USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 992 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 92 THR OG1 : rot 180:sc= 0.0287 USER MOD Set 1.2: A 93 GLN : amide:sc= 0.856 K(o=0.88,f=-3.7!) USER MOD Set 2.1: A 23 LYS NZ :NH3+ 166:sc= 2.33 (180deg=1.21) USER MOD Set 2.2: A 34 SER OG : rot -92:sc= 1.82 USER MOD Set 2.3: A 60 GLN : amide:sc= 0.205! C(o=4.9!,f=-3.7!) USER MOD Set 2.4: A 62 SER OG : rot -72:sc= 0.579 USER MOD Set 3.1: A 8 CYS SG : rot 180:sc= 1 USER MOD Set 3.2: A 15 SER OG : rot 73:sc= 0.515 USER MOD Set 4.1: A 11 ASN : amide:sc= -0.562 K(o=-0.47,f=0.5) USER MOD Set 4.2: A 12 SER OG : rot 174:sc= 0.22 USER MOD Set 4.3: A 39 SER OG : rot -117:sc= 0.745 USER MOD Set 4.4: A 43 HIS : no HD1:sc= -0.87 K(o=-0.47,f=0.5) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -121:sc= 0.154 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -161:sc= 1.23 (180deg=1.16) USER MOD Single : A 3 LYS NZ :NH3+ -175:sc= 1.23 (180deg=1.2) USER MOD Single : A 5 MET CE :methyl 178:sc= -0.058 (180deg=-0.0615) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 CYS SG : rot 142:sc= 1.85 USER MOD Single : A 16 GLN : amide:sc= -0.079 K(o=-0.079,f=-1.1) USER MOD Single : A 17 MET CE :methyl -174:sc= -1.85 (180deg=-1.95) USER MOD Single : A 24 THR OG1 : rot 98:sc= 0.476 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 70:sc= 0.691 USER MOD Single : A 35 CYS SG : rot 35:sc= -0.267 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 170:sc= -0.833 (180deg=-1.03) USER MOD Single : A 50 MET CE :methyl 152:sc= -0.209 (180deg=-1.4) USER MOD Single : A 58 SER OG : rot 73:sc= 1.27 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 0.456 K(o=0.46,f=-0.39) USER MOD Single : A 69 ASN : amide:sc= 0.683 K(o=0.68,f=0) USER MOD Single : A 73 TYR OH : rot 68:sc= 0.395 USER MOD Single : A 78 SER OG : rot 108:sc= 1.05 USER MOD Single : A 80 CYS SG : rot 180:sc= -0.0319 USER MOD Single : A 82 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 GLN : amide:sc= -1.98! C(o=-2!,f=-6.2!) USER MOD Single : A 107 GLN : amide:sc= 0.608 K(o=0.61,f=-0.011) USER MOD Single : A 108 SER OG : rot 180:sc= 0.0438 USER MOD Single : A 114 THR OG1 : rot 79:sc= 1.2 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 120 LYS NZ :NH3+ 179:sc= 1.26 (180deg=1.26) USER MOD Single : A 125 ASN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 173:sc= 1.21 (180deg=1.09) USER MOD Single : A 131 SER OG : rot 84:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.893 -2.113 1.344 1.00 0.00 N ATOM 2 CA MET A 1 1.721 -1.290 0.405 1.00 0.00 C ATOM 3 C MET A 1 2.942 -2.114 -0.076 1.00 0.00 C ATOM 4 O MET A 1 3.138 -3.218 0.425 1.00 0.00 O ATOM 5 CB MET A 1 2.090 0.068 1.071 1.00 0.00 C ATOM 6 CG MET A 1 2.218 1.244 0.090 1.00 0.00 C ATOM 7 SD MET A 1 0.740 1.580 -0.907 1.00 0.00 S ATOM 8 CE MET A 1 1.277 3.067 -1.797 1.00 0.00 C ATOM 0 H1 MET A 1 -0.071 -2.207 0.966 1.00 0.00 H new ATOM 0 H2 MET A 1 1.318 -3.057 1.446 1.00 0.00 H new ATOM 0 H3 MET A 1 0.856 -1.648 2.273 1.00 0.00 H new ATOM 0 HA MET A 1 1.153 -1.039 -0.490 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.331 0.312 1.814 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.033 -0.048 1.605 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.468 2.142 0.655 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.053 1.047 -0.582 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.478 3.404 -2.457 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.513 3.854 -1.081 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.163 2.837 -2.388 1.00 0.00 H new ATOM 18 N LYS A 2 3.772 -1.643 -1.032 1.00 0.00 N ATOM 19 CA LYS A 2 4.908 -2.445 -1.547 1.00 0.00 C ATOM 20 C LYS A 2 5.858 -2.725 -0.397 1.00 0.00 C ATOM 21 O LYS A 2 6.306 -1.773 0.234 1.00 0.00 O ATOM 22 CB LYS A 2 5.686 -1.783 -2.712 1.00 0.00 C ATOM 23 CG LYS A 2 4.806 -1.321 -3.881 1.00 0.00 C ATOM 24 CD LYS A 2 4.293 0.130 -3.722 1.00 0.00 C ATOM 25 CE LYS A 2 5.227 1.213 -4.303 1.00 0.00 C ATOM 26 NZ LYS A 2 4.787 1.630 -5.668 1.00 0.00 N ATOM 0 H LYS A 2 3.680 -0.722 -1.460 1.00 0.00 H new ATOM 0 HA LYS A 2 4.485 -3.361 -1.960 1.00 0.00 H new ATOM 0 HB2 LYS A 2 6.234 -0.924 -2.325 1.00 0.00 H new ATOM 0 HB3 LYS A 2 6.425 -2.491 -3.087 1.00 0.00 H new ATOM 0 HG2 LYS A 2 5.374 -1.399 -4.808 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.953 -1.993 -3.973 1.00 0.00 H new ATOM 0 HD2 LYS A 2 3.320 0.212 -4.206 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.140 0.332 -2.662 1.00 0.00 H new ATOM 0 HE2 LYS A 2 5.239 2.079 -3.642 1.00 0.00 H new ATOM 0 HE3 LYS A 2 6.247 0.831 -4.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 5.576 2.097 -6.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 4.490 0.792 -6.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 3.989 2.292 -5.588 1.00 0.00 H new ATOM 40 N LYS A 3 6.127 -3.987 -0.081 1.00 0.00 N ATOM 41 CA LYS A 3 6.853 -4.336 1.138 1.00 0.00 C ATOM 42 C LYS A 3 8.323 -4.429 0.782 1.00 0.00 C ATOM 43 O LYS A 3 8.667 -5.039 -0.229 1.00 0.00 O ATOM 44 CB LYS A 3 6.285 -5.613 1.791 1.00 0.00 C ATOM 45 CG LYS A 3 4.751 -5.646 1.877 1.00 0.00 C ATOM 46 CD LYS A 3 4.160 -6.944 2.453 1.00 0.00 C ATOM 47 CE LYS A 3 4.805 -7.399 3.774 1.00 0.00 C ATOM 48 NZ LYS A 3 4.096 -8.558 4.379 1.00 0.00 N ATOM 0 H LYS A 3 5.854 -4.787 -0.652 1.00 0.00 H new ATOM 0 HA LYS A 3 6.729 -3.568 1.901 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.625 -6.480 1.224 1.00 0.00 H new ATOM 0 HB3 LYS A 3 6.696 -5.708 2.796 1.00 0.00 H new ATOM 0 HG2 LYS A 3 4.418 -4.809 2.491 1.00 0.00 H new ATOM 0 HG3 LYS A 3 4.343 -5.490 0.878 1.00 0.00 H new ATOM 0 HD2 LYS A 3 3.091 -6.804 2.613 1.00 0.00 H new ATOM 0 HD3 LYS A 3 4.270 -7.739 1.715 1.00 0.00 H new ATOM 0 HE2 LYS A 3 5.846 -7.667 3.594 1.00 0.00 H new ATOM 0 HE3 LYS A 3 4.807 -6.568 4.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 4.513 -8.775 5.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 3.089 -8.326 4.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 4.189 -9.385 3.756 1.00 0.00 H new ATOM 62 N VAL A 4 9.171 -3.835 1.608 1.00 0.00 N ATOM 63 CA VAL A 4 10.597 -3.727 1.366 1.00 0.00 C ATOM 64 C VAL A 4 11.330 -4.408 2.513 1.00 0.00 C ATOM 65 O VAL A 4 10.813 -4.459 3.631 1.00 0.00 O ATOM 66 CB VAL A 4 11.043 -2.264 1.178 1.00 0.00 C ATOM 67 CG1 VAL A 4 12.501 -2.185 0.703 1.00 0.00 C ATOM 68 CG2 VAL A 4 10.135 -1.488 0.210 1.00 0.00 C ATOM 0 H VAL A 4 8.877 -3.405 2.485 1.00 0.00 H new ATOM 0 HA VAL A 4 10.846 -4.228 0.430 1.00 0.00 H new ATOM 0 HB VAL A 4 10.960 -1.793 2.157 1.00 0.00 H new ATOM 0 HG11 VAL A 4 12.787 -1.141 0.579 1.00 0.00 H new ATOM 0 HG12 VAL A 4 13.150 -2.654 1.442 1.00 0.00 H new ATOM 0 HG13 VAL A 4 12.602 -2.704 -0.250 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.496 -0.464 0.115 1.00 0.00 H new ATOM 0 HG22 VAL A 4 10.149 -1.970 -0.768 1.00 0.00 H new ATOM 0 HG23 VAL A 4 9.115 -1.479 0.595 1.00 0.00 H new ATOM 78 N MET A 5 12.546 -4.882 2.263 1.00 0.00 N ATOM 79 CA MET A 5 13.382 -5.528 3.253 1.00 0.00 C ATOM 80 C MET A 5 14.809 -5.045 3.057 1.00 0.00 C ATOM 81 O MET A 5 15.247 -4.896 1.912 1.00 0.00 O ATOM 82 CB MET A 5 13.318 -7.027 2.997 1.00 0.00 C ATOM 83 CG MET A 5 14.096 -7.862 4.015 1.00 0.00 C ATOM 84 SD MET A 5 13.499 -7.773 5.718 1.00 0.00 S ATOM 85 CE MET A 5 12.010 -8.799 5.549 1.00 0.00 C ATOM 0 H MET A 5 12.982 -4.823 1.343 1.00 0.00 H new ATOM 0 HA MET A 5 13.052 -5.300 4.266 1.00 0.00 H new ATOM 0 HB2 MET A 5 12.275 -7.343 3.004 1.00 0.00 H new ATOM 0 HB3 MET A 5 13.707 -7.233 2.000 1.00 0.00 H new ATOM 0 HG2 MET A 5 14.075 -8.904 3.696 1.00 0.00 H new ATOM 0 HG3 MET A 5 15.139 -7.545 3.997 1.00 0.00 H new ATOM 0 HE1 MET A 5 11.520 -8.891 6.518 1.00 0.00 H new ATOM 0 HE2 MET A 5 11.326 -8.334 4.839 1.00 0.00 H new ATOM 0 HE3 MET A 5 12.289 -9.789 5.188 1.00 0.00 H new ATOM 95 N PHE A 6 15.537 -4.900 4.162 1.00 0.00 N ATOM 96 CA PHE A 6 16.950 -4.566 4.187 1.00 0.00 C ATOM 97 C PHE A 6 17.604 -5.641 5.044 1.00 0.00 C ATOM 98 O PHE A 6 17.159 -5.864 6.167 1.00 0.00 O ATOM 99 CB PHE A 6 17.125 -3.152 4.752 1.00 0.00 C ATOM 100 CG PHE A 6 16.499 -2.109 3.859 1.00 0.00 C ATOM 101 CD1 PHE A 6 17.200 -1.611 2.747 1.00 0.00 C ATOM 102 CD2 PHE A 6 15.163 -1.738 4.067 1.00 0.00 C ATOM 103 CE1 PHE A 6 16.558 -0.755 1.839 1.00 0.00 C ATOM 104 CE2 PHE A 6 14.518 -0.907 3.144 1.00 0.00 C ATOM 105 CZ PHE A 6 15.215 -0.399 2.036 1.00 0.00 C ATOM 0 H PHE A 6 15.141 -5.017 5.095 1.00 0.00 H new ATOM 0 HA PHE A 6 17.413 -4.551 3.200 1.00 0.00 H new ATOM 0 HB2 PHE A 6 16.675 -3.099 5.743 1.00 0.00 H new ATOM 0 HB3 PHE A 6 18.187 -2.938 4.872 1.00 0.00 H new ATOM 0 HD1 PHE A 6 18.232 -1.887 2.591 1.00 0.00 H new ATOM 0 HD2 PHE A 6 14.632 -2.093 4.938 1.00 0.00 H new ATOM 0 HE1 PHE A 6 17.098 -0.370 0.987 1.00 0.00 H new ATOM 0 HE2 PHE A 6 13.477 -0.655 3.285 1.00 0.00 H new ATOM 0 HZ PHE A 6 14.720 0.262 1.339 1.00 0.00 H new ATOM 115 N VAL A 7 18.627 -6.323 4.538 1.00 0.00 N ATOM 116 CA VAL A 7 19.173 -7.519 5.181 1.00 0.00 C ATOM 117 C VAL A 7 20.625 -7.255 5.561 1.00 0.00 C ATOM 118 O VAL A 7 21.384 -6.753 4.739 1.00 0.00 O ATOM 119 CB VAL A 7 18.998 -8.732 4.234 1.00 0.00 C ATOM 120 CG1 VAL A 7 19.332 -10.052 4.937 1.00 0.00 C ATOM 121 CG2 VAL A 7 17.576 -8.839 3.634 1.00 0.00 C ATOM 0 H VAL A 7 19.102 -6.065 3.673 1.00 0.00 H new ATOM 0 HA VAL A 7 18.638 -7.757 6.100 1.00 0.00 H new ATOM 0 HB VAL A 7 19.700 -8.556 3.419 1.00 0.00 H new ATOM 0 HG11 VAL A 7 19.197 -10.879 4.240 1.00 0.00 H new ATOM 0 HG12 VAL A 7 20.367 -10.030 5.279 1.00 0.00 H new ATOM 0 HG13 VAL A 7 18.670 -10.186 5.792 1.00 0.00 H new ATOM 0 HG21 VAL A 7 17.521 -9.710 2.980 1.00 0.00 H new ATOM 0 HG22 VAL A 7 16.848 -8.943 4.439 1.00 0.00 H new ATOM 0 HG23 VAL A 7 17.355 -7.940 3.059 1.00 0.00 H new ATOM 131 N CYS A 8 21.000 -7.551 6.806 1.00 0.00 N ATOM 132 CA CYS A 8 22.339 -7.314 7.349 1.00 0.00 C ATOM 133 C CYS A 8 23.009 -8.629 7.767 1.00 0.00 C ATOM 134 O CYS A 8 22.335 -9.623 8.039 1.00 0.00 O ATOM 135 CB CYS A 8 22.214 -6.368 8.566 1.00 0.00 C ATOM 136 SG CYS A 8 23.694 -5.325 8.727 1.00 0.00 S ATOM 0 H CYS A 8 20.364 -7.973 7.483 1.00 0.00 H new ATOM 0 HA CYS A 8 22.963 -6.859 6.580 1.00 0.00 H new ATOM 0 HB2 CYS A 8 21.331 -5.739 8.454 1.00 0.00 H new ATOM 0 HB3 CYS A 8 22.076 -6.954 9.475 1.00 0.00 H new ATOM 0 HG CYS A 8 23.562 -4.540 9.754 1.00 0.00 H new ATOM 142 N LYS A 9 24.343 -8.591 7.900 1.00 0.00 N ATOM 143 CA LYS A 9 25.171 -9.682 8.437 1.00 0.00 C ATOM 144 C LYS A 9 26.307 -9.091 9.294 1.00 0.00 C ATOM 145 O LYS A 9 27.440 -9.569 9.276 1.00 0.00 O ATOM 146 CB LYS A 9 25.644 -10.564 7.258 1.00 0.00 C ATOM 147 CG LYS A 9 26.043 -11.984 7.695 1.00 0.00 C ATOM 148 CD LYS A 9 26.477 -12.828 6.486 1.00 0.00 C ATOM 149 CE LYS A 9 26.782 -14.290 6.856 1.00 0.00 C ATOM 150 NZ LYS A 9 28.009 -14.448 7.685 1.00 0.00 N ATOM 0 H LYS A 9 24.893 -7.776 7.629 1.00 0.00 H new ATOM 0 HA LYS A 9 24.608 -10.332 9.107 1.00 0.00 H new ATOM 0 HB2 LYS A 9 24.848 -10.628 6.516 1.00 0.00 H new ATOM 0 HB3 LYS A 9 26.495 -10.086 6.772 1.00 0.00 H new ATOM 0 HG2 LYS A 9 26.857 -11.931 8.418 1.00 0.00 H new ATOM 0 HG3 LYS A 9 25.203 -12.464 8.196 1.00 0.00 H new ATOM 0 HD2 LYS A 9 25.690 -12.806 5.732 1.00 0.00 H new ATOM 0 HD3 LYS A 9 27.363 -12.380 6.035 1.00 0.00 H new ATOM 0 HE2 LYS A 9 25.931 -14.705 7.397 1.00 0.00 H new ATOM 0 HE3 LYS A 9 26.893 -14.873 5.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 28.156 -15.455 7.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 28.830 -14.081 7.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 27.898 -13.918 8.573 1.00 0.00 H new ATOM 164 N ARG A 10 26.025 -7.984 9.990 1.00 0.00 N ATOM 165 CA ARG A 10 26.989 -7.218 10.791 1.00 0.00 C ATOM 166 C ARG A 10 26.306 -6.722 12.060 1.00 0.00 C ATOM 167 O ARG A 10 25.080 -6.778 12.161 1.00 0.00 O ATOM 168 CB ARG A 10 27.549 -6.042 9.946 1.00 0.00 C ATOM 169 CG ARG A 10 28.873 -6.383 9.260 1.00 0.00 C ATOM 170 CD ARG A 10 30.021 -6.560 10.268 1.00 0.00 C ATOM 171 NE ARG A 10 31.289 -6.703 9.552 1.00 0.00 N ATOM 172 CZ ARG A 10 31.957 -7.807 9.212 1.00 0.00 C ATOM 173 NH1 ARG A 10 31.502 -9.027 9.502 1.00 0.00 N ATOM 174 NH2 ARG A 10 33.097 -7.648 8.558 1.00 0.00 N ATOM 0 H ARG A 10 25.088 -7.582 10.012 1.00 0.00 H new ATOM 0 HA ARG A 10 27.828 -7.851 11.081 1.00 0.00 H new ATOM 0 HB2 ARG A 10 26.815 -5.762 9.190 1.00 0.00 H new ATOM 0 HB3 ARG A 10 27.691 -5.174 10.589 1.00 0.00 H new ATOM 0 HG2 ARG A 10 28.755 -7.299 8.682 1.00 0.00 H new ATOM 0 HG3 ARG A 10 29.129 -5.592 8.555 1.00 0.00 H new ATOM 0 HD2 ARG A 10 30.065 -5.701 10.938 1.00 0.00 H new ATOM 0 HD3 ARG A 10 29.841 -7.438 10.888 1.00 0.00 H new ATOM 0 HE ARG A 10 31.729 -5.827 9.270 1.00 0.00 H new ATOM 0 HH11 ARG A 10 30.618 -9.137 9.999 1.00 0.00 H new ATOM 0 HH12 ARG A 10 32.038 -9.850 9.227 1.00 0.00 H new ATOM 0 HH21 ARG A 10 33.430 -6.710 8.335 1.00 0.00 H new ATOM 0 HH22 ARG A 10 33.642 -8.463 8.278 1.00 0.00 H new ATOM 188 N ASN A 11 27.121 -6.224 12.997 1.00 0.00 N ATOM 189 CA ASN A 11 26.690 -5.509 14.202 1.00 0.00 C ATOM 190 C ASN A 11 25.632 -4.480 13.802 1.00 0.00 C ATOM 191 O ASN A 11 25.919 -3.645 12.947 1.00 0.00 O ATOM 192 CB ASN A 11 27.921 -4.847 14.851 1.00 0.00 C ATOM 193 CG ASN A 11 27.563 -4.049 16.102 1.00 0.00 C ATOM 194 OD1 ASN A 11 27.605 -4.573 17.210 1.00 0.00 O ATOM 195 ND2 ASN A 11 27.232 -2.775 15.960 1.00 0.00 N ATOM 0 H ASN A 11 28.135 -6.311 12.934 1.00 0.00 H new ATOM 0 HA ASN A 11 26.248 -6.187 14.932 1.00 0.00 H new ATOM 0 HB2 ASN A 11 28.649 -5.616 15.110 1.00 0.00 H new ATOM 0 HB3 ASN A 11 28.399 -4.187 14.127 1.00 0.00 H new ATOM 0 HD21 ASN A 11 27.007 -2.212 16.780 1.00 0.00 H new ATOM 0 HD22 ASN A 11 27.202 -2.356 15.030 1.00 0.00 H new ATOM 202 N SER A 12 24.436 -4.573 14.386 1.00 0.00 N ATOM 203 CA SER A 12 23.216 -3.860 14.022 1.00 0.00 C ATOM 204 C SER A 12 23.439 -2.389 13.643 1.00 0.00 C ATOM 205 O SER A 12 23.556 -1.535 14.520 1.00 0.00 O ATOM 206 CB SER A 12 22.238 -4.010 15.188 1.00 0.00 C ATOM 207 OG SER A 12 22.103 -5.381 15.542 1.00 0.00 O ATOM 0 H SER A 12 24.287 -5.193 15.182 1.00 0.00 H new ATOM 0 HA SER A 12 22.810 -4.302 13.112 1.00 0.00 H new ATOM 0 HB2 SER A 12 22.593 -3.439 16.046 1.00 0.00 H new ATOM 0 HB3 SER A 12 21.266 -3.601 14.912 1.00 0.00 H new ATOM 0 HG SER A 12 21.553 -5.458 16.350 1.00 0.00 H new ATOM 213 N CYS A 13 23.520 -2.081 12.338 1.00 0.00 N ATOM 214 CA CYS A 13 23.678 -0.704 11.865 1.00 0.00 C ATOM 215 C CYS A 13 23.226 -0.529 10.413 1.00 0.00 C ATOM 216 O CYS A 13 22.072 -0.175 10.201 1.00 0.00 O ATOM 217 CB CYS A 13 25.132 -0.237 12.114 1.00 0.00 C ATOM 218 SG CYS A 13 25.370 1.473 11.533 1.00 0.00 S ATOM 0 H CYS A 13 23.478 -2.775 11.591 1.00 0.00 H new ATOM 0 HA CYS A 13 23.015 -0.057 12.439 1.00 0.00 H new ATOM 0 HB2 CYS A 13 25.362 -0.300 13.178 1.00 0.00 H new ATOM 0 HB3 CYS A 13 25.826 -0.901 11.598 1.00 0.00 H new ATOM 0 HG CYS A 13 26.140 2.111 12.364 1.00 0.00 H new ATOM 224 N ARG A 14 24.082 -0.804 9.415 1.00 0.00 N ATOM 225 CA ARG A 14 23.836 -0.423 8.007 1.00 0.00 C ATOM 226 C ARG A 14 22.438 -0.713 7.472 1.00 0.00 C ATOM 227 O ARG A 14 21.763 0.209 7.031 1.00 0.00 O ATOM 228 CB ARG A 14 25.024 -0.815 7.088 1.00 0.00 C ATOM 229 CG ARG A 14 25.361 -2.307 6.908 1.00 0.00 C ATOM 230 CD ARG A 14 26.630 -2.497 6.046 1.00 0.00 C ATOM 231 NE ARG A 14 26.782 -3.908 5.617 1.00 0.00 N ATOM 232 CZ ARG A 14 27.866 -4.434 5.023 1.00 0.00 C ATOM 233 NH1 ARG A 14 28.936 -3.688 4.791 1.00 0.00 N ATOM 234 NH2 ARG A 14 27.874 -5.710 4.658 1.00 0.00 N ATOM 0 H ARG A 14 24.964 -1.296 9.557 1.00 0.00 H new ATOM 0 HA ARG A 14 23.813 0.667 7.993 1.00 0.00 H new ATOM 0 HB2 ARG A 14 24.828 -0.399 6.100 1.00 0.00 H new ATOM 0 HB3 ARG A 14 25.916 -0.319 7.471 1.00 0.00 H new ATOM 0 HG2 ARG A 14 25.510 -2.769 7.884 1.00 0.00 H new ATOM 0 HG3 ARG A 14 24.520 -2.818 6.439 1.00 0.00 H new ATOM 0 HD2 ARG A 14 26.577 -1.852 5.169 1.00 0.00 H new ATOM 0 HD3 ARG A 14 27.508 -2.191 6.615 1.00 0.00 H new ATOM 0 HE ARG A 14 25.995 -4.534 5.788 1.00 0.00 H new ATOM 0 HH11 ARG A 14 28.941 -2.705 5.064 1.00 0.00 H new ATOM 0 HH12 ARG A 14 29.754 -4.096 4.339 1.00 0.00 H new ATOM 0 HH21 ARG A 14 27.055 -6.294 4.828 1.00 0.00 H new ATOM 0 HH22 ARG A 14 28.699 -6.106 4.207 1.00 0.00 H new ATOM 248 N SER A 15 21.935 -1.933 7.593 1.00 0.00 N ATOM 249 CA SER A 15 20.649 -2.259 6.973 1.00 0.00 C ATOM 250 C SER A 15 19.461 -1.868 7.868 1.00 0.00 C ATOM 251 O SER A 15 18.393 -1.531 7.365 1.00 0.00 O ATOM 252 CB SER A 15 20.640 -3.722 6.551 1.00 0.00 C ATOM 253 OG SER A 15 21.975 -4.200 6.409 1.00 0.00 O ATOM 0 H SER A 15 22.380 -2.699 8.100 1.00 0.00 H new ATOM 0 HA SER A 15 20.525 -1.660 6.071 1.00 0.00 H new ATOM 0 HB2 SER A 15 20.109 -4.319 7.292 1.00 0.00 H new ATOM 0 HB3 SER A 15 20.104 -3.833 5.609 1.00 0.00 H new ATOM 0 HG SER A 15 22.380 -4.306 7.295 1.00 0.00 H new ATOM 259 N GLN A 16 19.644 -1.829 9.191 1.00 0.00 N ATOM 260 CA GLN A 16 18.636 -1.304 10.122 1.00 0.00 C ATOM 261 C GLN A 16 18.458 0.203 9.881 1.00 0.00 C ATOM 262 O GLN A 16 17.333 0.693 9.843 1.00 0.00 O ATOM 263 CB GLN A 16 19.084 -1.655 11.552 1.00 0.00 C ATOM 264 CG GLN A 16 18.235 -1.074 12.710 1.00 0.00 C ATOM 265 CD GLN A 16 19.029 -0.962 14.018 1.00 0.00 C ATOM 266 OE1 GLN A 16 20.064 -1.586 14.204 1.00 0.00 O ATOM 267 NE2 GLN A 16 18.604 -0.122 14.951 1.00 0.00 N ATOM 0 H GLN A 16 20.494 -2.160 9.648 1.00 0.00 H new ATOM 0 HA GLN A 16 17.656 -1.754 9.964 1.00 0.00 H new ATOM 0 HB2 GLN A 16 19.093 -2.741 11.649 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.112 -1.315 11.680 1.00 0.00 H new ATOM 0 HG2 GLN A 16 17.865 -0.088 12.427 1.00 0.00 H new ATOM 0 HG3 GLN A 16 17.363 -1.707 12.871 1.00 0.00 H new ATOM 0 HE21 GLN A 16 17.742 0.405 14.809 1.00 0.00 H new ATOM 0 HE22 GLN A 16 19.139 -0.002 15.811 1.00 0.00 H new ATOM 276 N MET A 17 19.552 0.935 9.648 1.00 0.00 N ATOM 277 CA MET A 17 19.497 2.336 9.236 1.00 0.00 C ATOM 278 C MET A 17 18.811 2.449 7.893 1.00 0.00 C ATOM 279 O MET A 17 18.017 3.360 7.695 1.00 0.00 O ATOM 280 CB MET A 17 20.911 2.912 9.128 1.00 0.00 C ATOM 281 CG MET A 17 20.941 4.340 8.541 1.00 0.00 C ATOM 282 SD MET A 17 20.195 5.719 9.459 1.00 0.00 S ATOM 283 CE MET A 17 18.382 5.693 9.378 1.00 0.00 C ATOM 0 H MET A 17 20.500 0.570 9.741 1.00 0.00 H new ATOM 0 HA MET A 17 18.936 2.897 9.984 1.00 0.00 H new ATOM 0 HB2 MET A 17 21.369 2.923 10.117 1.00 0.00 H new ATOM 0 HB3 MET A 17 21.517 2.256 8.503 1.00 0.00 H new ATOM 0 HG2 MET A 17 21.986 4.596 8.366 1.00 0.00 H new ATOM 0 HG3 MET A 17 20.455 4.299 7.566 1.00 0.00 H new ATOM 0 HE1 MET A 17 17.984 6.592 9.849 1.00 0.00 H new ATOM 0 HE2 MET A 17 18.065 5.659 8.336 1.00 0.00 H new ATOM 0 HE3 MET A 17 18.007 4.813 9.901 1.00 0.00 H new ATOM 293 N ALA A 18 19.095 1.535 6.973 1.00 0.00 N ATOM 294 CA ALA A 18 18.499 1.597 5.655 1.00 0.00 C ATOM 295 C ALA A 18 16.983 1.510 5.764 1.00 0.00 C ATOM 296 O ALA A 18 16.295 2.279 5.102 1.00 0.00 O ATOM 297 CB ALA A 18 19.115 0.502 4.789 1.00 0.00 C ATOM 0 H ALA A 18 19.730 0.750 7.119 1.00 0.00 H new ATOM 0 HA ALA A 18 18.710 2.551 5.171 1.00 0.00 H new ATOM 0 HB1 ALA A 18 18.675 0.536 3.792 1.00 0.00 H new ATOM 0 HB2 ALA A 18 20.191 0.658 4.717 1.00 0.00 H new ATOM 0 HB3 ALA A 18 18.919 -0.471 5.239 1.00 0.00 H new ATOM 303 N GLU A 19 16.459 0.708 6.696 1.00 0.00 N ATOM 304 CA GLU A 19 15.038 0.732 6.993 1.00 0.00 C ATOM 305 C GLU A 19 14.617 2.065 7.607 1.00 0.00 C ATOM 306 O GLU A 19 13.555 2.564 7.246 1.00 0.00 O ATOM 307 CB GLU A 19 14.618 -0.417 7.914 1.00 0.00 C ATOM 308 CG GLU A 19 13.122 -0.703 7.693 1.00 0.00 C ATOM 309 CD GLU A 19 12.381 -1.232 8.923 1.00 0.00 C ATOM 310 OE1 GLU A 19 12.832 -2.226 9.529 1.00 0.00 O ATOM 311 OE2 GLU A 19 11.356 -0.632 9.310 1.00 0.00 O ATOM 0 H GLU A 19 16.998 0.042 7.249 1.00 0.00 H new ATOM 0 HA GLU A 19 14.526 0.605 6.039 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.209 -1.308 7.701 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.803 -0.154 8.955 1.00 0.00 H new ATOM 0 HG2 GLU A 19 12.636 0.214 7.360 1.00 0.00 H new ATOM 0 HG3 GLU A 19 13.021 -1.428 6.885 1.00 0.00 H new ATOM 318 N GLY A 20 15.404 2.676 8.502 1.00 0.00 N ATOM 319 CA GLY A 20 15.022 3.931 9.139 1.00 0.00 C ATOM 320 C GLY A 20 14.899 5.048 8.115 1.00 0.00 C ATOM 321 O GLY A 20 13.897 5.755 8.096 1.00 0.00 O ATOM 0 H GLY A 20 16.311 2.316 8.798 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.073 3.804 9.660 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.764 4.202 9.890 1.00 0.00 H new ATOM 325 N PHE A 21 15.861 5.165 7.195 1.00 0.00 N ATOM 326 CA PHE A 21 15.766 6.116 6.090 1.00 0.00 C ATOM 327 C PHE A 21 14.612 5.711 5.183 1.00 0.00 C ATOM 328 O PHE A 21 13.862 6.579 4.757 1.00 0.00 O ATOM 329 CB PHE A 21 17.077 6.198 5.289 1.00 0.00 C ATOM 330 CG PHE A 21 18.162 7.089 5.866 1.00 0.00 C ATOM 331 CD1 PHE A 21 17.916 8.460 6.078 1.00 0.00 C ATOM 332 CD2 PHE A 21 19.449 6.581 6.112 1.00 0.00 C ATOM 333 CE1 PHE A 21 18.934 9.300 6.562 1.00 0.00 C ATOM 334 CE2 PHE A 21 20.462 7.420 6.589 1.00 0.00 C ATOM 335 CZ PHE A 21 20.209 8.781 6.824 1.00 0.00 C ATOM 0 H PHE A 21 16.716 4.609 7.196 1.00 0.00 H new ATOM 0 HA PHE A 21 15.583 7.108 6.503 1.00 0.00 H new ATOM 0 HB2 PHE A 21 17.480 5.190 5.187 1.00 0.00 H new ATOM 0 HB3 PHE A 21 16.843 6.550 4.284 1.00 0.00 H new ATOM 0 HD1 PHE A 21 16.939 8.868 5.867 1.00 0.00 H new ATOM 0 HD2 PHE A 21 19.657 5.537 5.932 1.00 0.00 H new ATOM 0 HE1 PHE A 21 18.733 10.347 6.732 1.00 0.00 H new ATOM 0 HE2 PHE A 21 21.446 7.018 6.778 1.00 0.00 H new ATOM 0 HZ PHE A 21 20.991 9.422 7.204 1.00 0.00 H new ATOM 345 N ALA A 22 14.420 4.424 4.888 1.00 0.00 N ATOM 346 CA ALA A 22 13.411 3.998 3.922 1.00 0.00 C ATOM 347 C ALA A 22 11.992 4.205 4.456 1.00 0.00 C ATOM 348 O ALA A 22 11.124 4.600 3.692 1.00 0.00 O ATOM 349 CB ALA A 22 13.693 2.556 3.488 1.00 0.00 C ATOM 0 H ALA A 22 14.951 3.660 5.305 1.00 0.00 H new ATOM 0 HA ALA A 22 13.475 4.626 3.034 1.00 0.00 H new ATOM 0 HB1 ALA A 22 12.939 2.239 2.767 1.00 0.00 H new ATOM 0 HB2 ALA A 22 14.680 2.501 3.029 1.00 0.00 H new ATOM 0 HB3 ALA A 22 13.660 1.901 4.359 1.00 0.00 H new ATOM 355 N LYS A 23 11.731 4.030 5.753 1.00 0.00 N ATOM 356 CA LYS A 23 10.420 4.301 6.348 1.00 0.00 C ATOM 357 C LYS A 23 10.184 5.790 6.616 1.00 0.00 C ATOM 358 O LYS A 23 9.047 6.199 6.820 1.00 0.00 O ATOM 359 CB LYS A 23 10.214 3.414 7.588 1.00 0.00 C ATOM 360 CG LYS A 23 10.945 3.893 8.857 1.00 0.00 C ATOM 361 CD LYS A 23 11.115 2.772 9.893 1.00 0.00 C ATOM 362 CE LYS A 23 9.773 2.213 10.400 1.00 0.00 C ATOM 363 NZ LYS A 23 9.950 0.906 11.080 1.00 0.00 N ATOM 0 H LYS A 23 12.424 3.696 6.422 1.00 0.00 H new ATOM 0 HA LYS A 23 9.653 4.034 5.621 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.147 3.355 7.801 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.548 2.403 7.353 1.00 0.00 H new ATOM 0 HG2 LYS A 23 11.925 4.283 8.583 1.00 0.00 H new ATOM 0 HG3 LYS A 23 10.389 4.716 9.305 1.00 0.00 H new ATOM 0 HD2 LYS A 23 11.696 1.962 9.452 1.00 0.00 H new ATOM 0 HD3 LYS A 23 11.688 3.151 10.740 1.00 0.00 H new ATOM 0 HE2 LYS A 23 9.319 2.924 11.090 1.00 0.00 H new ATOM 0 HE3 LYS A 23 9.086 2.098 9.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 9.087 0.671 11.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 10.132 0.168 10.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 10.755 0.962 11.736 1.00 0.00 H new ATOM 377 N THR A 24 11.248 6.589 6.600 1.00 0.00 N ATOM 378 CA THR A 24 11.224 8.043 6.654 1.00 0.00 C ATOM 379 C THR A 24 10.895 8.596 5.259 1.00 0.00 C ATOM 380 O THR A 24 9.981 9.402 5.097 1.00 0.00 O ATOM 381 CB THR A 24 12.620 8.459 7.172 1.00 0.00 C ATOM 382 OG1 THR A 24 12.671 8.323 8.576 1.00 0.00 O ATOM 383 CG2 THR A 24 13.131 9.837 6.764 1.00 0.00 C ATOM 0 H THR A 24 12.197 6.218 6.546 1.00 0.00 H new ATOM 0 HA THR A 24 10.458 8.445 7.317 1.00 0.00 H new ATOM 0 HB THR A 24 13.300 7.771 6.670 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.091 7.468 8.807 1.00 0.00 H new ATOM 0 HG21 THR A 24 14.119 10.001 7.194 1.00 0.00 H new ATOM 0 HG22 THR A 24 13.194 9.894 5.677 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.445 10.602 7.128 1.00 0.00 H new ATOM 391 N LEU A 25 11.626 8.133 4.243 1.00 0.00 N ATOM 392 CA LEU A 25 11.624 8.680 2.890 1.00 0.00 C ATOM 393 C LEU A 25 10.546 8.043 2.004 1.00 0.00 C ATOM 394 O LEU A 25 10.043 8.680 1.081 1.00 0.00 O ATOM 395 CB LEU A 25 13.008 8.448 2.263 1.00 0.00 C ATOM 396 CG LEU A 25 14.153 9.307 2.820 1.00 0.00 C ATOM 397 CD1 LEU A 25 15.472 8.871 2.170 1.00 0.00 C ATOM 398 CD2 LEU A 25 13.945 10.806 2.570 1.00 0.00 C ATOM 0 H LEU A 25 12.257 7.338 4.346 1.00 0.00 H new ATOM 0 HA LEU A 25 11.399 9.744 2.956 1.00 0.00 H new ATOM 0 HB2 LEU A 25 13.272 7.398 2.392 1.00 0.00 H new ATOM 0 HB3 LEU A 25 12.934 8.628 1.191 1.00 0.00 H new ATOM 0 HG LEU A 25 14.177 9.155 3.899 1.00 0.00 H new ATOM 0 HD11 LEU A 25 16.289 9.478 2.562 1.00 0.00 H new ATOM 0 HD12 LEU A 25 15.659 7.821 2.396 1.00 0.00 H new ATOM 0 HD13 LEU A 25 15.407 9.004 1.090 1.00 0.00 H new ATOM 0 HD21 LEU A 25 14.784 11.364 2.985 1.00 0.00 H new ATOM 0 HD22 LEU A 25 13.881 10.991 1.498 1.00 0.00 H new ATOM 0 HD23 LEU A 25 13.021 11.130 3.050 1.00 0.00 H new ATOM 410 N GLY A 26 10.183 6.792 2.300 1.00 0.00 N ATOM 411 CA GLY A 26 9.203 5.978 1.582 1.00 0.00 C ATOM 412 C GLY A 26 7.846 5.973 2.286 1.00 0.00 C ATOM 413 O GLY A 26 6.992 5.136 1.990 1.00 0.00 O ATOM 0 H GLY A 26 10.589 6.294 3.092 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.085 6.361 0.568 1.00 0.00 H new ATOM 0 HA3 GLY A 26 9.572 4.956 1.496 1.00 0.00 H new ATOM 417 N ALA A 27 7.656 6.863 3.259 1.00 0.00 N ATOM 418 CA ALA A 27 6.497 6.908 4.128 1.00 0.00 C ATOM 419 C ALA A 27 5.235 7.124 3.295 1.00 0.00 C ATOM 420 O ALA A 27 5.127 8.107 2.559 1.00 0.00 O ATOM 421 CB ALA A 27 6.701 8.023 5.166 1.00 0.00 C ATOM 0 H ALA A 27 8.334 7.596 3.465 1.00 0.00 H new ATOM 0 HA ALA A 27 6.377 5.963 4.659 1.00 0.00 H new ATOM 0 HB1 ALA A 27 5.835 8.068 5.827 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.595 7.814 5.753 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.817 8.979 4.655 1.00 0.00 H new ATOM 427 N GLY A 28 4.289 6.187 3.398 1.00 0.00 N ATOM 428 CA GLY A 28 3.018 6.258 2.679 1.00 0.00 C ATOM 429 C GLY A 28 3.127 5.866 1.209 1.00 0.00 C ATOM 430 O GLY A 28 2.184 6.081 0.448 1.00 0.00 O ATOM 0 H GLY A 28 4.385 5.357 3.984 1.00 0.00 H new ATOM 0 HA2 GLY A 28 2.296 5.604 3.168 1.00 0.00 H new ATOM 0 HA3 GLY A 28 2.627 7.273 2.748 1.00 0.00 H new ATOM 434 N LYS A 29 4.265 5.298 0.795 1.00 0.00 N ATOM 435 CA LYS A 29 4.555 4.885 -0.567 1.00 0.00 C ATOM 436 C LYS A 29 4.947 3.418 -0.570 1.00 0.00 C ATOM 437 O LYS A 29 4.680 2.713 -1.536 1.00 0.00 O ATOM 438 CB LYS A 29 5.686 5.755 -1.123 1.00 0.00 C ATOM 439 CG LYS A 29 5.317 7.242 -1.200 1.00 0.00 C ATOM 440 CD LYS A 29 4.287 7.558 -2.301 1.00 0.00 C ATOM 441 CE LYS A 29 4.022 9.067 -2.452 1.00 0.00 C ATOM 442 NZ LYS A 29 3.293 9.652 -1.292 1.00 0.00 N ATOM 0 H LYS A 29 5.037 5.109 1.434 1.00 0.00 H new ATOM 0 HA LYS A 29 3.676 5.010 -1.199 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.569 5.638 -0.495 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.953 5.401 -2.119 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.918 7.561 -0.237 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.221 7.825 -1.379 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.643 7.159 -3.251 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.350 7.050 -2.073 1.00 0.00 H new ATOM 0 HE2 LYS A 29 4.973 9.586 -2.575 1.00 0.00 H new ATOM 0 HE3 LYS A 29 3.445 9.239 -3.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 3.145 10.669 -1.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 2.372 9.180 -1.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 3.853 9.516 -0.426 1.00 0.00 H new ATOM 456 N ILE A 30 5.533 2.938 0.526 1.00 0.00 N ATOM 457 CA ILE A 30 5.963 1.561 0.726 1.00 0.00 C ATOM 458 C ILE A 30 5.735 1.156 2.187 1.00 0.00 C ATOM 459 O ILE A 30 5.396 1.987 3.029 1.00 0.00 O ATOM 460 CB ILE A 30 7.453 1.429 0.337 1.00 0.00 C ATOM 461 CG1 ILE A 30 8.371 2.414 1.094 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.625 1.605 -1.179 1.00 0.00 C ATOM 463 CD1 ILE A 30 9.827 1.950 1.190 1.00 0.00 C ATOM 0 H ILE A 30 5.728 3.529 1.334 1.00 0.00 H new ATOM 0 HA ILE A 30 5.379 0.892 0.093 1.00 0.00 H new ATOM 0 HB ILE A 30 7.762 0.426 0.631 1.00 0.00 H new ATOM 0 HG12 ILE A 30 8.340 3.382 0.595 1.00 0.00 H new ATOM 0 HG13 ILE A 30 7.979 2.562 2.100 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.679 1.510 -1.439 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.052 0.839 -1.702 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.266 2.591 -1.474 1.00 0.00 H new ATOM 0 HD11 ILE A 30 10.410 2.692 1.735 1.00 0.00 H new ATOM 0 HD12 ILE A 30 9.871 0.997 1.716 1.00 0.00 H new ATOM 0 HD13 ILE A 30 10.238 1.830 0.187 1.00 0.00 H new ATOM 475 N ALA A 31 5.954 -0.128 2.464 1.00 0.00 N ATOM 476 CA ALA A 31 6.031 -0.713 3.798 1.00 0.00 C ATOM 477 C ALA A 31 7.457 -1.228 3.887 1.00 0.00 C ATOM 478 O ALA A 31 7.999 -1.686 2.886 1.00 0.00 O ATOM 479 CB ALA A 31 5.000 -1.835 3.948 1.00 0.00 C ATOM 0 H ALA A 31 6.089 -0.821 1.728 1.00 0.00 H new ATOM 0 HA ALA A 31 5.807 -0.006 4.597 1.00 0.00 H new ATOM 0 HB1 ALA A 31 5.070 -2.262 4.949 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.999 -1.432 3.794 1.00 0.00 H new ATOM 0 HB3 ALA A 31 5.196 -2.611 3.208 1.00 0.00 H new ATOM 485 N VAL A 32 8.082 -1.161 5.052 1.00 0.00 N ATOM 486 CA VAL A 32 9.509 -1.381 5.185 1.00 0.00 C ATOM 487 C VAL A 32 9.834 -2.324 6.366 1.00 0.00 C ATOM 488 O VAL A 32 9.104 -2.330 7.363 1.00 0.00 O ATOM 489 CB VAL A 32 10.137 0.026 5.324 1.00 0.00 C ATOM 490 CG1 VAL A 32 11.527 0.048 4.717 1.00 0.00 C ATOM 491 CG2 VAL A 32 9.374 1.211 4.673 1.00 0.00 C ATOM 0 H VAL A 32 7.611 -0.952 5.932 1.00 0.00 H new ATOM 0 HA VAL A 32 9.927 -1.894 4.319 1.00 0.00 H new ATOM 0 HB VAL A 32 10.115 0.182 6.403 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.955 1.045 4.823 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.160 -0.675 5.231 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.466 -0.210 3.660 1.00 0.00 H new ATOM 0 HG21 VAL A 32 9.924 2.136 4.846 1.00 0.00 H new ATOM 0 HG22 VAL A 32 9.281 1.039 3.601 1.00 0.00 H new ATOM 0 HG23 VAL A 32 8.381 1.291 5.115 1.00 0.00 H new ATOM 501 N THR A 33 10.918 -3.111 6.251 1.00 0.00 N ATOM 502 CA THR A 33 11.318 -4.155 7.209 1.00 0.00 C ATOM 503 C THR A 33 12.860 -4.300 7.233 1.00 0.00 C ATOM 504 O THR A 33 13.519 -3.951 6.248 1.00 0.00 O ATOM 505 CB THR A 33 10.663 -5.502 6.827 1.00 0.00 C ATOM 506 OG1 THR A 33 9.495 -5.369 6.029 1.00 0.00 O ATOM 507 CG2 THR A 33 10.296 -6.347 8.050 1.00 0.00 C ATOM 0 H THR A 33 11.561 -3.035 5.462 1.00 0.00 H new ATOM 0 HA THR A 33 10.980 -3.866 8.204 1.00 0.00 H new ATOM 0 HB THR A 33 11.435 -6.002 6.241 1.00 0.00 H new ATOM 0 HG1 THR A 33 9.744 -5.054 5.135 1.00 0.00 H new ATOM 0 HG21 THR A 33 9.840 -7.281 7.723 1.00 0.00 H new ATOM 0 HG22 THR A 33 11.196 -6.564 8.625 1.00 0.00 H new ATOM 0 HG23 THR A 33 9.591 -5.798 8.673 1.00 0.00 H new ATOM 515 N SER A 34 13.446 -4.849 8.305 1.00 0.00 N ATOM 516 CA SER A 34 14.891 -5.052 8.481 1.00 0.00 C ATOM 517 C SER A 34 15.150 -6.492 8.939 1.00 0.00 C ATOM 518 O SER A 34 14.294 -7.115 9.574 1.00 0.00 O ATOM 519 CB SER A 34 15.476 -4.023 9.462 1.00 0.00 C ATOM 520 OG SER A 34 14.626 -3.790 10.565 1.00 0.00 O ATOM 0 H SER A 34 12.905 -5.177 9.105 1.00 0.00 H new ATOM 0 HA SER A 34 15.397 -4.898 7.528 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.444 -4.375 9.820 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.652 -3.084 8.938 1.00 0.00 H new ATOM 0 HG SER A 34 14.032 -3.036 10.367 1.00 0.00 H new ATOM 526 N CYS A 35 16.333 -7.027 8.636 1.00 0.00 N ATOM 527 CA CYS A 35 16.700 -8.408 8.888 1.00 0.00 C ATOM 528 C CYS A 35 18.190 -8.436 9.228 1.00 0.00 C ATOM 529 O CYS A 35 18.941 -7.600 8.726 1.00 0.00 O ATOM 530 CB CYS A 35 16.358 -9.201 7.616 1.00 0.00 C ATOM 531 SG CYS A 35 16.861 -10.933 7.744 1.00 0.00 S ATOM 0 H CYS A 35 17.080 -6.490 8.196 1.00 0.00 H new ATOM 0 HA CYS A 35 16.164 -8.857 9.724 1.00 0.00 H new ATOM 0 HB2 CYS A 35 15.285 -9.147 7.433 1.00 0.00 H new ATOM 0 HB3 CYS A 35 16.851 -8.742 6.759 1.00 0.00 H new ATOM 0 HG CYS A 35 16.710 -11.339 8.970 1.00 0.00 H new ATOM 537 N GLY A 36 18.621 -9.378 10.066 1.00 0.00 N ATOM 538 CA GLY A 36 19.996 -9.470 10.548 1.00 0.00 C ATOM 539 C GLY A 36 19.966 -9.184 12.043 1.00 0.00 C ATOM 540 O GLY A 36 19.410 -9.991 12.789 1.00 0.00 O ATOM 0 H GLY A 36 18.014 -10.110 10.434 1.00 0.00 H new ATOM 0 HA2 GLY A 36 20.407 -10.461 10.353 1.00 0.00 H new ATOM 0 HA3 GLY A 36 20.634 -8.753 10.031 1.00 0.00 H new ATOM 544 N LEU A 37 20.452 -8.003 12.462 1.00 0.00 N ATOM 545 CA LEU A 37 20.389 -7.528 13.835 1.00 0.00 C ATOM 546 C LEU A 37 21.237 -8.464 14.696 1.00 0.00 C ATOM 547 O LEU A 37 20.787 -9.005 15.705 1.00 0.00 O ATOM 548 CB LEU A 37 18.925 -7.323 14.267 1.00 0.00 C ATOM 549 CG LEU A 37 18.753 -6.275 15.377 1.00 0.00 C ATOM 550 CD1 LEU A 37 18.749 -4.856 14.794 1.00 0.00 C ATOM 551 CD2 LEU A 37 17.438 -6.466 16.144 1.00 0.00 C ATOM 0 H LEU A 37 20.909 -7.344 11.832 1.00 0.00 H new ATOM 0 HA LEU A 37 20.823 -6.536 13.959 1.00 0.00 H new ATOM 0 HB2 LEU A 37 18.338 -7.021 13.400 1.00 0.00 H new ATOM 0 HB3 LEU A 37 18.520 -8.275 14.611 1.00 0.00 H new ATOM 0 HG LEU A 37 19.595 -6.408 16.056 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.626 -4.132 15.600 1.00 0.00 H new ATOM 0 HD12 LEU A 37 19.693 -4.671 14.281 1.00 0.00 H new ATOM 0 HD13 LEU A 37 17.926 -4.755 14.087 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.355 -5.705 16.920 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.598 -6.375 15.455 1.00 0.00 H new ATOM 0 HD23 LEU A 37 17.425 -7.455 16.603 1.00 0.00 H new ATOM 563 N GLU A 38 22.476 -8.684 14.227 1.00 0.00 N ATOM 564 CA GLU A 38 23.425 -9.638 14.796 1.00 0.00 C ATOM 565 C GLU A 38 23.707 -9.325 16.261 1.00 0.00 C ATOM 566 O GLU A 38 24.081 -10.222 17.020 1.00 0.00 O ATOM 567 CB GLU A 38 24.752 -9.599 14.034 1.00 0.00 C ATOM 568 CG GLU A 38 24.636 -10.127 12.598 1.00 0.00 C ATOM 569 CD GLU A 38 24.349 -11.639 12.553 1.00 0.00 C ATOM 570 OE1 GLU A 38 25.299 -12.442 12.711 1.00 0.00 O ATOM 571 OE2 GLU A 38 23.178 -12.033 12.344 1.00 0.00 O ATOM 0 H GLU A 38 22.850 -8.186 13.419 1.00 0.00 H new ATOM 0 HA GLU A 38 22.975 -10.627 14.713 1.00 0.00 H new ATOM 0 HB2 GLU A 38 25.120 -8.573 14.009 1.00 0.00 H new ATOM 0 HB3 GLU A 38 25.492 -10.190 14.574 1.00 0.00 H new ATOM 0 HG2 GLU A 38 23.840 -9.593 12.080 1.00 0.00 H new ATOM 0 HG3 GLU A 38 25.561 -9.919 12.061 1.00 0.00 H new ATOM 578 N SER A 39 23.507 -8.067 16.662 1.00 0.00 N ATOM 579 CA SER A 39 23.737 -7.626 18.037 1.00 0.00 C ATOM 580 C SER A 39 22.593 -8.016 18.987 1.00 0.00 C ATOM 581 O SER A 39 22.454 -7.453 20.074 1.00 0.00 O ATOM 582 CB SER A 39 24.018 -6.120 18.035 1.00 0.00 C ATOM 583 OG SER A 39 24.949 -5.800 17.013 1.00 0.00 O ATOM 0 H SER A 39 23.181 -7.326 16.041 1.00 0.00 H new ATOM 0 HA SER A 39 24.610 -8.146 18.431 1.00 0.00 H new ATOM 0 HB2 SER A 39 23.091 -5.569 17.879 1.00 0.00 H new ATOM 0 HB3 SER A 39 24.411 -5.814 19.005 1.00 0.00 H new ATOM 0 HG SER A 39 25.766 -5.440 17.416 1.00 0.00 H new ATOM 589 N SER A 40 21.747 -8.945 18.548 1.00 0.00 N ATOM 590 CA SER A 40 20.501 -9.435 19.146 1.00 0.00 C ATOM 591 C SER A 40 19.412 -8.363 19.363 1.00 0.00 C ATOM 592 O SER A 40 18.255 -8.705 19.620 1.00 0.00 O ATOM 593 CB SER A 40 20.807 -10.228 20.428 1.00 0.00 C ATOM 594 OG SER A 40 21.785 -11.236 20.184 1.00 0.00 O ATOM 0 H SER A 40 21.936 -9.427 17.669 1.00 0.00 H new ATOM 0 HA SER A 40 20.055 -10.103 18.409 1.00 0.00 H new ATOM 0 HB2 SER A 40 21.164 -9.550 21.203 1.00 0.00 H new ATOM 0 HB3 SER A 40 19.892 -10.687 20.803 1.00 0.00 H new ATOM 0 HG SER A 40 21.964 -11.726 21.014 1.00 0.00 H new ATOM 600 N ARG A 41 19.749 -7.078 19.243 1.00 0.00 N ATOM 601 CA ARG A 41 18.871 -5.919 19.375 1.00 0.00 C ATOM 602 C ARG A 41 19.552 -4.756 18.643 1.00 0.00 C ATOM 603 O ARG A 41 20.571 -4.953 17.977 1.00 0.00 O ATOM 604 CB ARG A 41 18.591 -5.609 20.871 1.00 0.00 C ATOM 605 CG ARG A 41 19.850 -5.404 21.741 1.00 0.00 C ATOM 606 CD ARG A 41 20.275 -6.678 22.485 1.00 0.00 C ATOM 607 NE ARG A 41 21.725 -6.685 22.747 1.00 0.00 N ATOM 608 CZ ARG A 41 22.355 -6.333 23.877 1.00 0.00 C ATOM 609 NH1 ARG A 41 21.667 -5.904 24.933 1.00 0.00 N ATOM 610 NH2 ARG A 41 23.681 -6.415 23.944 1.00 0.00 N ATOM 0 H ARG A 41 20.709 -6.803 19.037 1.00 0.00 H new ATOM 0 HA ARG A 41 17.894 -6.104 18.928 1.00 0.00 H new ATOM 0 HB2 ARG A 41 17.976 -4.711 20.932 1.00 0.00 H new ATOM 0 HB3 ARG A 41 18.005 -6.426 21.293 1.00 0.00 H new ATOM 0 HG2 ARG A 41 20.672 -5.067 21.109 1.00 0.00 H new ATOM 0 HG3 ARG A 41 19.660 -4.612 22.466 1.00 0.00 H new ATOM 0 HD2 ARG A 41 19.732 -6.750 23.428 1.00 0.00 H new ATOM 0 HD3 ARG A 41 20.005 -7.554 21.895 1.00 0.00 H new ATOM 0 HE ARG A 41 22.320 -6.994 21.978 1.00 0.00 H new ATOM 0 HH11 ARG A 41 20.650 -5.840 24.888 1.00 0.00 H new ATOM 0 HH12 ARG A 41 22.157 -5.639 25.787 1.00 0.00 H new ATOM 0 HH21 ARG A 41 24.213 -6.744 23.138 1.00 0.00 H new ATOM 0 HH22 ARG A 41 24.166 -6.149 24.801 1.00 0.00 H new ATOM 624 N VAL A 42 18.991 -3.555 18.740 1.00 0.00 N ATOM 625 CA VAL A 42 19.589 -2.325 18.235 1.00 0.00 C ATOM 626 C VAL A 42 20.916 -2.024 18.945 1.00 0.00 C ATOM 627 O VAL A 42 21.283 -2.665 19.933 1.00 0.00 O ATOM 628 CB VAL A 42 18.557 -1.181 18.377 1.00 0.00 C ATOM 629 CG1 VAL A 42 17.210 -1.530 17.716 1.00 0.00 C ATOM 630 CG2 VAL A 42 18.322 -0.754 19.839 1.00 0.00 C ATOM 0 H VAL A 42 18.084 -3.407 19.184 1.00 0.00 H new ATOM 0 HA VAL A 42 19.838 -2.433 17.179 1.00 0.00 H new ATOM 0 HB VAL A 42 18.999 -0.335 17.851 1.00 0.00 H new ATOM 0 HG11 VAL A 42 16.517 -0.698 17.841 1.00 0.00 H new ATOM 0 HG12 VAL A 42 17.364 -1.718 16.653 1.00 0.00 H new ATOM 0 HG13 VAL A 42 16.795 -2.422 18.186 1.00 0.00 H new ATOM 0 HG21 VAL A 42 17.588 0.051 19.869 1.00 0.00 H new ATOM 0 HG22 VAL A 42 17.951 -1.604 20.411 1.00 0.00 H new ATOM 0 HG23 VAL A 42 19.260 -0.406 20.272 1.00 0.00 H new ATOM 640 N HIS A 43 21.607 -0.996 18.450 1.00 0.00 N ATOM 641 CA HIS A 43 22.942 -0.624 18.886 1.00 0.00 C ATOM 642 C HIS A 43 22.942 0.889 19.119 1.00 0.00 C ATOM 643 O HIS A 43 22.684 1.632 18.172 1.00 0.00 O ATOM 644 CB HIS A 43 23.907 -1.078 17.789 1.00 0.00 C ATOM 645 CG HIS A 43 25.364 -0.925 18.142 1.00 0.00 C ATOM 646 ND1 HIS A 43 26.279 -0.113 17.504 1.00 0.00 N ATOM 647 CD2 HIS A 43 26.031 -1.580 19.143 1.00 0.00 C ATOM 648 CE1 HIS A 43 27.463 -0.254 18.131 1.00 0.00 C ATOM 649 NE2 HIS A 43 27.363 -1.150 19.128 1.00 0.00 N ATOM 0 H HIS A 43 21.240 -0.388 17.718 1.00 0.00 H new ATOM 0 HA HIS A 43 23.253 -1.094 19.819 1.00 0.00 H new ATOM 0 HB2 HIS A 43 23.709 -2.125 17.558 1.00 0.00 H new ATOM 0 HB3 HIS A 43 23.703 -0.507 16.883 1.00 0.00 H new ATOM 0 HD2 HIS A 43 25.604 -2.301 19.824 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.366 0.278 17.869 1.00 0.00 H new ATOM 0 HE2 HIS A 43 28.110 -1.456 19.751 1.00 0.00 H new ATOM 657 N PRO A 44 23.189 1.377 20.347 1.00 0.00 N ATOM 658 CA PRO A 44 22.993 2.784 20.709 1.00 0.00 C ATOM 659 C PRO A 44 23.896 3.749 19.939 1.00 0.00 C ATOM 660 O PRO A 44 23.481 4.881 19.688 1.00 0.00 O ATOM 661 CB PRO A 44 23.216 2.866 22.226 1.00 0.00 C ATOM 662 CG PRO A 44 24.109 1.660 22.502 1.00 0.00 C ATOM 663 CD PRO A 44 23.559 0.620 21.533 1.00 0.00 C ATOM 0 HA PRO A 44 21.987 3.103 20.434 1.00 0.00 H new ATOM 0 HB2 PRO A 44 23.698 3.800 22.514 1.00 0.00 H new ATOM 0 HB3 PRO A 44 22.277 2.808 22.777 1.00 0.00 H new ATOM 0 HG2 PRO A 44 25.159 1.879 22.310 1.00 0.00 H new ATOM 0 HG3 PRO A 44 24.037 1.329 23.538 1.00 0.00 H new ATOM 0 HD2 PRO A 44 24.306 -0.139 21.301 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.699 0.101 21.956 1.00 0.00 H new ATOM 671 N THR A 45 25.077 3.317 19.486 1.00 0.00 N ATOM 672 CA THR A 45 25.898 4.138 18.599 1.00 0.00 C ATOM 673 C THR A 45 25.135 4.406 17.301 1.00 0.00 C ATOM 674 O THR A 45 25.113 5.549 16.863 1.00 0.00 O ATOM 675 CB THR A 45 27.273 3.477 18.362 1.00 0.00 C ATOM 676 OG1 THR A 45 27.825 3.094 19.614 1.00 0.00 O ATOM 677 CG2 THR A 45 28.247 4.420 17.641 1.00 0.00 C ATOM 0 H THR A 45 25.481 2.410 19.718 1.00 0.00 H new ATOM 0 HA THR A 45 26.099 5.102 19.066 1.00 0.00 H new ATOM 0 HB THR A 45 27.124 2.605 17.725 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.698 2.672 19.471 1.00 0.00 H new ATOM 0 HG21 THR A 45 29.202 3.915 17.495 1.00 0.00 H new ATOM 0 HG22 THR A 45 27.833 4.700 16.673 1.00 0.00 H new ATOM 0 HG23 THR A 45 28.399 5.316 18.243 1.00 0.00 H new ATOM 685 N ALA A 46 24.424 3.422 16.721 1.00 0.00 N ATOM 686 CA ALA A 46 23.658 3.684 15.503 1.00 0.00 C ATOM 687 C ALA A 46 22.566 4.699 15.814 1.00 0.00 C ATOM 688 O ALA A 46 22.420 5.659 15.073 1.00 0.00 O ATOM 689 CB ALA A 46 23.094 2.394 14.876 1.00 0.00 C ATOM 0 H ALA A 46 24.367 2.465 17.069 1.00 0.00 H new ATOM 0 HA ALA A 46 24.326 4.102 14.750 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.534 2.642 13.975 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.915 1.725 14.620 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.434 1.901 15.590 1.00 0.00 H new ATOM 695 N ILE A 47 21.879 4.561 16.951 1.00 0.00 N ATOM 696 CA ILE A 47 20.828 5.502 17.345 1.00 0.00 C ATOM 697 C ILE A 47 21.405 6.918 17.386 1.00 0.00 C ATOM 698 O ILE A 47 20.835 7.806 16.758 1.00 0.00 O ATOM 699 CB ILE A 47 20.185 5.100 18.685 1.00 0.00 C ATOM 700 CG1 ILE A 47 19.149 3.978 18.535 1.00 0.00 C ATOM 701 CG2 ILE A 47 19.471 6.268 19.399 1.00 0.00 C ATOM 702 CD1 ILE A 47 19.653 2.587 18.177 1.00 0.00 C ATOM 0 H ILE A 47 22.033 3.804 17.617 1.00 0.00 H new ATOM 0 HA ILE A 47 20.029 5.476 16.604 1.00 0.00 H new ATOM 0 HB ILE A 47 21.033 4.763 19.281 1.00 0.00 H new ATOM 0 HG12 ILE A 47 18.599 3.903 19.473 1.00 0.00 H new ATOM 0 HG13 ILE A 47 18.435 4.282 17.770 1.00 0.00 H new ATOM 0 HG21 ILE A 47 19.041 5.914 20.336 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.189 7.061 19.606 1.00 0.00 H new ATOM 0 HG23 ILE A 47 18.678 6.655 18.759 1.00 0.00 H new ATOM 0 HD11 ILE A 47 18.809 1.901 18.106 1.00 0.00 H new ATOM 0 HD12 ILE A 47 20.173 2.624 17.220 1.00 0.00 H new ATOM 0 HD13 ILE A 47 20.339 2.239 18.949 1.00 0.00 H new ATOM 714 N ALA A 48 22.546 7.128 18.051 1.00 0.00 N ATOM 715 CA ALA A 48 23.152 8.451 18.150 1.00 0.00 C ATOM 716 C ALA A 48 23.484 9.006 16.767 1.00 0.00 C ATOM 717 O ALA A 48 23.243 10.176 16.483 1.00 0.00 O ATOM 718 CB ALA A 48 24.408 8.396 19.019 1.00 0.00 C ATOM 0 H ALA A 48 23.067 6.393 18.529 1.00 0.00 H new ATOM 0 HA ALA A 48 22.431 9.121 18.618 1.00 0.00 H new ATOM 0 HB1 ALA A 48 24.849 9.390 19.084 1.00 0.00 H new ATOM 0 HB2 ALA A 48 24.144 8.050 20.018 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.128 7.708 18.575 1.00 0.00 H new ATOM 724 N MET A 49 24.003 8.155 15.886 1.00 0.00 N ATOM 725 CA MET A 49 24.378 8.532 14.531 1.00 0.00 C ATOM 726 C MET A 49 23.174 8.935 13.698 1.00 0.00 C ATOM 727 O MET A 49 23.347 9.660 12.716 1.00 0.00 O ATOM 728 CB MET A 49 25.115 7.371 13.860 1.00 0.00 C ATOM 729 CG MET A 49 26.424 7.076 14.588 1.00 0.00 C ATOM 730 SD MET A 49 27.754 8.247 14.270 1.00 0.00 S ATOM 731 CE MET A 49 27.726 9.033 15.896 1.00 0.00 C ATOM 0 H MET A 49 24.176 7.172 16.098 1.00 0.00 H new ATOM 0 HA MET A 49 25.034 9.400 14.596 1.00 0.00 H new ATOM 0 HB2 MET A 49 24.483 6.483 13.861 1.00 0.00 H new ATOM 0 HB3 MET A 49 25.319 7.616 12.818 1.00 0.00 H new ATOM 0 HG2 MET A 49 26.229 7.054 15.660 1.00 0.00 H new ATOM 0 HG3 MET A 49 26.763 6.079 14.305 1.00 0.00 H new ATOM 0 HE1 MET A 49 28.593 9.685 16.000 1.00 0.00 H new ATOM 0 HE2 MET A 49 26.815 9.622 16.000 1.00 0.00 H new ATOM 0 HE3 MET A 49 27.753 8.267 16.671 1.00 0.00 H new ATOM 741 N MET A 50 21.973 8.496 14.066 1.00 0.00 N ATOM 742 CA MET A 50 20.772 8.829 13.318 1.00 0.00 C ATOM 743 C MET A 50 20.077 9.999 14.002 1.00 0.00 C ATOM 744 O MET A 50 19.472 10.832 13.332 1.00 0.00 O ATOM 745 CB MET A 50 19.865 7.603 13.171 1.00 0.00 C ATOM 746 CG MET A 50 20.581 6.341 12.683 1.00 0.00 C ATOM 747 SD MET A 50 22.162 6.534 11.779 1.00 0.00 S ATOM 748 CE MET A 50 22.841 4.862 11.901 1.00 0.00 C ATOM 0 H MET A 50 21.809 7.906 14.882 1.00 0.00 H new ATOM 0 HA MET A 50 21.031 9.134 12.304 1.00 0.00 H new ATOM 0 HB2 MET A 50 19.400 7.393 14.134 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.061 7.842 12.475 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.769 5.709 13.551 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.892 5.797 12.036 1.00 0.00 H new ATOM 0 HE1 MET A 50 23.488 4.669 11.045 1.00 0.00 H new ATOM 0 HE2 MET A 50 23.419 4.770 12.821 1.00 0.00 H new ATOM 0 HE3 MET A 50 22.026 4.138 11.911 1.00 0.00 H new ATOM 758 N GLU A 51 20.242 10.137 15.314 1.00 0.00 N ATOM 759 CA GLU A 51 19.822 11.299 16.077 1.00 0.00 C ATOM 760 C GLU A 51 20.576 12.547 15.602 1.00 0.00 C ATOM 761 O GLU A 51 19.999 13.632 15.530 1.00 0.00 O ATOM 762 CB GLU A 51 20.042 10.999 17.571 1.00 0.00 C ATOM 763 CG GLU A 51 19.478 12.097 18.477 1.00 0.00 C ATOM 764 CD GLU A 51 19.625 11.726 19.964 1.00 0.00 C ATOM 765 OE1 GLU A 51 20.716 11.947 20.543 1.00 0.00 O ATOM 766 OE2 GLU A 51 18.644 11.227 20.570 1.00 0.00 O ATOM 0 H GLU A 51 20.685 9.420 15.889 1.00 0.00 H new ATOM 0 HA GLU A 51 18.763 11.507 15.922 1.00 0.00 H new ATOM 0 HB2 GLU A 51 19.571 10.048 17.821 1.00 0.00 H new ATOM 0 HB3 GLU A 51 21.109 10.886 17.763 1.00 0.00 H new ATOM 0 HG2 GLU A 51 19.997 13.035 18.281 1.00 0.00 H new ATOM 0 HG3 GLU A 51 18.426 12.260 18.243 1.00 0.00 H new ATOM 773 N GLU A 52 21.826 12.373 15.164 1.00 0.00 N ATOM 774 CA GLU A 52 22.655 13.390 14.521 1.00 0.00 C ATOM 775 C GLU A 52 22.011 13.940 13.229 1.00 0.00 C ATOM 776 O GLU A 52 22.413 15.010 12.763 1.00 0.00 O ATOM 777 CB GLU A 52 24.048 12.795 14.231 1.00 0.00 C ATOM 778 CG GLU A 52 24.973 12.690 15.455 1.00 0.00 C ATOM 779 CD GLU A 52 25.827 13.956 15.643 1.00 0.00 C ATOM 780 OE1 GLU A 52 25.323 14.960 16.205 1.00 0.00 O ATOM 781 OE2 GLU A 52 27.016 13.938 15.239 1.00 0.00 O ATOM 0 H GLU A 52 22.307 11.478 15.253 1.00 0.00 H new ATOM 0 HA GLU A 52 22.749 14.236 15.202 1.00 0.00 H new ATOM 0 HB2 GLU A 52 23.921 11.801 13.803 1.00 0.00 H new ATOM 0 HB3 GLU A 52 24.538 13.407 13.474 1.00 0.00 H new ATOM 0 HG2 GLU A 52 24.373 12.521 16.349 1.00 0.00 H new ATOM 0 HG3 GLU A 52 25.627 11.825 15.342 1.00 0.00 H new ATOM 788 N VAL A 53 21.007 13.254 12.662 1.00 0.00 N ATOM 789 CA VAL A 53 20.258 13.655 11.474 1.00 0.00 C ATOM 790 C VAL A 53 18.734 13.597 11.723 1.00 0.00 C ATOM 791 O VAL A 53 17.946 13.680 10.778 1.00 0.00 O ATOM 792 CB VAL A 53 20.723 12.820 10.262 1.00 0.00 C ATOM 793 CG1 VAL A 53 22.104 13.277 9.773 1.00 0.00 C ATOM 794 CG2 VAL A 53 20.755 11.299 10.485 1.00 0.00 C ATOM 0 H VAL A 53 20.685 12.364 13.041 1.00 0.00 H new ATOM 0 HA VAL A 53 20.469 14.699 11.242 1.00 0.00 H new ATOM 0 HB VAL A 53 19.959 13.006 9.507 1.00 0.00 H new ATOM 0 HG11 VAL A 53 22.406 12.671 8.919 1.00 0.00 H new ATOM 0 HG12 VAL A 53 22.057 14.325 9.476 1.00 0.00 H new ATOM 0 HG13 VAL A 53 22.831 13.160 10.576 1.00 0.00 H new ATOM 0 HG21 VAL A 53 21.095 10.805 9.575 1.00 0.00 H new ATOM 0 HG22 VAL A 53 21.438 11.065 11.302 1.00 0.00 H new ATOM 0 HG23 VAL A 53 19.755 10.947 10.737 1.00 0.00 H new ATOM 804 N GLY A 54 18.302 13.511 12.988 1.00 0.00 N ATOM 805 CA GLY A 54 16.894 13.585 13.368 1.00 0.00 C ATOM 806 C GLY A 54 16.070 12.373 12.917 1.00 0.00 C ATOM 807 O GLY A 54 14.921 12.549 12.508 1.00 0.00 O ATOM 0 H GLY A 54 18.931 13.387 13.781 1.00 0.00 H new ATOM 0 HA2 GLY A 54 16.824 13.678 14.452 1.00 0.00 H new ATOM 0 HA3 GLY A 54 16.459 14.489 12.941 1.00 0.00 H new ATOM 811 N ILE A 55 16.634 11.161 12.991 1.00 0.00 N ATOM 812 CA ILE A 55 15.935 9.899 12.765 1.00 0.00 C ATOM 813 C ILE A 55 16.072 9.068 14.046 1.00 0.00 C ATOM 814 O ILE A 55 17.052 9.197 14.783 1.00 0.00 O ATOM 815 CB ILE A 55 16.418 9.177 11.482 1.00 0.00 C ATOM 816 CG1 ILE A 55 16.239 10.142 10.292 1.00 0.00 C ATOM 817 CG2 ILE A 55 15.650 7.850 11.263 1.00 0.00 C ATOM 818 CD1 ILE A 55 16.469 9.463 8.954 1.00 0.00 C ATOM 0 H ILE A 55 17.620 11.032 13.217 1.00 0.00 H new ATOM 0 HA ILE A 55 14.877 10.072 12.570 1.00 0.00 H new ATOM 0 HB ILE A 55 17.470 8.910 11.579 1.00 0.00 H new ATOM 0 HG12 ILE A 55 15.233 10.560 10.315 1.00 0.00 H new ATOM 0 HG13 ILE A 55 16.933 10.976 10.397 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.011 7.366 10.355 1.00 0.00 H new ATOM 0 HG22 ILE A 55 15.813 7.190 12.115 1.00 0.00 H new ATOM 0 HG23 ILE A 55 14.585 8.058 11.164 1.00 0.00 H new ATOM 0 HD11 ILE A 55 16.331 10.186 8.150 1.00 0.00 H new ATOM 0 HD12 ILE A 55 17.484 9.068 8.916 1.00 0.00 H new ATOM 0 HD13 ILE A 55 15.757 8.646 8.833 1.00 0.00 H new ATOM 830 N ASP A 56 15.102 8.188 14.293 1.00 0.00 N ATOM 831 CA ASP A 56 15.088 7.254 15.416 1.00 0.00 C ATOM 832 C ASP A 56 15.073 5.838 14.851 1.00 0.00 C ATOM 833 O ASP A 56 14.213 5.504 14.036 1.00 0.00 O ATOM 834 CB ASP A 56 13.856 7.482 16.302 1.00 0.00 C ATOM 835 CG ASP A 56 13.621 6.291 17.251 1.00 0.00 C ATOM 836 OD1 ASP A 56 14.597 5.797 17.861 1.00 0.00 O ATOM 837 OD2 ASP A 56 12.464 5.822 17.373 1.00 0.00 O ATOM 0 H ASP A 56 14.278 8.104 13.697 1.00 0.00 H new ATOM 0 HA ASP A 56 15.972 7.409 16.035 1.00 0.00 H new ATOM 0 HB2 ASP A 56 13.988 8.394 16.885 1.00 0.00 H new ATOM 0 HB3 ASP A 56 12.977 7.629 15.675 1.00 0.00 H new ATOM 842 N ILE A 57 16.024 5.009 15.296 1.00 0.00 N ATOM 843 CA ILE A 57 16.062 3.573 15.007 1.00 0.00 C ATOM 844 C ILE A 57 16.212 2.741 16.284 1.00 0.00 C ATOM 845 O ILE A 57 16.571 1.573 16.196 1.00 0.00 O ATOM 846 CB ILE A 57 17.091 3.251 13.892 1.00 0.00 C ATOM 847 CG1 ILE A 57 18.545 3.629 14.246 1.00 0.00 C ATOM 848 CG2 ILE A 57 16.675 3.901 12.557 1.00 0.00 C ATOM 849 CD1 ILE A 57 19.549 3.131 13.199 1.00 0.00 C ATOM 0 H ILE A 57 16.801 5.324 15.877 1.00 0.00 H new ATOM 0 HA ILE A 57 15.098 3.272 14.598 1.00 0.00 H new ATOM 0 HB ILE A 57 17.080 2.166 13.790 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.625 4.712 14.335 1.00 0.00 H new ATOM 0 HG13 ILE A 57 18.800 3.209 15.219 1.00 0.00 H new ATOM 0 HG21 ILE A 57 17.412 3.661 11.790 1.00 0.00 H new ATOM 0 HG22 ILE A 57 15.700 3.519 12.255 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.619 4.983 12.681 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.557 3.422 13.494 1.00 0.00 H new ATOM 0 HD12 ILE A 57 19.491 2.045 13.127 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.313 3.571 12.230 1.00 0.00 H new ATOM 861 N SER A 58 15.932 3.303 17.460 1.00 0.00 N ATOM 862 CA SER A 58 15.894 2.591 18.731 1.00 0.00 C ATOM 863 C SER A 58 14.618 1.753 18.887 1.00 0.00 C ATOM 864 O SER A 58 14.659 0.670 19.471 1.00 0.00 O ATOM 865 CB SER A 58 16.029 3.573 19.908 1.00 0.00 C ATOM 866 OG SER A 58 16.330 4.911 19.542 1.00 0.00 O ATOM 0 H SER A 58 15.719 4.296 17.554 1.00 0.00 H new ATOM 0 HA SER A 58 16.741 1.905 18.738 1.00 0.00 H new ATOM 0 HB2 SER A 58 15.098 3.568 20.474 1.00 0.00 H new ATOM 0 HB3 SER A 58 16.810 3.211 20.576 1.00 0.00 H new ATOM 0 HG SER A 58 15.537 5.327 19.144 1.00 0.00 H new ATOM 872 N GLY A 59 13.497 2.225 18.328 1.00 0.00 N ATOM 873 CA GLY A 59 12.225 1.503 18.346 1.00 0.00 C ATOM 874 C GLY A 59 12.174 0.361 17.326 1.00 0.00 C ATOM 875 O GLY A 59 11.172 -0.354 17.254 1.00 0.00 O ATOM 0 H GLY A 59 13.450 3.124 17.848 1.00 0.00 H new ATOM 0 HA2 GLY A 59 12.056 1.100 19.344 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.413 2.202 18.143 1.00 0.00 H new ATOM 879 N GLN A 60 13.225 0.200 16.512 1.00 0.00 N ATOM 880 CA GLN A 60 13.334 -0.853 15.522 1.00 0.00 C ATOM 881 C GLN A 60 13.449 -2.220 16.183 1.00 0.00 C ATOM 882 O GLN A 60 14.025 -2.368 17.263 1.00 0.00 O ATOM 883 CB GLN A 60 14.599 -0.638 14.676 1.00 0.00 C ATOM 884 CG GLN A 60 14.435 0.461 13.631 1.00 0.00 C ATOM 885 CD GLN A 60 13.473 0.057 12.522 1.00 0.00 C ATOM 886 OE1 GLN A 60 12.357 0.558 12.441 1.00 0.00 O ATOM 887 NE2 GLN A 60 13.878 -0.877 11.682 1.00 0.00 N ATOM 0 H GLN A 60 14.036 0.818 16.532 1.00 0.00 H new ATOM 0 HA GLN A 60 12.437 -0.819 14.904 1.00 0.00 H new ATOM 0 HB2 GLN A 60 15.431 -0.386 15.333 1.00 0.00 H new ATOM 0 HB3 GLN A 60 14.859 -1.571 14.177 1.00 0.00 H new ATOM 0 HG2 GLN A 60 14.071 1.368 14.113 1.00 0.00 H new ATOM 0 HG3 GLN A 60 15.407 0.698 13.199 1.00 0.00 H new ATOM 0 HE21 GLN A 60 14.812 -1.275 11.774 1.00 0.00 H new ATOM 0 HE22 GLN A 60 13.257 -1.200 10.941 1.00 0.00 H new ATOM 896 N THR A 61 12.997 -3.216 15.435 1.00 0.00 N ATOM 897 CA THR A 61 13.178 -4.627 15.699 1.00 0.00 C ATOM 898 C THR A 61 13.282 -5.343 14.345 1.00 0.00 C ATOM 899 O THR A 61 12.844 -4.819 13.315 1.00 0.00 O ATOM 900 CB THR A 61 12.039 -5.195 16.579 1.00 0.00 C ATOM 901 OG1 THR A 61 10.770 -4.678 16.197 1.00 0.00 O ATOM 902 CG2 THR A 61 12.268 -4.885 18.062 1.00 0.00 C ATOM 0 H THR A 61 12.465 -3.047 14.581 1.00 0.00 H new ATOM 0 HA THR A 61 14.092 -4.790 16.270 1.00 0.00 H new ATOM 0 HB THR A 61 12.047 -6.274 16.428 1.00 0.00 H new ATOM 0 HG1 THR A 61 10.075 -5.059 16.773 1.00 0.00 H new ATOM 0 HG21 THR A 61 11.449 -5.298 18.651 1.00 0.00 H new ATOM 0 HG22 THR A 61 13.209 -5.330 18.386 1.00 0.00 H new ATOM 0 HG23 THR A 61 12.309 -3.805 18.206 1.00 0.00 H new ATOM 910 N SER A 62 13.892 -6.529 14.348 1.00 0.00 N ATOM 911 CA SER A 62 14.283 -7.276 13.157 1.00 0.00 C ATOM 912 C SER A 62 14.342 -8.769 13.518 1.00 0.00 C ATOM 913 O SER A 62 14.219 -9.122 14.697 1.00 0.00 O ATOM 914 CB SER A 62 15.673 -6.805 12.723 1.00 0.00 C ATOM 915 OG SER A 62 15.820 -5.393 12.682 1.00 0.00 O ATOM 0 H SER A 62 14.135 -7.011 15.213 1.00 0.00 H new ATOM 0 HA SER A 62 13.569 -7.116 12.349 1.00 0.00 H new ATOM 0 HB2 SER A 62 16.415 -7.217 13.407 1.00 0.00 H new ATOM 0 HB3 SER A 62 15.890 -7.211 11.735 1.00 0.00 H new ATOM 0 HG SER A 62 15.324 -5.035 11.917 1.00 0.00 H new ATOM 921 N ASP A 63 14.553 -9.648 12.534 1.00 0.00 N ATOM 922 CA ASP A 63 14.555 -11.105 12.718 1.00 0.00 C ATOM 923 C ASP A 63 15.423 -11.732 11.600 1.00 0.00 C ATOM 924 O ASP A 63 15.804 -10.994 10.684 1.00 0.00 O ATOM 925 CB ASP A 63 13.083 -11.565 12.700 1.00 0.00 C ATOM 926 CG ASP A 63 12.770 -12.738 13.652 1.00 0.00 C ATOM 927 OD1 ASP A 63 13.255 -12.743 14.809 1.00 0.00 O ATOM 928 OD2 ASP A 63 11.982 -13.636 13.269 1.00 0.00 O ATOM 0 H ASP A 63 14.730 -9.364 11.571 1.00 0.00 H new ATOM 0 HA ASP A 63 14.991 -11.423 13.665 1.00 0.00 H new ATOM 0 HB2 ASP A 63 12.448 -10.720 12.964 1.00 0.00 H new ATOM 0 HB3 ASP A 63 12.819 -11.857 11.684 1.00 0.00 H new ATOM 933 N PRO A 64 15.824 -13.020 11.631 1.00 0.00 N ATOM 934 CA PRO A 64 16.793 -13.561 10.675 1.00 0.00 C ATOM 935 C PRO A 64 16.163 -13.907 9.319 1.00 0.00 C ATOM 936 O PRO A 64 14.943 -14.022 9.198 1.00 0.00 O ATOM 937 CB PRO A 64 17.387 -14.796 11.356 1.00 0.00 C ATOM 938 CG PRO A 64 16.237 -15.309 12.215 1.00 0.00 C ATOM 939 CD PRO A 64 15.513 -14.028 12.633 1.00 0.00 C ATOM 0 HA PRO A 64 17.556 -12.821 10.436 1.00 0.00 H new ATOM 0 HB2 PRO A 64 17.709 -15.541 10.628 1.00 0.00 H new ATOM 0 HB3 PRO A 64 18.258 -14.543 11.960 1.00 0.00 H new ATOM 0 HG2 PRO A 64 15.583 -15.977 11.654 1.00 0.00 H new ATOM 0 HG3 PRO A 64 16.598 -15.868 13.079 1.00 0.00 H new ATOM 0 HD2 PRO A 64 14.437 -14.194 12.692 1.00 0.00 H new ATOM 0 HD3 PRO A 64 15.841 -13.704 13.621 1.00 0.00 H new ATOM 947 N ILE A 65 17.006 -14.115 8.298 1.00 0.00 N ATOM 948 CA ILE A 65 16.577 -14.250 6.904 1.00 0.00 C ATOM 949 C ILE A 65 15.700 -15.486 6.729 1.00 0.00 C ATOM 950 O ILE A 65 14.743 -15.476 5.962 1.00 0.00 O ATOM 951 CB ILE A 65 17.815 -14.240 5.967 1.00 0.00 C ATOM 952 CG1 ILE A 65 17.384 -14.149 4.485 1.00 0.00 C ATOM 953 CG2 ILE A 65 18.764 -15.432 6.218 1.00 0.00 C ATOM 954 CD1 ILE A 65 18.544 -14.017 3.485 1.00 0.00 C ATOM 0 H ILE A 65 18.015 -14.195 8.421 1.00 0.00 H new ATOM 0 HA ILE A 65 15.959 -13.397 6.624 1.00 0.00 H new ATOM 0 HB ILE A 65 18.389 -13.345 6.206 1.00 0.00 H new ATOM 0 HG12 ILE A 65 16.805 -15.038 4.234 1.00 0.00 H new ATOM 0 HG13 ILE A 65 16.720 -13.293 4.366 1.00 0.00 H new ATOM 0 HG21 ILE A 65 19.611 -15.373 5.535 1.00 0.00 H new ATOM 0 HG22 ILE A 65 19.124 -15.400 7.246 1.00 0.00 H new ATOM 0 HG23 ILE A 65 18.227 -16.366 6.051 1.00 0.00 H new ATOM 0 HD11 ILE A 65 18.146 -13.960 2.472 1.00 0.00 H new ATOM 0 HD12 ILE A 65 19.112 -13.113 3.704 1.00 0.00 H new ATOM 0 HD13 ILE A 65 19.198 -14.885 3.570 1.00 0.00 H new ATOM 966 N GLU A 66 16.007 -16.535 7.489 1.00 0.00 N ATOM 967 CA GLU A 66 15.359 -17.830 7.377 1.00 0.00 C ATOM 968 C GLU A 66 13.925 -17.821 7.922 1.00 0.00 C ATOM 969 O GLU A 66 13.127 -18.694 7.569 1.00 0.00 O ATOM 970 CB GLU A 66 16.262 -18.872 8.054 1.00 0.00 C ATOM 971 CG GLU A 66 16.408 -18.688 9.575 1.00 0.00 C ATOM 972 CD GLU A 66 17.287 -19.796 10.186 1.00 0.00 C ATOM 973 OE1 GLU A 66 18.530 -19.626 10.259 1.00 0.00 O ATOM 974 OE2 GLU A 66 16.738 -20.842 10.616 1.00 0.00 O ATOM 0 H GLU A 66 16.727 -16.503 8.211 1.00 0.00 H new ATOM 0 HA GLU A 66 15.240 -18.094 6.326 1.00 0.00 H new ATOM 0 HB2 GLU A 66 15.862 -19.866 7.857 1.00 0.00 H new ATOM 0 HB3 GLU A 66 17.251 -18.830 7.598 1.00 0.00 H new ATOM 0 HG2 GLU A 66 16.848 -17.713 9.786 1.00 0.00 H new ATOM 0 HG3 GLU A 66 15.423 -18.702 10.042 1.00 0.00 H new ATOM 981 N ASN A 67 13.578 -16.830 8.753 1.00 0.00 N ATOM 982 CA ASN A 67 12.206 -16.585 9.167 1.00 0.00 C ATOM 983 C ASN A 67 11.397 -15.936 8.032 1.00 0.00 C ATOM 984 O ASN A 67 10.169 -16.054 8.020 1.00 0.00 O ATOM 985 CB ASN A 67 12.158 -15.732 10.454 1.00 0.00 C ATOM 986 CG ASN A 67 11.482 -14.378 10.247 1.00 0.00 C ATOM 987 OD1 ASN A 67 10.280 -14.208 10.447 1.00 0.00 O ATOM 988 ND2 ASN A 67 12.249 -13.409 9.790 1.00 0.00 N ATOM 0 H ASN A 67 14.251 -16.177 9.155 1.00 0.00 H new ATOM 0 HA ASN A 67 11.745 -17.546 9.393 1.00 0.00 H new ATOM 0 HB2 ASN A 67 11.625 -16.283 11.229 1.00 0.00 H new ATOM 0 HB3 ASN A 67 13.174 -15.573 10.816 1.00 0.00 H new ATOM 0 HD21 ASN A 67 11.849 -12.492 9.593 1.00 0.00 H new ATOM 0 HD22 ASN A 67 13.243 -13.576 9.633 1.00 0.00 H new ATOM 995 N PHE A 68 12.060 -15.244 7.100 1.00 0.00 N ATOM 996 CA PHE A 68 11.409 -14.413 6.105 1.00 0.00 C ATOM 997 C PHE A 68 11.213 -15.172 4.791 1.00 0.00 C ATOM 998 O PHE A 68 11.735 -16.272 4.582 1.00 0.00 O ATOM 999 CB PHE A 68 12.180 -13.090 5.898 1.00 0.00 C ATOM 1000 CG PHE A 68 12.074 -12.091 7.037 1.00 0.00 C ATOM 1001 CD1 PHE A 68 10.812 -11.665 7.501 1.00 0.00 C ATOM 1002 CD2 PHE A 68 13.238 -11.573 7.638 1.00 0.00 C ATOM 1003 CE1 PHE A 68 10.714 -10.733 8.547 1.00 0.00 C ATOM 1004 CE2 PHE A 68 13.137 -10.627 8.676 1.00 0.00 C ATOM 1005 CZ PHE A 68 11.876 -10.205 9.129 1.00 0.00 C ATOM 0 H PHE A 68 13.077 -15.251 7.022 1.00 0.00 H new ATOM 0 HA PHE A 68 10.417 -14.156 6.476 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.233 -13.323 5.738 1.00 0.00 H new ATOM 0 HB3 PHE A 68 11.817 -12.616 4.986 1.00 0.00 H new ATOM 0 HD1 PHE A 68 9.914 -12.059 7.048 1.00 0.00 H new ATOM 0 HD2 PHE A 68 14.210 -11.902 7.302 1.00 0.00 H new ATOM 0 HE1 PHE A 68 9.743 -10.422 8.904 1.00 0.00 H new ATOM 0 HE2 PHE A 68 14.033 -10.224 9.126 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.801 -9.476 9.923 1.00 0.00 H new ATOM 1015 N ASN A 69 10.436 -14.557 3.901 1.00 0.00 N ATOM 1016 CA ASN A 69 10.072 -15.069 2.590 1.00 0.00 C ATOM 1017 C ASN A 69 9.911 -13.871 1.669 1.00 0.00 C ATOM 1018 O ASN A 69 8.868 -13.217 1.690 1.00 0.00 O ATOM 1019 CB ASN A 69 8.822 -15.977 2.632 1.00 0.00 C ATOM 1020 CG ASN A 69 7.738 -15.593 3.637 1.00 0.00 C ATOM 1021 OD1 ASN A 69 7.439 -16.355 4.554 1.00 0.00 O ATOM 1022 ND2 ASN A 69 7.138 -14.420 3.517 1.00 0.00 N ATOM 0 H ASN A 69 10.025 -13.643 4.089 1.00 0.00 H new ATOM 0 HA ASN A 69 10.857 -15.722 2.209 1.00 0.00 H new ATOM 0 HB2 ASN A 69 8.376 -15.991 1.637 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.146 -16.995 2.851 1.00 0.00 H new ATOM 0 HD21 ASN A 69 6.422 -14.142 4.188 1.00 0.00 H new ATOM 0 HD22 ASN A 69 7.392 -13.793 2.753 1.00 0.00 H new ATOM 1029 N ALA A 70 10.955 -13.547 0.895 1.00 0.00 N ATOM 1030 CA ALA A 70 10.920 -12.511 -0.132 1.00 0.00 C ATOM 1031 C ALA A 70 9.741 -12.644 -1.090 1.00 0.00 C ATOM 1032 O ALA A 70 9.349 -11.651 -1.695 1.00 0.00 O ATOM 1033 CB ALA A 70 12.175 -12.578 -0.980 1.00 0.00 C ATOM 0 H ALA A 70 11.861 -14.009 0.971 1.00 0.00 H new ATOM 0 HA ALA A 70 10.832 -11.569 0.409 1.00 0.00 H new ATOM 0 HB1 ALA A 70 12.140 -11.801 -1.744 1.00 0.00 H new ATOM 0 HB2 ALA A 70 13.050 -12.426 -0.348 1.00 0.00 H new ATOM 0 HB3 ALA A 70 12.239 -13.555 -1.459 1.00 0.00 H new ATOM 1039 N ASP A 71 9.180 -13.848 -1.221 1.00 0.00 N ATOM 1040 CA ASP A 71 7.940 -14.091 -1.952 1.00 0.00 C ATOM 1041 C ASP A 71 6.817 -13.136 -1.511 1.00 0.00 C ATOM 1042 O ASP A 71 5.904 -12.851 -2.288 1.00 0.00 O ATOM 1043 CB ASP A 71 7.498 -15.545 -1.771 1.00 0.00 C ATOM 1044 CG ASP A 71 6.182 -15.829 -2.515 1.00 0.00 C ATOM 1045 OD1 ASP A 71 6.192 -15.867 -3.769 1.00 0.00 O ATOM 1046 OD2 ASP A 71 5.146 -16.073 -1.850 1.00 0.00 O ATOM 0 H ASP A 71 9.583 -14.693 -0.815 1.00 0.00 H new ATOM 0 HA ASP A 71 8.137 -13.901 -3.007 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.277 -16.212 -2.140 1.00 0.00 H new ATOM 0 HB3 ASP A 71 7.371 -15.759 -0.710 1.00 0.00 H new ATOM 1051 N ASP A 72 6.924 -12.592 -0.293 1.00 0.00 N ATOM 1052 CA ASP A 72 5.974 -11.652 0.292 1.00 0.00 C ATOM 1053 C ASP A 72 6.569 -10.250 0.520 1.00 0.00 C ATOM 1054 O ASP A 72 5.975 -9.454 1.248 1.00 0.00 O ATOM 1055 CB ASP A 72 5.388 -12.243 1.580 1.00 0.00 C ATOM 1056 CG ASP A 72 4.127 -11.489 2.042 1.00 0.00 C ATOM 1057 OD1 ASP A 72 3.152 -11.380 1.257 1.00 0.00 O ATOM 1058 OD2 ASP A 72 4.075 -11.061 3.220 1.00 0.00 O ATOM 0 H ASP A 72 7.703 -12.805 0.330 1.00 0.00 H new ATOM 0 HA ASP A 72 5.169 -11.505 -0.429 1.00 0.00 H new ATOM 0 HB2 ASP A 72 5.143 -13.293 1.418 1.00 0.00 H new ATOM 0 HB3 ASP A 72 6.140 -12.209 2.369 1.00 0.00 H new ATOM 1063 N TYR A 73 7.710 -9.894 -0.092 1.00 0.00 N ATOM 1064 CA TYR A 73 8.222 -8.531 -0.080 1.00 0.00 C ATOM 1065 C TYR A 73 8.657 -8.139 -1.478 1.00 0.00 C ATOM 1066 O TYR A 73 9.621 -8.688 -2.003 1.00 0.00 O ATOM 1067 CB TYR A 73 9.365 -8.314 0.917 1.00 0.00 C ATOM 1068 CG TYR A 73 9.080 -8.775 2.329 1.00 0.00 C ATOM 1069 CD1 TYR A 73 9.140 -10.145 2.621 1.00 0.00 C ATOM 1070 CD2 TYR A 73 8.725 -7.858 3.330 1.00 0.00 C ATOM 1071 CE1 TYR A 73 8.800 -10.623 3.895 1.00 0.00 C ATOM 1072 CE2 TYR A 73 8.399 -8.322 4.620 1.00 0.00 C ATOM 1073 CZ TYR A 73 8.422 -9.710 4.906 1.00 0.00 C ATOM 1074 OH TYR A 73 8.074 -10.180 6.139 1.00 0.00 O ATOM 0 H TYR A 73 8.297 -10.550 -0.607 1.00 0.00 H new ATOM 0 HA TYR A 73 7.407 -7.890 0.255 1.00 0.00 H new ATOM 0 HB2 TYR A 73 10.249 -8.837 0.552 1.00 0.00 H new ATOM 0 HB3 TYR A 73 9.610 -7.252 0.940 1.00 0.00 H new ATOM 0 HD1 TYR A 73 9.452 -10.841 1.856 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.702 -6.800 3.113 1.00 0.00 H new ATOM 0 HE1 TYR A 73 8.827 -11.683 4.102 1.00 0.00 H new ATOM 0 HE2 TYR A 73 8.131 -7.618 5.393 1.00 0.00 H new ATOM 0 HH TYR A 73 8.863 -10.558 6.580 1.00 0.00 H new ATOM 1084 N ASP A 74 7.943 -7.184 -2.078 1.00 0.00 N ATOM 1085 CA ASP A 74 8.118 -6.870 -3.499 1.00 0.00 C ATOM 1086 C ASP A 74 9.477 -6.243 -3.828 1.00 0.00 C ATOM 1087 O ASP A 74 9.796 -6.026 -4.994 1.00 0.00 O ATOM 1088 CB ASP A 74 7.014 -5.923 -3.976 1.00 0.00 C ATOM 1089 CG ASP A 74 6.736 -6.002 -5.489 1.00 0.00 C ATOM 1090 OD1 ASP A 74 6.895 -7.081 -6.110 1.00 0.00 O ATOM 1091 OD2 ASP A 74 6.239 -4.989 -6.037 1.00 0.00 O ATOM 0 H ASP A 74 7.240 -6.616 -1.605 1.00 0.00 H new ATOM 0 HA ASP A 74 8.064 -7.826 -4.020 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.095 -6.150 -3.435 1.00 0.00 H new ATOM 0 HB3 ASP A 74 7.290 -4.900 -3.720 1.00 0.00 H new ATOM 1096 N VAL A 75 10.277 -5.876 -2.829 1.00 0.00 N ATOM 1097 CA VAL A 75 11.498 -5.116 -3.017 1.00 0.00 C ATOM 1098 C VAL A 75 12.451 -5.620 -1.932 1.00 0.00 C ATOM 1099 O VAL A 75 12.144 -5.506 -0.745 1.00 0.00 O ATOM 1100 CB VAL A 75 11.105 -3.636 -2.887 1.00 0.00 C ATOM 1101 CG1 VAL A 75 12.224 -2.619 -2.628 1.00 0.00 C ATOM 1102 CG2 VAL A 75 10.147 -3.071 -3.950 1.00 0.00 C ATOM 0 H VAL A 75 10.087 -6.105 -1.853 1.00 0.00 H new ATOM 0 HA VAL A 75 11.993 -5.230 -3.981 1.00 0.00 H new ATOM 0 HB VAL A 75 10.548 -3.739 -1.955 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.797 -1.618 -2.560 1.00 0.00 H new ATOM 0 HG12 VAL A 75 12.728 -2.863 -1.693 1.00 0.00 H new ATOM 0 HG13 VAL A 75 12.942 -2.652 -3.447 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.952 -2.019 -3.742 1.00 0.00 H new ATOM 0 HG22 VAL A 75 10.600 -3.167 -4.937 1.00 0.00 H new ATOM 0 HG23 VAL A 75 9.209 -3.626 -3.926 1.00 0.00 H new ATOM 1112 N VAL A 76 13.607 -6.182 -2.278 1.00 0.00 N ATOM 1113 CA VAL A 76 14.483 -6.769 -1.287 1.00 0.00 C ATOM 1114 C VAL A 76 15.897 -6.290 -1.569 1.00 0.00 C ATOM 1115 O VAL A 76 16.357 -6.308 -2.708 1.00 0.00 O ATOM 1116 CB VAL A 76 14.333 -8.302 -1.276 1.00 0.00 C ATOM 1117 CG1 VAL A 76 13.034 -8.737 -0.579 1.00 0.00 C ATOM 1118 CG2 VAL A 76 14.332 -8.969 -2.655 1.00 0.00 C ATOM 0 H VAL A 76 13.951 -6.239 -3.236 1.00 0.00 H new ATOM 0 HA VAL A 76 14.217 -6.449 -0.280 1.00 0.00 H new ATOM 0 HB VAL A 76 15.222 -8.631 -0.737 1.00 0.00 H new ATOM 0 HG11 VAL A 76 12.962 -9.825 -0.590 1.00 0.00 H new ATOM 0 HG12 VAL A 76 13.039 -8.384 0.452 1.00 0.00 H new ATOM 0 HG13 VAL A 76 12.179 -8.311 -1.104 1.00 0.00 H new ATOM 0 HG21 VAL A 76 14.221 -10.047 -2.538 1.00 0.00 H new ATOM 0 HG22 VAL A 76 13.502 -8.581 -3.246 1.00 0.00 H new ATOM 0 HG23 VAL A 76 15.272 -8.754 -3.164 1.00 0.00 H new ATOM 1128 N ILE A 77 16.559 -5.812 -0.523 1.00 0.00 N ATOM 1129 CA ILE A 77 17.857 -5.176 -0.600 1.00 0.00 C ATOM 1130 C ILE A 77 18.728 -5.939 0.386 1.00 0.00 C ATOM 1131 O ILE A 77 18.593 -5.789 1.603 1.00 0.00 O ATOM 1132 CB ILE A 77 17.721 -3.669 -0.296 1.00 0.00 C ATOM 1133 CG1 ILE A 77 16.844 -2.895 -1.312 1.00 0.00 C ATOM 1134 CG2 ILE A 77 19.102 -3.006 -0.206 1.00 0.00 C ATOM 1135 CD1 ILE A 77 17.307 -2.934 -2.776 1.00 0.00 C ATOM 0 H ILE A 77 16.192 -5.860 0.428 1.00 0.00 H new ATOM 0 HA ILE A 77 18.311 -5.215 -1.590 1.00 0.00 H new ATOM 0 HB ILE A 77 17.210 -3.615 0.665 1.00 0.00 H new ATOM 0 HG12 ILE A 77 15.830 -3.293 -1.263 1.00 0.00 H new ATOM 0 HG13 ILE A 77 16.793 -1.853 -0.996 1.00 0.00 H new ATOM 0 HG21 ILE A 77 18.982 -1.944 0.009 1.00 0.00 H new ATOM 0 HG22 ILE A 77 19.679 -3.475 0.591 1.00 0.00 H new ATOM 0 HG23 ILE A 77 19.626 -3.128 -1.154 1.00 0.00 H new ATOM 0 HD11 ILE A 77 16.616 -2.358 -3.392 1.00 0.00 H new ATOM 0 HD12 ILE A 77 18.306 -2.505 -2.853 1.00 0.00 H new ATOM 0 HD13 ILE A 77 17.328 -3.967 -3.123 1.00 0.00 H new ATOM 1147 N SER A 78 19.573 -6.825 -0.123 1.00 0.00 N ATOM 1148 CA SER A 78 20.574 -7.474 0.701 1.00 0.00 C ATOM 1149 C SER A 78 21.736 -6.490 0.926 1.00 0.00 C ATOM 1150 O SER A 78 21.897 -5.538 0.165 1.00 0.00 O ATOM 1151 CB SER A 78 20.915 -8.821 0.044 1.00 0.00 C ATOM 1152 OG SER A 78 21.338 -8.697 -1.282 1.00 0.00 O ATOM 0 H SER A 78 19.582 -7.108 -1.103 1.00 0.00 H new ATOM 0 HA SER A 78 20.235 -7.723 1.707 1.00 0.00 H new ATOM 0 HB2 SER A 78 21.697 -9.312 0.623 1.00 0.00 H new ATOM 0 HB3 SER A 78 20.038 -9.467 0.080 1.00 0.00 H new ATOM 0 HG SER A 78 22.300 -8.876 -1.337 1.00 0.00 H new ATOM 1158 N LEU A 79 22.538 -6.659 1.980 1.00 0.00 N ATOM 1159 CA LEU A 79 23.796 -5.930 2.179 1.00 0.00 C ATOM 1160 C LEU A 79 24.818 -6.989 2.580 1.00 0.00 C ATOM 1161 O LEU A 79 25.554 -6.846 3.555 1.00 0.00 O ATOM 1162 CB LEU A 79 23.725 -4.772 3.204 1.00 0.00 C ATOM 1163 CG LEU A 79 22.839 -3.559 2.859 1.00 0.00 C ATOM 1164 CD1 LEU A 79 21.334 -3.810 3.012 1.00 0.00 C ATOM 1165 CD2 LEU A 79 23.212 -2.361 3.745 1.00 0.00 C ATOM 0 H LEU A 79 22.330 -7.316 2.732 1.00 0.00 H new ATOM 0 HA LEU A 79 24.068 -5.413 1.258 1.00 0.00 H new ATOM 0 HB2 LEU A 79 23.375 -5.184 4.151 1.00 0.00 H new ATOM 0 HB3 LEU A 79 24.739 -4.409 3.370 1.00 0.00 H new ATOM 0 HG LEU A 79 23.031 -3.359 1.805 1.00 0.00 H new ATOM 0 HD11 LEU A 79 20.786 -2.905 2.749 1.00 0.00 H new ATOM 0 HD12 LEU A 79 21.032 -4.622 2.351 1.00 0.00 H new ATOM 0 HD13 LEU A 79 21.113 -4.081 4.044 1.00 0.00 H new ATOM 0 HD21 LEU A 79 22.579 -1.510 3.492 1.00 0.00 H new ATOM 0 HD22 LEU A 79 23.065 -2.624 4.793 1.00 0.00 H new ATOM 0 HD23 LEU A 79 24.257 -2.098 3.580 1.00 0.00 H new ATOM 1177 N CYS A 80 24.786 -8.106 1.859 1.00 0.00 N ATOM 1178 CA CYS A 80 25.573 -9.301 2.108 1.00 0.00 C ATOM 1179 C CYS A 80 26.878 -9.259 1.291 1.00 0.00 C ATOM 1180 O CYS A 80 27.587 -10.263 1.209 1.00 0.00 O ATOM 1181 CB CYS A 80 24.695 -10.527 1.794 1.00 0.00 C ATOM 1182 SG CYS A 80 23.198 -10.480 2.833 1.00 0.00 S ATOM 0 H CYS A 80 24.179 -8.203 1.045 1.00 0.00 H new ATOM 0 HA CYS A 80 25.878 -9.363 3.153 1.00 0.00 H new ATOM 0 HB2 CYS A 80 24.419 -10.530 0.739 1.00 0.00 H new ATOM 0 HB3 CYS A 80 25.252 -11.445 1.981 1.00 0.00 H new ATOM 0 HG CYS A 80 22.454 -11.512 2.569 1.00 0.00 H new ATOM 1188 N GLY A 81 27.201 -8.109 0.681 1.00 0.00 N ATOM 1189 CA GLY A 81 28.491 -7.870 0.037 1.00 0.00 C ATOM 1190 C GLY A 81 28.517 -8.429 -1.382 1.00 0.00 C ATOM 1191 O GLY A 81 29.573 -8.849 -1.853 1.00 0.00 O ATOM 0 H GLY A 81 26.564 -7.314 0.623 1.00 0.00 H new ATOM 0 HA2 GLY A 81 28.694 -6.799 0.012 1.00 0.00 H new ATOM 0 HA3 GLY A 81 29.284 -8.331 0.626 1.00 0.00 H new ATOM 1195 N CYS A 82 27.346 -8.468 -2.032 1.00 0.00 N ATOM 1196 CA CYS A 82 27.079 -9.119 -3.318 1.00 0.00 C ATOM 1197 C CYS A 82 27.808 -10.475 -3.467 1.00 0.00 C ATOM 1198 O CYS A 82 28.404 -10.763 -4.509 1.00 0.00 O ATOM 1199 CB CYS A 82 27.368 -8.102 -4.435 1.00 0.00 C ATOM 1200 SG CYS A 82 26.486 -8.532 -5.965 1.00 0.00 S ATOM 0 H CYS A 82 26.513 -8.020 -1.651 1.00 0.00 H new ATOM 0 HA CYS A 82 26.029 -9.404 -3.386 1.00 0.00 H new ATOM 0 HB2 CYS A 82 27.070 -7.106 -4.109 1.00 0.00 H new ATOM 0 HB3 CYS A 82 28.440 -8.066 -4.629 1.00 0.00 H new ATOM 0 HG CYS A 82 26.753 -7.650 -6.882 1.00 0.00 H new ATOM 1206 N GLY A 83 27.784 -11.292 -2.406 1.00 0.00 N ATOM 1207 CA GLY A 83 28.562 -12.525 -2.287 1.00 0.00 C ATOM 1208 C GLY A 83 27.764 -13.589 -1.537 1.00 0.00 C ATOM 1209 O GLY A 83 28.282 -14.237 -0.625 1.00 0.00 O ATOM 0 H GLY A 83 27.206 -11.106 -1.586 1.00 0.00 H new ATOM 0 HA2 GLY A 83 28.827 -12.892 -3.278 1.00 0.00 H new ATOM 0 HA3 GLY A 83 29.496 -12.324 -1.761 1.00 0.00 H new ATOM 1213 N VAL A 84 26.482 -13.720 -1.887 1.00 0.00 N ATOM 1214 CA VAL A 84 25.492 -14.563 -1.236 1.00 0.00 C ATOM 1215 C VAL A 84 24.688 -15.319 -2.308 1.00 0.00 C ATOM 1216 O VAL A 84 24.713 -14.955 -3.488 1.00 0.00 O ATOM 1217 CB VAL A 84 24.658 -13.644 -0.315 1.00 0.00 C ATOM 1218 CG1 VAL A 84 23.730 -12.693 -1.090 1.00 0.00 C ATOM 1219 CG2 VAL A 84 23.857 -14.405 0.755 1.00 0.00 C ATOM 0 H VAL A 84 26.091 -13.209 -2.678 1.00 0.00 H new ATOM 0 HA VAL A 84 25.927 -15.342 -0.610 1.00 0.00 H new ATOM 0 HB VAL A 84 25.405 -13.042 0.202 1.00 0.00 H new ATOM 0 HG11 VAL A 84 23.172 -12.075 -0.386 1.00 0.00 H new ATOM 0 HG12 VAL A 84 24.326 -12.054 -1.741 1.00 0.00 H new ATOM 0 HG13 VAL A 84 23.033 -13.276 -1.693 1.00 0.00 H new ATOM 0 HG21 VAL A 84 23.297 -13.695 1.363 1.00 0.00 H new ATOM 0 HG22 VAL A 84 23.165 -15.093 0.270 1.00 0.00 H new ATOM 0 HG23 VAL A 84 24.541 -14.967 1.391 1.00 0.00 H new ATOM 1229 N ASN A 85 23.953 -16.357 -1.898 1.00 0.00 N ATOM 1230 CA ASN A 85 23.140 -17.204 -2.770 1.00 0.00 C ATOM 1231 C ASN A 85 21.752 -17.279 -2.140 1.00 0.00 C ATOM 1232 O ASN A 85 21.384 -18.284 -1.524 1.00 0.00 O ATOM 1233 CB ASN A 85 23.789 -18.588 -2.962 1.00 0.00 C ATOM 1234 CG ASN A 85 25.051 -18.523 -3.818 1.00 0.00 C ATOM 1235 OD1 ASN A 85 26.161 -18.404 -3.303 1.00 0.00 O ATOM 1236 ND2 ASN A 85 24.921 -18.588 -5.136 1.00 0.00 N ATOM 0 H ASN A 85 23.907 -16.638 -0.919 1.00 0.00 H new ATOM 0 HA ASN A 85 23.063 -16.786 -3.774 1.00 0.00 H new ATOM 0 HB2 ASN A 85 24.035 -19.010 -1.987 1.00 0.00 H new ATOM 0 HB3 ASN A 85 23.071 -19.262 -3.429 1.00 0.00 H new ATOM 0 HD21 ASN A 85 25.747 -18.539 -5.733 1.00 0.00 H new ATOM 0 HD22 ASN A 85 23.995 -18.687 -5.553 1.00 0.00 H new ATOM 1243 N LEU A 86 21.014 -16.160 -2.209 1.00 0.00 N ATOM 1244 CA LEU A 86 19.653 -16.070 -1.673 1.00 0.00 C ATOM 1245 C LEU A 86 18.757 -17.093 -2.397 1.00 0.00 C ATOM 1246 O LEU A 86 18.994 -17.358 -3.583 1.00 0.00 O ATOM 1247 CB LEU A 86 19.050 -14.659 -1.861 1.00 0.00 C ATOM 1248 CG LEU A 86 19.897 -13.452 -1.413 1.00 0.00 C ATOM 1249 CD1 LEU A 86 19.131 -12.151 -1.657 1.00 0.00 C ATOM 1250 CD2 LEU A 86 20.304 -13.507 0.064 1.00 0.00 C ATOM 0 H LEU A 86 21.346 -15.296 -2.637 1.00 0.00 H new ATOM 0 HA LEU A 86 19.701 -16.279 -0.604 1.00 0.00 H new ATOM 0 HB2 LEU A 86 18.818 -14.532 -2.918 1.00 0.00 H new ATOM 0 HB3 LEU A 86 18.104 -14.624 -1.321 1.00 0.00 H new ATOM 0 HG LEU A 86 20.809 -13.489 -2.009 1.00 0.00 H new ATOM 0 HD11 LEU A 86 19.739 -11.305 -1.337 1.00 0.00 H new ATOM 0 HD12 LEU A 86 18.906 -12.055 -2.719 1.00 0.00 H new ATOM 0 HD13 LEU A 86 18.201 -12.165 -1.089 1.00 0.00 H new ATOM 0 HD21 LEU A 86 20.898 -12.627 0.311 1.00 0.00 H new ATOM 0 HD22 LEU A 86 19.410 -13.528 0.687 1.00 0.00 H new ATOM 0 HD23 LEU A 86 20.894 -14.405 0.246 1.00 0.00 H new ATOM 1262 N PRO A 87 17.716 -17.645 -1.740 1.00 0.00 N ATOM 1263 CA PRO A 87 16.700 -18.451 -2.414 1.00 0.00 C ATOM 1264 C PRO A 87 16.083 -17.703 -3.605 1.00 0.00 C ATOM 1265 O PRO A 87 15.994 -16.475 -3.563 1.00 0.00 O ATOM 1266 CB PRO A 87 15.635 -18.748 -1.362 1.00 0.00 C ATOM 1267 CG PRO A 87 16.371 -18.607 -0.030 1.00 0.00 C ATOM 1268 CD PRO A 87 17.451 -17.563 -0.312 1.00 0.00 C ATOM 0 HA PRO A 87 17.137 -19.363 -2.819 1.00 0.00 H new ATOM 0 HB2 PRO A 87 14.801 -18.049 -1.432 1.00 0.00 H new ATOM 0 HB3 PRO A 87 15.223 -19.750 -1.485 1.00 0.00 H new ATOM 0 HG2 PRO A 87 15.699 -18.282 0.764 1.00 0.00 H new ATOM 0 HG3 PRO A 87 16.806 -19.555 0.288 1.00 0.00 H new ATOM 0 HD2 PRO A 87 17.113 -16.565 -0.033 1.00 0.00 H new ATOM 0 HD3 PRO A 87 18.353 -17.767 0.266 1.00 0.00 H new ATOM 1276 N PRO A 88 15.562 -18.401 -4.629 1.00 0.00 N ATOM 1277 CA PRO A 88 15.171 -17.758 -5.875 1.00 0.00 C ATOM 1278 C PRO A 88 13.989 -16.789 -5.755 1.00 0.00 C ATOM 1279 O PRO A 88 13.830 -15.913 -6.602 1.00 0.00 O ATOM 1280 CB PRO A 88 14.902 -18.898 -6.865 1.00 0.00 C ATOM 1281 CG PRO A 88 14.579 -20.090 -5.967 1.00 0.00 C ATOM 1282 CD PRO A 88 15.455 -19.848 -4.741 1.00 0.00 C ATOM 0 HA PRO A 88 15.973 -17.104 -6.217 1.00 0.00 H new ATOM 0 HB2 PRO A 88 14.072 -18.662 -7.531 1.00 0.00 H new ATOM 0 HB3 PRO A 88 15.770 -19.095 -7.494 1.00 0.00 H new ATOM 0 HG2 PRO A 88 13.521 -20.123 -5.706 1.00 0.00 H new ATOM 0 HG3 PRO A 88 14.817 -21.036 -6.452 1.00 0.00 H new ATOM 0 HD2 PRO A 88 15.008 -20.280 -3.846 1.00 0.00 H new ATOM 0 HD3 PRO A 88 16.436 -20.307 -4.861 1.00 0.00 H new ATOM 1290 N GLU A 89 13.184 -16.871 -4.695 1.00 0.00 N ATOM 1291 CA GLU A 89 12.112 -15.918 -4.462 1.00 0.00 C ATOM 1292 C GLU A 89 12.663 -14.512 -4.228 1.00 0.00 C ATOM 1293 O GLU A 89 11.996 -13.521 -4.504 1.00 0.00 O ATOM 1294 CB GLU A 89 11.230 -16.377 -3.299 1.00 0.00 C ATOM 1295 CG GLU A 89 11.986 -16.733 -2.011 1.00 0.00 C ATOM 1296 CD GLU A 89 11.005 -17.161 -0.910 1.00 0.00 C ATOM 1297 OE1 GLU A 89 10.437 -16.263 -0.247 1.00 0.00 O ATOM 1298 OE2 GLU A 89 10.811 -18.385 -0.706 1.00 0.00 O ATOM 0 H GLU A 89 13.260 -17.596 -3.982 1.00 0.00 H new ATOM 0 HA GLU A 89 11.492 -15.876 -5.357 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.512 -15.588 -3.074 1.00 0.00 H new ATOM 0 HB3 GLU A 89 10.658 -17.248 -3.619 1.00 0.00 H new ATOM 0 HG2 GLU A 89 12.693 -17.538 -2.209 1.00 0.00 H new ATOM 0 HG3 GLU A 89 12.567 -15.874 -1.674 1.00 0.00 H new ATOM 1305 N TRP A 90 13.899 -14.399 -3.752 1.00 0.00 N ATOM 1306 CA TRP A 90 14.532 -13.116 -3.534 1.00 0.00 C ATOM 1307 C TRP A 90 14.888 -12.388 -4.836 1.00 0.00 C ATOM 1308 O TRP A 90 15.185 -11.202 -4.752 1.00 0.00 O ATOM 1309 CB TRP A 90 15.757 -13.280 -2.623 1.00 0.00 C ATOM 1310 CG TRP A 90 15.473 -13.623 -1.187 1.00 0.00 C ATOM 1311 CD1 TRP A 90 15.145 -14.843 -0.706 1.00 0.00 C ATOM 1312 CD2 TRP A 90 15.456 -12.741 -0.021 1.00 0.00 C ATOM 1313 NE1 TRP A 90 14.904 -14.768 0.653 1.00 0.00 N ATOM 1314 CE2 TRP A 90 15.044 -13.484 1.121 1.00 0.00 C ATOM 1315 CE3 TRP A 90 15.660 -11.361 0.166 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 14.835 -12.890 2.373 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 15.455 -10.742 1.415 1.00 0.00 C ATOM 1318 CH2 TRP A 90 15.042 -11.508 2.522 1.00 0.00 C ATOM 0 H TRP A 90 14.485 -15.198 -3.509 1.00 0.00 H new ATOM 0 HA TRP A 90 13.803 -12.478 -3.034 1.00 0.00 H new ATOM 0 HB2 TRP A 90 16.394 -14.059 -3.042 1.00 0.00 H new ATOM 0 HB3 TRP A 90 16.329 -12.353 -2.647 1.00 0.00 H new ATOM 0 HD1 TRP A 90 15.081 -15.745 -1.297 1.00 0.00 H new ATOM 0 HE1 TRP A 90 14.653 -15.567 1.236 1.00 0.00 H new ATOM 0 HE3 TRP A 90 15.983 -10.760 -0.671 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 14.518 -13.488 3.215 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 15.615 -9.679 1.523 1.00 0.00 H new ATOM 0 HH2 TRP A 90 14.885 -11.036 3.481 1.00 0.00 H new ATOM 1329 N VAL A 91 14.824 -13.013 -6.022 1.00 0.00 N ATOM 1330 CA VAL A 91 15.245 -12.372 -7.266 1.00 0.00 C ATOM 1331 C VAL A 91 14.075 -12.050 -8.210 1.00 0.00 C ATOM 1332 O VAL A 91 14.273 -11.349 -9.203 1.00 0.00 O ATOM 1333 CB VAL A 91 16.399 -13.148 -7.941 1.00 0.00 C ATOM 1334 CG1 VAL A 91 17.584 -13.358 -6.979 1.00 0.00 C ATOM 1335 CG2 VAL A 91 16.017 -14.514 -8.532 1.00 0.00 C ATOM 0 H VAL A 91 14.482 -13.967 -6.140 1.00 0.00 H new ATOM 0 HA VAL A 91 15.649 -11.395 -7.000 1.00 0.00 H new ATOM 0 HB VAL A 91 16.677 -12.503 -8.775 1.00 0.00 H new ATOM 0 HG11 VAL A 91 18.375 -13.907 -7.490 1.00 0.00 H new ATOM 0 HG12 VAL A 91 17.966 -12.390 -6.655 1.00 0.00 H new ATOM 0 HG13 VAL A 91 17.251 -13.926 -6.110 1.00 0.00 H new ATOM 0 HG21 VAL A 91 16.897 -14.975 -8.981 1.00 0.00 H new ATOM 0 HG22 VAL A 91 15.634 -15.158 -7.741 1.00 0.00 H new ATOM 0 HG23 VAL A 91 15.249 -14.379 -9.294 1.00 0.00 H new ATOM 1345 N THR A 92 12.858 -12.519 -7.915 1.00 0.00 N ATOM 1346 CA THR A 92 11.694 -12.385 -8.797 1.00 0.00 C ATOM 1347 C THR A 92 10.877 -11.107 -8.524 1.00 0.00 C ATOM 1348 O THR A 92 9.992 -10.738 -9.301 1.00 0.00 O ATOM 1349 CB THR A 92 10.834 -13.649 -8.626 1.00 0.00 C ATOM 1350 OG1 THR A 92 10.617 -13.908 -7.247 1.00 0.00 O ATOM 1351 CG2 THR A 92 11.576 -14.853 -9.204 1.00 0.00 C ATOM 0 H THR A 92 12.651 -13.009 -7.045 1.00 0.00 H new ATOM 0 HA THR A 92 12.036 -12.288 -9.827 1.00 0.00 H new ATOM 0 HB THR A 92 9.885 -13.491 -9.139 1.00 0.00 H new ATOM 0 HG1 THR A 92 10.067 -14.713 -7.148 1.00 0.00 H new ATOM 0 HG21 THR A 92 10.967 -15.749 -9.083 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.770 -14.687 -10.264 1.00 0.00 H new ATOM 0 HG23 THR A 92 12.522 -14.984 -8.678 1.00 0.00 H new ATOM 1359 N GLN A 93 11.185 -10.442 -7.412 1.00 0.00 N ATOM 1360 CA GLN A 93 10.613 -9.219 -6.903 1.00 0.00 C ATOM 1361 C GLN A 93 10.815 -8.030 -7.854 1.00 0.00 C ATOM 1362 O GLN A 93 11.612 -8.099 -8.796 1.00 0.00 O ATOM 1363 CB GLN A 93 11.318 -9.010 -5.558 1.00 0.00 C ATOM 1364 CG GLN A 93 11.100 -10.108 -4.517 1.00 0.00 C ATOM 1365 CD GLN A 93 9.709 -10.755 -4.585 1.00 0.00 C ATOM 1366 OE1 GLN A 93 8.661 -10.113 -4.562 1.00 0.00 O ATOM 1367 NE2 GLN A 93 9.688 -12.057 -4.799 1.00 0.00 N ATOM 0 H GLN A 93 11.915 -10.790 -6.791 1.00 0.00 H new ATOM 0 HA GLN A 93 9.530 -9.288 -6.799 1.00 0.00 H new ATOM 0 HB2 GLN A 93 12.388 -8.916 -5.741 1.00 0.00 H new ATOM 0 HB3 GLN A 93 10.982 -8.063 -5.136 1.00 0.00 H new ATOM 0 HG2 GLN A 93 11.857 -10.880 -4.652 1.00 0.00 H new ATOM 0 HG3 GLN A 93 11.247 -9.688 -3.522 1.00 0.00 H new ATOM 0 HE21 GLN A 93 10.561 -12.585 -4.817 1.00 0.00 H new ATOM 0 HE22 GLN A 93 8.799 -12.535 -4.946 1.00 0.00 H new ATOM 1376 N GLU A 94 10.106 -6.926 -7.605 1.00 0.00 N ATOM 1377 CA GLU A 94 10.205 -5.708 -8.372 1.00 0.00 C ATOM 1378 C GLU A 94 11.579 -5.089 -8.125 1.00 0.00 C ATOM 1379 O GLU A 94 12.210 -4.617 -9.075 1.00 0.00 O ATOM 1380 CB GLU A 94 9.036 -4.787 -7.991 1.00 0.00 C ATOM 1381 CG GLU A 94 9.292 -3.294 -8.184 1.00 0.00 C ATOM 1382 CD GLU A 94 9.578 -2.870 -9.641 1.00 0.00 C ATOM 1383 OE1 GLU A 94 9.128 -3.554 -10.594 1.00 0.00 O ATOM 1384 OE2 GLU A 94 10.229 -1.816 -9.842 1.00 0.00 O ATOM 0 H GLU A 94 9.433 -6.866 -6.841 1.00 0.00 H new ATOM 0 HA GLU A 94 10.125 -5.891 -9.444 1.00 0.00 H new ATOM 0 HB2 GLU A 94 8.165 -5.069 -8.583 1.00 0.00 H new ATOM 0 HB3 GLU A 94 8.782 -4.963 -6.946 1.00 0.00 H new ATOM 0 HG2 GLU A 94 8.425 -2.741 -7.823 1.00 0.00 H new ATOM 0 HG3 GLU A 94 10.138 -3.001 -7.562 1.00 0.00 H new ATOM 1391 N ILE A 95 12.073 -5.154 -6.881 1.00 0.00 N ATOM 1392 CA ILE A 95 13.455 -4.800 -6.589 1.00 0.00 C ATOM 1393 C ILE A 95 14.175 -6.000 -5.994 1.00 0.00 C ATOM 1394 O ILE A 95 13.667 -6.676 -5.099 1.00 0.00 O ATOM 1395 CB ILE A 95 13.542 -3.558 -5.661 1.00 0.00 C ATOM 1396 CG1 ILE A 95 13.611 -2.262 -6.498 1.00 0.00 C ATOM 1397 CG2 ILE A 95 14.749 -3.571 -4.711 1.00 0.00 C ATOM 1398 CD1 ILE A 95 13.444 -0.932 -5.766 1.00 0.00 C ATOM 0 H ILE A 95 11.532 -5.448 -6.068 1.00 0.00 H new ATOM 0 HA ILE A 95 13.951 -4.525 -7.520 1.00 0.00 H new ATOM 0 HB ILE A 95 12.638 -3.594 -5.053 1.00 0.00 H new ATOM 0 HG12 ILE A 95 14.573 -2.244 -7.009 1.00 0.00 H new ATOM 0 HG13 ILE A 95 12.842 -2.319 -7.268 1.00 0.00 H new ATOM 0 HG21 ILE A 95 14.738 -2.671 -4.097 1.00 0.00 H new ATOM 0 HG22 ILE A 95 14.696 -4.450 -4.068 1.00 0.00 H new ATOM 0 HG23 ILE A 95 15.670 -3.602 -5.293 1.00 0.00 H new ATOM 0 HD11 ILE A 95 13.515 -0.112 -6.481 1.00 0.00 H new ATOM 0 HD12 ILE A 95 12.469 -0.905 -5.279 1.00 0.00 H new ATOM 0 HD13 ILE A 95 14.228 -0.829 -5.016 1.00 0.00 H new ATOM 1410 N PHE A 96 15.386 -6.212 -6.498 1.00 0.00 N ATOM 1411 CA PHE A 96 16.364 -7.095 -5.919 1.00 0.00 C ATOM 1412 C PHE A 96 17.691 -6.453 -6.271 1.00 0.00 C ATOM 1413 O PHE A 96 18.040 -6.340 -7.450 1.00 0.00 O ATOM 1414 CB PHE A 96 16.349 -8.553 -6.367 1.00 0.00 C ATOM 1415 CG PHE A 96 17.588 -9.244 -5.790 1.00 0.00 C ATOM 1416 CD1 PHE A 96 17.900 -9.114 -4.416 1.00 0.00 C ATOM 1417 CD2 PHE A 96 18.554 -9.808 -6.647 1.00 0.00 C ATOM 1418 CE1 PHE A 96 19.136 -9.523 -3.916 1.00 0.00 C ATOM 1419 CE2 PHE A 96 19.789 -10.256 -6.133 1.00 0.00 C ATOM 1420 CZ PHE A 96 20.083 -10.113 -4.765 1.00 0.00 C ATOM 0 H PHE A 96 15.714 -5.754 -7.348 1.00 0.00 H new ATOM 0 HA PHE A 96 16.150 -7.188 -4.854 1.00 0.00 H new ATOM 0 HB2 PHE A 96 15.442 -9.048 -6.020 1.00 0.00 H new ATOM 0 HB3 PHE A 96 16.351 -8.616 -7.455 1.00 0.00 H new ATOM 0 HD1 PHE A 96 17.169 -8.691 -3.743 1.00 0.00 H new ATOM 0 HD2 PHE A 96 18.348 -9.898 -7.703 1.00 0.00 H new ATOM 0 HE1 PHE A 96 19.365 -9.385 -2.870 1.00 0.00 H new ATOM 0 HE2 PHE A 96 20.512 -10.711 -6.793 1.00 0.00 H new ATOM 0 HZ PHE A 96 21.029 -10.454 -4.372 1.00 0.00 H new ATOM 1430 N GLU A 97 18.399 -6.013 -5.246 1.00 0.00 N ATOM 1431 CA GLU A 97 19.745 -5.497 -5.336 1.00 0.00 C ATOM 1432 C GLU A 97 20.470 -5.953 -4.073 1.00 0.00 C ATOM 1433 O GLU A 97 19.851 -6.371 -3.089 1.00 0.00 O ATOM 1434 CB GLU A 97 19.732 -3.959 -5.396 1.00 0.00 C ATOM 1435 CG GLU A 97 19.316 -3.366 -6.741 1.00 0.00 C ATOM 1436 CD GLU A 97 19.094 -1.846 -6.640 1.00 0.00 C ATOM 1437 OE1 GLU A 97 20.008 -1.116 -6.191 1.00 0.00 O ATOM 1438 OE2 GLU A 97 18.004 -1.370 -7.037 1.00 0.00 O ATOM 0 H GLU A 97 18.034 -6.007 -4.293 1.00 0.00 H new ATOM 0 HA GLU A 97 20.238 -5.861 -6.238 1.00 0.00 H new ATOM 0 HB2 GLU A 97 19.055 -3.587 -4.627 1.00 0.00 H new ATOM 0 HB3 GLU A 97 20.728 -3.593 -5.148 1.00 0.00 H new ATOM 0 HG2 GLU A 97 20.084 -3.574 -7.485 1.00 0.00 H new ATOM 0 HG3 GLU A 97 18.400 -3.847 -7.085 1.00 0.00 H new ATOM 1445 N ASP A 98 21.787 -5.795 -4.098 1.00 0.00 N ATOM 1446 CA ASP A 98 22.634 -5.947 -2.924 1.00 0.00 C ATOM 1447 C ASP A 98 23.443 -4.665 -2.809 1.00 0.00 C ATOM 1448 O ASP A 98 24.072 -4.229 -3.776 1.00 0.00 O ATOM 1449 CB ASP A 98 23.534 -7.183 -2.951 1.00 0.00 C ATOM 1450 CG ASP A 98 24.281 -7.307 -1.618 1.00 0.00 C ATOM 1451 OD1 ASP A 98 25.311 -6.634 -1.405 1.00 0.00 O ATOM 1452 OD2 ASP A 98 23.848 -8.137 -0.789 1.00 0.00 O ATOM 0 H ASP A 98 22.302 -5.555 -4.945 1.00 0.00 H new ATOM 0 HA ASP A 98 22.004 -6.110 -2.049 1.00 0.00 H new ATOM 0 HB2 ASP A 98 22.936 -8.077 -3.128 1.00 0.00 H new ATOM 0 HB3 ASP A 98 24.246 -7.108 -3.773 1.00 0.00 H new ATOM 1457 N TRP A 99 23.356 -4.018 -1.654 1.00 0.00 N ATOM 1458 CA TRP A 99 23.996 -2.756 -1.346 1.00 0.00 C ATOM 1459 C TRP A 99 25.239 -3.083 -0.527 1.00 0.00 C ATOM 1460 O TRP A 99 25.265 -2.960 0.694 1.00 0.00 O ATOM 1461 CB TRP A 99 22.974 -1.798 -0.702 1.00 0.00 C ATOM 1462 CG TRP A 99 21.931 -1.246 -1.633 1.00 0.00 C ATOM 1463 CD1 TRP A 99 21.766 -1.540 -2.947 1.00 0.00 C ATOM 1464 CD2 TRP A 99 20.811 -0.378 -1.292 1.00 0.00 C ATOM 1465 NE1 TRP A 99 20.635 -0.922 -3.429 1.00 0.00 N ATOM 1466 CE2 TRP A 99 19.951 -0.277 -2.426 1.00 0.00 C ATOM 1467 CE3 TRP A 99 20.397 0.266 -0.106 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 18.703 0.353 -2.362 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 19.150 0.918 -0.037 1.00 0.00 C ATOM 1470 CH2 TRP A 99 18.299 0.924 -1.151 1.00 0.00 C ATOM 0 H TRP A 99 22.810 -4.381 -0.872 1.00 0.00 H new ATOM 0 HA TRP A 99 24.338 -2.207 -2.223 1.00 0.00 H new ATOM 0 HB2 TRP A 99 22.471 -2.323 0.110 1.00 0.00 H new ATOM 0 HB3 TRP A 99 23.515 -0.964 -0.255 1.00 0.00 H new ATOM 0 HD1 TRP A 99 22.425 -2.167 -3.529 1.00 0.00 H new ATOM 0 HE1 TRP A 99 20.342 -0.940 -4.406 1.00 0.00 H new ATOM 0 HE3 TRP A 99 21.044 0.259 0.759 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 18.064 0.397 -3.231 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 18.850 1.413 0.874 1.00 0.00 H new ATOM 0 HH2 TRP A 99 17.321 1.375 -1.073 1.00 0.00 H new ATOM 1481 N GLN A 100 26.261 -3.537 -1.248 1.00 0.00 N ATOM 1482 CA GLN A 100 27.603 -3.916 -0.805 1.00 0.00 C ATOM 1483 C GLN A 100 28.418 -2.754 -0.182 1.00 0.00 C ATOM 1484 O GLN A 100 29.625 -2.648 -0.415 1.00 0.00 O ATOM 1485 CB GLN A 100 28.356 -4.555 -1.982 1.00 0.00 C ATOM 1486 CG GLN A 100 28.580 -3.688 -3.237 1.00 0.00 C ATOM 1487 CD GLN A 100 27.309 -3.454 -4.049 1.00 0.00 C ATOM 1488 OE1 GLN A 100 26.685 -2.399 -3.958 1.00 0.00 O ATOM 1489 NE2 GLN A 100 26.849 -4.443 -4.791 1.00 0.00 N ATOM 0 H GLN A 100 26.162 -3.661 -2.256 1.00 0.00 H new ATOM 0 HA GLN A 100 27.483 -4.636 0.005 1.00 0.00 H new ATOM 0 HB2 GLN A 100 29.331 -4.882 -1.620 1.00 0.00 H new ATOM 0 HB3 GLN A 100 27.812 -5.450 -2.284 1.00 0.00 H new ATOM 0 HG2 GLN A 100 28.991 -2.725 -2.935 1.00 0.00 H new ATOM 0 HG3 GLN A 100 29.325 -4.168 -3.872 1.00 0.00 H new ATOM 0 HE21 GLN A 100 27.374 -5.315 -4.861 1.00 0.00 H new ATOM 0 HE22 GLN A 100 25.969 -4.336 -5.295 1.00 0.00 H new ATOM 1498 N LEU A 101 27.771 -1.815 0.512 1.00 0.00 N ATOM 1499 CA LEU A 101 28.403 -0.588 0.983 1.00 0.00 C ATOM 1500 C LEU A 101 29.392 -0.889 2.118 1.00 0.00 C ATOM 1501 O LEU A 101 29.599 -2.044 2.494 1.00 0.00 O ATOM 1502 CB LEU A 101 27.324 0.445 1.417 1.00 0.00 C ATOM 1503 CG LEU A 101 26.770 1.370 0.310 1.00 0.00 C ATOM 1504 CD1 LEU A 101 27.829 2.390 -0.123 1.00 0.00 C ATOM 1505 CD2 LEU A 101 26.310 0.609 -0.931 1.00 0.00 C ATOM 0 H LEU A 101 26.785 -1.889 0.763 1.00 0.00 H new ATOM 0 HA LEU A 101 28.972 -0.148 0.164 1.00 0.00 H new ATOM 0 HB2 LEU A 101 26.488 -0.099 1.857 1.00 0.00 H new ATOM 0 HB3 LEU A 101 27.747 1.070 2.204 1.00 0.00 H new ATOM 0 HG LEU A 101 25.905 1.869 0.748 1.00 0.00 H new ATOM 0 HD11 LEU A 101 27.419 3.031 -0.903 1.00 0.00 H new ATOM 0 HD12 LEU A 101 28.119 2.999 0.733 1.00 0.00 H new ATOM 0 HD13 LEU A 101 28.704 1.865 -0.507 1.00 0.00 H new ATOM 0 HD21 LEU A 101 25.932 1.314 -1.671 1.00 0.00 H new ATOM 0 HD22 LEU A 101 27.151 0.057 -1.352 1.00 0.00 H new ATOM 0 HD23 LEU A 101 25.519 -0.089 -0.657 1.00 0.00 H new ATOM 1517 N GLU A 102 30.005 0.163 2.668 1.00 0.00 N ATOM 1518 CA GLU A 102 30.946 0.053 3.771 1.00 0.00 C ATOM 1519 C GLU A 102 30.374 -0.676 4.984 1.00 0.00 C ATOM 1520 O GLU A 102 29.169 -0.861 5.168 1.00 0.00 O ATOM 1521 CB GLU A 102 31.514 1.435 4.148 1.00 0.00 C ATOM 1522 CG GLU A 102 32.875 1.664 3.488 1.00 0.00 C ATOM 1523 CD GLU A 102 34.036 0.965 4.232 1.00 0.00 C ATOM 1524 OE1 GLU A 102 33.852 -0.170 4.743 1.00 0.00 O ATOM 1525 OE2 GLU A 102 35.144 1.551 4.294 1.00 0.00 O ATOM 0 H GLU A 102 29.856 1.121 2.352 1.00 0.00 H new ATOM 0 HA GLU A 102 31.768 -0.570 3.418 1.00 0.00 H new ATOM 0 HB2 GLU A 102 30.819 2.215 3.838 1.00 0.00 H new ATOM 0 HB3 GLU A 102 31.613 1.509 5.231 1.00 0.00 H new ATOM 0 HG2 GLU A 102 32.839 1.301 2.461 1.00 0.00 H new ATOM 0 HG3 GLU A 102 33.074 2.735 3.441 1.00 0.00 H new ATOM 1532 N ASP A 103 31.309 -1.106 5.808 1.00 0.00 N ATOM 1533 CA ASP A 103 31.181 -1.998 6.940 1.00 0.00 C ATOM 1534 C ASP A 103 31.528 -1.206 8.203 1.00 0.00 C ATOM 1535 O ASP A 103 32.706 -0.919 8.448 1.00 0.00 O ATOM 1536 CB ASP A 103 32.147 -3.171 6.741 1.00 0.00 C ATOM 1537 CG ASP A 103 32.208 -4.066 7.979 1.00 0.00 C ATOM 1538 OD1 ASP A 103 31.305 -3.969 8.838 1.00 0.00 O ATOM 1539 OD2 ASP A 103 33.121 -4.923 8.069 1.00 0.00 O ATOM 0 H ASP A 103 32.277 -0.807 5.687 1.00 0.00 H new ATOM 0 HA ASP A 103 30.169 -2.392 7.033 1.00 0.00 H new ATOM 0 HB2 ASP A 103 31.832 -3.761 5.880 1.00 0.00 H new ATOM 0 HB3 ASP A 103 33.143 -2.789 6.518 1.00 0.00 H new ATOM 1544 N PRO A 104 30.528 -0.787 8.997 1.00 0.00 N ATOM 1545 CA PRO A 104 30.756 -0.028 10.213 1.00 0.00 C ATOM 1546 C PRO A 104 31.124 -0.930 11.412 1.00 0.00 C ATOM 1547 O PRO A 104 30.976 -0.469 12.540 1.00 0.00 O ATOM 1548 CB PRO A 104 29.450 0.750 10.430 1.00 0.00 C ATOM 1549 CG PRO A 104 28.395 -0.237 9.929 1.00 0.00 C ATOM 1550 CD PRO A 104 29.098 -0.928 8.757 1.00 0.00 C ATOM 0 HA PRO A 104 31.613 0.640 10.124 1.00 0.00 H new ATOM 0 HB2 PRO A 104 29.300 1.008 11.478 1.00 0.00 H new ATOM 0 HB3 PRO A 104 29.434 1.683 9.867 1.00 0.00 H new ATOM 0 HG2 PRO A 104 28.108 -0.948 10.703 1.00 0.00 H new ATOM 0 HG3 PRO A 104 27.485 0.272 9.611 1.00 0.00 H new ATOM 0 HD2 PRO A 104 28.815 -1.979 8.699 1.00 0.00 H new ATOM 0 HD3 PRO A 104 28.816 -0.469 7.809 1.00 0.00 H new ATOM 1558 N ASP A 105 31.566 -2.185 11.213 1.00 0.00 N ATOM 1559 CA ASP A 105 31.931 -3.162 12.254 1.00 0.00 C ATOM 1560 C ASP A 105 32.683 -2.554 13.442 1.00 0.00 C ATOM 1561 O ASP A 105 33.902 -2.358 13.389 1.00 0.00 O ATOM 1562 CB ASP A 105 32.784 -4.302 11.687 1.00 0.00 C ATOM 1563 CG ASP A 105 33.212 -5.287 12.791 1.00 0.00 C ATOM 1564 OD1 ASP A 105 32.362 -5.659 13.638 1.00 0.00 O ATOM 1565 OD2 ASP A 105 34.389 -5.725 12.794 1.00 0.00 O ATOM 0 H ASP A 105 31.684 -2.564 10.273 1.00 0.00 H new ATOM 0 HA ASP A 105 30.974 -3.540 12.614 1.00 0.00 H new ATOM 0 HB2 ASP A 105 32.220 -4.834 10.921 1.00 0.00 H new ATOM 0 HB3 ASP A 105 33.669 -3.890 11.202 1.00 0.00 H new ATOM 1570 N GLY A 106 31.932 -2.242 14.503 1.00 0.00 N ATOM 1571 CA GLY A 106 32.406 -1.520 15.689 1.00 0.00 C ATOM 1572 C GLY A 106 33.322 -0.322 15.374 1.00 0.00 C ATOM 1573 O GLY A 106 34.259 -0.059 16.132 1.00 0.00 O ATOM 0 H GLY A 106 30.945 -2.493 14.562 1.00 0.00 H new ATOM 0 HA2 GLY A 106 31.544 -1.165 16.253 1.00 0.00 H new ATOM 0 HA3 GLY A 106 32.944 -2.215 16.333 1.00 0.00 H new ATOM 1577 N GLN A 107 33.111 0.354 14.237 1.00 0.00 N ATOM 1578 CA GLN A 107 34.018 1.361 13.700 1.00 0.00 C ATOM 1579 C GLN A 107 33.930 2.703 14.422 1.00 0.00 C ATOM 1580 O GLN A 107 33.125 2.914 15.334 1.00 0.00 O ATOM 1581 CB GLN A 107 33.786 1.525 12.183 1.00 0.00 C ATOM 1582 CG GLN A 107 34.448 0.373 11.407 1.00 0.00 C ATOM 1583 CD GLN A 107 35.395 0.867 10.315 1.00 0.00 C ATOM 1584 OE1 GLN A 107 36.415 1.494 10.598 1.00 0.00 O ATOM 1585 NE2 GLN A 107 35.088 0.613 9.054 1.00 0.00 N ATOM 0 H GLN A 107 32.285 0.208 13.657 1.00 0.00 H new ATOM 0 HA GLN A 107 35.032 1.001 13.873 1.00 0.00 H new ATOM 0 HB2 GLN A 107 32.717 1.545 11.973 1.00 0.00 H new ATOM 0 HB3 GLN A 107 34.194 2.478 11.848 1.00 0.00 H new ATOM 0 HG2 GLN A 107 35.000 -0.259 12.103 1.00 0.00 H new ATOM 0 HG3 GLN A 107 33.674 -0.249 10.957 1.00 0.00 H new ATOM 0 HE21 GLN A 107 34.240 0.092 8.831 1.00 0.00 H new ATOM 0 HE22 GLN A 107 35.699 0.938 8.305 1.00 0.00 H new ATOM 1594 N SER A 108 34.793 3.612 13.971 1.00 0.00 N ATOM 1595 CA SER A 108 34.783 5.011 14.346 1.00 0.00 C ATOM 1596 C SER A 108 33.445 5.632 13.949 1.00 0.00 C ATOM 1597 O SER A 108 32.792 5.194 12.993 1.00 0.00 O ATOM 1598 CB SER A 108 35.974 5.718 13.675 1.00 0.00 C ATOM 1599 OG SER A 108 36.124 5.296 12.323 1.00 0.00 O ATOM 0 H SER A 108 35.539 3.380 13.315 1.00 0.00 H new ATOM 0 HA SER A 108 34.890 5.124 15.425 1.00 0.00 H new ATOM 0 HB2 SER A 108 35.826 6.797 13.708 1.00 0.00 H new ATOM 0 HB3 SER A 108 36.888 5.504 14.230 1.00 0.00 H new ATOM 0 HG SER A 108 36.886 5.760 11.918 1.00 0.00 H new ATOM 1605 N LEU A 109 33.063 6.702 14.653 1.00 0.00 N ATOM 1606 CA LEU A 109 31.812 7.414 14.401 1.00 0.00 C ATOM 1607 C LEU A 109 31.763 7.932 12.967 1.00 0.00 C ATOM 1608 O LEU A 109 30.692 8.018 12.385 1.00 0.00 O ATOM 1609 CB LEU A 109 31.621 8.584 15.388 1.00 0.00 C ATOM 1610 CG LEU A 109 31.586 8.207 16.885 1.00 0.00 C ATOM 1611 CD1 LEU A 109 31.159 9.423 17.719 1.00 0.00 C ATOM 1612 CD2 LEU A 109 30.662 7.020 17.188 1.00 0.00 C ATOM 0 H LEU A 109 33.615 7.097 15.414 1.00 0.00 H new ATOM 0 HA LEU A 109 30.998 6.704 14.549 1.00 0.00 H new ATOM 0 HB2 LEU A 109 32.428 9.300 15.233 1.00 0.00 H new ATOM 0 HB3 LEU A 109 30.690 9.094 15.140 1.00 0.00 H new ATOM 0 HG LEU A 109 32.596 7.898 17.154 1.00 0.00 H new ATOM 0 HD11 LEU A 109 31.136 9.151 18.774 1.00 0.00 H new ATOM 0 HD12 LEU A 109 31.871 10.235 17.569 1.00 0.00 H new ATOM 0 HD13 LEU A 109 30.167 9.748 17.407 1.00 0.00 H new ATOM 0 HD21 LEU A 109 30.683 6.806 18.257 1.00 0.00 H new ATOM 0 HD22 LEU A 109 29.644 7.265 16.887 1.00 0.00 H new ATOM 0 HD23 LEU A 109 31.002 6.144 16.636 1.00 0.00 H new ATOM 1624 N GLU A 110 32.914 8.238 12.372 1.00 0.00 N ATOM 1625 CA GLU A 110 32.984 8.727 11.002 1.00 0.00 C ATOM 1626 C GLU A 110 32.484 7.682 10.025 1.00 0.00 C ATOM 1627 O GLU A 110 31.752 8.039 9.101 1.00 0.00 O ATOM 1628 CB GLU A 110 34.415 9.130 10.640 1.00 0.00 C ATOM 1629 CG GLU A 110 34.806 10.359 11.453 1.00 0.00 C ATOM 1630 CD GLU A 110 36.175 10.921 11.030 1.00 0.00 C ATOM 1631 OE1 GLU A 110 37.213 10.476 11.577 1.00 0.00 O ATOM 1632 OE2 GLU A 110 36.222 11.821 10.156 1.00 0.00 O ATOM 0 H GLU A 110 33.822 8.153 12.828 1.00 0.00 H new ATOM 0 HA GLU A 110 32.342 9.605 10.934 1.00 0.00 H new ATOM 0 HB2 GLU A 110 35.101 8.308 10.846 1.00 0.00 H new ATOM 0 HB3 GLU A 110 34.487 9.345 9.574 1.00 0.00 H new ATOM 0 HG2 GLU A 110 34.045 11.130 11.332 1.00 0.00 H new ATOM 0 HG3 GLU A 110 34.832 10.100 12.511 1.00 0.00 H new ATOM 1639 N VAL A 111 32.815 6.400 10.207 1.00 0.00 N ATOM 1640 CA VAL A 111 32.314 5.398 9.290 1.00 0.00 C ATOM 1641 C VAL A 111 30.823 5.211 9.524 1.00 0.00 C ATOM 1642 O VAL A 111 30.090 5.158 8.545 1.00 0.00 O ATOM 1643 CB VAL A 111 33.126 4.093 9.365 1.00 0.00 C ATOM 1644 CG1 VAL A 111 32.590 3.072 8.348 1.00 0.00 C ATOM 1645 CG2 VAL A 111 34.606 4.372 9.053 1.00 0.00 C ATOM 0 H VAL A 111 33.409 6.049 10.958 1.00 0.00 H new ATOM 0 HA VAL A 111 32.445 5.740 8.264 1.00 0.00 H new ATOM 0 HB VAL A 111 33.031 3.690 10.373 1.00 0.00 H new ATOM 0 HG11 VAL A 111 33.174 2.154 8.412 1.00 0.00 H new ATOM 0 HG12 VAL A 111 31.545 2.854 8.568 1.00 0.00 H new ATOM 0 HG13 VAL A 111 32.671 3.484 7.342 1.00 0.00 H new ATOM 0 HG21 VAL A 111 35.171 3.442 9.109 1.00 0.00 H new ATOM 0 HG22 VAL A 111 34.694 4.790 8.050 1.00 0.00 H new ATOM 0 HG23 VAL A 111 35.003 5.082 9.778 1.00 0.00 H new ATOM 1655 N PHE A 112 30.347 5.212 10.773 1.00 0.00 N ATOM 1656 CA PHE A 112 28.903 5.256 11.024 1.00 0.00 C ATOM 1657 C PHE A 112 28.231 6.416 10.268 1.00 0.00 C ATOM 1658 O PHE A 112 27.285 6.176 9.517 1.00 0.00 O ATOM 1659 CB PHE A 112 28.594 5.336 12.522 1.00 0.00 C ATOM 1660 CG PHE A 112 28.592 4.010 13.258 1.00 0.00 C ATOM 1661 CD1 PHE A 112 29.793 3.419 13.686 1.00 0.00 C ATOM 1662 CD2 PHE A 112 27.368 3.373 13.543 1.00 0.00 C ATOM 1663 CE1 PHE A 112 29.772 2.196 14.379 1.00 0.00 C ATOM 1664 CE2 PHE A 112 27.345 2.154 14.242 1.00 0.00 C ATOM 1665 CZ PHE A 112 28.551 1.558 14.652 1.00 0.00 C ATOM 0 H PHE A 112 30.927 5.183 11.611 1.00 0.00 H new ATOM 0 HA PHE A 112 28.486 4.323 10.644 1.00 0.00 H new ATOM 0 HB2 PHE A 112 29.327 5.992 12.992 1.00 0.00 H new ATOM 0 HB3 PHE A 112 27.618 5.805 12.650 1.00 0.00 H new ATOM 0 HD1 PHE A 112 30.735 3.906 13.482 1.00 0.00 H new ATOM 0 HD2 PHE A 112 26.441 3.825 13.222 1.00 0.00 H new ATOM 0 HE1 PHE A 112 30.699 1.745 14.703 1.00 0.00 H new ATOM 0 HE2 PHE A 112 26.403 1.676 14.464 1.00 0.00 H new ATOM 0 HZ PHE A 112 28.538 0.613 15.175 1.00 0.00 H new ATOM 1675 N ARG A 113 28.739 7.650 10.390 1.00 0.00 N ATOM 1676 CA ARG A 113 28.176 8.827 9.712 1.00 0.00 C ATOM 1677 C ARG A 113 28.184 8.630 8.203 1.00 0.00 C ATOM 1678 O ARG A 113 27.196 8.921 7.530 1.00 0.00 O ATOM 1679 CB ARG A 113 29.002 10.096 10.021 1.00 0.00 C ATOM 1680 CG ARG A 113 28.829 10.663 11.441 1.00 0.00 C ATOM 1681 CD ARG A 113 29.677 11.932 11.612 1.00 0.00 C ATOM 1682 NE ARG A 113 29.370 12.648 12.868 1.00 0.00 N ATOM 1683 CZ ARG A 113 30.109 13.621 13.419 1.00 0.00 C ATOM 1684 NH1 ARG A 113 31.289 13.965 12.903 1.00 0.00 N ATOM 1685 NH2 ARG A 113 29.657 14.257 14.494 1.00 0.00 N ATOM 0 H ARG A 113 29.555 7.861 10.964 1.00 0.00 H new ATOM 0 HA ARG A 113 27.156 8.947 10.077 1.00 0.00 H new ATOM 0 HB2 ARG A 113 30.057 9.870 9.864 1.00 0.00 H new ATOM 0 HB3 ARG A 113 28.731 10.870 9.303 1.00 0.00 H new ATOM 0 HG2 ARG A 113 27.779 10.891 11.624 1.00 0.00 H new ATOM 0 HG3 ARG A 113 29.126 9.916 12.177 1.00 0.00 H new ATOM 0 HD2 ARG A 113 30.734 11.665 11.598 1.00 0.00 H new ATOM 0 HD3 ARG A 113 29.505 12.597 10.766 1.00 0.00 H new ATOM 0 HE ARG A 113 28.519 12.377 13.360 1.00 0.00 H new ATOM 0 HH11 ARG A 113 31.643 13.485 12.075 1.00 0.00 H new ATOM 0 HH12 ARG A 113 31.838 14.708 13.336 1.00 0.00 H new ATOM 0 HH21 ARG A 113 28.754 14.004 14.894 1.00 0.00 H new ATOM 0 HH22 ARG A 113 30.213 14.999 14.919 1.00 0.00 H new ATOM 1699 N THR A 114 29.300 8.142 7.679 1.00 0.00 N ATOM 1700 CA THR A 114 29.498 8.037 6.250 1.00 0.00 C ATOM 1701 C THR A 114 28.570 6.958 5.701 1.00 0.00 C ATOM 1702 O THR A 114 27.895 7.189 4.700 1.00 0.00 O ATOM 1703 CB THR A 114 30.977 7.732 5.967 1.00 0.00 C ATOM 1704 OG1 THR A 114 31.793 8.778 6.465 1.00 0.00 O ATOM 1705 CG2 THR A 114 31.266 7.568 4.474 1.00 0.00 C ATOM 0 H THR A 114 30.088 7.810 8.235 1.00 0.00 H new ATOM 0 HA THR A 114 29.253 8.975 5.751 1.00 0.00 H new ATOM 0 HB THR A 114 31.202 6.790 6.467 1.00 0.00 H new ATOM 0 HG1 THR A 114 31.896 8.679 7.435 1.00 0.00 H new ATOM 0 HG21 THR A 114 32.325 7.354 4.330 1.00 0.00 H new ATOM 0 HG22 THR A 114 30.672 6.745 4.077 1.00 0.00 H new ATOM 0 HG23 THR A 114 31.007 8.488 3.950 1.00 0.00 H new ATOM 1713 N VAL A 115 28.487 5.801 6.362 1.00 0.00 N ATOM 1714 CA VAL A 115 27.763 4.649 5.829 1.00 0.00 C ATOM 1715 C VAL A 115 26.295 5.022 5.760 1.00 0.00 C ATOM 1716 O VAL A 115 25.672 4.890 4.716 1.00 0.00 O ATOM 1717 CB VAL A 115 28.017 3.402 6.711 1.00 0.00 C ATOM 1718 CG1 VAL A 115 27.023 2.257 6.466 1.00 0.00 C ATOM 1719 CG2 VAL A 115 29.411 2.837 6.442 1.00 0.00 C ATOM 0 H VAL A 115 28.916 5.639 7.273 1.00 0.00 H new ATOM 0 HA VAL A 115 28.110 4.391 4.829 1.00 0.00 H new ATOM 0 HB VAL A 115 27.902 3.753 7.737 1.00 0.00 H new ATOM 0 HG11 VAL A 115 27.265 1.419 7.120 1.00 0.00 H new ATOM 0 HG12 VAL A 115 26.011 2.602 6.678 1.00 0.00 H new ATOM 0 HG13 VAL A 115 27.087 1.936 5.426 1.00 0.00 H new ATOM 0 HG21 VAL A 115 29.576 1.961 7.069 1.00 0.00 H new ATOM 0 HG22 VAL A 115 29.492 2.553 5.393 1.00 0.00 H new ATOM 0 HG23 VAL A 115 30.161 3.594 6.672 1.00 0.00 H new ATOM 1729 N ARG A 116 25.775 5.584 6.851 1.00 0.00 N ATOM 1730 CA ARG A 116 24.450 6.176 6.926 1.00 0.00 C ATOM 1731 C ARG A 116 24.181 7.067 5.716 1.00 0.00 C ATOM 1732 O ARG A 116 23.193 6.850 5.031 1.00 0.00 O ATOM 1733 CB ARG A 116 24.445 6.923 8.267 1.00 0.00 C ATOM 1734 CG ARG A 116 23.296 7.894 8.520 1.00 0.00 C ATOM 1735 CD ARG A 116 23.765 8.871 9.592 1.00 0.00 C ATOM 1736 NE ARG A 116 24.525 9.996 8.997 1.00 0.00 N ATOM 1737 CZ ARG A 116 25.028 11.057 9.641 1.00 0.00 C ATOM 1738 NH1 ARG A 116 24.856 11.210 10.948 1.00 0.00 N ATOM 1739 NH2 ARG A 116 25.723 11.964 8.966 1.00 0.00 N ATOM 0 H ARG A 116 26.285 5.639 7.733 1.00 0.00 H new ATOM 0 HA ARG A 116 23.642 5.445 6.894 1.00 0.00 H new ATOM 0 HB2 ARG A 116 24.443 6.182 9.066 1.00 0.00 H new ATOM 0 HB3 ARG A 116 25.380 7.477 8.348 1.00 0.00 H new ATOM 0 HG2 ARG A 116 23.030 8.424 7.605 1.00 0.00 H new ATOM 0 HG3 ARG A 116 22.405 7.359 8.849 1.00 0.00 H new ATOM 0 HD2 ARG A 116 22.904 9.258 10.137 1.00 0.00 H new ATOM 0 HD3 ARG A 116 24.391 8.348 10.315 1.00 0.00 H new ATOM 0 HE ARG A 116 24.682 9.958 7.990 1.00 0.00 H new ATOM 0 HH11 ARG A 116 24.334 10.513 11.479 1.00 0.00 H new ATOM 0 HH12 ARG A 116 25.246 12.025 11.422 1.00 0.00 H new ATOM 0 HH21 ARG A 116 25.871 11.850 7.963 1.00 0.00 H new ATOM 0 HH22 ARG A 116 26.109 12.775 9.450 1.00 0.00 H new ATOM 1753 N GLY A 117 25.049 8.031 5.409 1.00 0.00 N ATOM 1754 CA GLY A 117 24.792 8.939 4.294 1.00 0.00 C ATOM 1755 C GLY A 117 24.769 8.205 2.955 1.00 0.00 C ATOM 1756 O GLY A 117 23.874 8.422 2.142 1.00 0.00 O ATOM 0 H GLY A 117 25.922 8.201 5.908 1.00 0.00 H new ATOM 0 HA2 GLY A 117 23.838 9.442 4.448 1.00 0.00 H new ATOM 0 HA3 GLY A 117 25.560 9.712 4.271 1.00 0.00 H new ATOM 1760 N GLN A 118 25.693 7.275 2.731 1.00 0.00 N ATOM 1761 CA GLN A 118 25.744 6.514 1.487 1.00 0.00 C ATOM 1762 C GLN A 118 24.501 5.634 1.338 1.00 0.00 C ATOM 1763 O GLN A 118 23.939 5.509 0.247 1.00 0.00 O ATOM 1764 CB GLN A 118 27.026 5.677 1.440 1.00 0.00 C ATOM 1765 CG GLN A 118 28.260 6.588 1.464 1.00 0.00 C ATOM 1766 CD GLN A 118 29.584 5.820 1.521 1.00 0.00 C ATOM 1767 OE1 GLN A 118 29.695 4.776 2.163 1.00 0.00 O ATOM 1768 NE2 GLN A 118 30.628 6.322 0.876 1.00 0.00 N ATOM 0 H GLN A 118 26.422 7.029 3.401 1.00 0.00 H new ATOM 0 HA GLN A 118 25.756 7.209 0.648 1.00 0.00 H new ATOM 0 HB2 GLN A 118 27.054 4.994 2.289 1.00 0.00 H new ATOM 0 HB3 GLN A 118 27.035 5.065 0.538 1.00 0.00 H new ATOM 0 HG2 GLN A 118 28.253 7.220 0.576 1.00 0.00 H new ATOM 0 HG3 GLN A 118 28.196 7.251 2.327 1.00 0.00 H new ATOM 0 HE21 GLN A 118 30.531 7.188 0.345 1.00 0.00 H new ATOM 0 HE22 GLN A 118 31.528 5.843 0.911 1.00 0.00 H new ATOM 1777 N VAL A 119 24.031 5.077 2.454 1.00 0.00 N ATOM 1778 CA VAL A 119 22.793 4.326 2.508 1.00 0.00 C ATOM 1779 C VAL A 119 21.646 5.275 2.154 1.00 0.00 C ATOM 1780 O VAL A 119 20.783 4.880 1.385 1.00 0.00 O ATOM 1781 CB VAL A 119 22.622 3.681 3.904 1.00 0.00 C ATOM 1782 CG1 VAL A 119 21.222 3.112 4.145 1.00 0.00 C ATOM 1783 CG2 VAL A 119 23.610 2.515 4.089 1.00 0.00 C ATOM 0 H VAL A 119 24.510 5.140 3.352 1.00 0.00 H new ATOM 0 HA VAL A 119 22.799 3.507 1.789 1.00 0.00 H new ATOM 0 HB VAL A 119 22.806 4.489 4.612 1.00 0.00 H new ATOM 0 HG11 VAL A 119 21.173 2.676 5.143 1.00 0.00 H new ATOM 0 HG12 VAL A 119 20.485 3.911 4.062 1.00 0.00 H new ATOM 0 HG13 VAL A 119 21.009 2.343 3.402 1.00 0.00 H new ATOM 0 HG21 VAL A 119 23.473 2.075 5.077 1.00 0.00 H new ATOM 0 HG22 VAL A 119 23.426 1.758 3.326 1.00 0.00 H new ATOM 0 HG23 VAL A 119 24.631 2.885 3.995 1.00 0.00 H new ATOM 1793 N LYS A 120 21.617 6.516 2.660 1.00 0.00 N ATOM 1794 CA LYS A 120 20.481 7.424 2.461 1.00 0.00 C ATOM 1795 C LYS A 120 20.236 7.690 0.982 1.00 0.00 C ATOM 1796 O LYS A 120 19.088 7.723 0.548 1.00 0.00 O ATOM 1797 CB LYS A 120 20.624 8.693 3.331 1.00 0.00 C ATOM 1798 CG LYS A 120 21.331 9.941 2.753 1.00 0.00 C ATOM 1799 CD LYS A 120 20.409 11.161 2.583 1.00 0.00 C ATOM 1800 CE LYS A 120 19.322 10.953 1.512 1.00 0.00 C ATOM 1801 NZ LYS A 120 18.515 12.184 1.293 1.00 0.00 N ATOM 0 H LYS A 120 22.374 6.915 3.214 1.00 0.00 H new ATOM 0 HA LYS A 120 19.571 6.937 2.813 1.00 0.00 H new ATOM 0 HB2 LYS A 120 19.621 8.997 3.632 1.00 0.00 H new ATOM 0 HB3 LYS A 120 21.156 8.408 4.238 1.00 0.00 H new ATOM 0 HG2 LYS A 120 22.159 10.213 3.408 1.00 0.00 H new ATOM 0 HG3 LYS A 120 21.761 9.686 1.785 1.00 0.00 H new ATOM 0 HD2 LYS A 120 19.932 11.384 3.537 1.00 0.00 H new ATOM 0 HD3 LYS A 120 21.011 12.030 2.317 1.00 0.00 H new ATOM 0 HE2 LYS A 120 19.789 10.654 0.574 1.00 0.00 H new ATOM 0 HE3 LYS A 120 18.665 10.138 1.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 17.806 12.007 0.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 18.035 12.446 2.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 19.140 12.960 0.995 1.00 0.00 H new ATOM 1815 N GLU A 121 21.301 7.838 0.200 1.00 0.00 N ATOM 1816 CA GLU A 121 21.197 8.052 -1.235 1.00 0.00 C ATOM 1817 C GLU A 121 20.691 6.788 -1.924 1.00 0.00 C ATOM 1818 O GLU A 121 19.824 6.883 -2.789 1.00 0.00 O ATOM 1819 CB GLU A 121 22.560 8.461 -1.824 1.00 0.00 C ATOM 1820 CG GLU A 121 23.094 9.786 -1.268 1.00 0.00 C ATOM 1821 CD GLU A 121 24.371 10.230 -2.005 1.00 0.00 C ATOM 1822 OE1 GLU A 121 25.480 9.766 -1.648 1.00 0.00 O ATOM 1823 OE2 GLU A 121 24.272 11.056 -2.946 1.00 0.00 O ATOM 0 H GLU A 121 22.260 7.813 0.546 1.00 0.00 H new ATOM 0 HA GLU A 121 20.486 8.860 -1.409 1.00 0.00 H new ATOM 0 HB2 GLU A 121 23.285 7.673 -1.622 1.00 0.00 H new ATOM 0 HB3 GLU A 121 22.469 8.541 -2.907 1.00 0.00 H new ATOM 0 HG2 GLU A 121 22.330 10.557 -1.364 1.00 0.00 H new ATOM 0 HG3 GLU A 121 23.305 9.677 -0.204 1.00 0.00 H new ATOM 1830 N ARG A 122 21.176 5.597 -1.551 1.00 0.00 N ATOM 1831 CA ARG A 122 20.680 4.365 -2.168 1.00 0.00 C ATOM 1832 C ARG A 122 19.235 4.092 -1.782 1.00 0.00 C ATOM 1833 O ARG A 122 18.449 3.740 -2.656 1.00 0.00 O ATOM 1834 CB ARG A 122 21.589 3.174 -1.859 1.00 0.00 C ATOM 1835 CG ARG A 122 22.910 3.296 -2.638 1.00 0.00 C ATOM 1836 CD ARG A 122 23.433 1.909 -3.004 1.00 0.00 C ATOM 1837 NE ARG A 122 24.636 1.995 -3.858 1.00 0.00 N ATOM 1838 CZ ARG A 122 25.322 0.952 -4.345 1.00 0.00 C ATOM 1839 NH1 ARG A 122 24.865 -0.281 -4.163 1.00 0.00 N ATOM 1840 NH2 ARG A 122 26.469 1.145 -4.987 1.00 0.00 N ATOM 0 H ARG A 122 21.896 5.463 -0.841 1.00 0.00 H new ATOM 0 HA ARG A 122 20.702 4.509 -3.248 1.00 0.00 H new ATOM 0 HB2 ARG A 122 21.792 3.131 -0.789 1.00 0.00 H new ATOM 0 HB3 ARG A 122 21.086 2.245 -2.126 1.00 0.00 H new ATOM 0 HG2 ARG A 122 22.755 3.885 -3.542 1.00 0.00 H new ATOM 0 HG3 ARG A 122 23.649 3.825 -2.036 1.00 0.00 H new ATOM 0 HD2 ARG A 122 23.669 1.356 -2.095 1.00 0.00 H new ATOM 0 HD3 ARG A 122 22.655 1.350 -3.524 1.00 0.00 H new ATOM 0 HE ARG A 122 24.973 2.928 -4.097 1.00 0.00 H new ATOM 0 HH11 ARG A 122 23.994 -0.432 -3.654 1.00 0.00 H new ATOM 0 HH12 ARG A 122 25.385 -1.077 -4.532 1.00 0.00 H new ATOM 0 HH21 ARG A 122 26.831 2.090 -5.111 1.00 0.00 H new ATOM 0 HH22 ARG A 122 26.987 0.348 -5.356 1.00 0.00 H new ATOM 1854 N VAL A 123 18.849 4.341 -0.531 1.00 0.00 N ATOM 1855 CA VAL A 123 17.466 4.278 -0.101 1.00 0.00 C ATOM 1856 C VAL A 123 16.642 5.193 -0.998 1.00 0.00 C ATOM 1857 O VAL A 123 15.686 4.749 -1.626 1.00 0.00 O ATOM 1858 CB VAL A 123 17.391 4.642 1.397 1.00 0.00 C ATOM 1859 CG1 VAL A 123 15.960 4.883 1.849 1.00 0.00 C ATOM 1860 CG2 VAL A 123 17.956 3.520 2.279 1.00 0.00 C ATOM 0 H VAL A 123 19.499 4.594 0.214 1.00 0.00 H new ATOM 0 HA VAL A 123 17.050 3.275 -0.198 1.00 0.00 H new ATOM 0 HB VAL A 123 17.982 5.551 1.508 1.00 0.00 H new ATOM 0 HG11 VAL A 123 15.951 5.136 2.909 1.00 0.00 H new ATOM 0 HG12 VAL A 123 15.531 5.705 1.276 1.00 0.00 H new ATOM 0 HG13 VAL A 123 15.370 3.981 1.687 1.00 0.00 H new ATOM 0 HG21 VAL A 123 17.887 3.811 3.327 1.00 0.00 H new ATOM 0 HG22 VAL A 123 17.383 2.607 2.118 1.00 0.00 H new ATOM 0 HG23 VAL A 123 19.000 3.344 2.020 1.00 0.00 H new ATOM 1870 N GLU A 124 17.041 6.448 -1.132 1.00 0.00 N ATOM 1871 CA GLU A 124 16.277 7.412 -1.897 1.00 0.00 C ATOM 1872 C GLU A 124 16.210 7.041 -3.378 1.00 0.00 C ATOM 1873 O GLU A 124 15.184 7.253 -4.017 1.00 0.00 O ATOM 1874 CB GLU A 124 16.869 8.780 -1.615 1.00 0.00 C ATOM 1875 CG GLU A 124 16.037 9.886 -2.245 1.00 0.00 C ATOM 1876 CD GLU A 124 16.565 11.284 -1.888 1.00 0.00 C ATOM 1877 OE1 GLU A 124 16.667 11.611 -0.681 1.00 0.00 O ATOM 1878 OE2 GLU A 124 16.888 12.068 -2.813 1.00 0.00 O ATOM 0 H GLU A 124 17.895 6.821 -0.717 1.00 0.00 H new ATOM 0 HA GLU A 124 15.231 7.420 -1.592 1.00 0.00 H new ATOM 0 HB2 GLU A 124 16.929 8.937 -0.538 1.00 0.00 H new ATOM 0 HB3 GLU A 124 17.887 8.824 -2.001 1.00 0.00 H new ATOM 0 HG2 GLU A 124 16.036 9.765 -3.328 1.00 0.00 H new ATOM 0 HG3 GLU A 124 15.003 9.794 -1.913 1.00 0.00 H new ATOM 1885 N ASN A 125 17.256 6.420 -3.922 1.00 0.00 N ATOM 1886 CA ASN A 125 17.250 5.887 -5.278 1.00 0.00 C ATOM 1887 C ASN A 125 16.218 4.780 -5.416 1.00 0.00 C ATOM 1888 O ASN A 125 15.421 4.802 -6.348 1.00 0.00 O ATOM 1889 CB ASN A 125 18.622 5.341 -5.684 1.00 0.00 C ATOM 1890 CG ASN A 125 19.477 6.402 -6.369 1.00 0.00 C ATOM 1891 OD1 ASN A 125 19.572 6.446 -7.594 1.00 0.00 O ATOM 1892 ND2 ASN A 125 20.097 7.284 -5.602 1.00 0.00 N ATOM 0 H ASN A 125 18.136 6.273 -3.428 1.00 0.00 H new ATOM 0 HA ASN A 125 16.996 6.715 -5.940 1.00 0.00 H new ATOM 0 HB2 ASN A 125 19.142 4.971 -4.800 1.00 0.00 H new ATOM 0 HB3 ASN A 125 18.491 4.492 -6.355 1.00 0.00 H new ATOM 0 HD21 ASN A 125 20.666 8.017 -6.025 1.00 0.00 H new ATOM 0 HD22 ASN A 125 20.006 7.231 -4.587 1.00 0.00 H new ATOM 1899 N LEU A 126 16.205 3.821 -4.490 1.00 0.00 N ATOM 1900 CA LEU A 126 15.226 2.732 -4.470 1.00 0.00 C ATOM 1901 C LEU A 126 13.824 3.307 -4.458 1.00 0.00 C ATOM 1902 O LEU A 126 13.002 2.915 -5.277 1.00 0.00 O ATOM 1903 CB LEU A 126 15.534 1.786 -3.294 1.00 0.00 C ATOM 1904 CG LEU A 126 14.381 1.201 -2.455 1.00 0.00 C ATOM 1905 CD1 LEU A 126 14.715 -0.219 -2.021 1.00 0.00 C ATOM 1906 CD2 LEU A 126 14.120 1.972 -1.161 1.00 0.00 C ATOM 0 H LEU A 126 16.879 3.777 -3.726 1.00 0.00 H new ATOM 0 HA LEU A 126 15.294 2.125 -5.373 1.00 0.00 H new ATOM 0 HB2 LEU A 126 16.103 0.946 -3.693 1.00 0.00 H new ATOM 0 HB3 LEU A 126 16.193 2.322 -2.611 1.00 0.00 H new ATOM 0 HG LEU A 126 13.505 1.255 -3.101 1.00 0.00 H new ATOM 0 HD11 LEU A 126 13.893 -0.621 -1.429 1.00 0.00 H new ATOM 0 HD12 LEU A 126 14.867 -0.843 -2.902 1.00 0.00 H new ATOM 0 HD13 LEU A 126 15.625 -0.211 -1.421 1.00 0.00 H new ATOM 0 HD21 LEU A 126 13.296 1.506 -0.620 1.00 0.00 H new ATOM 0 HD22 LEU A 126 15.016 1.956 -0.541 1.00 0.00 H new ATOM 0 HD23 LEU A 126 13.861 3.004 -1.398 1.00 0.00 H new ATOM 1918 N ILE A 127 13.599 4.291 -3.602 1.00 0.00 N ATOM 1919 CA ILE A 127 12.344 5.015 -3.494 1.00 0.00 C ATOM 1920 C ILE A 127 12.012 5.665 -4.833 1.00 0.00 C ATOM 1921 O ILE A 127 10.881 5.550 -5.288 1.00 0.00 O ATOM 1922 CB ILE A 127 12.497 6.010 -2.333 1.00 0.00 C ATOM 1923 CG1 ILE A 127 12.126 5.253 -1.042 1.00 0.00 C ATOM 1924 CG2 ILE A 127 11.698 7.311 -2.446 1.00 0.00 C ATOM 1925 CD1 ILE A 127 13.105 5.582 0.079 1.00 0.00 C ATOM 0 H ILE A 127 14.307 4.617 -2.944 1.00 0.00 H new ATOM 0 HA ILE A 127 11.499 4.363 -3.271 1.00 0.00 H new ATOM 0 HB ILE A 127 13.531 6.356 -2.343 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.114 5.519 -0.737 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.130 4.179 -1.231 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.887 7.931 -1.570 1.00 0.00 H new ATOM 0 HG22 ILE A 127 12.003 7.849 -3.344 1.00 0.00 H new ATOM 0 HG23 ILE A 127 10.634 7.081 -2.505 1.00 0.00 H new ATOM 0 HD11 ILE A 127 12.823 5.037 0.980 1.00 0.00 H new ATOM 0 HD12 ILE A 127 14.112 5.292 -0.221 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.081 6.653 0.281 1.00 0.00 H new ATOM 1937 N ALA A 128 12.980 6.295 -5.501 1.00 0.00 N ATOM 1938 CA ALA A 128 12.746 6.941 -6.781 1.00 0.00 C ATOM 1939 C ALA A 128 12.258 5.947 -7.844 1.00 0.00 C ATOM 1940 O ALA A 128 11.516 6.343 -8.747 1.00 0.00 O ATOM 1941 CB ALA A 128 14.005 7.692 -7.236 1.00 0.00 C ATOM 0 H ALA A 128 13.941 6.368 -5.167 1.00 0.00 H new ATOM 0 HA ALA A 128 11.945 7.669 -6.651 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.816 8.171 -8.196 1.00 0.00 H new ATOM 0 HB2 ALA A 128 14.263 8.450 -6.497 1.00 0.00 H new ATOM 0 HB3 ALA A 128 14.831 6.988 -7.338 1.00 0.00 H new ATOM 1947 N LYS A 129 12.648 4.668 -7.750 1.00 0.00 N ATOM 1948 CA LYS A 129 12.169 3.639 -8.657 1.00 0.00 C ATOM 1949 C LYS A 129 10.724 3.247 -8.348 1.00 0.00 C ATOM 1950 O LYS A 129 9.937 3.071 -9.281 1.00 0.00 O ATOM 1951 CB LYS A 129 13.049 2.385 -8.571 1.00 0.00 C ATOM 1952 CG LYS A 129 14.521 2.669 -8.883 1.00 0.00 C ATOM 1953 CD LYS A 129 15.376 1.445 -8.568 1.00 0.00 C ATOM 1954 CE LYS A 129 16.852 1.829 -8.703 1.00 0.00 C ATOM 1955 NZ LYS A 129 17.745 0.651 -8.871 1.00 0.00 N ATOM 0 H LYS A 129 13.301 4.328 -7.044 1.00 0.00 H new ATOM 0 HA LYS A 129 12.217 4.056 -9.663 1.00 0.00 H new ATOM 0 HB2 LYS A 129 12.970 1.960 -7.571 1.00 0.00 H new ATOM 0 HB3 LYS A 129 12.673 1.635 -9.267 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.632 2.937 -9.934 1.00 0.00 H new ATOM 0 HG3 LYS A 129 14.866 3.522 -8.298 1.00 0.00 H new ATOM 0 HD2 LYS A 129 15.169 1.089 -7.559 1.00 0.00 H new ATOM 0 HD3 LYS A 129 15.134 0.629 -9.249 1.00 0.00 H new ATOM 0 HE2 LYS A 129 16.972 2.494 -9.558 1.00 0.00 H new ATOM 0 HE3 LYS A 129 17.159 2.388 -7.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 18.712 0.975 -9.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 17.746 0.088 -7.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 17.402 0.065 -9.659 1.00 0.00 H new ATOM 1969 N ILE A 130 10.373 3.101 -7.067 1.00 0.00 N ATOM 1970 CA ILE A 130 9.117 2.508 -6.647 1.00 0.00 C ATOM 1971 C ILE A 130 8.004 3.484 -6.271 1.00 0.00 C ATOM 1972 O ILE A 130 6.851 3.225 -6.621 1.00 0.00 O ATOM 1973 CB ILE A 130 9.375 1.499 -5.512 1.00 0.00 C ATOM 1974 CG1 ILE A 130 10.039 2.079 -4.249 1.00 0.00 C ATOM 1975 CG2 ILE A 130 10.044 0.246 -6.120 1.00 0.00 C ATOM 1976 CD1 ILE A 130 10.640 1.032 -3.306 1.00 0.00 C ATOM 0 H ILE A 130 10.965 3.397 -6.291 1.00 0.00 H new ATOM 0 HA ILE A 130 8.728 2.006 -7.533 1.00 0.00 H new ATOM 0 HB ILE A 130 8.419 1.196 -5.086 1.00 0.00 H new ATOM 0 HG12 ILE A 130 10.826 2.769 -4.553 1.00 0.00 H new ATOM 0 HG13 ILE A 130 9.299 2.661 -3.700 1.00 0.00 H new ATOM 0 HG21 ILE A 130 10.236 -0.483 -5.332 1.00 0.00 H new ATOM 0 HG22 ILE A 130 9.383 -0.193 -6.867 1.00 0.00 H new ATOM 0 HG23 ILE A 130 10.986 0.528 -6.590 1.00 0.00 H new ATOM 0 HD11 ILE A 130 11.085 1.531 -2.445 1.00 0.00 H new ATOM 0 HD12 ILE A 130 9.856 0.354 -2.968 1.00 0.00 H new ATOM 0 HD13 ILE A 130 11.407 0.465 -3.833 1.00 0.00 H new ATOM 1988 N SER A 131 8.297 4.532 -5.516 1.00 0.00 N ATOM 1989 CA SER A 131 7.300 5.413 -4.941 1.00 0.00 C ATOM 1990 C SER A 131 6.596 6.208 -6.045 1.00 0.00 C ATOM 1991 O SER A 131 7.287 6.798 -6.910 1.00 0.00 O ATOM 1992 CB SER A 131 7.962 6.326 -3.915 1.00 0.00 C ATOM 1993 OG SER A 131 8.559 5.512 -2.904 1.00 0.00 O ATOM 1994 OXT SER A 131 5.344 6.244 -6.048 1.00 0.00 O ATOM 0 H SER A 131 9.254 4.796 -5.283 1.00 0.00 H new ATOM 0 HA SER A 131 6.537 4.826 -4.429 1.00 0.00 H new ATOM 0 HB2 SER A 131 8.717 6.950 -4.394 1.00 0.00 H new ATOM 0 HB3 SER A 131 7.225 6.998 -3.475 1.00 0.00 H new ATOM 0 HG SER A 131 9.444 5.215 -3.203 1.00 0.00 H new TER 2000 SER A 131