9.951 -24.861 1.00 0.00 H new ATOM 0 HH22 ARG A 113 23.997 10.222 -26.279 1.00 0.00 H new ATOM 1697 N THR A 114 16.652 3.147 -26.773 1.00 0.00 N ATOM 1698 CA THR A 114 15.502 2.324 -27.110 1.00 0.00 C ATOM 1699 C THR A 114 14.987 1.638 -25.844 1.00 0.00 C ATOM 1700 O THR A 114 13.788 1.664 -25.572 1.00 0.00 O ATOM 1701 CB THR A 114 15.962 1.320 -28.183 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.014 1.953 -29.448 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.104 0.065 -28.269 1.00 0.00 C ATOM 0 H THR A 114 17.504 2.868 -27.259 1.00 0.00 H new ATOM 0 HA THR A 114 14.675 2.911 -27.509 1.00 0.00 H new ATOM 0 HB THR A 114 16.955 0.989 -27.878 1.00 0.00 H new ATOM 0 HG1 THR A 114 16.898 2.356 -29.576 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.494 -0.590 -29.048 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.125 -0.457 -27.312 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.077 0.342 -28.509 1.00 0.00 H new ATOM 1711 N VAL A 115 15.875 1.039 -25.051 1.00 0.00 N ATOM 1712 CA VAL A 115 15.501 0.251 -23.888 1.00 0.00 C ATOM 1713 C VAL A 115 14.848 1.147 -22.844 1.00 0.00 C ATOM 1714 O VAL A 115 13.912 0.698 -22.191 1.00 0.00 O ATOM 1715 CB VAL A 115 16.726 -0.549 -23.395 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.534 -1.180 -22.009 1.00 0.00 C ATOM 1717 CG2 VAL A 115 16.999 -1.683 -24.394 1.00 0.00 C ATOM 0 H VAL A 115 16.882 1.091 -25.203 1.00 0.00 H new ATOM 0 HA VAL A 115 14.745 -0.493 -24.137 1.00 0.00 H new ATOM 0 HB VAL A 115 17.554 0.156 -23.320 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.435 -1.726 -21.730 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.342 -0.396 -21.276 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.688 -1.867 -22.036 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.862 -2.260 -24.062 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.127 -2.335 -24.452 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.202 -1.260 -25.378 1.00 0.00 H new ATOM 1727 N ARG A 116 15.232 2.425 -22.742 1.00 0.00 N ATOM 1728 CA ARG A 116 14.516 3.353 -21.866 1.00 0.00 C ATOM 1729 C ARG A 116 13.032 3.416 -22.253 1.00 0.00 C ATOM 1730 O ARG A 116 12.182 3.257 -21.386 1.00 0.00 O ATOM 1731 CB ARG A 116 15.172 4.750 -21.844 1.00 0.00 C ATOM 1732 CG ARG A 116 16.577 4.746 -21.216 1.00 0.00 C ATOM 1733 CD ARG A 116 16.997 6.120 -20.672 1.00 0.00 C ATOM 1734 NE ARG A 116 17.633 7.016 -21.672 1.00 0.00 N ATOM 1735 CZ ARG A 116 17.077 8.013 -22.381 1.00 0.00 C ATOM 1736 NH1 ARG A 116 15.759 8.194 -22.405 1.00 0.00 N ATOM 1737 NH2 ARG A 116 17.847 8.846 -23.071 1.00 0.00 N ATOM 0 H ARG A 116 16.020 2.832 -23.246 1.00 0.00 H new ATOM 0 HA ARG A 116 14.580 2.973 -20.846 1.00 0.00 H new ATOM 0 HB2 ARG A 116 15.237 5.131 -22.863 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.534 5.436 -21.288 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.604 4.017 -20.406 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.301 4.420 -21.963 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.117 6.619 -20.265 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.691 5.971 -19.844 1.00 0.00 H new ATOM 0 HE ARG A 116 18.625 6.852 -21.843 1.00 0.00 H new ATOM 0 HH11 ARG A 116 15.149 7.569 -21.878 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.359 8.958 -22.950 1.00 0.00 H new ATOM 0 HH21 ARG A 116 18.860 8.729 -23.063 1.00 0.00 H new ATOM 0 HH22 ARG A 116 17.425 9.603 -23.609 1.00 0.00 H new ATOM 1751 N GLY A 117 12.728 3.543 -23.547 1.00 0.00 N ATOM 1752 CA GLY A 117 11.356 3.522 -24.054 1.00 0.00 C ATOM 1753 C GLY A 117 10.674 2.182 -23.779 1.00 0.00 C ATOM 1754 O GLY A 117 9.588 2.161 -23.196 1.00 0.00 O ATOM 0 H GLY A 117 13.432 3.664 -24.276 1.00 0.00 H new ATOM 0 HA2 GLY A 117 10.783 4.324 -23.589 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.361 3.715 -25.127 1.00 0.00 H new ATOM 1758 N GLN A 118 11.322 1.062 -24.138 1.00 0.00 N ATOM 1759 CA GLN A 118 10.735 -0.275 -23.984 1.00 0.00 C ATOM 1760 C GLN A 118 10.348 -0.523 -22.525 1.00 0.00 C ATOM 1761 O GLN A 118 9.240 -0.958 -22.211 1.00 0.00 O ATOM 1762 CB GLN A 118 11.709 -1.384 -24.423 1.00 0.00 C ATOM 1763 CG GLN A 118 12.099 -1.374 -25.906 1.00 0.00 C ATOM 1764 CD GLN A 118 12.779 -2.679 -26.335 1.00 0.00 C ATOM 1765 OE1 GLN A 118 13.445 -3.355 -25.553 1.00 0.00 O ATOM 1766 NE2 GLN A 118 12.624 -3.060 -27.592 1.00 0.00 N ATOM 0 H GLN A 118 12.260 1.059 -24.540 1.00 0.00 H new ATOM 0 HA GLN A 118 9.852 -0.307 -24.623 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.617 -1.302 -23.826 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.261 -2.350 -24.190 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.208 -1.214 -26.513 1.00 0.00 H new ATOM 0 HG3 GLN A 118 12.770 -0.537 -26.098 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.069 -2.492 -28.232 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.059 -3.922 -27.921 1.00 0.00 H new ATOM 1775 N VAL A 119 11.288 -0.255 -21.629 1.00 0.00 N ATOM 1776 CA VAL A 119 11.154 -0.589 -20.217 1.00 0.00 C ATOM 1777 C VAL A 119 10.193 0.375 -19.534 1.00 0.00 C ATOM 1778 O VAL A 119 9.384 -0.088 -18.731 1.00 0.00 O ATOM 1779 CB VAL A 119 12.544 -0.655 -19.566 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.436 -1.013 -18.087 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.393 -1.754 -20.218 1.00 0.00 C ATOM 0 H VAL A 119 12.169 0.202 -21.862 1.00 0.00 H new ATOM 0 HA VAL A 119 10.712 -1.579 -20.100 1.00 0.00 H new ATOM 0 HB VAL A 119 13.000 0.326 -19.697 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.433 -1.054 -17.649 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.844 -0.257 -17.572 1.00 0.00 H new ATOM 0 HG13 VAL A 119 11.954 -1.985 -17.982 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.374 -1.786 -19.744 1.00 0.00 H new ATOM 0 HG22 VAL A 119 12.899 -2.717 -20.094 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.510 -1.541 -21.280 1.00 0.00 H new ATOM 1791 N LYS A 120 10.190 1.669 -19.877 1.00 0.00 N ATOM 1792 CA LYS A 120 9.188 2.587 -19.340 1.00 0.00 C ATOM 1793 C LYS A 120 7.805 2.031 -19.635 1.00 0.00 C ATOM 1794 O LYS A 120 6.967 1.999 -18.743 1.00 0.00 O ATOM 1795 CB LYS A 120 9.331 3.965 -20.008 1.00 0.00 C ATOM 1796 CG LYS A 120 8.363 5.006 -19.422 1.00 0.00 C ATOM 1797 CD LYS A 120 8.484 6.347 -20.160 1.00 0.00 C ATOM 1798 CE LYS A 120 7.489 7.375 -19.595 1.00 0.00 C ATOM 1799 NZ LYS A 120 7.546 8.674 -20.320 1.00 0.00 N ATOM 0 H LYS A 120 10.862 2.096 -20.515 1.00 0.00 H new ATOM 0 HA LYS A 120 9.330 2.693 -18.265 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.355 4.318 -19.889 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.150 3.867 -21.078 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.340 4.638 -19.495 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.575 5.149 -18.363 1.00 0.00 H new ATOM 0 HD2 LYS A 120 9.501 6.729 -20.065 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.297 6.200 -21.224 1.00 0.00 H new ATOM 0 HE2 LYS A 120 6.478 6.971 -19.657 1.00 0.00 H new ATOM 0 HE3 LYS A 120 7.702 7.541 -18.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 6.858 9.334 -19.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 8.503 9.074 -20.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.317 8.522 -21.323 1.00 0.00 H new ATOM 1813 N GLU A 121 7.575 1.563 -20.859 1.00 0.00 N ATOM 1814 CA GLU A 121 6.275 1.097 -21.293 1.00 0.00 C ATOM 1815 C GLU A 121 5.865 -0.184 -20.549 1.00 0.00 C ATOM 1816 O GLU A 121 4.729 -0.277 -20.084 1.00 0.00 O ATOM 1817 CB GLU A 121 6.321 0.948 -22.819 1.00 0.00 C ATOM 1818 CG GLU A 121 4.980 0.490 -23.400 1.00 0.00 C ATOM 1819 CD GLU A 121 5.009 0.469 -24.938 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.409 -0.563 -25.529 1.00 0.00 O ATOM 1821 OE2 GLU A 121 4.613 1.478 -25.570 1.00 0.00 O ATOM 0 H GLU A 121 8.296 1.499 -21.578 1.00 0.00 H new ATOM 0 HA GLU A 121 5.494 1.816 -21.044 1.00 0.00 H new ATOM 0 HB2 GLU A 121 6.601 1.902 -23.266 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.095 0.230 -23.088 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.741 -0.506 -23.026 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.188 1.157 -23.059 1.00 0.00 H new ATOM 1828 N ARG A 122 6.778 -1.150 -20.361 1.00 0.00 N ATOM 1829 CA ARG A 122 6.468 -2.371 -19.598 1.00 0.00 C ATOM 1830 C ARG A 122 6.155 -2.049 -18.140 1.00 0.00 C ATOM 1831 O ARG A 122 5.181 -2.554 -17.585 1.00 0.00 O ATOM 1832 CB ARG A 122 7.618 -3.400 -19.684 1.00 0.00 C ATOM 1833 CG ARG A 122 7.868 -4.003 -21.076 1.00 0.00 C ATOM 1834 CD ARG A 122 6.678 -4.795 -21.627 1.00 0.00 C ATOM 1835 NE ARG A 122 7.002 -5.395 -22.938 1.00 0.00 N ATOM 1836 CZ ARG A 122 6.251 -6.284 -23.610 1.00 0.00 C ATOM 1837 NH1 ARG A 122 5.116 -6.748 -23.090 1.00 0.00 N ATOM 1838 NH2 ARG A 122 6.644 -6.713 -24.806 1.00 0.00 N ATOM 0 H ARG A 122 7.731 -1.111 -20.724 1.00 0.00 H new ATOM 0 HA ARG A 122 5.581 -2.814 -20.050 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.536 -2.921 -19.345 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.407 -4.212 -18.988 1.00 0.00 H new ATOM 0 HG2 ARG A 122 8.112 -3.200 -21.772 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.738 -4.658 -21.028 1.00 0.00 H new ATOM 0 HD2 ARG A 122 6.401 -5.579 -20.923 1.00 0.00 H new ATOM 0 HD3 ARG A 122 5.814 -4.138 -21.727 1.00 0.00 H new ATOM 0 HE ARG A 122 7.878 -5.107 -23.374 1.00 0.00 H new ATOM 0 HH11 ARG A 122 4.808 -6.429 -22.172 1.00 0.00 H new ATOM 0 HH12 ARG A 122 4.555 -7.423 -23.610 1.00 0.00 H new ATOM 0 HH21 ARG A 122 7.514 -6.367 -25.211 1.00 0.00 H new ATOM 0 HH22 ARG A 122 6.076 -7.388 -25.318 1.00 0.00 H new ATOM 1852 N VAL A 123 6.969 -1.204 -17.515 1.00 0.00 N ATOM 1853 CA VAL A 123 6.810 -0.844 -16.111 1.00 0.00 C ATOM 1854 C VAL A 123 5.520 -0.005 -15.957 1.00 0.00 C ATOM 1855 O VAL A 123 4.780 -0.219 -15.000 1.00 0.00 O ATOM 1856 CB VAL A 123 8.099 -0.169 -15.620 1.00 0.00 C ATOM 1857 CG1 VAL A 123 8.005 0.259 -14.152 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.333 -1.088 -15.719 1.00 0.00 C ATOM 0 H VAL A 123 7.760 -0.748 -17.970 1.00 0.00 H new ATOM 0 HA VAL A 123 6.675 -1.714 -15.468 1.00 0.00 H new ATOM 0 HB VAL A 123 8.214 0.694 -16.276 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.940 0.731 -13.850 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.185 0.967 -14.031 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.823 -0.616 -13.529 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.213 -0.556 -15.358 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.173 -1.979 -15.111 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.487 -1.380 -16.758 1.00 0.00 H new ATOM 1868 N GLU A 124 5.189 0.875 -16.912 1.00 0.00 N ATOM 1869 CA GLU A 124 3.919 1.598 -16.935 1.00 0.00 C ATOM 1870 C GLU A 124 2.752 0.621 -16.986 1.00 0.00 C ATOM 1871 O GLU A 124 1.804 0.765 -16.222 1.00 0.00 O ATOM 1872 CB GLU A 124 3.828 2.560 -18.140 1.00 0.00 C ATOM 1873 CG GLU A 124 4.368 3.968 -17.884 1.00 0.00 C ATOM 1874 CD GLU A 124 3.439 4.787 -16.964 1.00 0.00 C ATOM 1875 OE1 GLU A 124 3.494 4.620 -15.723 1.00 0.00 O ATOM 1876 OE2 GLU A 124 2.651 5.609 -17.491 1.00 0.00 O ATOM 0 H GLU A 124 5.803 1.104 -17.694 1.00 0.00 H new ATOM 0 HA GLU A 124 3.869 2.187 -16.019 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.374 2.124 -18.976 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.785 2.637 -18.446 1.00 0.00 H new ATOM 0 HG2 GLU A 124 5.357 3.900 -17.432 1.00 0.00 H new ATOM 0 HG3 GLU A 124 4.487 4.488 -18.834 1.00 0.00 H new ATOM 1883 N ASN A 125 2.824 -0.386 -17.854 1.00 0.00 N ATOM 1884 CA ASN A 125 1.747 -1.350 -18.048 1.00 0.00 C ATOM 1885 C ASN A 125 1.517 -2.185 -16.784 1.00 0.00 C ATOM 1886 O ASN A 125 0.374 -2.407 -16.393 1.00 0.00 O ATOM 1887 CB ASN A 125 2.051 -2.245 -19.258 1.00 0.00 C ATOM 1888 CG ASN A 125 0.919 -3.229 -19.523 1.00 0.00 C ATOM 1889 OD1 ASN A 125 1.025 -4.408 -19.204 1.00 0.00 O ATOM 1890 ND2 ASN A 125 -0.187 -2.779 -20.098 1.00 0.00 N ATOM 0 H ASN A 125 3.637 -0.556 -18.446 1.00 0.00 H new ATOM 0 HA ASN A 125 0.825 -0.803 -18.247 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.209 -1.625 -20.140 1.00 0.00 H new ATOM 0 HB3 ASN A 125 2.977 -2.793 -19.083 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.963 -3.416 -20.280 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.263 -1.796 -20.359 1.00 0.00 H new ATOM 1897 N LEU A 126 2.595 -2.588 -16.102 1.00 0.00 N ATOM 1898 CA LEU A 126 2.566 -3.258 -14.809 1.00 0.00 C ATOM 1899 C LEU A 126 1.869 -2.390 -13.760 1.00 0.00 C ATOM 1900 O LEU A 126 0.975 -2.867 -13.070 1.00 0.00 O ATOM 1901 CB LEU A 126 4.027 -3.544 -14.413 1.00 0.00 C ATOM 1902 CG LEU A 126 4.232 -3.961 -12.950 1.00 0.00 C ATOM 1903 CD1 LEU A 126 3.549 -5.304 -12.693 1.00 0.00 C ATOM 1904 CD2 LEU A 126 5.725 -4.023 -12.630 1.00 0.00 C ATOM 0 H LEU A 126 3.543 -2.449 -16.453 1.00 0.00 H new ATOM 0 HA LEU A 126 2.000 -4.188 -14.870 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.415 -4.333 -15.058 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.622 -2.652 -14.608 1.00 0.00 H new ATOM 0 HG LEU A 126 3.778 -3.220 -12.292 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.698 -5.595 -11.653 1.00 0.00 H new ATOM 0 HD12 LEU A 126 2.482 -5.214 -12.895 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.980 -6.062 -13.347 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.862 -4.320 -11.590 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.207 -4.752 -13.282 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.172 -3.042 -12.790 1.00 0.00 H new ATOM 1916 N ILE A 127 2.254 -1.122 -13.639 1.00 0.00 N ATOM 1917 CA ILE A 127 1.693 -0.212 -12.649 1.00 0.00 C ATOM 1918 C ILE A 127 0.215 -0.013 -12.981 1.00 0.00 C ATOM 1919 O ILE A 127 -0.627 -0.136 -12.098 1.00 0.00 O ATOM 1920 CB ILE A 127 2.522 1.090 -12.698 1.00 0.00 C ATOM 1921 CG1 ILE A 127 3.889 0.832 -12.032 1.00 0.00 C ATOM 1922 CG2 ILE A 127 1.819 2.269 -12.011 1.00 0.00 C ATOM 1923 CD1 ILE A 127 4.943 1.884 -12.362 1.00 0.00 C ATOM 0 H ILE A 127 2.968 -0.696 -14.230 1.00 0.00 H new ATOM 0 HA ILE A 127 1.743 -0.595 -11.630 1.00 0.00 H new ATOM 0 HB ILE A 127 2.647 1.368 -13.744 1.00 0.00 H new ATOM 0 HG12 ILE A 127 3.754 0.793 -10.951 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.256 -0.146 -12.343 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.449 3.156 -12.077 1.00 0.00 H new ATOM 0 HG22 ILE A 127 0.867 2.462 -12.504 1.00 0.00 H new ATOM 0 HG23 ILE A 127 1.642 2.027 -10.963 1.00 0.00 H new ATOM 0 HD11 ILE A 127 5.877 1.634 -11.858 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.108 1.909 -13.439 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.599 2.862 -12.025 1.00 0.00 H new ATOM 1935 N ALA A 128 -0.113 0.228 -14.251 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.475 0.465 -14.694 1.00 0.00 C ATOM 1937 C ALA A 128 -2.404 -0.712 -14.373 1.00 0.00 C ATOM 1938 O ALA A 128 -3.595 -0.478 -14.145 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.468 0.762 -16.200 1.00 0.00 C ATOM 0 H ALA A 128 0.573 0.263 -15.005 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.868 1.324 -14.150 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.488 0.941 -16.540 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.860 1.646 -16.394 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -1.051 -0.090 -16.737 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.904 -1.960 -14.351 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.721 -3.113 -13.990 1.00 0.00 C ATOM 1947 C LYS A 129 -2.802 -3.324 -12.479 1.00 0.00 C ATOM 1948 O LYS A 129 -3.892 -3.652 -12.000 1.00 0.00 O ATOM 1949 CB LYS A 129 -2.370 -4.373 -14.805 1.00 0.00 C ATOM 1950 CG LYS A 129 -0.992 -4.973 -14.504 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.602 -6.155 -15.403 1.00 0.00 C ATOM 1952 CE LYS A 129 -0.419 -5.728 -16.866 1.00 0.00 C ATOM 1953 NZ LYS A 129 0.162 -6.807 -17.707 1.00 0.00 N ATOM 0 H LYS A 129 -0.937 -2.187 -14.580 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.744 -2.883 -14.286 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -3.129 -5.132 -14.618 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -2.419 -4.127 -15.866 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -0.239 -4.191 -14.606 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -0.972 -5.301 -13.465 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.323 -6.600 -15.037 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.371 -6.925 -15.343 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -1.384 -5.431 -17.278 1.00 0.00 H new ATOM 0 HE3 LYS A 129 0.228 -4.852 -16.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 0.692 -6.385 -18.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.803 -7.389 -17.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -0.602 -7.403 -18.083 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.715 -3.140 -11.715 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.747 -3.438 -10.290 1.00 0.00 C ATOM 1969 C ILE A 130 -2.340 -2.313 -9.436 1.00 0.00 C ATOM 1970 O ILE A 130 -2.997 -2.605 -8.432 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.385 -3.925 -9.778 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.664 -2.800 -9.721 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.078 -5.157 -10.578 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.054 -3.281 -9.317 1.00 0.00 C ATOM 0 H ILE A 130 -0.820 -2.792 -12.060 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.444 -4.268 -10.173 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.505 -4.240 -8.742 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.724 -2.321 -10.698 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.332 -2.040 -9.014 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.046 -5.491 -10.204 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.651 -5.959 -10.465 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.168 -4.894 -11.632 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.741 -2.435 -9.298 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.009 -3.734 -8.327 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.407 -4.019 -10.037 1.00 0.00 H new ATOM 1986 N SER A 131 -2.096 -1.055 -9.796 1.00 0.00 N ATOM 1987 CA SER A 131 -2.397 0.113 -8.997 1.00 0.00 C ATOM 1988 C SER A 131 -3.736 0.706 -9.434 1.00 0.00 C ATOM 1989 O SER A 131 -4.658 0.763 -8.588 1.00 0.00 O ATOM 1990 CB SER A 131 -1.237 1.100 -9.077 1.00 0.00 C ATOM 1991 OG SER A 131 -0.066 0.481 -8.551 1.00 0.00 O ATOM 1992 OXT SER A 131 -3.882 1.096 -10.616 1.00 0.00 O ATOM 0 H SER A 131 -1.665 -0.820 -10.690 1.00 0.00 H new ATOM 0 HA SER A 131 -2.506 -0.156 -7.946 1.00 0.00 H new ATOM 0 HB2 SER A 131 -1.071 1.403 -10.111 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.471 2.003 -8.514 1.00 0.00 H new ATOM 0 HG SER A 131 0.686 1.108 -8.600 1.00 0.00 H new