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 125 ASN : amide:sc= 0.527 K(o=2.8,f=-5.2!) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -170:sc= 2.3 (180deg=1.04) USER MOD Set 2.1: A 78 SER OG : rot -77:sc= 1.48 USER MOD Set 2.2: A 80 CYS SG : rot 96:sc= -1.11 USER MOD Set 3.1: A 39 SER OG : rot 180:sc= -0.0068 USER MOD Set 3.2: A 62 SER OG : rot 140:sc= 0.363 USER MOD Set 4.1: A 16 GLN : amide:sc= 1.88 K(o=4,f=-0.084) USER MOD Set 4.2: A 34 SER OG : rot -69:sc= 2.16 USER MOD Set 5.1: A 8 CYS SG : rot 69:sc= 0.465 USER MOD Set 5.2: A 12 SER OG : rot 149:sc= 1.49 USER MOD Set 5.3: A 40 SER OG : rot 140:sc= 0.86 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 146:sc= 0.0114 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0.523 (180deg=0.523) USER MOD Single : A 3 LYS NZ :NH3+ 177:sc= 1.31 (180deg=1.28) USER MOD Single : A 5 MET CE :methyl -158:sc= 0 (180deg=-0.986) USER MOD Single : A 9 LYS NZ :NH3+ 168:sc= 0.956 (180deg=0.855) USER MOD Single : A 11 ASN : amide:sc= 0.371 K(o=0.37,f=-5.9!) USER MOD Single : A 13 CYS SG : rot -33:sc= -0.335 USER MOD Single : A 15 SER OG : rot 179:sc= 0.0466 USER MOD Single : A 17 MET CE :methyl -171:sc= -0.821 (180deg=-0.962) USER MOD Single : A 23 LYS NZ :NH3+ 173:sc= 1.16 (180deg=1.11) USER MOD Single : A 24 THR OG1 : rot 86:sc= 0.765 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot -170:sc= 0 USER MOD Single : A 35 CYS SG : rot -120:sc= -0.367 USER MOD Single : A 43 HIS : no HD1:sc= 0.816 K(o=0.82,f=-7.5!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -158:sc= 0 (180deg=-0.089) USER MOD Single : A 50 MET CE :methyl -146:sc= -0.025 (180deg=-1.16) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0224 USER MOD Single : A 60 GLN : amide:sc= 0.542 K(o=0.54,f=-0.072) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 2.41 K(o=2.4,f=-0.014) USER MOD Single : A 69 ASN : amide:sc= 1.02 K(o=1,f=-0.065) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 92 THR OG1 : rot -22:sc= 0.106 USER MOD Single : A 93 GLN : amide:sc= -0.131! C(o=-0.13!,f=-6!) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 GLN : amide:sc= 1.84 K(o=1.8,f=-0.011) USER MOD Single : A 108 SER OG : rot 180:sc=-0.00639 USER MOD Single : A 114 THR OG1 : rot 77:sc= 1.23 USER MOD Single : A 118 GLN : amide:sc= 0.409 X(o=0.41,f=-0.00027) USER MOD Single : A 120 LYS NZ :NH3+ -168:sc= 1.29 (180deg=1.16) USER MOD Single : A 131 SER OG : rot 29:sc= 0.0185 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.761 1.995 1.621 1.00 0.00 N ATOM 2 CA MET A 1 3.826 1.660 0.162 1.00 0.00 C ATOM 3 C MET A 1 4.729 0.438 -0.088 1.00 0.00 C ATOM 4 O MET A 1 5.758 0.302 0.571 1.00 0.00 O ATOM 5 CB MET A 1 4.281 2.886 -0.679 1.00 0.00 C ATOM 6 CG MET A 1 4.315 2.648 -2.199 1.00 0.00 C ATOM 7 SD MET A 1 2.775 2.017 -2.931 1.00 0.00 S ATOM 8 CE MET A 1 1.762 3.524 -2.963 1.00 0.00 C ATOM 0 H1 MET A 1 3.681 3.025 1.737 1.00 0.00 H new ATOM 0 H2 MET A 1 2.932 1.533 2.047 1.00 0.00 H new ATOM 0 H3 MET A 1 4.625 1.659 2.093 1.00 0.00 H new ATOM 0 HA MET A 1 2.820 1.397 -0.164 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.611 3.721 -0.471 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.276 3.186 -0.350 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.571 3.587 -2.690 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.117 1.943 -2.420 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.784 3.296 -3.387 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.638 3.901 -1.948 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.255 4.281 -3.573 1.00 0.00 H new ATOM 18 N LYS A 2 4.387 -0.431 -1.059 1.00 0.00 N ATOM 19 CA LYS A 2 5.209 -1.597 -1.457 1.00 0.00 C ATOM 20 C LYS A 2 6.366 -1.208 -2.373 1.00 0.00 C ATOM 21 O LYS A 2 6.194 -0.418 -3.303 1.00 0.00 O ATOM 22 CB LYS A 2 4.352 -2.757 -2.003 1.00 0.00 C ATOM 23 CG LYS A 2 3.310 -2.391 -3.067 1.00 0.00 C ATOM 24 CD LYS A 2 2.434 -3.612 -3.386 1.00 0.00 C ATOM 25 CE LYS A 2 1.315 -3.303 -4.392 1.00 0.00 C ATOM 26 NZ LYS A 2 0.188 -2.505 -3.816 1.00 0.00 N ATOM 0 H LYS A 2 3.524 -0.345 -1.596 1.00 0.00 H new ATOM 0 HA LYS A 2 5.676 -1.981 -0.550 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.021 -3.508 -2.424 1.00 0.00 H new ATOM 0 HB3 LYS A 2 3.835 -3.224 -1.165 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.688 -1.570 -2.711 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.809 -2.044 -3.972 1.00 0.00 H new ATOM 0 HD2 LYS A 2 3.062 -4.409 -3.784 1.00 0.00 H new ATOM 0 HD3 LYS A 2 1.992 -3.986 -2.463 1.00 0.00 H new ATOM 0 HE2 LYS A 2 1.738 -2.759 -5.236 1.00 0.00 H new ATOM 0 HE3 LYS A 2 0.921 -4.241 -4.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -0.528 -2.335 -4.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.242 -3.030 -3.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 0.550 -1.594 -3.468 1.00 0.00 H new ATOM 40 N LYS A 3 7.546 -1.774 -2.107 1.00 0.00 N ATOM 41 CA LYS A 3 8.793 -1.492 -2.837 1.00 0.00 C ATOM 42 C LYS A 3 9.179 -2.650 -3.758 1.00 0.00 C ATOM 43 O LYS A 3 9.254 -3.796 -3.321 1.00 0.00 O ATOM 44 CB LYS A 3 9.893 -1.126 -1.823 1.00 0.00 C ATOM 45 CG LYS A 3 11.111 -0.441 -2.466 1.00 0.00 C ATOM 46 CD LYS A 3 12.193 -0.045 -1.445 1.00 0.00 C ATOM 47 CE LYS A 3 11.694 0.962 -0.395 1.00 0.00 C ATOM 48 NZ LYS A 3 12.784 1.378 0.531 1.00 0.00 N ATOM 0 H LYS A 3 7.668 -2.458 -1.361 1.00 0.00 H new ATOM 0 HA LYS A 3 8.649 -0.638 -3.499 1.00 0.00 H new ATOM 0 HB2 LYS A 3 9.473 -0.466 -1.064 1.00 0.00 H new ATOM 0 HB3 LYS A 3 10.222 -2.031 -1.312 1.00 0.00 H new ATOM 0 HG2 LYS A 3 11.547 -1.111 -3.207 1.00 0.00 H new ATOM 0 HG3 LYS A 3 10.779 0.450 -2.998 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.551 -0.941 -0.938 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.044 0.383 -1.975 1.00 0.00 H new ATOM 0 HE2 LYS A 3 11.288 1.840 -0.897 1.00 0.00 H new ATOM 0 HE3 LYS A 3 10.880 0.517 0.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.423 2.095 1.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.120 0.551 1.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 13.571 1.779 -0.018 1.00 0.00 H new ATOM 62 N VAL A 4 9.428 -2.321 -5.024 1.00 0.00 N ATOM 63 CA VAL A 4 9.806 -3.238 -6.106 1.00 0.00 C ATOM 64 C VAL A 4 11.325 -3.243 -6.292 1.00 0.00 C ATOM 65 O VAL A 4 11.889 -2.250 -6.748 1.00 0.00 O ATOM 66 CB VAL A 4 9.106 -2.834 -7.424 1.00 0.00 C ATOM 67 CG1 VAL A 4 9.418 -3.826 -8.552 1.00 0.00 C ATOM 68 CG2 VAL A 4 7.580 -2.773 -7.272 1.00 0.00 C ATOM 0 H VAL A 4 9.369 -1.354 -5.344 1.00 0.00 H new ATOM 0 HA VAL A 4 9.484 -4.244 -5.836 1.00 0.00 H new ATOM 0 HB VAL A 4 9.491 -1.845 -7.670 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.910 -3.512 -9.464 1.00 0.00 H new ATOM 0 HG12 VAL A 4 10.494 -3.852 -8.726 1.00 0.00 H new ATOM 0 HG13 VAL A 4 9.072 -4.820 -8.268 1.00 0.00 H new ATOM 0 HG21 VAL A 4 7.131 -2.485 -8.223 1.00 0.00 H new ATOM 0 HG22 VAL A 4 7.205 -3.752 -6.975 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.319 -2.038 -6.510 1.00 0.00 H new ATOM 78 N MET A 5 11.999 -4.349 -5.972 1.00 0.00 N ATOM 79 CA MET A 5 13.413 -4.531 -6.331 1.00 0.00 C ATOM 80 C MET A 5 13.505 -5.259 -7.673 1.00 0.00 C ATOM 81 O MET A 5 13.025 -6.385 -7.786 1.00 0.00 O ATOM 82 CB MET A 5 14.181 -5.318 -5.257 1.00 0.00 C ATOM 83 CG MET A 5 15.665 -5.492 -5.613 1.00 0.00 C ATOM 84 SD MET A 5 16.629 -3.957 -5.661 1.00 0.00 S ATOM 85 CE MET A 5 17.324 -3.994 -3.986 1.00 0.00 C ATOM 0 H MET A 5 11.591 -5.134 -5.465 1.00 0.00 H new ATOM 0 HA MET A 5 13.872 -3.545 -6.406 1.00 0.00 H new ATOM 0 HB2 MET A 5 14.097 -4.801 -4.301 1.00 0.00 H new ATOM 0 HB3 MET A 5 13.722 -6.299 -5.131 1.00 0.00 H new ATOM 0 HG2 MET A 5 16.120 -6.166 -4.887 1.00 0.00 H new ATOM 0 HG3 MET A 5 15.735 -5.977 -6.587 1.00 0.00 H new ATOM 0 HE1 MET A 5 17.612 -2.985 -3.689 1.00 0.00 H new ATOM 0 HE2 MET A 5 16.577 -4.378 -3.291 1.00 0.00 H new ATOM 0 HE3 MET A 5 18.201 -4.641 -3.970 1.00 0.00 H new ATOM 95 N PHE A 6 14.165 -4.660 -8.663 1.00 0.00 N ATOM 96 CA PHE A 6 14.514 -5.337 -9.912 1.00 0.00 C ATOM 97 C PHE A 6 15.927 -5.932 -9.808 1.00 0.00 C ATOM 98 O PHE A 6 16.896 -5.185 -9.691 1.00 0.00 O ATOM 99 CB PHE A 6 14.351 -4.371 -11.090 1.00 0.00 C ATOM 100 CG PHE A 6 12.904 -4.065 -11.421 1.00 0.00 C ATOM 101 CD1 PHE A 6 12.116 -5.039 -12.060 1.00 0.00 C ATOM 102 CD2 PHE A 6 12.333 -2.823 -11.093 1.00 0.00 C ATOM 103 CE1 PHE A 6 10.785 -4.761 -12.415 1.00 0.00 C ATOM 104 CE2 PHE A 6 10.991 -2.553 -11.433 1.00 0.00 C ATOM 105 CZ PHE A 6 10.221 -3.514 -12.115 1.00 0.00 C ATOM 0 H PHE A 6 14.474 -3.689 -8.622 1.00 0.00 H new ATOM 0 HA PHE A 6 13.835 -6.171 -10.092 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.868 -3.439 -10.861 1.00 0.00 H new ATOM 0 HB3 PHE A 6 14.835 -4.797 -11.969 1.00 0.00 H new ATOM 0 HD1 PHE A 6 12.537 -6.009 -12.280 1.00 0.00 H new ATOM 0 HD2 PHE A 6 12.921 -2.076 -10.581 1.00 0.00 H new ATOM 0 HE1 PHE A 6 10.195 -5.511 -12.921 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.551 -1.603 -11.168 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.204 -3.292 -12.404 1.00 0.00 H new ATOM 115 N VAL A 7 16.052 -7.263 -9.850 1.00 0.00 N ATOM 116 CA VAL A 7 17.329 -8.000 -9.740 1.00 0.00 C ATOM 117 C VAL A 7 17.746 -8.627 -11.074 1.00 0.00 C ATOM 118 O VAL A 7 16.903 -9.087 -11.841 1.00 0.00 O ATOM 119 CB VAL A 7 17.339 -9.043 -8.598 1.00 0.00 C ATOM 120 CG1 VAL A 7 16.978 -8.403 -7.255 1.00 0.00 C ATOM 121 CG2 VAL A 7 16.396 -10.234 -8.807 1.00 0.00 C ATOM 0 H VAL A 7 15.248 -7.881 -9.965 1.00 0.00 H new ATOM 0 HA VAL A 7 18.077 -7.252 -9.476 1.00 0.00 H new ATOM 0 HB VAL A 7 18.362 -9.420 -8.601 1.00 0.00 H new ATOM 0 HG11 VAL A 7 16.994 -9.163 -6.474 1.00 0.00 H new ATOM 0 HG12 VAL A 7 17.701 -7.623 -7.017 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.981 -7.967 -7.316 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.471 -10.911 -7.956 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.371 -9.875 -8.895 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.675 -10.763 -9.718 1.00 0.00 H new ATOM 131 N CYS A 8 19.047 -8.670 -11.368 1.00 0.00 N ATOM 132 CA CYS A 8 19.570 -9.319 -12.579 1.00 0.00 C ATOM 133 C CYS A 8 20.969 -9.932 -12.373 1.00 0.00 C ATOM 134 O CYS A 8 21.624 -9.682 -11.364 1.00 0.00 O ATOM 135 CB CYS A 8 19.552 -8.274 -13.709 1.00 0.00 C ATOM 136 SG CYS A 8 19.749 -9.074 -15.327 1.00 0.00 S ATOM 0 H CYS A 8 19.769 -8.258 -10.777 1.00 0.00 H new ATOM 0 HA CYS A 8 18.936 -10.166 -12.841 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.614 -7.720 -13.684 1.00 0.00 H new ATOM 0 HB3 CYS A 8 20.353 -7.551 -13.555 1.00 0.00 H new ATOM 0 HG CYS A 8 18.687 -9.773 -15.598 1.00 0.00 H new ATOM 142 N LYS A 9 21.438 -10.711 -13.358 1.00 0.00 N ATOM 143 CA LYS A 9 22.822 -11.211 -13.468 1.00 0.00 C ATOM 144 C LYS A 9 23.814 -10.044 -13.615 1.00 0.00 C ATOM 145 O LYS A 9 23.426 -8.915 -13.918 1.00 0.00 O ATOM 146 CB LYS A 9 22.909 -12.189 -14.663 1.00 0.00 C ATOM 147 CG LYS A 9 22.286 -13.557 -14.333 1.00 0.00 C ATOM 148 CD LYS A 9 22.096 -14.407 -15.602 1.00 0.00 C ATOM 149 CE LYS A 9 21.681 -15.845 -15.243 1.00 0.00 C ATOM 150 NZ LYS A 9 21.172 -16.589 -16.432 1.00 0.00 N ATOM 0 H LYS A 9 20.846 -11.023 -14.128 1.00 0.00 H new ATOM 0 HA LYS A 9 23.094 -11.745 -12.557 1.00 0.00 H new ATOM 0 HB2 LYS A 9 22.399 -11.756 -15.524 1.00 0.00 H new ATOM 0 HB3 LYS A 9 23.953 -12.324 -14.946 1.00 0.00 H new ATOM 0 HG2 LYS A 9 22.925 -14.089 -13.629 1.00 0.00 H new ATOM 0 HG3 LYS A 9 21.323 -13.412 -13.843 1.00 0.00 H new ATOM 0 HD2 LYS A 9 21.336 -13.953 -16.238 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.023 -14.424 -16.175 1.00 0.00 H new ATOM 0 HE2 LYS A 9 22.535 -16.375 -14.821 1.00 0.00 H new ATOM 0 HE3 LYS A 9 20.910 -15.819 -14.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 21.095 -17.600 -16.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 20.236 -16.222 -16.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 21.830 -16.464 -17.228 1.00 0.00 H new ATOM 164 N ARG A 10 25.100 -10.315 -13.380 1.00 0.00 N ATOM 165 CA ARG A 10 26.173 -9.298 -13.347 1.00 0.00 C ATOM 166 C ARG A 10 26.296 -8.529 -14.675 1.00 0.00 C ATOM 167 O ARG A 10 26.184 -9.125 -15.744 1.00 0.00 O ATOM 168 CB ARG A 10 27.514 -9.984 -12.994 1.00 0.00 C ATOM 169 CG ARG A 10 28.548 -8.986 -12.444 1.00 0.00 C ATOM 170 CD ARG A 10 30.001 -9.444 -12.596 1.00 0.00 C ATOM 171 NE ARG A 10 30.290 -10.745 -11.951 1.00 0.00 N ATOM 172 CZ ARG A 10 31.419 -11.427 -12.037 1.00 0.00 C ATOM 173 NH1 ARG A 10 32.451 -11.005 -12.713 1.00 0.00 N ATOM 174 NH2 ARG A 10 31.518 -12.567 -11.427 1.00 0.00 N ATOM 0 H ARG A 10 25.439 -11.261 -13.203 1.00 0.00 H new ATOM 0 HA ARG A 10 25.916 -8.564 -12.584 1.00 0.00 H new ATOM 0 HB2 ARG A 10 27.337 -10.766 -12.255 1.00 0.00 H new ATOM 0 HB3 ARG A 10 27.917 -10.470 -13.883 1.00 0.00 H new ATOM 0 HG2 ARG A 10 28.424 -8.032 -12.956 1.00 0.00 H new ATOM 0 HG3 ARG A 10 28.342 -8.811 -11.388 1.00 0.00 H new ATOM 0 HD2 ARG A 10 30.240 -9.514 -13.657 1.00 0.00 H new ATOM 0 HD3 ARG A 10 30.657 -8.685 -12.171 1.00 0.00 H new ATOM 0 HE ARG A 10 29.546 -11.154 -11.386 1.00 0.00 H new ATOM 0 HH11 ARG A 10 32.408 -10.112 -13.205 1.00 0.00 H new ATOM 0 HH12 ARG A 10 33.301 -11.567 -12.750 1.00 0.00 H new ATOM 0 HH21 ARG A 10 30.730 -12.928 -10.889 1.00 0.00 H new ATOM 0 HH22 ARG A 10 32.384 -13.103 -11.485 1.00 0.00 H new ATOM 188 N ASN A 11 26.598 -7.226 -14.590 1.00 0.00 N ATOM 189 CA ASN A 11 26.972 -6.369 -15.735 1.00 0.00 C ATOM 190 C ASN A 11 25.953 -6.428 -16.905 1.00 0.00 C ATOM 191 O ASN A 11 26.325 -6.561 -18.071 1.00 0.00 O ATOM 192 CB ASN A 11 28.436 -6.725 -16.104 1.00 0.00 C ATOM 193 CG ASN A 11 29.129 -5.755 -17.050 1.00 0.00 C ATOM 194 OD1 ASN A 11 28.652 -4.674 -17.357 1.00 0.00 O ATOM 195 ND2 ASN A 11 30.306 -6.101 -17.521 1.00 0.00 N ATOM 0 H ASN A 11 26.590 -6.722 -13.703 1.00 0.00 H new ATOM 0 HA ASN A 11 26.929 -5.314 -15.465 1.00 0.00 H new ATOM 0 HB2 ASN A 11 29.019 -6.787 -15.185 1.00 0.00 H new ATOM 0 HB3 ASN A 11 28.447 -7.717 -16.556 1.00 0.00 H new ATOM 0 HD21 ASN A 11 30.814 -5.468 -18.138 1.00 0.00 H new ATOM 0 HD22 ASN A 11 30.711 -7.003 -17.269 1.00 0.00 H new ATOM 202 N SER A 12 24.651 -6.365 -16.577 1.00 0.00 N ATOM 203 CA SER A 12 23.546 -6.631 -17.523 1.00 0.00 C ATOM 204 C SER A 12 22.713 -5.422 -17.957 1.00 0.00 C ATOM 205 O SER A 12 22.066 -5.462 -19.000 1.00 0.00 O ATOM 206 CB SER A 12 22.614 -7.644 -16.862 1.00 0.00 C ATOM 207 OG SER A 12 22.008 -7.007 -15.742 1.00 0.00 O ATOM 0 H SER A 12 24.330 -6.126 -15.639 1.00 0.00 H new ATOM 0 HA SER A 12 24.019 -6.986 -18.439 1.00 0.00 H new ATOM 0 HB2 SER A 12 21.855 -7.982 -17.567 1.00 0.00 H new ATOM 0 HB3 SER A 12 23.170 -8.526 -16.546 1.00 0.00 H new ATOM 0 HG SER A 12 21.109 -7.372 -15.605 1.00 0.00 H new ATOM 213 N CYS A 13 22.636 -4.377 -17.122 1.00 0.00 N ATOM 214 CA CYS A 13 21.728 -3.219 -17.247 1.00 0.00 C ATOM 215 C CYS A 13 20.216 -3.544 -17.296 1.00 0.00 C ATOM 216 O CYS A 13 19.413 -2.622 -17.389 1.00 0.00 O ATOM 217 CB CYS A 13 22.243 -2.345 -18.411 1.00 0.00 C ATOM 218 SG CYS A 13 21.456 -0.703 -18.476 1.00 0.00 S ATOM 0 H CYS A 13 23.234 -4.309 -16.298 1.00 0.00 H new ATOM 0 HA CYS A 13 21.766 -2.651 -16.317 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.322 -2.221 -18.314 1.00 0.00 H new ATOM 0 HB3 CYS A 13 22.065 -2.864 -19.353 1.00 0.00 H new ATOM 0 HG CYS A 13 20.227 -0.794 -18.063 1.00 0.00 H new ATOM 224 N ARG A 14 19.757 -4.804 -17.191 1.00 0.00 N ATOM 225 CA ARG A 14 18.314 -5.143 -17.341 1.00 0.00 C ATOM 226 C ARG A 14 17.544 -4.756 -16.084 1.00 0.00 C ATOM 227 O ARG A 14 16.465 -4.201 -16.186 1.00 0.00 O ATOM 228 CB ARG A 14 18.083 -6.631 -17.709 1.00 0.00 C ATOM 229 CG ARG A 14 18.919 -7.207 -18.866 1.00 0.00 C ATOM 230 CD ARG A 14 18.694 -6.539 -20.228 1.00 0.00 C ATOM 231 NE ARG A 14 19.580 -5.369 -20.431 1.00 0.00 N ATOM 232 CZ ARG A 14 19.281 -4.176 -20.900 1.00 0.00 C ATOM 233 NH1 ARG A 14 18.053 -3.777 -21.068 1.00 0.00 N ATOM 234 NH2 ARG A 14 20.232 -3.356 -21.224 1.00 0.00 N ATOM 0 H ARG A 14 20.356 -5.608 -17.004 1.00 0.00 H new ATOM 0 HA ARG A 14 17.931 -4.560 -18.179 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.276 -7.233 -16.821 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.029 -6.758 -17.958 1.00 0.00 H new ATOM 0 HG2 ARG A 14 19.975 -7.123 -18.608 1.00 0.00 H new ATOM 0 HG3 ARG A 14 18.697 -8.270 -18.959 1.00 0.00 H new ATOM 0 HD2 ARG A 14 18.868 -7.266 -21.021 1.00 0.00 H new ATOM 0 HD3 ARG A 14 17.654 -6.223 -20.308 1.00 0.00 H new ATOM 0 HE ARG A 14 20.557 -5.507 -20.171 1.00 0.00 H new ATOM 0 HH11 ARG A 14 17.278 -4.398 -20.833 1.00 0.00 H new ATOM 0 HH12 ARG A 14 17.866 -2.844 -21.434 1.00 0.00 H new ATOM 0 HH21 ARG A 14 21.207 -3.637 -21.115 1.00 0.00 H new ATOM 0 HH22 ARG A 14 20.005 -2.430 -21.588 1.00 0.00 H new ATOM 248 N SER A 15 18.141 -4.936 -14.908 1.00 0.00 N ATOM 249 CA SER A 15 17.621 -4.452 -13.616 1.00 0.00 C ATOM 250 C SER A 15 17.528 -2.927 -13.580 1.00 0.00 C ATOM 251 O SER A 15 16.498 -2.375 -13.207 1.00 0.00 O ATOM 252 CB SER A 15 18.554 -4.942 -12.507 1.00 0.00 C ATOM 253 OG SER A 15 19.886 -4.693 -12.927 1.00 0.00 O ATOM 0 H SER A 15 19.025 -5.436 -14.817 1.00 0.00 H new ATOM 0 HA SER A 15 16.613 -4.842 -13.473 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.344 -4.423 -11.572 1.00 0.00 H new ATOM 0 HB3 SER A 15 18.403 -6.005 -12.322 1.00 0.00 H new ATOM 0 HG SER A 15 20.509 -4.979 -12.227 1.00 0.00 H new ATOM 259 N GLN A 16 18.586 -2.244 -14.021 1.00 0.00 N ATOM 260 CA GLN A 16 18.674 -0.776 -13.986 1.00 0.00 C ATOM 261 C GLN A 16 17.755 -0.122 -15.037 1.00 0.00 C ATOM 262 O GLN A 16 17.131 0.901 -14.762 1.00 0.00 O ATOM 263 CB GLN A 16 20.147 -0.332 -14.103 1.00 0.00 C ATOM 264 CG GLN A 16 21.103 -1.052 -13.120 1.00 0.00 C ATOM 265 CD GLN A 16 21.938 -0.101 -12.260 1.00 0.00 C ATOM 266 OE1 GLN A 16 23.080 0.225 -12.552 1.00 0.00 O ATOM 267 NE2 GLN A 16 21.406 0.347 -11.144 1.00 0.00 N ATOM 0 H GLN A 16 19.413 -2.693 -14.415 1.00 0.00 H new ATOM 0 HA GLN A 16 18.306 -0.423 -13.023 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.489 -0.510 -15.122 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.207 0.743 -13.930 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.517 -1.698 -12.466 1.00 0.00 H new ATOM 0 HG3 GLN A 16 21.774 -1.697 -13.688 1.00 0.00 H new ATOM 0 HE21 GLN A 16 20.454 0.082 -10.890 1.00 0.00 H new ATOM 0 HE22 GLN A 16 21.945 0.960 -10.532 1.00 0.00 H new ATOM 276 N MET A 17 17.567 -0.755 -16.204 1.00 0.00 N ATOM 277 CA MET A 17 16.554 -0.342 -17.192 1.00 0.00 C ATOM 278 C MET A 17 15.127 -0.691 -16.777 1.00 0.00 C ATOM 279 O MET A 17 14.232 0.122 -16.990 1.00 0.00 O ATOM 280 CB MET A 17 16.876 -0.941 -18.569 1.00 0.00 C ATOM 281 CG MET A 17 17.894 -0.081 -19.326 1.00 0.00 C ATOM 282 SD MET A 17 17.136 1.009 -20.566 1.00 0.00 S ATOM 283 CE MET A 17 16.234 2.243 -19.575 1.00 0.00 C ATOM 0 H MET A 17 18.112 -1.568 -16.492 1.00 0.00 H new ATOM 0 HA MET A 17 16.600 0.746 -17.247 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.269 -1.950 -18.446 1.00 0.00 H new ATOM 0 HB3 MET A 17 15.961 -1.025 -19.155 1.00 0.00 H new ATOM 0 HG2 MET A 17 18.450 0.526 -18.611 1.00 0.00 H new ATOM 0 HG3 MET A 17 18.615 -0.733 -19.819 1.00 0.00 H new ATOM 0 HE1 MET A 17 15.612 2.852 -20.231 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.603 1.734 -18.846 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.947 2.883 -19.054 1.00 0.00 H new ATOM 293 N ALA A 18 14.898 -1.845 -16.143 1.00 0.00 N ATOM 294 CA ALA A 18 13.583 -2.170 -15.563 1.00 0.00 C ATOM 295 C ALA A 18 13.170 -1.122 -14.519 1.00 0.00 C ATOM 296 O ALA A 18 12.070 -0.581 -14.592 1.00 0.00 O ATOM 297 CB ALA A 18 13.627 -3.585 -14.984 1.00 0.00 C ATOM 0 H ALA A 18 15.603 -2.572 -16.016 1.00 0.00 H new ATOM 0 HA ALA A 18 12.820 -2.144 -16.341 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.657 -3.832 -14.553 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.864 -4.295 -15.776 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.392 -3.638 -14.209 1.00 0.00 H new ATOM 303 N GLU A 19 14.088 -0.735 -13.626 1.00 0.00 N ATOM 304 CA GLU A 19 13.884 0.409 -12.730 1.00 0.00 C ATOM 305 C GLU A 19 13.616 1.691 -13.526 1.00 0.00 C ATOM 306 O GLU A 19 12.649 2.369 -13.221 1.00 0.00 O ATOM 307 CB GLU A 19 15.083 0.563 -11.789 1.00 0.00 C ATOM 308 CG GLU A 19 15.086 1.898 -11.029 1.00 0.00 C ATOM 309 CD GLU A 19 16.271 1.976 -10.063 1.00 0.00 C ATOM 310 OE1 GLU A 19 17.427 1.778 -10.506 1.00 0.00 O ATOM 311 OE2 GLU A 19 16.064 2.264 -8.867 1.00 0.00 O ATOM 0 H GLU A 19 14.987 -1.202 -13.504 1.00 0.00 H new ATOM 0 HA GLU A 19 13.000 0.223 -12.120 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.081 -0.257 -11.071 1.00 0.00 H new ATOM 0 HB3 GLU A 19 16.004 0.479 -12.367 1.00 0.00 H new ATOM 0 HG2 GLU A 19 15.135 2.724 -11.738 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.153 2.008 -10.476 1.00 0.00 H new ATOM 318 N GLY A 20 14.394 2.002 -14.566 1.00 0.00 N ATOM 319 CA GLY A 20 14.192 3.177 -15.434 1.00 0.00 C ATOM 320 C GLY A 20 12.779 3.338 -16.004 1.00 0.00 C ATOM 321 O GLY A 20 12.175 4.399 -15.856 1.00 0.00 O ATOM 0 H GLY A 20 15.198 1.437 -14.838 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.441 4.074 -14.867 1.00 0.00 H new ATOM 0 HA3 GLY A 20 14.896 3.120 -16.264 1.00 0.00 H new ATOM 325 N PHE A 21 12.192 2.289 -16.588 1.00 0.00 N ATOM 326 CA PHE A 21 10.793 2.353 -17.051 1.00 0.00 C ATOM 327 C PHE A 21 9.807 2.339 -15.875 1.00 0.00 C ATOM 328 O PHE A 21 8.825 3.077 -15.892 1.00 0.00 O ATOM 329 CB PHE A 21 10.524 1.268 -18.114 1.00 0.00 C ATOM 330 CG PHE A 21 11.155 1.610 -19.449 1.00 0.00 C ATOM 331 CD1 PHE A 21 10.455 2.428 -20.357 1.00 0.00 C ATOM 332 CD2 PHE A 21 12.457 1.181 -19.755 1.00 0.00 C ATOM 333 CE1 PHE A 21 11.093 2.891 -21.518 1.00 0.00 C ATOM 334 CE2 PHE A 21 13.091 1.637 -20.924 1.00 0.00 C ATOM 335 CZ PHE A 21 12.423 2.529 -21.782 1.00 0.00 C ATOM 0 H PHE A 21 12.653 1.394 -16.752 1.00 0.00 H new ATOM 0 HA PHE A 21 10.626 3.310 -17.546 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.914 0.313 -17.763 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.449 1.145 -18.242 1.00 0.00 H new ATOM 0 HD1 PHE A 21 9.428 2.699 -20.160 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.971 0.501 -19.092 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.560 3.527 -22.209 1.00 0.00 H new ATOM 0 HE2 PHE A 21 14.090 1.303 -21.163 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.933 2.935 -22.643 1.00 0.00 H new ATOM 345 N ALA A 22 10.090 1.599 -14.801 1.00 0.00 N ATOM 346 CA ALA A 22 9.211 1.531 -13.631 1.00 0.00 C ATOM 347 C ALA A 22 9.167 2.827 -12.797 1.00 0.00 C ATOM 348 O ALA A 22 8.095 3.190 -12.333 1.00 0.00 O ATOM 349 CB ALA A 22 9.621 0.313 -12.804 1.00 0.00 C ATOM 0 H ALA A 22 10.933 1.031 -14.717 1.00 0.00 H new ATOM 0 HA ALA A 22 8.184 1.421 -13.978 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.981 0.238 -11.925 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.515 -0.589 -13.407 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.659 0.420 -12.489 1.00 0.00 H new ATOM 355 N LYS A 23 10.261 3.588 -12.662 1.00 0.00 N ATOM 356 CA LYS A 23 10.257 4.911 -11.992 1.00 0.00 C ATOM 357 C LYS A 23 9.494 5.973 -12.794 1.00 0.00 C ATOM 358 O LYS A 23 8.963 6.914 -12.212 1.00 0.00 O ATOM 359 CB LYS A 23 11.686 5.380 -11.633 1.00 0.00 C ATOM 360 CG LYS A 23 12.572 5.750 -12.839 1.00 0.00 C ATOM 361 CD LYS A 23 13.938 6.340 -12.453 1.00 0.00 C ATOM 362 CE LYS A 23 13.832 7.814 -12.017 1.00 0.00 C ATOM 363 NZ LYS A 23 15.176 8.444 -11.851 1.00 0.00 N ATOM 0 H LYS A 23 11.178 3.311 -13.012 1.00 0.00 H new ATOM 0 HA LYS A 23 9.715 4.780 -11.055 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.613 6.246 -10.975 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.180 4.590 -11.067 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.731 4.859 -13.447 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.039 6.470 -13.461 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.370 5.753 -11.642 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.619 6.261 -13.301 1.00 0.00 H new ATOM 0 HE2 LYS A 23 13.259 8.371 -12.758 1.00 0.00 H new ATOM 0 HE3 LYS A 23 13.283 7.876 -11.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 15.062 9.462 -11.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 15.668 8.005 -11.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 15.735 8.304 -12.717 1.00 0.00 H new ATOM 377 N THR A 24 9.420 5.800 -14.118 1.00 0.00 N ATOM 378 CA THR A 24 8.727 6.726 -15.036 1.00 0.00 C ATOM 379 C THR A 24 7.224 6.423 -15.119 1.00 0.00 C ATOM 380 O THR A 24 6.406 7.335 -15.035 1.00 0.00 O ATOM 381 CB THR A 24 9.372 6.693 -16.432 1.00 0.00 C ATOM 382 OG1 THR A 24 10.768 6.887 -16.328 1.00 0.00 O ATOM 383 CG2 THR A 24 8.853 7.805 -17.341 1.00 0.00 C ATOM 0 H THR A 24 9.844 5.004 -14.594 1.00 0.00 H new ATOM 0 HA THR A 24 8.834 7.732 -14.632 1.00 0.00 H new ATOM 0 HB THR A 24 9.121 5.720 -16.855 1.00 0.00 H new ATOM 0 HG1 THR A 24 11.207 6.026 -16.167 1.00 0.00 H new ATOM 0 HG21 THR A 24 9.340 7.737 -18.314 1.00 0.00 H new ATOM 0 HG22 THR A 24 7.775 7.699 -17.466 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.073 8.774 -16.892 1.00 0.00 H new ATOM 391 N LEU A 25 6.848 5.140 -15.246 1.00 0.00 N ATOM 392 CA LEU A 25 5.452 4.698 -15.457 1.00 0.00 C ATOM 393 C LEU A 25 4.737 4.302 -14.157 1.00 0.00 C ATOM 394 O LEU A 25 3.536 4.515 -14.005 1.00 0.00 O ATOM 395 CB LEU A 25 5.444 3.534 -16.470 1.00 0.00 C ATOM 396 CG LEU A 25 6.147 3.851 -17.801 1.00 0.00 C ATOM 397 CD1 LEU A 25 6.143 2.615 -18.693 1.00 0.00 C ATOM 398 CD2 LEU A 25 5.484 4.997 -18.564 1.00 0.00 C ATOM 0 H LEU A 25 7.512 4.367 -15.205 1.00 0.00 H new ATOM 0 HA LEU A 25 4.891 5.545 -15.852 1.00 0.00 H new ATOM 0 HB2 LEU A 25 5.925 2.668 -16.015 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.411 3.253 -16.676 1.00 0.00 H new ATOM 0 HG LEU A 25 7.164 4.155 -17.552 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.642 2.844 -19.635 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.669 1.803 -18.192 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.115 2.313 -18.891 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.024 5.175 -19.494 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.450 4.735 -18.789 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.505 5.900 -17.954 1.00 0.00 H new ATOM 410 N GLY A 26 5.495 3.762 -13.200 1.00 0.00 N ATOM 411 CA GLY A 26 5.074 3.490 -11.820 1.00 0.00 C ATOM 412 C GLY A 26 5.204 4.700 -10.898 1.00 0.00 C ATOM 413 O GLY A 26 4.972 4.560 -9.698 1.00 0.00 O ATOM 0 H GLY A 26 6.463 3.489 -13.372 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.037 3.155 -11.824 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.672 2.671 -11.420 1.00 0.00 H new ATOM 417 N ALA A 27 5.558 5.877 -11.438 1.00 0.00 N ATOM 418 CA ALA A 27 5.592 7.143 -10.692 1.00 0.00 C ATOM 419 C ALA A 27 4.308 7.355 -9.860 1.00 0.00 C ATOM 420 O ALA A 27 3.209 7.473 -10.409 1.00 0.00 O ATOM 421 CB ALA A 27 5.789 8.298 -11.687 1.00 0.00 C ATOM 0 H ALA A 27 5.831 5.976 -12.416 1.00 0.00 H new ATOM 0 HA ALA A 27 6.423 7.112 -9.987 1.00 0.00 H new ATOM 0 HB1 ALA A 27 5.816 9.244 -11.146 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.728 8.160 -12.223 1.00 0.00 H new ATOM 0 HB3 ALA A 27 4.963 8.310 -12.398 1.00 0.00 H new ATOM 427 N GLY A 28 4.446 7.381 -8.528 1.00 0.00 N ATOM 428 CA GLY A 28 3.327 7.553 -7.589 1.00 0.00 C ATOM 429 C GLY A 28 2.412 6.329 -7.405 1.00 0.00 C ATOM 430 O GLY A 28 1.310 6.488 -6.874 1.00 0.00 O ATOM 0 H GLY A 28 5.349 7.282 -8.065 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.733 7.829 -6.616 1.00 0.00 H new ATOM 0 HA3 GLY A 28 2.718 8.390 -7.929 1.00 0.00 H new ATOM 434 N LYS A 29 2.834 5.122 -7.830 1.00 0.00 N ATOM 435 CA LYS A 29 2.030 3.882 -7.761 1.00 0.00 C ATOM 436 C LYS A 29 2.704 2.813 -6.904 1.00 0.00 C ATOM 437 O LYS A 29 2.025 2.052 -6.223 1.00 0.00 O ATOM 438 CB LYS A 29 1.773 3.345 -9.178 1.00 0.00 C ATOM 439 CG LYS A 29 0.954 4.332 -10.030 1.00 0.00 C ATOM 440 CD LYS A 29 0.694 3.785 -11.442 1.00 0.00 C ATOM 441 CE LYS A 29 -0.013 4.800 -12.357 1.00 0.00 C ATOM 442 NZ LYS A 29 -1.434 5.044 -11.967 1.00 0.00 N ATOM 0 H LYS A 29 3.758 4.977 -8.238 1.00 0.00 H new ATOM 0 HA LYS A 29 1.079 4.128 -7.287 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.726 3.147 -9.669 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.243 2.395 -9.115 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.003 4.535 -9.538 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.486 5.281 -10.100 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.643 3.495 -11.894 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.086 2.883 -11.370 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.532 5.744 -12.333 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.019 4.439 -13.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.859 5.735 -12.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.965 4.151 -12.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.469 5.416 -10.996 1.00 0.00 H new ATOM 456 N ILE A 30 4.038 2.779 -6.949 1.00 0.00 N ATOM 457 CA ILE A 30 4.923 1.940 -6.132 1.00 0.00 C ATOM 458 C ILE A 30 6.279 2.620 -5.885 1.00 0.00 C ATOM 459 O ILE A 30 6.625 3.600 -6.542 1.00 0.00 O ATOM 460 CB ILE A 30 5.134 0.542 -6.772 1.00 0.00 C ATOM 461 CG1 ILE A 30 5.226 0.447 -8.313 1.00 0.00 C ATOM 462 CG2 ILE A 30 4.059 -0.437 -6.280 1.00 0.00 C ATOM 463 CD1 ILE A 30 6.441 1.159 -8.919 1.00 0.00 C ATOM 0 H ILE A 30 4.562 3.371 -7.594 1.00 0.00 H new ATOM 0 HA ILE A 30 4.429 1.805 -5.170 1.00 0.00 H new ATOM 0 HB ILE A 30 6.136 0.282 -6.432 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.256 -0.604 -8.599 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.319 0.869 -8.746 1.00 0.00 H new ATOM 0 HG21 ILE A 30 4.219 -1.413 -6.737 1.00 0.00 H new ATOM 0 HG22 ILE A 30 4.120 -0.530 -5.196 1.00 0.00 H new ATOM 0 HG23 ILE A 30 3.073 -0.064 -6.557 1.00 0.00 H new ATOM 0 HD11 ILE A 30 6.428 1.043 -10.003 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.404 2.219 -8.667 1.00 0.00 H new ATOM 0 HD13 ILE A 30 7.356 0.722 -8.518 1.00 0.00 H new ATOM 475 N ALA A 31 7.057 2.079 -4.942 1.00 0.00 N ATOM 476 CA ALA A 31 8.466 2.457 -4.749 1.00 0.00 C ATOM 477 C ALA A 31 9.353 1.490 -5.556 1.00 0.00 C ATOM 478 O ALA A 31 8.957 0.344 -5.766 1.00 0.00 O ATOM 479 CB ALA A 31 8.791 2.485 -3.248 1.00 0.00 C ATOM 0 H ALA A 31 6.730 1.366 -4.289 1.00 0.00 H new ATOM 0 HA ALA A 31 8.663 3.462 -5.123 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.835 2.765 -3.107 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.150 3.212 -2.750 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.619 1.497 -2.820 1.00 0.00 H new ATOM 485 N VAL A 32 10.543 1.896 -6.012 1.00 0.00 N ATOM 486 CA VAL A 32 11.395 1.056 -6.882 1.00 0.00 C ATOM 487 C VAL A 32 12.903 1.220 -6.622 1.00 0.00 C ATOM 488 O VAL A 32 13.372 2.318 -6.318 1.00 0.00 O ATOM 489 CB VAL A 32 11.023 1.280 -8.363 1.00 0.00 C ATOM 490 CG1 VAL A 32 11.310 2.695 -8.876 1.00 0.00 C ATOM 491 CG2 VAL A 32 11.715 0.279 -9.287 1.00 0.00 C ATOM 0 H VAL A 32 10.946 2.807 -5.795 1.00 0.00 H new ATOM 0 HA VAL A 32 11.189 0.017 -6.625 1.00 0.00 H new ATOM 0 HB VAL A 32 9.944 1.129 -8.388 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.020 2.768 -9.924 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.740 3.417 -8.291 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.374 2.909 -8.778 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.424 0.475 -10.319 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.796 0.381 -9.190 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.420 -0.734 -9.013 1.00 0.00 H new ATOM 501 N THR A 33 13.648 0.117 -6.768 1.00 0.00 N ATOM 502 CA THR A 33 15.121 0.039 -6.696 1.00 0.00 C ATOM 503 C THR A 33 15.642 -1.006 -7.697 1.00 0.00 C ATOM 504 O THR A 33 14.907 -1.939 -8.032 1.00 0.00 O ATOM 505 CB THR A 33 15.581 -0.317 -5.271 1.00 0.00 C ATOM 506 OG1 THR A 33 14.995 0.556 -4.322 1.00 0.00 O ATOM 507 CG2 THR A 33 17.092 -0.219 -5.053 1.00 0.00 C ATOM 0 H THR A 33 13.223 -0.793 -6.949 1.00 0.00 H new ATOM 0 HA THR A 33 15.531 1.016 -6.954 1.00 0.00 H new ATOM 0 HB THR A 33 15.268 -1.353 -5.142 1.00 0.00 H new ATOM 0 HG1 THR A 33 15.416 0.419 -3.448 1.00 0.00 H new ATOM 0 HG21 THR A 33 17.329 -0.486 -4.023 1.00 0.00 H new ATOM 0 HG22 THR A 33 17.603 -0.902 -5.732 1.00 0.00 H new ATOM 0 HG23 THR A 33 17.422 0.801 -5.248 1.00 0.00 H new ATOM 515 N SER A 34 16.888 -0.898 -8.178 1.00 0.00 N ATOM 516 CA SER A 34 17.551 -1.956 -8.964 1.00 0.00 C ATOM 517 C SER A 34 18.823 -2.501 -8.302 1.00 0.00 C ATOM 518 O SER A 34 19.501 -1.810 -7.540 1.00 0.00 O ATOM 519 CB SER A 34 17.849 -1.514 -10.398 1.00 0.00 C ATOM 520 OG SER A 34 18.750 -0.428 -10.447 1.00 0.00 O ATOM 0 H SER A 34 17.469 -0.072 -8.034 1.00 0.00 H new ATOM 0 HA SER A 34 16.830 -2.773 -8.998 1.00 0.00 H new ATOM 0 HB2 SER A 34 18.264 -2.353 -10.956 1.00 0.00 H new ATOM 0 HB3 SER A 34 16.918 -1.233 -10.890 1.00 0.00 H new ATOM 0 HG SER A 34 18.313 0.375 -10.094 1.00 0.00 H new ATOM 526 N CYS A 35 19.138 -3.763 -8.604 1.00 0.00 N ATOM 527 CA CYS A 35 20.265 -4.510 -8.043 1.00 0.00 C ATOM 528 C CYS A 35 20.799 -5.547 -9.053 1.00 0.00 C ATOM 529 O CYS A 35 20.054 -6.057 -9.888 1.00 0.00 O ATOM 530 CB CYS A 35 19.745 -5.153 -6.737 1.00 0.00 C ATOM 531 SG CYS A 35 20.829 -6.473 -6.115 1.00 0.00 S ATOM 0 H CYS A 35 18.595 -4.312 -9.270 1.00 0.00 H new ATOM 0 HA CYS A 35 21.116 -3.864 -7.827 1.00 0.00 H new ATOM 0 HB2 CYS A 35 19.646 -4.382 -5.973 1.00 0.00 H new ATOM 0 HB3 CYS A 35 18.749 -5.560 -6.910 1.00 0.00 H new ATOM 0 HG CYS A 35 20.165 -7.589 -6.059 1.00 0.00 H new ATOM 537 N GLY A 36 22.092 -5.866 -8.987 1.00 0.00 N ATOM 538 CA GLY A 36 22.705 -6.990 -9.709 1.00 0.00 C ATOM 539 C GLY A 36 23.245 -8.000 -8.697 1.00 0.00 C ATOM 540 O GLY A 36 23.772 -7.584 -7.667 1.00 0.00 O ATOM 0 H GLY A 36 22.759 -5.342 -8.420 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.970 -7.465 -10.359 1.00 0.00 H new ATOM 0 HA3 GLY A 36 23.511 -6.631 -10.349 1.00 0.00 H new ATOM 544 N LEU A 37 23.171 -9.310 -8.964 1.00 0.00 N ATOM 545 CA LEU A 37 23.605 -10.344 -7.997 1.00 0.00 C ATOM 546 C LEU A 37 25.044 -10.108 -7.499 1.00 0.00 C ATOM 547 O LEU A 37 25.308 -10.181 -6.302 1.00 0.00 O ATOM 548 CB LEU A 37 23.485 -11.752 -8.614 1.00 0.00 C ATOM 549 CG LEU A 37 22.064 -12.238 -8.960 1.00 0.00 C ATOM 550 CD1 LEU A 37 22.157 -13.668 -9.492 1.00 0.00 C ATOM 551 CD2 LEU A 37 21.111 -12.217 -7.769 1.00 0.00 C ATOM 0 H LEU A 37 22.815 -9.687 -9.842 1.00 0.00 H new ATOM 0 HA LEU A 37 22.941 -10.271 -7.136 1.00 0.00 H new ATOM 0 HB2 LEU A 37 24.084 -11.777 -9.524 1.00 0.00 H new ATOM 0 HB3 LEU A 37 23.929 -12.466 -7.921 1.00 0.00 H new ATOM 0 HG LEU A 37 21.659 -11.552 -9.704 1.00 0.00 H new ATOM 0 HD11 LEU A 37 21.159 -14.029 -9.742 1.00 0.00 H new ATOM 0 HD12 LEU A 37 22.783 -13.684 -10.384 1.00 0.00 H new ATOM 0 HD13 LEU A 37 22.595 -14.312 -8.729 1.00 0.00 H new ATOM 0 HD21 LEU A 37 20.129 -12.571 -8.083 1.00 0.00 H new ATOM 0 HD22 LEU A 37 21.497 -12.866 -6.983 1.00 0.00 H new ATOM 0 HD23 LEU A 37 21.025 -11.199 -7.389 1.00 0.00 H new ATOM 563 N GLU A 38 25.933 -9.712 -8.415 1.00 0.00 N ATOM 564 CA GLU A 38 27.316 -9.283 -8.148 1.00 0.00 C ATOM 565 C GLU A 38 27.565 -7.846 -8.673 1.00 0.00 C ATOM 566 O GLU A 38 28.647 -7.537 -9.173 1.00 0.00 O ATOM 567 CB GLU A 38 28.297 -10.316 -8.734 1.00 0.00 C ATOM 568 CG GLU A 38 28.129 -11.729 -8.164 1.00 0.00 C ATOM 569 CD GLU A 38 29.155 -12.683 -8.799 1.00 0.00 C ATOM 570 OE1 GLU A 38 29.166 -12.821 -10.047 1.00 0.00 O ATOM 571 OE2 GLU A 38 29.972 -13.288 -8.064 1.00 0.00 O ATOM 0 H GLU A 38 25.701 -9.679 -9.408 1.00 0.00 H new ATOM 0 HA GLU A 38 27.485 -9.241 -7.072 1.00 0.00 H new ATOM 0 HB2 GLU A 38 28.166 -10.354 -9.815 1.00 0.00 H new ATOM 0 HB3 GLU A 38 29.317 -9.979 -8.548 1.00 0.00 H new ATOM 0 HG2 GLU A 38 28.260 -11.711 -7.082 1.00 0.00 H new ATOM 0 HG3 GLU A 38 27.118 -12.089 -8.357 1.00 0.00 H new ATOM 578 N SER A 39 26.550 -6.972 -8.551 1.00 0.00 N ATOM 579 CA SER A 39 26.451 -5.624 -9.153 1.00 0.00 C ATOM 580 C SER A 39 26.192 -5.604 -10.673 1.00 0.00 C ATOM 581 O SER A 39 26.533 -6.535 -11.404 1.00 0.00 O ATOM 582 CB SER A 39 27.655 -4.757 -8.757 1.00 0.00 C ATOM 583 OG SER A 39 27.364 -3.394 -8.981 1.00 0.00 O ATOM 0 H SER A 39 25.725 -7.199 -7.996 1.00 0.00 H new ATOM 0 HA SER A 39 25.549 -5.183 -8.729 1.00 0.00 H new ATOM 0 HB2 SER A 39 27.899 -4.917 -7.707 1.00 0.00 H new ATOM 0 HB3 SER A 39 28.531 -5.050 -9.336 1.00 0.00 H new ATOM 0 HG SER A 39 28.136 -2.848 -8.724 1.00 0.00 H new ATOM 589 N SER A 40 25.535 -4.547 -11.159 1.00 0.00 N ATOM 590 CA SER A 40 25.232 -4.286 -12.583 1.00 0.00 C ATOM 591 C SER A 40 25.598 -2.838 -12.982 1.00 0.00 C ATOM 592 O SER A 40 26.297 -2.145 -12.239 1.00 0.00 O ATOM 593 CB SER A 40 23.766 -4.630 -12.858 1.00 0.00 C ATOM 594 OG SER A 40 23.564 -4.797 -14.254 1.00 0.00 O ATOM 0 H SER A 40 25.180 -3.811 -10.548 1.00 0.00 H new ATOM 0 HA SER A 40 25.850 -4.927 -13.212 1.00 0.00 H new ATOM 0 HB2 SER A 40 23.492 -5.543 -12.330 1.00 0.00 H new ATOM 0 HB3 SER A 40 23.120 -3.838 -12.480 1.00 0.00 H new ATOM 0 HG SER A 40 22.960 -5.553 -14.409 1.00 0.00 H new ATOM 600 N ARG A 41 25.186 -2.379 -14.174 1.00 0.00 N ATOM 601 CA ARG A 41 25.591 -1.074 -14.749 1.00 0.00 C ATOM 602 C ARG A 41 24.490 -0.343 -15.511 1.00 0.00 C ATOM 603 O ARG A 41 23.406 -0.872 -15.723 1.00 0.00 O ATOM 604 CB ARG A 41 26.841 -1.293 -15.638 1.00 0.00 C ATOM 605 CG ARG A 41 26.514 -1.959 -16.991 1.00 0.00 C ATOM 606 CD ARG A 41 27.598 -1.685 -18.032 1.00 0.00 C ATOM 607 NE ARG A 41 27.069 -1.949 -19.384 1.00 0.00 N ATOM 608 CZ ARG A 41 27.504 -2.809 -20.286 1.00 0.00 C ATOM 609 NH1 ARG A 41 28.392 -3.720 -20.026 1.00 0.00 N ATOM 610 NH2 ARG A 41 27.024 -2.750 -21.487 1.00 0.00 N ATOM 0 H ARG A 41 24.554 -2.905 -14.778 1.00 0.00 H new ATOM 0 HA ARG A 41 25.820 -0.413 -13.913 1.00 0.00 H new ATOM 0 HB2 ARG A 41 27.323 -0.332 -15.820 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.558 -1.912 -15.099 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.408 -3.035 -16.851 1.00 0.00 H new ATOM 0 HG3 ARG A 41 25.556 -1.589 -17.357 1.00 0.00 H new ATOM 0 HD2 ARG A 41 27.933 -0.650 -17.958 1.00 0.00 H new ATOM 0 HD3 ARG A 41 28.466 -2.316 -17.841 1.00 0.00 H new ATOM 0 HE ARG A 41 26.259 -1.393 -19.658 1.00 0.00 H new ATOM 0 HH11 ARG A 41 28.787 -3.795 -19.088 1.00 0.00 H new ATOM 0 HH12 ARG A 41 28.695 -4.361 -20.759 1.00 0.00 H new ATOM 0 HH21 ARG A 41 26.323 -2.048 -21.722 1.00 0.00 H new ATOM 0 HH22 ARG A 41 27.347 -3.406 -22.198 1.00 0.00 H new ATOM 624 N VAL A 42 24.855 0.840 -16.003 1.00 0.00 N ATOM 625 CA VAL A 42 24.102 1.657 -16.959 1.00 0.00 C ATOM 626 C VAL A 42 25.063 2.199 -18.030 1.00 0.00 C ATOM 627 O VAL A 42 25.991 2.943 -17.714 1.00 0.00 O ATOM 628 CB VAL A 42 23.325 2.789 -16.258 1.00 0.00 C ATOM 629 CG1 VAL A 42 22.072 2.240 -15.573 1.00 0.00 C ATOM 630 CG2 VAL A 42 24.104 3.601 -15.214 1.00 0.00 C ATOM 0 H VAL A 42 25.734 1.281 -15.731 1.00 0.00 H new ATOM 0 HA VAL A 42 23.352 1.032 -17.444 1.00 0.00 H new ATOM 0 HB VAL A 42 23.092 3.473 -17.074 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.538 3.055 -15.084 1.00 0.00 H new ATOM 0 HG12 VAL A 42 21.424 1.776 -16.317 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.360 1.497 -14.829 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.454 4.367 -14.790 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.449 2.938 -14.421 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.963 4.076 -15.689 1.00 0.00 H new ATOM 640 N HIS A 43 24.876 1.808 -19.299 1.00 0.00 N ATOM 641 CA HIS A 43 25.711 2.296 -20.418 1.00 0.00 C ATOM 642 C HIS A 43 25.206 3.639 -20.973 1.00 0.00 C ATOM 643 O HIS A 43 23.993 3.838 -21.024 1.00 0.00 O ATOM 644 CB HIS A 43 25.871 1.250 -21.544 1.00 0.00 C ATOM 645 CG HIS A 43 24.819 0.184 -21.680 1.00 0.00 C ATOM 646 ND1 HIS A 43 24.713 -0.920 -20.840 1.00 0.00 N ATOM 647 CD2 HIS A 43 23.985 0.009 -22.741 1.00 0.00 C ATOM 648 CE1 HIS A 43 23.808 -1.736 -21.405 1.00 0.00 C ATOM 649 NE2 HIS A 43 23.349 -1.200 -22.545 1.00 0.00 N ATOM 0 H HIS A 43 24.150 1.150 -19.582 1.00 0.00 H new ATOM 0 HA HIS A 43 26.703 2.464 -19.999 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.925 1.787 -22.491 1.00 0.00 H new ATOM 0 HB3 HIS A 43 26.831 0.754 -21.403 1.00 0.00 H new ATOM 0 HD2 HIS A 43 23.848 0.684 -23.573 1.00 0.00 H new ATOM 0 HE1 HIS A 43 23.495 -2.687 -20.999 1.00 0.00 H new ATOM 0 HE2 HIS A 43 22.650 -1.614 -23.161 1.00 0.00 H new ATOM 657 N PRO A 44 26.082 4.527 -21.497 1.00 0.00 N ATOM 658 CA PRO A 44 25.674 5.803 -22.106 1.00 0.00 C ATOM 659 C PRO A 44 24.630 5.654 -23.220 1.00 0.00 C ATOM 660 O PRO A 44 23.664 6.414 -23.272 1.00 0.00 O ATOM 661 CB PRO A 44 26.968 6.445 -22.623 1.00 0.00 C ATOM 662 CG PRO A 44 28.029 5.887 -21.675 1.00 0.00 C ATOM 663 CD PRO A 44 27.539 4.462 -21.429 1.00 0.00 C ATOM 0 HA PRO A 44 25.172 6.426 -21.365 1.00 0.00 H new ATOM 0 HB2 PRO A 44 27.168 6.172 -23.659 1.00 0.00 H new ATOM 0 HB3 PRO A 44 26.923 7.533 -22.583 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.022 5.902 -22.124 1.00 0.00 H new ATOM 0 HG3 PRO A 44 28.088 6.461 -20.750 1.00 0.00 H new ATOM 0 HD2 PRO A 44 27.936 3.777 -22.178 1.00 0.00 H new ATOM 0 HD3 PRO A 44 27.870 4.097 -20.457 1.00 0.00 H new ATOM 671 N THR A 45 24.727 4.605 -24.044 1.00 0.00 N ATOM 672 CA THR A 45 23.721 4.309 -25.086 1.00 0.00 C ATOM 673 C THR A 45 22.361 3.945 -24.484 1.00 0.00 C ATOM 674 O THR A 45 21.337 4.360 -25.016 1.00 0.00 O ATOM 675 CB THR A 45 24.222 3.207 -26.043 1.00 0.00 C ATOM 676 OG1 THR A 45 25.537 3.518 -26.461 1.00 0.00 O ATOM 677 CG2 THR A 45 23.359 3.068 -27.298 1.00 0.00 C ATOM 0 H THR A 45 25.498 3.937 -24.013 1.00 0.00 H new ATOM 0 HA THR A 45 23.579 5.221 -25.666 1.00 0.00 H new ATOM 0 HB THR A 45 24.177 2.268 -25.491 1.00 0.00 H new ATOM 0 HG1 THR A 45 25.861 2.820 -27.068 1.00 0.00 H new ATOM 0 HG21 THR A 45 23.762 2.277 -27.931 1.00 0.00 H new ATOM 0 HG22 THR A 45 22.338 2.818 -27.011 1.00 0.00 H new ATOM 0 HG23 THR A 45 23.361 4.009 -27.847 1.00 0.00 H new ATOM 685 N ALA A 46 22.316 3.287 -23.318 1.00 0.00 N ATOM 686 CA ALA A 46 21.063 3.046 -22.590 1.00 0.00 C ATOM 687 C ALA A 46 20.504 4.296 -21.884 1.00 0.00 C ATOM 688 O ALA A 46 19.364 4.285 -21.432 1.00 0.00 O ATOM 689 CB ALA A 46 21.233 1.858 -21.630 1.00 0.00 C ATOM 0 H ALA A 46 23.142 2.909 -22.855 1.00 0.00 H new ATOM 0 HA ALA A 46 20.305 2.791 -23.331 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.299 1.686 -21.094 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.495 0.965 -22.198 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.026 2.078 -20.915 1.00 0.00 H new ATOM 695 N ILE A 47 21.272 5.386 -21.800 1.00 0.00 N ATOM 696 CA ILE A 47 20.745 6.694 -21.379 1.00 0.00 C ATOM 697 C ILE A 47 20.137 7.348 -22.628 1.00 0.00 C ATOM 698 O ILE A 47 18.951 7.668 -22.662 1.00 0.00 O ATOM 699 CB ILE A 47 21.834 7.584 -20.735 1.00 0.00 C ATOM 700 CG1 ILE A 47 22.568 6.853 -19.587 1.00 0.00 C ATOM 701 CG2 ILE A 47 21.188 8.888 -20.243 1.00 0.00 C ATOM 702 CD1 ILE A 47 23.742 7.638 -18.987 1.00 0.00 C ATOM 0 H ILE A 47 22.268 5.391 -22.019 1.00 0.00 H new ATOM 0 HA ILE A 47 19.989 6.566 -20.604 1.00 0.00 H new ATOM 0 HB ILE A 47 22.589 7.816 -21.486 1.00 0.00 H new ATOM 0 HG12 ILE A 47 21.852 6.632 -18.796 1.00 0.00 H new ATOM 0 HG13 ILE A 47 22.937 5.897 -19.958 1.00 0.00 H new ATOM 0 HG21 ILE A 47 21.949 9.522 -19.787 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.737 9.411 -21.086 1.00 0.00 H new ATOM 0 HG23 ILE A 47 20.419 8.657 -19.506 1.00 0.00 H new ATOM 0 HD11 ILE A 47 24.200 7.054 -18.189 1.00 0.00 H new ATOM 0 HD12 ILE A 47 24.482 7.836 -19.763 1.00 0.00 H new ATOM 0 HD13 ILE A 47 23.379 8.583 -18.582 1.00 0.00 H new ATOM 714 N ALA A 48 20.910 7.444 -23.714 1.00 0.00 N ATOM 715 CA ALA A 48 20.537 8.223 -24.897 1.00 0.00 C ATOM 716 C ALA A 48 19.398 7.600 -25.724 1.00 0.00 C ATOM 717 O ALA A 48 18.566 8.324 -26.270 1.00 0.00 O ATOM 718 CB ALA A 48 21.794 8.438 -25.746 1.00 0.00 C ATOM 0 H ALA A 48 21.815 6.982 -23.797 1.00 0.00 H new ATOM 0 HA ALA A 48 20.135 9.177 -24.557 1.00 0.00 H new ATOM 0 HB1 ALA A 48 21.539 9.017 -26.634 1.00 0.00 H new ATOM 0 HB2 ALA A 48 22.539 8.978 -25.162 1.00 0.00 H new ATOM 0 HB3 ALA A 48 22.199 7.472 -26.047 1.00 0.00 H new ATOM 724 N MET A 49 19.301 6.264 -25.761 1.00 0.00 N ATOM 725 CA MET A 49 18.198 5.540 -26.411 1.00 0.00 C ATOM 726 C MET A 49 16.874 5.618 -25.637 1.00 0.00 C ATOM 727 O MET A 49 15.843 5.171 -26.136 1.00 0.00 O ATOM 728 CB MET A 49 18.603 4.077 -26.660 1.00 0.00 C ATOM 729 CG MET A 49 19.705 3.938 -27.718 1.00 0.00 C ATOM 730 SD MET A 49 19.182 4.368 -29.403 1.00 0.00 S ATOM 731 CE MET A 49 19.969 5.995 -29.583 1.00 0.00 C ATOM 0 H MET A 49 19.994 5.648 -25.336 1.00 0.00 H new ATOM 0 HA MET A 49 18.014 6.036 -27.364 1.00 0.00 H new ATOM 0 HB2 MET A 49 18.946 3.635 -25.724 1.00 0.00 H new ATOM 0 HB3 MET A 49 17.727 3.511 -26.977 1.00 0.00 H new ATOM 0 HG2 MET A 49 20.544 4.574 -27.437 1.00 0.00 H new ATOM 0 HG3 MET A 49 20.069 2.910 -27.714 1.00 0.00 H new ATOM 0 HE1 MET A 49 19.456 6.563 -30.359 1.00 0.00 H new ATOM 0 HE2 MET A 49 19.908 6.535 -28.638 1.00 0.00 H new ATOM 0 HE3 MET A 49 21.015 5.865 -29.860 1.00 0.00 H new ATOM 741 N MET A 50 16.891 6.165 -24.416 1.00 0.00 N ATOM 742 CA MET A 50 15.769 6.113 -23.471 1.00 0.00 C ATOM 743 C MET A 50 15.357 7.504 -22.969 1.00 0.00 C ATOM 744 O MET A 50 14.178 7.731 -22.705 1.00 0.00 O ATOM 745 CB MET A 50 16.136 5.168 -22.316 1.00 0.00 C ATOM 746 CG MET A 50 16.778 3.855 -22.787 1.00 0.00 C ATOM 747 SD MET A 50 15.782 2.812 -23.875 1.00 0.00 S ATOM 748 CE MET A 50 16.995 1.506 -24.213 1.00 0.00 C ATOM 0 H MET A 50 17.701 6.666 -24.050 1.00 0.00 H new ATOM 0 HA MET A 50 14.893 5.724 -23.989 1.00 0.00 H new ATOM 0 HB2 MET A 50 16.823 5.679 -21.642 1.00 0.00 H new ATOM 0 HB3 MET A 50 15.237 4.940 -21.743 1.00 0.00 H new ATOM 0 HG2 MET A 50 17.707 4.096 -23.303 1.00 0.00 H new ATOM 0 HG3 MET A 50 17.045 3.271 -21.906 1.00 0.00 H new ATOM 0 HE1 MET A 50 16.861 1.139 -25.231 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.002 1.907 -24.102 1.00 0.00 H new ATOM 0 HE3 MET A 50 16.852 0.686 -23.510 1.00 0.00 H new ATOM 758 N GLU A 51 16.266 8.480 -22.929 1.00 0.00 N ATOM 759 CA GLU A 51 15.909 9.884 -22.671 1.00 0.00 C ATOM 760 C GLU A 51 14.973 10.452 -23.760 1.00 0.00 C ATOM 761 O GLU A 51 14.154 11.328 -23.481 1.00 0.00 O ATOM 762 CB GLU A 51 17.161 10.757 -22.466 1.00 0.00 C ATOM 763 CG GLU A 51 17.945 11.061 -23.748 1.00 0.00 C ATOM 764 CD GLU A 51 19.153 11.971 -23.448 1.00 0.00 C ATOM 765 OE1 GLU A 51 18.986 13.216 -23.430 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.279 11.456 -23.242 1.00 0.00 O ATOM 0 H GLU A 51 17.264 8.326 -23.073 1.00 0.00 H new ATOM 0 HA GLU A 51 15.347 9.908 -21.737 1.00 0.00 H new ATOM 0 HB2 GLU A 51 16.860 11.699 -22.008 1.00 0.00 H new ATOM 0 HB3 GLU A 51 17.824 10.257 -21.760 1.00 0.00 H new ATOM 0 HG2 GLU A 51 18.288 10.130 -24.199 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.291 11.545 -24.474 1.00 0.00 H new ATOM 773 N GLU A 52 15.014 9.885 -24.977 1.00 0.00 N ATOM 774 CA GLU A 52 14.090 10.212 -26.080 1.00 0.00 C ATOM 775 C GLU A 52 12.634 9.752 -25.824 1.00 0.00 C ATOM 776 O GLU A 52 11.718 10.216 -26.507 1.00 0.00 O ATOM 777 CB GLU A 52 14.648 9.710 -27.427 1.00 0.00 C ATOM 778 CG GLU A 52 14.904 8.199 -27.492 1.00 0.00 C ATOM 779 CD GLU A 52 15.332 7.745 -28.903 1.00 0.00 C ATOM 780 OE1 GLU A 52 16.329 8.252 -29.463 1.00 0.00 O ATOM 781 OE2 GLU A 52 14.681 6.831 -29.465 1.00 0.00 O ATOM 0 H GLU A 52 15.701 9.174 -25.228 1.00 0.00 H new ATOM 0 HA GLU A 52 14.029 11.299 -26.131 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.948 9.980 -28.218 1.00 0.00 H new ATOM 0 HB3 GLU A 52 15.582 10.232 -27.635 1.00 0.00 H new ATOM 0 HG2 GLU A 52 15.680 7.932 -26.774 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.000 7.665 -27.198 1.00 0.00 H new ATOM 788 N VAL A 53 12.410 8.887 -24.819 1.00 0.00 N ATOM 789 CA VAL A 53 11.078 8.517 -24.285 1.00 0.00 C ATOM 790 C VAL A 53 10.925 8.931 -22.804 1.00 0.00 C ATOM 791 O VAL A 53 10.037 8.456 -22.097 1.00 0.00 O ATOM 792 CB VAL A 53 10.682 7.051 -24.574 1.00 0.00 C ATOM 793 CG1 VAL A 53 10.758 6.737 -26.073 1.00 0.00 C ATOM 794 CG2 VAL A 53 11.515 6.011 -23.816 1.00 0.00 C ATOM 0 H VAL A 53 13.172 8.409 -24.338 1.00 0.00 H new ATOM 0 HA VAL A 53 10.343 9.099 -24.841 1.00 0.00 H new ATOM 0 HB VAL A 53 9.655 6.972 -24.216 1.00 0.00 H new ATOM 0 HG11 VAL A 53 10.474 5.698 -26.242 1.00 0.00 H new ATOM 0 HG12 VAL A 53 10.078 7.393 -26.617 1.00 0.00 H new ATOM 0 HG13 VAL A 53 11.777 6.896 -26.427 1.00 0.00 H new ATOM 0 HG21 VAL A 53 11.172 5.010 -24.076 1.00 0.00 H new ATOM 0 HG22 VAL A 53 12.565 6.117 -24.089 1.00 0.00 H new ATOM 0 HG23 VAL A 53 11.402 6.166 -22.743 1.00 0.00 H new ATOM 804 N GLY A 54 11.780 9.855 -22.341 1.00 0.00 N ATOM 805 CA GLY A 54 11.698 10.521 -21.037 1.00 0.00 C ATOM 806 C GLY A 54 12.340 9.789 -19.849 1.00 0.00 C ATOM 807 O GLY A 54 12.132 10.211 -18.709 1.00 0.00 O ATOM 0 H GLY A 54 12.580 10.170 -22.890 1.00 0.00 H new ATOM 0 HA2 GLY A 54 12.165 11.502 -21.126 1.00 0.00 H new ATOM 0 HA3 GLY A 54 10.646 10.689 -20.806 1.00 0.00 H new ATOM 811 N ILE A 55 13.114 8.717 -20.073 1.00 0.00 N ATOM 812 CA ILE A 55 13.758 7.952 -18.989 1.00 0.00 C ATOM 813 C ILE A 55 14.971 8.698 -18.414 1.00 0.00 C ATOM 814 O ILE A 55 15.723 9.356 -19.134 1.00 0.00 O ATOM 815 CB ILE A 55 14.130 6.520 -19.440 1.00 0.00 C ATOM 816 CG1 ILE A 55 12.968 5.785 -20.142 1.00 0.00 C ATOM 817 CG2 ILE A 55 14.636 5.659 -18.267 1.00 0.00 C ATOM 818 CD1 ILE A 55 11.654 5.705 -19.354 1.00 0.00 C ATOM 0 H ILE A 55 13.312 8.355 -21.006 1.00 0.00 H new ATOM 0 HA ILE A 55 13.027 7.855 -18.186 1.00 0.00 H new ATOM 0 HB ILE A 55 14.934 6.652 -20.164 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.770 6.282 -21.092 1.00 0.00 H new ATOM 0 HG13 ILE A 55 13.292 4.771 -20.374 1.00 0.00 H new ATOM 0 HG21 ILE A 55 14.886 4.662 -18.629 1.00 0.00 H new ATOM 0 HG22 ILE A 55 15.523 6.120 -17.833 1.00 0.00 H new ATOM 0 HG23 ILE A 55 13.858 5.585 -17.508 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.909 5.168 -19.942 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.824 5.178 -18.415 1.00 0.00 H new ATOM 0 HD13 ILE A 55 11.294 6.712 -19.144 1.00 0.00 H new ATOM 830 N ASP A 56 15.177 8.548 -17.104 1.00 0.00 N ATOM 831 CA ASP A 56 16.259 9.175 -16.329 1.00 0.00 C ATOM 832 C ASP A 56 16.937 8.149 -15.404 1.00 0.00 C ATOM 833 O ASP A 56 16.429 7.864 -14.319 1.00 0.00 O ATOM 834 CB ASP A 56 15.660 10.353 -15.539 1.00 0.00 C ATOM 835 CG ASP A 56 16.666 10.961 -14.542 1.00 0.00 C ATOM 836 OD1 ASP A 56 17.746 11.423 -14.980 1.00 0.00 O ATOM 837 OD2 ASP A 56 16.379 10.964 -13.320 1.00 0.00 O ATOM 0 H ASP A 56 14.572 7.963 -16.527 1.00 0.00 H new ATOM 0 HA ASP A 56 17.036 9.547 -16.996 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.331 11.124 -16.235 1.00 0.00 H new ATOM 0 HB3 ASP A 56 14.777 10.013 -14.999 1.00 0.00 H new ATOM 842 N ILE A 57 18.079 7.580 -15.821 1.00 0.00 N ATOM 843 CA ILE A 57 18.882 6.638 -15.011 1.00 0.00 C ATOM 844 C ILE A 57 20.388 6.957 -14.994 1.00 0.00 C ATOM 845 O ILE A 57 21.182 6.157 -14.504 1.00 0.00 O ATOM 846 CB ILE A 57 18.599 5.156 -15.362 1.00 0.00 C ATOM 847 CG1 ILE A 57 18.957 4.776 -16.815 1.00 0.00 C ATOM 848 CG2 ILE A 57 17.136 4.808 -15.046 1.00 0.00 C ATOM 849 CD1 ILE A 57 18.839 3.265 -17.068 1.00 0.00 C ATOM 0 H ILE A 57 18.479 7.761 -16.742 1.00 0.00 H new ATOM 0 HA ILE A 57 18.543 6.789 -13.986 1.00 0.00 H new ATOM 0 HB ILE A 57 19.261 4.559 -14.735 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.299 5.310 -17.501 1.00 0.00 H new ATOM 0 HG13 ILE A 57 19.975 5.100 -17.033 1.00 0.00 H new ATOM 0 HG21 ILE A 57 16.948 3.764 -15.297 1.00 0.00 H new ATOM 0 HG22 ILE A 57 16.945 4.966 -13.985 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.475 5.446 -15.632 1.00 0.00 H new ATOM 0 HD11 ILE A 57 19.101 3.048 -18.104 1.00 0.00 H new ATOM 0 HD12 ILE A 57 19.517 2.731 -16.403 1.00 0.00 H new ATOM 0 HD13 ILE A 57 17.815 2.943 -16.878 1.00 0.00 H new ATOM 861 N SER A 58 20.791 8.136 -15.475 1.00 0.00 N ATOM 862 CA SER A 58 22.199 8.569 -15.574 1.00 0.00 C ATOM 863 C SER A 58 22.929 8.578 -14.223 1.00 0.00 C ATOM 864 O SER A 58 24.137 8.349 -14.160 1.00 0.00 O ATOM 865 CB SER A 58 22.255 9.992 -16.150 1.00 0.00 C ATOM 866 OG SER A 58 21.355 10.126 -17.241 1.00 0.00 O ATOM 0 H SER A 58 20.135 8.838 -15.817 1.00 0.00 H new ATOM 0 HA SER A 58 22.698 7.847 -16.220 1.00 0.00 H new ATOM 0 HB2 SER A 58 22.004 10.714 -15.374 1.00 0.00 H new ATOM 0 HB3 SER A 58 23.270 10.217 -16.479 1.00 0.00 H new ATOM 0 HG SER A 58 21.403 11.039 -17.594 1.00 0.00 H new ATOM 872 N GLY A 59 22.182 8.832 -13.141 1.00 0.00 N ATOM 873 CA GLY A 59 22.686 8.871 -11.762 1.00 0.00 C ATOM 874 C GLY A 59 22.637 7.535 -11.006 1.00 0.00 C ATOM 875 O GLY A 59 23.044 7.498 -9.841 1.00 0.00 O ATOM 0 H GLY A 59 21.182 9.021 -13.202 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.718 9.222 -11.780 1.00 0.00 H new ATOM 0 HA3 GLY A 59 22.109 9.607 -11.203 1.00 0.00 H new ATOM 879 N GLN A 60 22.135 6.446 -11.611 1.00 0.00 N ATOM 880 CA GLN A 60 21.960 5.168 -10.901 1.00 0.00 C ATOM 881 C GLN A 60 23.295 4.435 -10.676 1.00 0.00 C ATOM 882 O GLN A 60 24.156 4.371 -11.556 1.00 0.00 O ATOM 883 CB GLN A 60 20.941 4.249 -11.605 1.00 0.00 C ATOM 884 CG GLN A 60 19.539 4.864 -11.737 1.00 0.00 C ATOM 885 CD GLN A 60 18.920 5.238 -10.393 1.00 0.00 C ATOM 886 OE1 GLN A 60 18.974 6.375 -9.945 1.00 0.00 O ATOM 887 NE2 GLN A 60 18.313 4.304 -9.701 1.00 0.00 N ATOM 0 H GLN A 60 21.844 6.425 -12.588 1.00 0.00 H new ATOM 0 HA GLN A 60 21.557 5.421 -9.920 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.314 4.002 -12.599 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.866 3.313 -11.051 1.00 0.00 H new ATOM 0 HG2 GLN A 60 19.597 5.754 -12.364 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.885 4.157 -12.247 1.00 0.00 H new ATOM 0 HE21 GLN A 60 18.262 3.352 -10.064 1.00 0.00 H new ATOM 0 HE22 GLN A 60 17.892 4.529 -8.800 1.00 0.00 H new ATOM 896 N THR A 61 23.426 3.841 -9.491 1.00 0.00 N ATOM 897 CA THR A 61 24.538 2.974 -9.062 1.00 0.00 C ATOM 898 C THR A 61 24.037 1.543 -8.822 1.00 0.00 C ATOM 899 O THR A 61 22.832 1.283 -8.886 1.00 0.00 O ATOM 900 CB THR A 61 25.214 3.538 -7.795 1.00 0.00 C ATOM 901 OG1 THR A 61 24.257 3.710 -6.764 1.00 0.00 O ATOM 902 CG2 THR A 61 25.882 4.890 -8.058 1.00 0.00 C ATOM 0 H THR A 61 22.724 3.954 -8.760 1.00 0.00 H new ATOM 0 HA THR A 61 25.283 2.949 -9.857 1.00 0.00 H new ATOM 0 HB THR A 61 25.976 2.819 -7.496 1.00 0.00 H new ATOM 0 HG1 THR A 61 24.698 4.067 -5.965 1.00 0.00 H new ATOM 0 HG21 THR A 61 26.346 5.251 -7.140 1.00 0.00 H new ATOM 0 HG22 THR A 61 26.644 4.775 -8.829 1.00 0.00 H new ATOM 0 HG23 THR A 61 25.132 5.607 -8.393 1.00 0.00 H new ATOM 910 N SER A 62 24.941 0.590 -8.573 1.00 0.00 N ATOM 911 CA SER A 62 24.592 -0.805 -8.249 1.00 0.00 C ATOM 912 C SER A 62 25.580 -1.422 -7.245 1.00 0.00 C ATOM 913 O SER A 62 26.708 -0.944 -7.092 1.00 0.00 O ATOM 914 CB SER A 62 24.545 -1.637 -9.532 1.00 0.00 C ATOM 915 OG SER A 62 23.857 -2.864 -9.318 1.00 0.00 O ATOM 0 H SER A 62 25.946 0.763 -8.590 1.00 0.00 H new ATOM 0 HA SER A 62 23.609 -0.807 -7.779 1.00 0.00 H new ATOM 0 HB2 SER A 62 24.049 -1.070 -10.320 1.00 0.00 H new ATOM 0 HB3 SER A 62 25.559 -1.840 -9.876 1.00 0.00 H new ATOM 0 HG SER A 62 23.293 -3.063 -10.095 1.00 0.00 H new ATOM 921 N ASP A 63 25.143 -2.480 -6.555 1.00 0.00 N ATOM 922 CA ASP A 63 25.924 -3.251 -5.580 1.00 0.00 C ATOM 923 C ASP A 63 25.454 -4.723 -5.550 1.00 0.00 C ATOM 924 O ASP A 63 24.306 -4.995 -5.926 1.00 0.00 O ATOM 925 CB ASP A 63 25.780 -2.638 -4.177 1.00 0.00 C ATOM 926 CG ASP A 63 26.610 -1.358 -3.987 1.00 0.00 C ATOM 927 OD1 ASP A 63 27.857 -1.462 -3.871 1.00 0.00 O ATOM 928 OD2 ASP A 63 26.022 -0.253 -3.882 1.00 0.00 O ATOM 0 H ASP A 63 24.194 -2.839 -6.665 1.00 0.00 H new ATOM 0 HA ASP A 63 26.971 -3.219 -5.881 1.00 0.00 H new ATOM 0 HB2 ASP A 63 24.730 -2.413 -3.992 1.00 0.00 H new ATOM 0 HB3 ASP A 63 26.084 -3.374 -3.433 1.00 0.00 H new ATOM 933 N PRO A 64 26.294 -5.679 -5.092 1.00 0.00 N ATOM 934 CA PRO A 64 25.911 -7.083 -4.925 1.00 0.00 C ATOM 935 C PRO A 64 24.698 -7.270 -4.009 1.00 0.00 C ATOM 936 O PRO A 64 24.570 -6.582 -2.994 1.00 0.00 O ATOM 937 CB PRO A 64 27.146 -7.789 -4.352 1.00 0.00 C ATOM 938 CG PRO A 64 28.305 -6.906 -4.806 1.00 0.00 C ATOM 939 CD PRO A 64 27.696 -5.508 -4.735 1.00 0.00 C ATOM 0 HA PRO A 64 25.604 -7.503 -5.883 1.00 0.00 H new ATOM 0 HB2 PRO A 64 27.099 -7.862 -3.265 1.00 0.00 H new ATOM 0 HB3 PRO A 64 27.241 -8.805 -4.735 1.00 0.00 H new ATOM 0 HG2 PRO A 64 29.172 -7.006 -4.153 1.00 0.00 H new ATOM 0 HG3 PRO A 64 28.635 -7.155 -5.814 1.00 0.00 H new ATOM 0 HD2 PRO A 64 27.798 -5.085 -3.736 1.00 0.00 H new ATOM 0 HD3 PRO A 64 28.196 -4.826 -5.423 1.00 0.00 H new ATOM 947 N ILE A 65 23.823 -8.226 -4.322 1.00 0.00 N ATOM 948 CA ILE A 65 22.519 -8.368 -3.649 1.00 0.00 C ATOM 949 C ILE A 65 22.618 -8.604 -2.133 1.00 0.00 C ATOM 950 O ILE A 65 21.782 -8.118 -1.377 1.00 0.00 O ATOM 951 CB ILE A 65 21.672 -9.446 -4.363 1.00 0.00 C ATOM 952 CG1 ILE A 65 20.203 -9.370 -3.895 1.00 0.00 C ATOM 953 CG2 ILE A 65 22.255 -10.864 -4.191 1.00 0.00 C ATOM 954 CD1 ILE A 65 19.257 -10.255 -4.712 1.00 0.00 C ATOM 0 H ILE A 65 23.991 -8.925 -5.046 1.00 0.00 H new ATOM 0 HA ILE A 65 22.009 -7.408 -3.735 1.00 0.00 H new ATOM 0 HB ILE A 65 21.703 -9.236 -5.432 1.00 0.00 H new ATOM 0 HG12 ILE A 65 20.148 -9.663 -2.847 1.00 0.00 H new ATOM 0 HG13 ILE A 65 19.863 -8.336 -3.955 1.00 0.00 H new ATOM 0 HG21 ILE A 65 21.622 -11.583 -4.711 1.00 0.00 H new ATOM 0 HG22 ILE A 65 23.261 -10.897 -4.609 1.00 0.00 H new ATOM 0 HG23 ILE A 65 22.294 -11.115 -3.131 1.00 0.00 H new ATOM 0 HD11 ILE A 65 18.242 -10.153 -4.329 1.00 0.00 H new ATOM 0 HD12 ILE A 65 19.283 -9.948 -5.757 1.00 0.00 H new ATOM 0 HD13 ILE A 65 19.572 -11.295 -4.632 1.00 0.00 H new ATOM 966 N GLU A 66 23.683 -9.265 -1.666 1.00 0.00 N ATOM 967 CA GLU A 66 23.902 -9.551 -0.238 1.00 0.00 C ATOM 968 C GLU A 66 24.168 -8.291 0.621 1.00 0.00 C ATOM 969 O GLU A 66 24.080 -8.364 1.849 1.00 0.00 O ATOM 970 CB GLU A 66 25.054 -10.558 -0.080 1.00 0.00 C ATOM 971 CG GLU A 66 24.738 -11.928 -0.698 1.00 0.00 C ATOM 972 CD GLU A 66 25.876 -12.928 -0.417 1.00 0.00 C ATOM 973 OE1 GLU A 66 26.838 -13.004 -1.220 1.00 0.00 O ATOM 974 OE2 GLU A 66 25.818 -13.649 0.610 1.00 0.00 O ATOM 0 H GLU A 66 24.424 -9.620 -2.270 1.00 0.00 H new ATOM 0 HA GLU A 66 22.972 -9.977 0.138 1.00 0.00 H new ATOM 0 HB2 GLU A 66 25.951 -10.152 -0.547 1.00 0.00 H new ATOM 0 HB3 GLU A 66 25.276 -10.685 0.980 1.00 0.00 H new ATOM 0 HG2 GLU A 66 23.803 -12.310 -0.289 1.00 0.00 H new ATOM 0 HG3 GLU A 66 24.597 -11.823 -1.774 1.00 0.00 H new ATOM 981 N ASN A 67 24.445 -7.128 0.009 1.00 0.00 N ATOM 982 CA ASN A 67 24.548 -5.851 0.732 1.00 0.00 C ATOM 983 C ASN A 67 23.168 -5.269 1.128 1.00 0.00 C ATOM 984 O ASN A 67 23.097 -4.437 2.035 1.00 0.00 O ATOM 985 CB ASN A 67 25.413 -4.851 -0.075 1.00 0.00 C ATOM 986 CG ASN A 67 24.594 -3.774 -0.777 1.00 0.00 C ATOM 987 OD1 ASN A 67 24.511 -2.636 -0.342 1.00 0.00 O ATOM 988 ND2 ASN A 67 23.940 -4.106 -1.858 1.00 0.00 N ATOM 0 H ASN A 67 24.603 -7.047 -0.995 1.00 0.00 H new ATOM 0 HA ASN A 67 25.052 -6.043 1.679 1.00 0.00 H new ATOM 0 HB2 ASN A 67 26.127 -4.374 0.597 1.00 0.00 H new ATOM 0 HB3 ASN A 67 25.992 -5.399 -0.818 1.00 0.00 H new ATOM 0 HD21 ASN A 67 23.362 -3.415 -2.337 1.00 0.00 H new ATOM 0 HD22 ASN A 67 24.008 -5.056 -2.223 1.00 0.00 H new ATOM 995 N PHE A 68 22.085 -5.684 0.454 1.00 0.00 N ATOM 996 CA PHE A 68 20.720 -5.179 0.663 1.00 0.00 C ATOM 997 C PHE A 68 19.905 -6.052 1.644 1.00 0.00 C ATOM 998 O PHE A 68 20.281 -7.180 1.966 1.00 0.00 O ATOM 999 CB PHE A 68 20.012 -5.034 -0.698 1.00 0.00 C ATOM 1000 CG PHE A 68 20.667 -4.091 -1.694 1.00 0.00 C ATOM 1001 CD1 PHE A 68 20.907 -2.744 -1.356 1.00 0.00 C ATOM 1002 CD2 PHE A 68 21.017 -4.556 -2.977 1.00 0.00 C ATOM 1003 CE1 PHE A 68 21.514 -1.880 -2.287 1.00 0.00 C ATOM 1004 CE2 PHE A 68 21.627 -3.690 -3.903 1.00 0.00 C ATOM 1005 CZ PHE A 68 21.875 -2.353 -3.560 1.00 0.00 C ATOM 0 H PHE A 68 22.136 -6.400 -0.271 1.00 0.00 H new ATOM 0 HA PHE A 68 20.790 -4.198 1.133 1.00 0.00 H new ATOM 0 HB2 PHE A 68 19.941 -6.021 -1.155 1.00 0.00 H new ATOM 0 HB3 PHE A 68 18.993 -4.691 -0.520 1.00 0.00 H new ATOM 0 HD1 PHE A 68 20.625 -2.374 -0.381 1.00 0.00 H new ATOM 0 HD2 PHE A 68 20.816 -5.581 -3.251 1.00 0.00 H new ATOM 0 HE1 PHE A 68 21.703 -0.850 -2.022 1.00 0.00 H new ATOM 0 HE2 PHE A 68 21.905 -4.056 -4.880 1.00 0.00 H new ATOM 0 HZ PHE A 68 22.342 -1.689 -4.272 1.00 0.00 H new ATOM 1015 N ASN A 69 18.762 -5.525 2.100 1.00 0.00 N ATOM 1016 CA ASN A 69 17.835 -6.172 3.040 1.00 0.00 C ATOM 1017 C ASN A 69 16.477 -6.454 2.374 1.00 0.00 C ATOM 1018 O ASN A 69 15.684 -5.537 2.165 1.00 0.00 O ATOM 1019 CB ASN A 69 17.719 -5.305 4.317 1.00 0.00 C ATOM 1020 CG ASN A 69 17.693 -3.791 4.095 1.00 0.00 C ATOM 1021 OD1 ASN A 69 18.492 -3.051 4.652 1.00 0.00 O ATOM 1022 ND2 ASN A 69 16.806 -3.275 3.272 1.00 0.00 N ATOM 0 H ASN A 69 18.444 -4.599 1.813 1.00 0.00 H new ATOM 0 HA ASN A 69 18.225 -7.146 3.335 1.00 0.00 H new ATOM 0 HB2 ASN A 69 16.810 -5.591 4.846 1.00 0.00 H new ATOM 0 HB3 ASN A 69 18.557 -5.543 4.972 1.00 0.00 H new ATOM 0 HD21 ASN A 69 16.790 -2.269 3.105 1.00 0.00 H new ATOM 0 HD22 ASN A 69 16.134 -3.881 2.801 1.00 0.00 H new ATOM 1029 N ALA A 70 16.165 -7.714 2.075 1.00 0.00 N ATOM 1030 CA ALA A 70 15.011 -8.095 1.256 1.00 0.00 C ATOM 1031 C ALA A 70 13.641 -7.782 1.886 1.00 0.00 C ATOM 1032 O ALA A 70 12.641 -7.661 1.179 1.00 0.00 O ATOM 1033 CB ALA A 70 15.133 -9.586 0.985 1.00 0.00 C ATOM 0 H ALA A 70 16.713 -8.511 2.398 1.00 0.00 H new ATOM 0 HA ALA A 70 15.036 -7.498 0.345 1.00 0.00 H new ATOM 0 HB1 ALA A 70 14.291 -9.915 0.376 1.00 0.00 H new ATOM 0 HB2 ALA A 70 16.064 -9.784 0.455 1.00 0.00 H new ATOM 0 HB3 ALA A 70 15.131 -10.129 1.930 1.00 0.00 H new ATOM 1039 N ASP A 71 13.590 -7.627 3.211 1.00 0.00 N ATOM 1040 CA ASP A 71 12.354 -7.372 3.966 1.00 0.00 C ATOM 1041 C ASP A 71 11.713 -6.018 3.607 1.00 0.00 C ATOM 1042 O ASP A 71 10.497 -5.838 3.695 1.00 0.00 O ATOM 1043 CB ASP A 71 12.705 -7.365 5.459 1.00 0.00 C ATOM 1044 CG ASP A 71 11.453 -7.291 6.351 1.00 0.00 C ATOM 1045 OD1 ASP A 71 10.653 -8.258 6.353 1.00 0.00 O ATOM 1046 OD2 ASP A 71 11.283 -6.283 7.079 1.00 0.00 O ATOM 0 H ASP A 71 14.419 -7.675 3.803 1.00 0.00 H new ATOM 0 HA ASP A 71 11.636 -8.153 3.716 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.269 -8.265 5.702 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.353 -6.515 5.674 1.00 0.00 H new ATOM 1051 N ASP A 72 12.548 -5.072 3.175 1.00 0.00 N ATOM 1052 CA ASP A 72 12.178 -3.712 2.791 1.00 0.00 C ATOM 1053 C ASP A 72 11.736 -3.623 1.315 1.00 0.00 C ATOM 1054 O ASP A 72 11.300 -2.566 0.859 1.00 0.00 O ATOM 1055 CB ASP A 72 13.382 -2.818 3.100 1.00 0.00 C ATOM 1056 CG ASP A 72 13.048 -1.318 3.021 1.00 0.00 C ATOM 1057 OD1 ASP A 72 12.161 -0.846 3.774 1.00 0.00 O ATOM 1058 OD2 ASP A 72 13.701 -0.590 2.235 1.00 0.00 O ATOM 0 H ASP A 72 13.549 -5.243 3.079 1.00 0.00 H new ATOM 0 HA ASP A 72 11.309 -3.378 3.358 1.00 0.00 H new ATOM 0 HB2 ASP A 72 13.754 -3.050 4.098 1.00 0.00 H new ATOM 0 HB3 ASP A 72 14.186 -3.044 2.399 1.00 0.00 H new ATOM 1063 N TYR A 73 11.825 -4.744 0.587 1.00 0.00 N ATOM 1064 CA TYR A 73 11.383 -4.937 -0.789 1.00 0.00 C ATOM 1065 C TYR A 73 10.266 -5.977 -0.799 1.00 0.00 C ATOM 1066 O TYR A 73 10.485 -7.156 -1.068 1.00 0.00 O ATOM 1067 CB TYR A 73 12.562 -5.332 -1.688 1.00 0.00 C ATOM 1068 CG TYR A 73 13.701 -4.345 -1.603 1.00 0.00 C ATOM 1069 CD1 TYR A 73 13.680 -3.165 -2.364 1.00 0.00 C ATOM 1070 CD2 TYR A 73 14.740 -4.572 -0.690 1.00 0.00 C ATOM 1071 CE1 TYR A 73 14.700 -2.210 -2.203 1.00 0.00 C ATOM 1072 CE2 TYR A 73 15.763 -3.623 -0.523 1.00 0.00 C ATOM 1073 CZ TYR A 73 15.741 -2.427 -1.271 1.00 0.00 C ATOM 1074 OH TYR A 73 16.729 -1.505 -1.096 1.00 0.00 O ATOM 0 H TYR A 73 12.236 -5.593 0.975 1.00 0.00 H new ATOM 0 HA TYR A 73 10.990 -4.005 -1.195 1.00 0.00 H new ATOM 0 HB2 TYR A 73 12.919 -6.321 -1.402 1.00 0.00 H new ATOM 0 HB3 TYR A 73 12.221 -5.402 -2.721 1.00 0.00 H new ATOM 0 HD1 TYR A 73 12.883 -2.991 -3.071 1.00 0.00 H new ATOM 0 HD2 TYR A 73 14.755 -5.483 -0.110 1.00 0.00 H new ATOM 0 HE1 TYR A 73 14.688 -1.306 -2.794 1.00 0.00 H new ATOM 0 HE2 TYR A 73 16.564 -3.809 0.177 1.00 0.00 H new ATOM 0 HH TYR A 73 17.357 -1.824 -0.414 1.00 0.00 H new ATOM 1084 N ASP A 74 9.057 -5.531 -0.466 1.00 0.00 N ATOM 1085 CA ASP A 74 7.824 -6.332 -0.434 1.00 0.00 C ATOM 1086 C ASP A 74 7.581 -7.113 -1.740 1.00 0.00 C ATOM 1087 O ASP A 74 6.945 -8.167 -1.732 1.00 0.00 O ATOM 1088 CB ASP A 74 6.621 -5.400 -0.216 1.00 0.00 C ATOM 1089 CG ASP A 74 6.886 -4.297 0.820 1.00 0.00 C ATOM 1090 OD1 ASP A 74 7.519 -3.288 0.428 1.00 0.00 O ATOM 1091 OD2 ASP A 74 6.452 -4.435 1.989 1.00 0.00 O ATOM 0 H ASP A 74 8.897 -4.560 -0.199 1.00 0.00 H new ATOM 0 HA ASP A 74 7.938 -7.051 0.378 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.351 -4.939 -1.166 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.765 -5.993 0.106 1.00 0.00 H new ATOM 1096 N VAL A 75 8.093 -6.592 -2.860 1.00 0.00 N ATOM 1097 CA VAL A 75 7.952 -7.137 -4.207 1.00 0.00 C ATOM 1098 C VAL A 75 9.344 -7.248 -4.845 1.00 0.00 C ATOM 1099 O VAL A 75 10.099 -6.276 -4.872 1.00 0.00 O ATOM 1100 CB VAL A 75 6.975 -6.241 -4.997 1.00 0.00 C ATOM 1101 CG1 VAL A 75 6.915 -6.634 -6.479 1.00 0.00 C ATOM 1102 CG2 VAL A 75 5.556 -6.332 -4.418 1.00 0.00 C ATOM 0 H VAL A 75 8.645 -5.734 -2.847 1.00 0.00 H new ATOM 0 HA VAL A 75 7.530 -8.142 -4.201 1.00 0.00 H new ATOM 0 HB VAL A 75 7.351 -5.222 -4.910 1.00 0.00 H new ATOM 0 HG11 VAL A 75 6.216 -5.980 -7.001 1.00 0.00 H new ATOM 0 HG12 VAL A 75 7.906 -6.534 -6.922 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.580 -7.667 -6.568 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.887 -5.691 -4.992 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.206 -7.363 -4.472 1.00 0.00 H new ATOM 0 HG23 VAL A 75 5.566 -6.006 -3.378 1.00 0.00 H new ATOM 1112 N VAL A 76 9.711 -8.423 -5.365 1.00 0.00 N ATOM 1113 CA VAL A 76 11.042 -8.673 -5.955 1.00 0.00 C ATOM 1114 C VAL A 76 10.871 -9.307 -7.330 1.00 0.00 C ATOM 1115 O VAL A 76 10.221 -10.338 -7.461 1.00 0.00 O ATOM 1116 CB VAL A 76 11.906 -9.559 -5.035 1.00 0.00 C ATOM 1117 CG1 VAL A 76 13.195 -10.038 -5.724 1.00 0.00 C ATOM 1118 CG2 VAL A 76 12.332 -8.807 -3.766 1.00 0.00 C ATOM 0 H VAL A 76 9.095 -9.235 -5.392 1.00 0.00 H new ATOM 0 HA VAL A 76 11.566 -7.723 -6.063 1.00 0.00 H new ATOM 0 HB VAL A 76 11.276 -10.413 -4.788 1.00 0.00 H new ATOM 0 HG11 VAL A 76 13.768 -10.658 -5.034 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.940 -10.621 -6.609 1.00 0.00 H new ATOM 0 HG13 VAL A 76 13.793 -9.175 -6.018 1.00 0.00 H new ATOM 0 HG21 VAL A 76 12.939 -9.462 -3.141 1.00 0.00 H new ATOM 0 HG22 VAL A 76 12.914 -7.927 -4.042 1.00 0.00 H new ATOM 0 HG23 VAL A 76 11.446 -8.497 -3.212 1.00 0.00 H new ATOM 1128 N ILE A 77 11.458 -8.697 -8.357 1.00 0.00 N ATOM 1129 CA ILE A 77 11.288 -9.087 -9.759 1.00 0.00 C ATOM 1130 C ILE A 77 12.661 -9.339 -10.381 1.00 0.00 C ATOM 1131 O ILE A 77 13.534 -8.475 -10.344 1.00 0.00 O ATOM 1132 CB ILE A 77 10.501 -7.999 -10.521 1.00 0.00 C ATOM 1133 CG1 ILE A 77 9.177 -7.587 -9.833 1.00 0.00 C ATOM 1134 CG2 ILE A 77 10.233 -8.459 -11.961 1.00 0.00 C ATOM 1135 CD1 ILE A 77 8.130 -8.694 -9.705 1.00 0.00 C ATOM 0 H ILE A 77 12.081 -7.898 -8.237 1.00 0.00 H new ATOM 0 HA ILE A 77 10.711 -10.009 -9.823 1.00 0.00 H new ATOM 0 HB ILE A 77 11.129 -7.108 -10.521 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.407 -7.212 -8.836 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.739 -6.760 -10.392 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.677 -7.686 -12.492 1.00 0.00 H new ATOM 0 HG22 ILE A 77 11.181 -8.638 -12.468 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.650 -9.380 -11.946 1.00 0.00 H new ATOM 0 HD11 ILE A 77 7.243 -8.300 -9.210 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.861 -9.057 -10.697 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.539 -9.516 -9.117 1.00 0.00 H new ATOM 1147 N SER A 78 12.868 -10.525 -10.941 1.00 0.00 N ATOM 1148 CA SER A 78 14.126 -10.942 -11.562 1.00 0.00 C ATOM 1149 C SER A 78 14.082 -10.811 -13.090 1.00 0.00 C ATOM 1150 O SER A 78 13.008 -10.843 -13.688 1.00 0.00 O ATOM 1151 CB SER A 78 14.459 -12.353 -11.070 1.00 0.00 C ATOM 1152 OG SER A 78 15.640 -12.828 -11.677 1.00 0.00 O ATOM 0 H SER A 78 12.147 -11.246 -10.978 1.00 0.00 H new ATOM 0 HA SER A 78 14.935 -10.277 -11.260 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.578 -12.347 -9.987 1.00 0.00 H new ATOM 0 HB3 SER A 78 13.632 -13.027 -11.296 1.00 0.00 H new ATOM 0 HG SER A 78 15.444 -13.115 -12.593 1.00 0.00 H new ATOM 1158 N LEU A 79 15.239 -10.637 -13.737 1.00 0.00 N ATOM 1159 CA LEU A 79 15.386 -10.542 -15.201 1.00 0.00 C ATOM 1160 C LEU A 79 16.518 -11.456 -15.724 1.00 0.00 C ATOM 1161 O LEU A 79 17.242 -11.102 -16.657 1.00 0.00 O ATOM 1162 CB LEU A 79 15.571 -9.069 -15.634 1.00 0.00 C ATOM 1163 CG LEU A 79 14.449 -8.102 -15.207 1.00 0.00 C ATOM 1164 CD1 LEU A 79 14.779 -7.378 -13.899 1.00 0.00 C ATOM 1165 CD2 LEU A 79 14.253 -7.020 -16.266 1.00 0.00 C ATOM 0 H LEU A 79 16.129 -10.555 -13.245 1.00 0.00 H new ATOM 0 HA LEU A 79 14.466 -10.905 -15.659 1.00 0.00 H new ATOM 0 HB2 LEU A 79 16.514 -8.705 -15.226 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.660 -9.037 -16.720 1.00 0.00 H new ATOM 0 HG LEU A 79 13.554 -8.711 -15.079 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.960 -6.708 -13.638 1.00 0.00 H new ATOM 0 HD12 LEU A 79 14.917 -8.110 -13.103 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.695 -6.800 -14.024 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.458 -6.344 -15.952 1.00 0.00 H new ATOM 0 HD22 LEU A 79 15.179 -6.459 -16.389 1.00 0.00 H new ATOM 0 HD23 LEU A 79 13.982 -7.484 -17.214 1.00 0.00 H new ATOM 1177 N CYS A 80 16.694 -12.621 -15.101 1.00 0.00 N ATOM 1178 CA CYS A 80 17.847 -13.503 -15.307 1.00 0.00 C ATOM 1179 C CYS A 80 17.680 -14.581 -16.390 1.00 0.00 C ATOM 1180 O CYS A 80 18.677 -15.206 -16.758 1.00 0.00 O ATOM 1181 CB CYS A 80 18.188 -14.139 -13.954 1.00 0.00 C ATOM 1182 SG CYS A 80 18.691 -12.838 -12.790 1.00 0.00 S ATOM 0 H CYS A 80 16.025 -12.988 -14.424 1.00 0.00 H new ATOM 0 HA CYS A 80 18.657 -12.883 -15.690 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.324 -14.678 -13.564 1.00 0.00 H new ATOM 0 HB3 CYS A 80 18.991 -14.867 -14.073 1.00 0.00 H new ATOM 0 HG CYS A 80 17.672 -12.488 -12.063 1.00 0.00 H new ATOM 1188 N GLY A 81 16.468 -14.818 -16.900 1.00 0.00 N ATOM 1189 CA GLY A 81 16.212 -15.872 -17.889 1.00 0.00 C ATOM 1190 C GLY A 81 16.337 -17.286 -17.304 1.00 0.00 C ATOM 1191 O GLY A 81 17.111 -18.103 -17.808 1.00 0.00 O ATOM 0 H GLY A 81 15.637 -14.286 -16.640 1.00 0.00 H new ATOM 0 HA2 GLY A 81 15.211 -15.742 -18.300 1.00 0.00 H new ATOM 0 HA3 GLY A 81 16.913 -15.764 -18.717 1.00 0.00 H new ATOM 1195 N CYS A 82 15.564 -17.547 -16.245 1.00 0.00 N ATOM 1196 CA CYS A 82 15.563 -18.740 -15.389 1.00 0.00 C ATOM 1197 C CYS A 82 16.866 -18.952 -14.577 1.00 0.00 C ATOM 1198 O CYS A 82 17.923 -18.385 -14.868 1.00 0.00 O ATOM 1199 CB CYS A 82 15.133 -19.988 -16.191 1.00 0.00 C ATOM 1200 SG CYS A 82 13.469 -19.757 -16.896 1.00 0.00 S ATOM 0 H CYS A 82 14.863 -16.872 -15.938 1.00 0.00 H new ATOM 0 HA CYS A 82 14.813 -18.564 -14.618 1.00 0.00 H new ATOM 0 HB2 CYS A 82 15.849 -20.177 -16.991 1.00 0.00 H new ATOM 0 HB3 CYS A 82 15.140 -20.864 -15.542 1.00 0.00 H new ATOM 0 HG CYS A 82 13.131 -20.818 -17.567 1.00 0.00 H new ATOM 1206 N GLY A 83 16.786 -19.788 -13.529 1.00 0.00 N ATOM 1207 CA GLY A 83 17.950 -20.241 -12.747 1.00 0.00 C ATOM 1208 C GLY A 83 18.625 -19.172 -11.873 1.00 0.00 C ATOM 1209 O GLY A 83 19.830 -19.257 -11.627 1.00 0.00 O ATOM 0 H GLY A 83 15.902 -20.173 -13.197 1.00 0.00 H new ATOM 0 HA2 GLY A 83 17.635 -21.063 -12.104 1.00 0.00 H new ATOM 0 HA3 GLY A 83 18.693 -20.642 -13.436 1.00 0.00 H new ATOM 1213 N VAL A 84 17.883 -18.150 -11.420 1.00 0.00 N ATOM 1214 CA VAL A 84 18.427 -17.060 -10.588 1.00 0.00 C ATOM 1215 C VAL A 84 18.827 -17.572 -9.196 1.00 0.00 C ATOM 1216 O VAL A 84 18.018 -18.152 -8.469 1.00 0.00 O ATOM 1217 CB VAL A 84 17.481 -15.837 -10.545 1.00 0.00 C ATOM 1218 CG1 VAL A 84 16.150 -16.052 -9.818 1.00 0.00 C ATOM 1219 CG2 VAL A 84 18.190 -14.622 -9.937 1.00 0.00 C ATOM 0 H VAL A 84 16.887 -18.054 -11.619 1.00 0.00 H new ATOM 0 HA VAL A 84 19.343 -16.702 -11.059 1.00 0.00 H new ATOM 0 HB VAL A 84 17.226 -15.666 -11.591 1.00 0.00 H new ATOM 0 HG11 VAL A 84 15.566 -15.132 -9.848 1.00 0.00 H new ATOM 0 HG12 VAL A 84 15.593 -16.851 -10.307 1.00 0.00 H new ATOM 0 HG13 VAL A 84 16.342 -16.326 -8.781 1.00 0.00 H new ATOM 0 HG21 VAL A 84 17.506 -13.774 -9.917 1.00 0.00 H new ATOM 0 HG22 VAL A 84 18.507 -14.857 -8.921 1.00 0.00 H new ATOM 0 HG23 VAL A 84 19.062 -14.370 -10.540 1.00 0.00 H new ATOM 1229 N ASN A 85 20.092 -17.360 -8.823 1.00 0.00 N ATOM 1230 CA ASN A 85 20.624 -17.713 -7.507 1.00 0.00 C ATOM 1231 C ASN A 85 20.316 -16.582 -6.507 1.00 0.00 C ATOM 1232 O ASN A 85 20.710 -15.439 -6.733 1.00 0.00 O ATOM 1233 CB ASN A 85 22.131 -18.006 -7.640 1.00 0.00 C ATOM 1234 CG ASN A 85 22.775 -18.508 -6.351 1.00 0.00 C ATOM 1235 OD1 ASN A 85 22.127 -18.795 -5.354 1.00 0.00 O ATOM 1236 ND2 ASN A 85 24.082 -18.638 -6.335 1.00 0.00 N ATOM 0 H ASN A 85 20.785 -16.932 -9.437 1.00 0.00 H new ATOM 0 HA ASN A 85 20.148 -18.614 -7.120 1.00 0.00 H new ATOM 0 HB2 ASN A 85 22.280 -18.749 -8.423 1.00 0.00 H new ATOM 0 HB3 ASN A 85 22.642 -17.098 -7.961 1.00 0.00 H new ATOM 0 HD21 ASN A 85 24.551 -18.977 -5.495 1.00 0.00 H new ATOM 0 HD22 ASN A 85 24.628 -18.400 -7.163 1.00 0.00 H new ATOM 1243 N LEU A 86 19.605 -16.887 -5.416 1.00 0.00 N ATOM 1244 CA LEU A 86 19.128 -15.908 -4.430 1.00 0.00 C ATOM 1245 C LEU A 86 19.191 -16.439 -2.984 1.00 0.00 C ATOM 1246 O LEU A 86 18.822 -17.597 -2.752 1.00 0.00 O ATOM 1247 CB LEU A 86 17.657 -15.546 -4.731 1.00 0.00 C ATOM 1248 CG LEU A 86 17.413 -14.676 -5.975 1.00 0.00 C ATOM 1249 CD1 LEU A 86 15.912 -14.490 -6.183 1.00 0.00 C ATOM 1250 CD2 LEU A 86 18.022 -13.282 -5.851 1.00 0.00 C ATOM 0 H LEU A 86 19.338 -17.845 -5.188 1.00 0.00 H new ATOM 0 HA LEU A 86 19.783 -15.041 -4.510 1.00 0.00 H new ATOM 0 HB2 LEU A 86 17.093 -16.472 -4.844 1.00 0.00 H new ATOM 0 HB3 LEU A 86 17.248 -15.027 -3.864 1.00 0.00 H new ATOM 0 HG LEU A 86 17.884 -15.195 -6.810 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.741 -13.873 -7.065 1.00 0.00 H new ATOM 0 HD12 LEU A 86 15.441 -15.463 -6.323 1.00 0.00 H new ATOM 0 HD13 LEU A 86 15.481 -14.001 -5.309 1.00 0.00 H new ATOM 0 HD21 LEU A 86 17.818 -12.714 -6.758 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.584 -12.768 -4.995 1.00 0.00 H new ATOM 0 HD23 LEU A 86 19.100 -13.367 -5.711 1.00 0.00 H new ATOM 1262 N PRO A 87 19.590 -15.606 -1.999 1.00 0.00 N ATOM 1263 CA PRO A 87 19.448 -15.942 -0.579 1.00 0.00 C ATOM 1264 C PRO A 87 17.955 -16.087 -0.213 1.00 0.00 C ATOM 1265 O PRO A 87 17.109 -15.443 -0.843 1.00 0.00 O ATOM 1266 CB PRO A 87 20.138 -14.809 0.198 1.00 0.00 C ATOM 1267 CG PRO A 87 21.079 -14.173 -0.826 1.00 0.00 C ATOM 1268 CD PRO A 87 20.350 -14.373 -2.154 1.00 0.00 C ATOM 0 HA PRO A 87 19.910 -16.898 -0.331 1.00 0.00 H new ATOM 0 HB2 PRO A 87 19.414 -14.087 0.577 1.00 0.00 H new ATOM 0 HB3 PRO A 87 20.686 -15.192 1.059 1.00 0.00 H new ATOM 0 HG2 PRO A 87 21.246 -13.117 -0.615 1.00 0.00 H new ATOM 0 HG3 PRO A 87 22.056 -14.656 -0.828 1.00 0.00 H new ATOM 0 HD2 PRO A 87 19.692 -13.531 -2.371 1.00 0.00 H new ATOM 0 HD3 PRO A 87 21.055 -14.448 -2.982 1.00 0.00 H new ATOM 1276 N PRO A 88 17.591 -16.872 0.820 1.00 0.00 N ATOM 1277 CA PRO A 88 16.197 -17.239 1.095 1.00 0.00 C ATOM 1278 C PRO A 88 15.264 -16.061 1.433 1.00 0.00 C ATOM 1279 O PRO A 88 14.057 -16.147 1.210 1.00 0.00 O ATOM 1280 CB PRO A 88 16.266 -18.274 2.227 1.00 0.00 C ATOM 1281 CG PRO A 88 17.603 -17.987 2.908 1.00 0.00 C ATOM 1282 CD PRO A 88 18.488 -17.548 1.745 1.00 0.00 C ATOM 0 HA PRO A 88 15.739 -17.640 0.190 1.00 0.00 H new ATOM 0 HB2 PRO A 88 15.433 -18.163 2.921 1.00 0.00 H new ATOM 0 HB3 PRO A 88 16.225 -19.292 1.840 1.00 0.00 H new ATOM 0 HG2 PRO A 88 17.513 -17.207 3.664 1.00 0.00 H new ATOM 0 HG3 PRO A 88 18.000 -18.871 3.407 1.00 0.00 H new ATOM 0 HD2 PRO A 88 19.281 -16.881 2.083 1.00 0.00 H new ATOM 0 HD3 PRO A 88 18.971 -18.403 1.272 1.00 0.00 H new ATOM 1290 N GLU A 89 15.798 -14.926 1.896 1.00 0.00 N ATOM 1291 CA GLU A 89 15.001 -13.715 2.149 1.00 0.00 C ATOM 1292 C GLU A 89 14.519 -12.992 0.871 1.00 0.00 C ATOM 1293 O GLU A 89 13.594 -12.189 0.947 1.00 0.00 O ATOM 1294 CB GLU A 89 15.745 -12.777 3.115 1.00 0.00 C ATOM 1295 CG GLU A 89 17.081 -12.229 2.591 1.00 0.00 C ATOM 1296 CD GLU A 89 17.676 -11.191 3.567 1.00 0.00 C ATOM 1297 OE1 GLU A 89 18.361 -11.602 4.538 1.00 0.00 O ATOM 1298 OE2 GLU A 89 17.468 -9.968 3.374 1.00 0.00 O ATOM 0 H GLU A 89 16.790 -14.818 2.106 1.00 0.00 H new ATOM 0 HA GLU A 89 14.079 -14.044 2.628 1.00 0.00 H new ATOM 0 HB2 GLU A 89 15.094 -11.936 3.354 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.930 -13.312 4.046 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.785 -13.049 2.454 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.931 -11.770 1.614 1.00 0.00 H new ATOM 1305 N TRP A 90 15.077 -13.297 -0.311 1.00 0.00 N ATOM 1306 CA TRP A 90 14.712 -12.674 -1.598 1.00 0.00 C ATOM 1307 C TRP A 90 13.614 -13.423 -2.386 1.00 0.00 C ATOM 1308 O TRP A 90 13.232 -12.981 -3.470 1.00 0.00 O ATOM 1309 CB TRP A 90 15.978 -12.465 -2.440 1.00 0.00 C ATOM 1310 CG TRP A 90 16.903 -11.427 -1.890 1.00 0.00 C ATOM 1311 CD1 TRP A 90 17.979 -11.655 -1.106 1.00 0.00 C ATOM 1312 CD2 TRP A 90 16.776 -9.977 -1.980 1.00 0.00 C ATOM 1313 NE1 TRP A 90 18.532 -10.450 -0.711 1.00 0.00 N ATOM 1314 CE2 TRP A 90 17.796 -9.385 -1.181 1.00 0.00 C ATOM 1315 CE3 TRP A 90 15.859 -9.107 -2.605 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 17.860 -8.005 -0.955 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 15.920 -7.717 -2.395 1.00 0.00 C ATOM 1318 CH2 TRP A 90 16.903 -7.167 -1.554 1.00 0.00 C ATOM 0 H TRP A 90 15.811 -13.999 -0.403 1.00 0.00 H new ATOM 0 HA TRP A 90 14.260 -11.710 -1.365 1.00 0.00 H new ATOM 0 HB2 TRP A 90 16.513 -13.412 -2.516 1.00 0.00 H new ATOM 0 HB3 TRP A 90 15.688 -12.181 -3.451 1.00 0.00 H new ATOM 0 HD1 TRP A 90 18.351 -12.630 -0.829 1.00 0.00 H new ATOM 0 HE1 TRP A 90 19.376 -10.362 -0.145 1.00 0.00 H new ATOM 0 HE3 TRP A 90 15.098 -9.514 -3.255 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 18.635 -7.589 -0.328 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 15.207 -7.069 -2.883 1.00 0.00 H new ATOM 0 HH2 TRP A 90 16.923 -6.103 -1.368 1.00 0.00 H new ATOM 1329 N VAL A 91 13.122 -14.557 -1.870 1.00 0.00 N ATOM 1330 CA VAL A 91 12.147 -15.459 -2.527 1.00 0.00 C ATOM 1331 C VAL A 91 10.871 -15.711 -1.697 1.00 0.00 C ATOM 1332 O VAL A 91 10.075 -16.592 -2.020 1.00 0.00 O ATOM 1333 CB VAL A 91 12.821 -16.788 -2.928 1.00 0.00 C ATOM 1334 CG1 VAL A 91 13.902 -16.569 -3.992 1.00 0.00 C ATOM 1335 CG2 VAL A 91 13.453 -17.491 -1.721 1.00 0.00 C ATOM 0 H VAL A 91 13.399 -14.891 -0.947 1.00 0.00 H new ATOM 0 HA VAL A 91 11.813 -14.941 -3.426 1.00 0.00 H new ATOM 0 HB VAL A 91 12.032 -17.420 -3.337 1.00 0.00 H new ATOM 0 HG11 VAL A 91 14.356 -17.525 -4.251 1.00 0.00 H new ATOM 0 HG12 VAL A 91 13.453 -16.127 -4.882 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.667 -15.898 -3.601 1.00 0.00 H new ATOM 0 HG21 VAL A 91 13.917 -18.423 -2.045 1.00 0.00 H new ATOM 0 HG22 VAL A 91 14.209 -16.843 -1.278 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.682 -17.707 -0.981 1.00 0.00 H new ATOM 1345 N THR A 92 10.677 -14.948 -0.617 1.00 0.00 N ATOM 1346 CA THR A 92 9.615 -15.122 0.405 1.00 0.00 C ATOM 1347 C THR A 92 8.575 -13.973 0.393 1.00 0.00 C ATOM 1348 O THR A 92 7.567 -13.994 1.102 1.00 0.00 O ATOM 1349 CB THR A 92 10.283 -15.358 1.780 1.00 0.00 C ATOM 1350 OG1 THR A 92 9.358 -15.572 2.827 1.00 0.00 O ATOM 1351 CG2 THR A 92 11.209 -14.216 2.185 1.00 0.00 C ATOM 0 H THR A 92 11.280 -14.151 -0.413 1.00 0.00 H new ATOM 0 HA THR A 92 9.020 -16.003 0.165 1.00 0.00 H new ATOM 0 HB THR A 92 10.865 -16.269 1.637 1.00 0.00 H new ATOM 0 HG1 THR A 92 8.489 -15.194 2.578 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.651 -14.433 3.157 1.00 0.00 H new ATOM 0 HG22 THR A 92 12.000 -14.108 1.443 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.639 -13.289 2.245 1.00 0.00 H new ATOM 1359 N GLN A 93 8.799 -12.981 -0.473 1.00 0.00 N ATOM 1360 CA GLN A 93 7.957 -11.817 -0.767 1.00 0.00 C ATOM 1361 C GLN A 93 6.530 -12.176 -1.217 1.00 0.00 C ATOM 1362 O GLN A 93 6.275 -13.278 -1.709 1.00 0.00 O ATOM 1363 CB GLN A 93 8.660 -11.012 -1.879 1.00 0.00 C ATOM 1364 CG GLN A 93 9.776 -10.097 -1.355 1.00 0.00 C ATOM 1365 CD GLN A 93 11.041 -10.807 -0.870 1.00 0.00 C ATOM 1366 OE1 GLN A 93 11.284 -11.975 -1.139 1.00 0.00 O ATOM 1367 NE2 GLN A 93 11.898 -10.151 -0.124 1.00 0.00 N ATOM 0 H GLN A 93 9.649 -12.971 -1.036 1.00 0.00 H new ATOM 0 HA GLN A 93 7.841 -11.245 0.154 1.00 0.00 H new ATOM 0 HB2 GLN A 93 9.080 -11.704 -2.609 1.00 0.00 H new ATOM 0 HB3 GLN A 93 7.920 -10.407 -2.403 1.00 0.00 H new ATOM 0 HG2 GLN A 93 10.053 -9.401 -2.147 1.00 0.00 H new ATOM 0 HG3 GLN A 93 9.377 -9.502 -0.533 1.00 0.00 H new ATOM 0 HE21 GLN A 93 11.722 -9.176 0.117 1.00 0.00 H new ATOM 0 HE22 GLN A 93 12.740 -10.616 0.215 1.00 0.00 H new ATOM 1376 N GLU A 94 5.602 -11.211 -1.112 1.00 0.00 N ATOM 1377 CA GLU A 94 4.208 -11.406 -1.549 1.00 0.00 C ATOM 1378 C GLU A 94 4.074 -11.601 -3.070 1.00 0.00 C ATOM 1379 O GLU A 94 3.208 -12.359 -3.512 1.00 0.00 O ATOM 1380 CB GLU A 94 3.297 -10.267 -1.059 1.00 0.00 C ATOM 1381 CG GLU A 94 3.713 -8.838 -1.438 1.00 0.00 C ATOM 1382 CD GLU A 94 2.603 -7.836 -1.072 1.00 0.00 C ATOM 1383 OE1 GLU A 94 2.509 -7.430 0.113 1.00 0.00 O ATOM 1384 OE2 GLU A 94 1.811 -7.450 -1.967 1.00 0.00 O ATOM 0 H GLU A 94 5.792 -10.286 -0.727 1.00 0.00 H new ATOM 0 HA GLU A 94 3.876 -12.335 -1.085 1.00 0.00 H new ATOM 0 HB2 GLU A 94 2.294 -10.443 -1.447 1.00 0.00 H new ATOM 0 HB3 GLU A 94 3.234 -10.326 0.028 1.00 0.00 H new ATOM 0 HG2 GLU A 94 4.635 -8.573 -0.921 1.00 0.00 H new ATOM 0 HG3 GLU A 94 3.920 -8.785 -2.507 1.00 0.00 H new ATOM 1391 N ILE A 95 4.948 -10.957 -3.861 1.00 0.00 N ATOM 1392 CA ILE A 95 5.018 -11.123 -5.321 1.00 0.00 C ATOM 1393 C ILE A 95 6.469 -11.359 -5.767 1.00 0.00 C ATOM 1394 O ILE A 95 7.361 -10.562 -5.454 1.00 0.00 O ATOM 1395 CB ILE A 95 4.368 -9.919 -6.049 1.00 0.00 C ATOM 1396 CG1 ILE A 95 2.893 -9.743 -5.610 1.00 0.00 C ATOM 1397 CG2 ILE A 95 4.464 -10.071 -7.581 1.00 0.00 C ATOM 1398 CD1 ILE A 95 2.201 -8.493 -6.157 1.00 0.00 C ATOM 0 H ILE A 95 5.636 -10.297 -3.498 1.00 0.00 H new ATOM 0 HA ILE A 95 4.445 -12.007 -5.600 1.00 0.00 H new ATOM 0 HB ILE A 95 4.921 -9.023 -5.767 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.328 -10.620 -5.926 1.00 0.00 H new ATOM 0 HG13 ILE A 95 2.855 -9.714 -4.521 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.999 -9.210 -8.062 1.00 0.00 H new ATOM 0 HG22 ILE A 95 5.512 -10.129 -7.876 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.949 -10.981 -7.889 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.174 -8.458 -5.795 1.00 0.00 H new ATOM 0 HD12 ILE A 95 2.735 -7.605 -5.820 1.00 0.00 H new ATOM 0 HD13 ILE A 95 2.201 -8.525 -7.247 1.00 0.00 H new ATOM 1410 N PHE A 96 6.675 -12.436 -6.535 1.00 0.00 N ATOM 1411 CA PHE A 96 7.929 -12.754 -7.230 1.00 0.00 C ATOM 1412 C PHE A 96 7.670 -13.305 -8.644 1.00 0.00 C ATOM 1413 O PHE A 96 6.748 -14.097 -8.854 1.00 0.00 O ATOM 1414 CB PHE A 96 8.767 -13.743 -6.400 1.00 0.00 C ATOM 1415 CG PHE A 96 10.176 -13.979 -6.931 1.00 0.00 C ATOM 1416 CD1 PHE A 96 10.403 -14.844 -8.025 1.00 0.00 C ATOM 1417 CD2 PHE A 96 11.269 -13.322 -6.335 1.00 0.00 C ATOM 1418 CE1 PHE A 96 11.703 -15.026 -8.530 1.00 0.00 C ATOM 1419 CE2 PHE A 96 12.570 -13.519 -6.828 1.00 0.00 C ATOM 1420 CZ PHE A 96 12.787 -14.367 -7.927 1.00 0.00 C ATOM 0 H PHE A 96 5.949 -13.134 -6.695 1.00 0.00 H new ATOM 0 HA PHE A 96 8.493 -11.828 -7.341 1.00 0.00 H new ATOM 0 HB2 PHE A 96 8.835 -13.373 -5.377 1.00 0.00 H new ATOM 0 HB3 PHE A 96 8.243 -14.698 -6.359 1.00 0.00 H new ATOM 0 HD1 PHE A 96 9.574 -15.368 -8.476 1.00 0.00 H new ATOM 0 HD2 PHE A 96 11.107 -12.663 -5.495 1.00 0.00 H new ATOM 0 HE1 PHE A 96 11.868 -15.671 -9.380 1.00 0.00 H new ATOM 0 HE2 PHE A 96 13.405 -13.018 -6.361 1.00 0.00 H new ATOM 0 HZ PHE A 96 13.787 -14.512 -8.308 1.00 0.00 H new ATOM 1430 N GLU A 97 8.508 -12.914 -9.606 1.00 0.00 N ATOM 1431 CA GLU A 97 8.571 -13.478 -10.967 1.00 0.00 C ATOM 1432 C GLU A 97 9.952 -13.220 -11.599 1.00 0.00 C ATOM 1433 O GLU A 97 10.697 -12.350 -11.142 1.00 0.00 O ATOM 1434 CB GLU A 97 7.427 -12.951 -11.854 1.00 0.00 C ATOM 1435 CG GLU A 97 7.436 -11.435 -12.045 1.00 0.00 C ATOM 1436 CD GLU A 97 6.138 -10.956 -12.707 1.00 0.00 C ATOM 1437 OE1 GLU A 97 5.944 -11.169 -13.928 1.00 0.00 O ATOM 1438 OE2 GLU A 97 5.284 -10.367 -12.006 1.00 0.00 O ATOM 0 H GLU A 97 9.189 -12.169 -9.459 1.00 0.00 H new ATOM 0 HA GLU A 97 8.437 -14.557 -10.891 1.00 0.00 H new ATOM 0 HB2 GLU A 97 7.488 -13.430 -12.831 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.474 -13.246 -11.414 1.00 0.00 H new ATOM 0 HG2 GLU A 97 7.559 -10.944 -11.080 1.00 0.00 H new ATOM 0 HG3 GLU A 97 8.289 -11.147 -12.659 1.00 0.00 H new ATOM 1445 N ASP A 98 10.292 -13.975 -12.647 1.00 0.00 N ATOM 1446 CA ASP A 98 11.539 -13.829 -13.416 1.00 0.00 C ATOM 1447 C ASP A 98 11.265 -13.646 -14.921 1.00 0.00 C ATOM 1448 O ASP A 98 10.466 -14.378 -15.511 1.00 0.00 O ATOM 1449 CB ASP A 98 12.476 -15.019 -13.167 1.00 0.00 C ATOM 1450 CG ASP A 98 13.759 -14.898 -14.006 1.00 0.00 C ATOM 1451 OD1 ASP A 98 14.608 -14.032 -13.683 1.00 0.00 O ATOM 1452 OD2 ASP A 98 13.912 -15.668 -14.978 1.00 0.00 O ATOM 0 H ASP A 98 9.695 -14.725 -12.996 1.00 0.00 H new ATOM 0 HA ASP A 98 12.035 -12.924 -13.066 1.00 0.00 H new ATOM 0 HB2 ASP A 98 12.733 -15.068 -12.109 1.00 0.00 H new ATOM 0 HB3 ASP A 98 11.962 -15.948 -13.414 1.00 0.00 H new ATOM 1457 N TRP A 99 11.945 -12.673 -15.534 1.00 0.00 N ATOM 1458 CA TRP A 99 11.836 -12.298 -16.948 1.00 0.00 C ATOM 1459 C TRP A 99 13.088 -12.700 -17.753 1.00 0.00 C ATOM 1460 O TRP A 99 14.153 -12.965 -17.195 1.00 0.00 O ATOM 1461 CB TRP A 99 11.497 -10.797 -17.047 1.00 0.00 C ATOM 1462 CG TRP A 99 10.264 -10.329 -16.318 1.00 0.00 C ATOM 1463 CD1 TRP A 99 9.215 -11.108 -15.955 1.00 0.00 C ATOM 1464 CD2 TRP A 99 9.915 -8.974 -15.877 1.00 0.00 C ATOM 1465 NE1 TRP A 99 8.274 -10.355 -15.290 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.641 -9.031 -15.236 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.514 -7.694 -15.978 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.003 -7.901 -14.715 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 9.877 -6.548 -15.460 1.00 0.00 C ATOM 1470 CH2 TRP A 99 8.626 -6.650 -14.826 1.00 0.00 C ATOM 0 H TRP A 99 12.621 -12.096 -15.033 1.00 0.00 H new ATOM 0 HA TRP A 99 11.022 -12.856 -17.409 1.00 0.00 H new ATOM 0 HB2 TRP A 99 12.349 -10.231 -16.671 1.00 0.00 H new ATOM 0 HB3 TRP A 99 11.385 -10.543 -18.101 1.00 0.00 H new ATOM 0 HD1 TRP A 99 9.130 -12.165 -16.158 1.00 0.00 H new ATOM 0 HE1 TRP A 99 7.415 -10.731 -14.889 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.475 -7.595 -16.460 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.041 -7.991 -14.232 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 10.354 -5.583 -15.551 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.147 -5.768 -14.426 1.00 0.00 H new ATOM 1481 N GLN A 100 12.970 -12.725 -19.088 1.00 0.00 N ATOM 1482 CA GLN A 100 13.971 -13.289 -20.012 1.00 0.00 C ATOM 1483 C GLN A 100 14.322 -12.321 -21.156 1.00 0.00 C ATOM 1484 O GLN A 100 14.076 -12.575 -22.335 1.00 0.00 O ATOM 1485 CB GLN A 100 13.536 -14.705 -20.450 1.00 0.00 C ATOM 1486 CG GLN A 100 12.112 -14.865 -21.018 1.00 0.00 C ATOM 1487 CD GLN A 100 11.793 -16.336 -21.291 1.00 0.00 C ATOM 1488 OE1 GLN A 100 11.737 -16.791 -22.428 1.00 0.00 O ATOM 1489 NE2 GLN A 100 11.587 -17.144 -20.266 1.00 0.00 N ATOM 0 H GLN A 100 12.156 -12.344 -19.570 1.00 0.00 H new ATOM 0 HA GLN A 100 14.921 -13.412 -19.493 1.00 0.00 H new ATOM 0 HB2 GLN A 100 14.241 -15.056 -21.204 1.00 0.00 H new ATOM 0 HB3 GLN A 100 13.632 -15.368 -19.590 1.00 0.00 H new ATOM 0 HG2 GLN A 100 11.388 -14.457 -20.313 1.00 0.00 H new ATOM 0 HG3 GLN A 100 12.018 -14.292 -21.940 1.00 0.00 H new ATOM 0 HE21 GLN A 100 11.630 -16.781 -19.314 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.385 -18.131 -20.427 1.00 0.00 H new ATOM 1498 N LEU A 101 14.873 -11.170 -20.762 1.00 0.00 N ATOM 1499 CA LEU A 101 15.313 -10.086 -21.650 1.00 0.00 C ATOM 1500 C LEU A 101 16.700 -10.384 -22.259 1.00 0.00 C ATOM 1501 O LEU A 101 17.435 -11.254 -21.789 1.00 0.00 O ATOM 1502 CB LEU A 101 15.353 -8.758 -20.856 1.00 0.00 C ATOM 1503 CG LEU A 101 14.028 -8.117 -20.412 1.00 0.00 C ATOM 1504 CD1 LEU A 101 13.132 -7.736 -21.587 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.222 -8.972 -19.442 1.00 0.00 C ATOM 0 H LEU A 101 15.032 -10.957 -19.777 1.00 0.00 H new ATOM 0 HA LEU A 101 14.603 -10.003 -22.472 1.00 0.00 H new ATOM 0 HB2 LEU A 101 15.953 -8.927 -19.962 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.885 -8.027 -21.464 1.00 0.00 H new ATOM 0 HG LEU A 101 14.343 -7.214 -19.889 1.00 0.00 H new ATOM 0 HD11 LEU A 101 12.211 -7.288 -21.212 1.00 0.00 H new ATOM 0 HD12 LEU A 101 13.651 -7.019 -22.223 1.00 0.00 H new ATOM 0 HD13 LEU A 101 12.892 -8.628 -22.166 1.00 0.00 H new ATOM 0 HD21 LEU A 101 12.302 -8.451 -19.176 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.977 -9.924 -19.913 1.00 0.00 H new ATOM 0 HD23 LEU A 101 13.810 -9.153 -18.542 1.00 0.00 H new ATOM 1517 N GLU A 102 17.076 -9.603 -23.275 1.00 0.00 N ATOM 1518 CA GLU A 102 18.426 -9.568 -23.856 1.00 0.00 C ATOM 1519 C GLU A 102 19.051 -8.176 -23.675 1.00 0.00 C ATOM 1520 O GLU A 102 18.335 -7.194 -23.483 1.00 0.00 O ATOM 1521 CB GLU A 102 18.390 -10.017 -25.326 1.00 0.00 C ATOM 1522 CG GLU A 102 17.721 -9.018 -26.282 1.00 0.00 C ATOM 1523 CD GLU A 102 17.758 -9.556 -27.724 1.00 0.00 C ATOM 1524 OE1 GLU A 102 18.859 -9.567 -28.327 1.00 0.00 O ATOM 1525 OE2 GLU A 102 16.698 -9.965 -28.259 1.00 0.00 O ATOM 0 H GLU A 102 16.432 -8.957 -23.732 1.00 0.00 H new ATOM 0 HA GLU A 102 19.066 -10.274 -23.326 1.00 0.00 H new ATOM 0 HB2 GLU A 102 19.411 -10.195 -25.663 1.00 0.00 H new ATOM 0 HB3 GLU A 102 17.863 -10.969 -25.389 1.00 0.00 H new ATOM 0 HG2 GLU A 102 16.689 -8.846 -25.976 1.00 0.00 H new ATOM 0 HG3 GLU A 102 18.232 -8.057 -26.231 1.00 0.00 H new ATOM 1532 N ASP A 103 20.378 -8.071 -23.739 1.00 0.00 N ATOM 1533 CA ASP A 103 21.089 -6.793 -23.626 1.00 0.00 C ATOM 1534 C ASP A 103 21.447 -6.261 -25.031 1.00 0.00 C ATOM 1535 O ASP A 103 22.138 -6.955 -25.786 1.00 0.00 O ATOM 1536 CB ASP A 103 22.307 -6.966 -22.707 1.00 0.00 C ATOM 1537 CG ASP A 103 23.018 -5.644 -22.367 1.00 0.00 C ATOM 1538 OD1 ASP A 103 22.360 -4.577 -22.421 1.00 0.00 O ATOM 1539 OD2 ASP A 103 24.217 -5.693 -22.013 1.00 0.00 O ATOM 0 H ASP A 103 20.995 -8.872 -23.871 1.00 0.00 H new ATOM 0 HA ASP A 103 20.451 -6.038 -23.167 1.00 0.00 H new ATOM 0 HB2 ASP A 103 21.988 -7.445 -21.781 1.00 0.00 H new ATOM 0 HB3 ASP A 103 23.019 -7.639 -23.185 1.00 0.00 H new ATOM 1544 N PRO A 104 20.981 -5.059 -25.427 1.00 0.00 N ATOM 1545 CA PRO A 104 21.254 -4.493 -26.748 1.00 0.00 C ATOM 1546 C PRO A 104 22.674 -3.913 -26.903 1.00 0.00 C ATOM 1547 O PRO A 104 23.049 -3.538 -28.008 1.00 0.00 O ATOM 1548 CB PRO A 104 20.163 -3.443 -26.953 1.00 0.00 C ATOM 1549 CG PRO A 104 19.912 -2.937 -25.535 1.00 0.00 C ATOM 1550 CD PRO A 104 20.021 -4.221 -24.721 1.00 0.00 C ATOM 0 HA PRO A 104 21.231 -5.268 -27.514 1.00 0.00 H new ATOM 0 HB2 PRO A 104 20.491 -2.643 -27.616 1.00 0.00 H new ATOM 0 HB3 PRO A 104 19.264 -3.874 -27.394 1.00 0.00 H new ATOM 0 HG2 PRO A 104 20.650 -2.195 -25.229 1.00 0.00 H new ATOM 0 HG3 PRO A 104 18.932 -2.471 -25.435 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.357 -4.013 -23.705 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.054 -4.717 -24.641 1.00 0.00 H new ATOM 1558 N ASP A 105 23.489 -3.854 -25.844 1.00 0.00 N ATOM 1559 CA ASP A 105 24.912 -3.505 -25.968 1.00 0.00 C ATOM 1560 C ASP A 105 25.648 -4.448 -26.945 1.00 0.00 C ATOM 1561 O ASP A 105 25.518 -5.673 -26.868 1.00 0.00 O ATOM 1562 CB ASP A 105 25.568 -3.543 -24.586 1.00 0.00 C ATOM 1563 CG ASP A 105 27.074 -3.229 -24.631 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.484 -2.302 -25.368 1.00 0.00 O ATOM 1565 OD2 ASP A 105 27.844 -3.873 -23.878 1.00 0.00 O ATOM 0 H ASP A 105 23.188 -4.044 -24.888 1.00 0.00 H new ATOM 0 HA ASP A 105 24.984 -2.498 -26.378 1.00 0.00 H new ATOM 0 HB2 ASP A 105 25.071 -2.825 -23.933 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.420 -4.529 -24.146 1.00 0.00 H new ATOM 1570 N GLY A 106 26.413 -3.874 -27.881 1.00 0.00 N ATOM 1571 CA GLY A 106 27.045 -4.604 -28.990 1.00 0.00 C ATOM 1572 C GLY A 106 26.087 -5.000 -30.132 1.00 0.00 C ATOM 1573 O GLY A 106 26.523 -5.605 -31.112 1.00 0.00 O ATOM 0 H GLY A 106 26.614 -2.874 -27.891 1.00 0.00 H new ATOM 0 HA2 GLY A 106 27.845 -3.989 -29.402 1.00 0.00 H new ATOM 0 HA3 GLY A 106 27.509 -5.507 -28.594 1.00 0.00 H new ATOM 1577 N GLN A 107 24.801 -4.644 -30.030 1.00 0.00 N ATOM 1578 CA GLN A 107 23.771 -4.807 -31.064 1.00 0.00 C ATOM 1579 C GLN A 107 23.371 -3.443 -31.677 1.00 0.00 C ATOM 1580 O GLN A 107 23.938 -2.400 -31.335 1.00 0.00 O ATOM 1581 CB GLN A 107 22.565 -5.585 -30.494 1.00 0.00 C ATOM 1582 CG GLN A 107 22.937 -6.840 -29.677 1.00 0.00 C ATOM 1583 CD GLN A 107 21.752 -7.795 -29.540 1.00 0.00 C ATOM 1584 OE1 GLN A 107 21.266 -8.354 -30.514 1.00 0.00 O ATOM 1585 NE2 GLN A 107 21.233 -8.020 -28.353 1.00 0.00 N ATOM 0 H GLN A 107 24.432 -4.213 -29.182 1.00 0.00 H new ATOM 0 HA GLN A 107 24.180 -5.398 -31.884 1.00 0.00 H new ATOM 0 HB2 GLN A 107 21.984 -4.915 -29.861 1.00 0.00 H new ATOM 0 HB3 GLN A 107 21.919 -5.884 -31.320 1.00 0.00 H new ATOM 0 HG2 GLN A 107 23.767 -7.356 -30.160 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.280 -6.541 -28.687 1.00 0.00 H new ATOM 0 HE21 GLN A 107 21.625 -7.563 -27.530 1.00 0.00 H new ATOM 0 HE22 GLN A 107 20.438 -8.652 -28.255 1.00 0.00 H new ATOM 1594 N SER A 108 22.413 -3.434 -32.617 1.00 0.00 N ATOM 1595 CA SER A 108 21.972 -2.207 -33.304 1.00 0.00 C ATOM 1596 C SER A 108 21.124 -1.307 -32.395 1.00 0.00 C ATOM 1597 O SER A 108 20.462 -1.780 -31.469 1.00 0.00 O ATOM 1598 CB SER A 108 21.231 -2.566 -34.600 1.00 0.00 C ATOM 1599 OG SER A 108 20.765 -1.394 -35.253 1.00 0.00 O ATOM 0 H SER A 108 21.922 -4.274 -32.923 1.00 0.00 H new ATOM 0 HA SER A 108 22.859 -1.629 -33.562 1.00 0.00 H new ATOM 0 HB2 SER A 108 21.896 -3.118 -35.264 1.00 0.00 H new ATOM 0 HB3 SER A 108 20.390 -3.221 -34.374 1.00 0.00 H new ATOM 0 HG SER A 108 20.297 -1.643 -36.077 1.00 0.00 H new ATOM 1605 N LEU A 109 21.058 -0.008 -32.702 1.00 0.00 N ATOM 1606 CA LEU A 109 20.162 0.947 -32.040 1.00 0.00 C ATOM 1607 C LEU A 109 18.683 0.576 -32.246 1.00 0.00 C ATOM 1608 O LEU A 109 17.850 0.846 -31.385 1.00 0.00 O ATOM 1609 CB LEU A 109 20.474 2.383 -32.511 1.00 0.00 C ATOM 1610 CG LEU A 109 21.873 2.964 -32.193 1.00 0.00 C ATOM 1611 CD1 LEU A 109 22.352 2.658 -30.773 1.00 0.00 C ATOM 1612 CD2 LEU A 109 22.963 2.502 -33.167 1.00 0.00 C ATOM 0 H LEU A 109 21.634 0.417 -33.429 1.00 0.00 H new ATOM 0 HA LEU A 109 20.341 0.900 -30.966 1.00 0.00 H new ATOM 0 HB2 LEU A 109 20.336 2.417 -33.592 1.00 0.00 H new ATOM 0 HB3 LEU A 109 19.729 3.047 -32.073 1.00 0.00 H new ATOM 0 HG LEU A 109 21.725 4.039 -32.300 1.00 0.00 H new ATOM 0 HD11 LEU A 109 23.339 3.095 -30.620 1.00 0.00 H new ATOM 0 HD12 LEU A 109 21.652 3.082 -30.053 1.00 0.00 H new ATOM 0 HD13 LEU A 109 22.408 1.579 -30.632 1.00 0.00 H new ATOM 0 HD21 LEU A 109 23.917 2.948 -32.884 1.00 0.00 H new ATOM 0 HD22 LEU A 109 23.046 1.416 -33.132 1.00 0.00 H new ATOM 0 HD23 LEU A 109 22.703 2.814 -34.179 1.00 0.00 H new ATOM 1624 N GLU A 110 18.351 -0.148 -33.318 1.00 0.00 N ATOM 1625 CA GLU A 110 17.018 -0.742 -33.499 1.00 0.00 C ATOM 1626 C GLU A 110 16.727 -1.826 -32.440 1.00 0.00 C ATOM 1627 O GLU A 110 15.594 -1.953 -31.977 1.00 0.00 O ATOM 1628 CB GLU A 110 16.912 -1.295 -34.929 1.00 0.00 C ATOM 1629 CG GLU A 110 15.482 -1.710 -35.295 1.00 0.00 C ATOM 1630 CD GLU A 110 15.401 -2.149 -36.770 1.00 0.00 C ATOM 1631 OE1 GLU A 110 15.671 -3.338 -37.071 1.00 0.00 O ATOM 1632 OE2 GLU A 110 15.059 -1.312 -37.644 1.00 0.00 O ATOM 0 H GLU A 110 18.995 -0.340 -34.085 1.00 0.00 H new ATOM 0 HA GLU A 110 16.259 0.028 -33.357 1.00 0.00 H new ATOM 0 HB2 GLU A 110 17.259 -0.539 -35.634 1.00 0.00 H new ATOM 0 HB3 GLU A 110 17.574 -2.155 -35.032 1.00 0.00 H new ATOM 0 HG2 GLU A 110 15.159 -2.527 -34.649 1.00 0.00 H new ATOM 0 HG3 GLU A 110 14.801 -0.877 -35.121 1.00 0.00 H new ATOM 1639 N VAL A 111 17.748 -2.555 -31.970 1.00 0.00 N ATOM 1640 CA VAL A 111 17.611 -3.531 -30.874 1.00 0.00 C ATOM 1641 C VAL A 111 17.430 -2.806 -29.542 1.00 0.00 C ATOM 1642 O VAL A 111 16.558 -3.194 -28.774 1.00 0.00 O ATOM 1643 CB VAL A 111 18.755 -4.566 -30.834 1.00 0.00 C ATOM 1644 CG1 VAL A 111 18.444 -5.692 -29.838 1.00 0.00 C ATOM 1645 CG2 VAL A 111 18.941 -5.231 -32.204 1.00 0.00 C ATOM 0 H VAL A 111 18.697 -2.486 -32.339 1.00 0.00 H new ATOM 0 HA VAL A 111 16.712 -4.116 -31.068 1.00 0.00 H new ATOM 0 HB VAL A 111 19.653 -4.024 -30.539 1.00 0.00 H new ATOM 0 HG11 VAL A 111 19.266 -6.408 -29.829 1.00 0.00 H new ATOM 0 HG12 VAL A 111 18.319 -5.271 -28.840 1.00 0.00 H new ATOM 0 HG13 VAL A 111 17.526 -6.198 -30.136 1.00 0.00 H new ATOM 0 HG21 VAL A 111 19.753 -5.956 -32.149 1.00 0.00 H new ATOM 0 HG22 VAL A 111 18.020 -5.739 -32.490 1.00 0.00 H new ATOM 0 HG23 VAL A 111 19.182 -4.471 -32.947 1.00 0.00 H new ATOM 1655 N PHE A 112 18.128 -1.689 -29.294 1.00 0.00 N ATOM 1656 CA PHE A 112 17.846 -0.817 -28.134 1.00 0.00 C ATOM 1657 C PHE A 112 16.382 -0.344 -28.138 1.00 0.00 C ATOM 1658 O PHE A 112 15.665 -0.509 -27.151 1.00 0.00 O ATOM 1659 CB PHE A 112 18.793 0.402 -28.116 1.00 0.00 C ATOM 1660 CG PHE A 112 20.165 0.173 -27.513 1.00 0.00 C ATOM 1661 CD1 PHE A 112 21.248 -0.242 -28.310 1.00 0.00 C ATOM 1662 CD2 PHE A 112 20.372 0.424 -26.144 1.00 0.00 C ATOM 1663 CE1 PHE A 112 22.517 -0.432 -27.736 1.00 0.00 C ATOM 1664 CE2 PHE A 112 21.642 0.245 -25.572 1.00 0.00 C ATOM 1665 CZ PHE A 112 22.716 -0.194 -26.366 1.00 0.00 C ATOM 0 H PHE A 112 18.896 -1.363 -29.881 1.00 0.00 H new ATOM 0 HA PHE A 112 18.017 -1.406 -27.233 1.00 0.00 H new ATOM 0 HB2 PHE A 112 18.923 0.751 -29.141 1.00 0.00 H new ATOM 0 HB3 PHE A 112 18.306 1.206 -27.565 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.104 -0.415 -29.366 1.00 0.00 H new ATOM 0 HD2 PHE A 112 19.549 0.757 -25.529 1.00 0.00 H new ATOM 0 HE1 PHE A 112 23.342 -0.762 -28.350 1.00 0.00 H new ATOM 0 HE2 PHE A 112 21.794 0.445 -24.522 1.00 0.00 H new ATOM 0 HZ PHE A 112 23.690 -0.348 -25.925 1.00 0.00 H new ATOM 1675 N ARG A 113 15.903 0.170 -29.278 1.00 0.00 N ATOM 1676 CA ARG A 113 14.520 0.668 -29.442 1.00 0.00 C ATOM 1677 C ARG A 113 13.456 -0.449 -29.449 1.00 0.00 C ATOM 1678 O ARG A 113 12.292 -0.176 -29.175 1.00 0.00 O ATOM 1679 CB ARG A 113 14.445 1.570 -30.691 1.00 0.00 C ATOM 1680 CG ARG A 113 15.268 2.862 -30.512 1.00 0.00 C ATOM 1681 CD ARG A 113 15.117 3.802 -31.712 1.00 0.00 C ATOM 1682 NE ARG A 113 15.755 5.111 -31.446 1.00 0.00 N ATOM 1683 CZ ARG A 113 16.705 5.715 -32.132 1.00 0.00 C ATOM 1684 NH1 ARG A 113 17.253 5.191 -33.193 1.00 0.00 N ATOM 1685 NH2 ARG A 113 17.115 6.887 -31.757 1.00 0.00 N ATOM 0 H ARG A 113 16.466 0.255 -30.124 1.00 0.00 H new ATOM 0 HA ARG A 113 14.274 1.263 -28.563 1.00 0.00 H new ATOM 0 HB2 ARG A 113 14.813 1.022 -31.558 1.00 0.00 H new ATOM 0 HB3 ARG A 113 13.405 1.826 -30.893 1.00 0.00 H new ATOM 0 HG2 ARG A 113 14.947 3.375 -29.605 1.00 0.00 H new ATOM 0 HG3 ARG A 113 16.320 2.608 -30.379 1.00 0.00 H new ATOM 0 HD2 ARG A 113 15.568 3.347 -32.594 1.00 0.00 H new ATOM 0 HD3 ARG A 113 14.060 3.947 -31.933 1.00 0.00 H new ATOM 0 HE ARG A 113 15.415 5.611 -30.625 1.00 0.00 H new ATOM 0 HH11 ARG A 113 16.949 4.275 -33.525 1.00 0.00 H new ATOM 0 HH12 ARG A 113 17.985 5.697 -33.691 1.00 0.00 H new ATOM 0 HH21 ARG A 113 16.703 7.333 -30.938 1.00 0.00 H new ATOM 0 HH22 ARG A 113 17.850 7.362 -32.281 1.00 0.00 H new ATOM 1699 N THR A 114 13.855 -1.706 -29.660 1.00 0.00 N ATOM 1700 CA THR A 114 13.009 -2.905 -29.489 1.00 0.00 C ATOM 1701 C THR A 114 12.958 -3.367 -28.029 1.00 0.00 C ATOM 1702 O THR A 114 11.875 -3.549 -27.473 1.00 0.00 O ATOM 1703 CB THR A 114 13.493 -4.054 -30.393 1.00 0.00 C ATOM 1704 OG1 THR A 114 13.470 -3.660 -31.748 1.00 0.00 O ATOM 1705 CG2 THR A 114 12.601 -5.293 -30.296 1.00 0.00 C ATOM 0 H THR A 114 14.802 -1.931 -29.964 1.00 0.00 H new ATOM 0 HA THR A 114 11.998 -2.625 -29.785 1.00 0.00 H new ATOM 0 HB THR A 114 14.501 -4.291 -30.052 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.235 -3.075 -31.932 1.00 0.00 H new ATOM 0 HG21 THR A 114 12.988 -6.072 -30.953 1.00 0.00 H new ATOM 0 HG22 THR A 114 12.593 -5.656 -29.268 1.00 0.00 H new ATOM 0 HG23 THR A 114 11.586 -5.035 -30.597 1.00 0.00 H new ATOM 1713 N VAL A 115 14.119 -3.541 -27.382 1.00 0.00 N ATOM 1714 CA VAL A 115 14.247 -4.072 -26.003 1.00 0.00 C ATOM 1715 C VAL A 115 13.627 -3.130 -24.984 1.00 0.00 C ATOM 1716 O VAL A 115 12.977 -3.606 -24.056 1.00 0.00 O ATOM 1717 CB VAL A 115 15.717 -4.424 -25.673 1.00 0.00 C ATOM 1718 CG1 VAL A 115 15.886 -4.825 -24.200 1.00 0.00 C ATOM 1719 CG2 VAL A 115 16.197 -5.605 -26.526 1.00 0.00 C ATOM 0 H VAL A 115 15.019 -3.314 -27.805 1.00 0.00 H new ATOM 0 HA VAL A 115 13.682 -5.002 -25.946 1.00 0.00 H new ATOM 0 HB VAL A 115 16.304 -3.530 -25.884 1.00 0.00 H new ATOM 0 HG11 VAL A 115 16.931 -5.065 -24.006 1.00 0.00 H new ATOM 0 HG12 VAL A 115 15.579 -3.998 -23.560 1.00 0.00 H new ATOM 0 HG13 VAL A 115 15.268 -5.697 -23.987 1.00 0.00 H new ATOM 0 HG21 VAL A 115 17.233 -5.836 -26.278 1.00 0.00 H new ATOM 0 HG22 VAL A 115 15.573 -6.476 -26.325 1.00 0.00 H new ATOM 0 HG23 VAL A 115 16.126 -5.344 -27.582 1.00 0.00 H new ATOM 1729 N ARG A 116 13.693 -1.812 -25.193 1.00 0.00 N ATOM 1730 CA ARG A 116 13.025 -0.841 -24.306 1.00 0.00 C ATOM 1731 C ARG A 116 11.519 -1.085 -24.190 1.00 0.00 C ATOM 1732 O ARG A 116 10.979 -1.082 -23.093 1.00 0.00 O ATOM 1733 CB ARG A 116 13.394 0.586 -24.745 1.00 0.00 C ATOM 1734 CG ARG A 116 12.585 1.170 -25.911 1.00 0.00 C ATOM 1735 CD ARG A 116 13.069 2.576 -26.271 1.00 0.00 C ATOM 1736 NE ARG A 116 12.311 3.105 -27.425 1.00 0.00 N ATOM 1737 CZ ARG A 116 12.594 4.191 -28.119 1.00 0.00 C ATOM 1738 NH1 ARG A 116 13.619 4.934 -27.842 1.00 0.00 N ATOM 1739 NH2 ARG A 116 11.863 4.545 -29.130 1.00 0.00 N ATOM 0 H ARG A 116 14.202 -1.387 -25.968 1.00 0.00 H new ATOM 0 HA ARG A 116 13.391 -0.979 -23.289 1.00 0.00 H new ATOM 0 HB2 ARG A 116 13.282 1.248 -23.886 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.448 0.597 -25.021 1.00 0.00 H new ATOM 0 HG2 ARG A 116 12.673 0.519 -26.780 1.00 0.00 H new ATOM 0 HG3 ARG A 116 11.529 1.204 -25.644 1.00 0.00 H new ATOM 0 HD2 ARG A 116 12.948 3.239 -25.414 1.00 0.00 H new ATOM 0 HD3 ARG A 116 14.133 2.551 -26.508 1.00 0.00 H new ATOM 0 HE ARG A 116 11.487 2.578 -27.713 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.235 4.685 -27.068 1.00 0.00 H new ATOM 0 HH12 ARG A 116 13.810 5.767 -28.398 1.00 0.00 H new ATOM 0 HH21 ARG A 116 11.056 3.981 -29.398 1.00 0.00 H new ATOM 0 HH22 ARG A 116 12.095 5.387 -29.657 1.00 0.00 H new ATOM 1753 N GLY A 117 10.871 -1.441 -25.302 1.00 0.00 N ATOM 1754 CA GLY A 117 9.453 -1.820 -25.340 1.00 0.00 C ATOM 1755 C GLY A 117 9.178 -3.169 -24.671 1.00 0.00 C ATOM 1756 O GLY A 117 8.150 -3.326 -24.016 1.00 0.00 O ATOM 0 H GLY A 117 11.322 -1.475 -26.216 1.00 0.00 H new ATOM 0 HA2 GLY A 117 8.863 -1.048 -24.846 1.00 0.00 H new ATOM 0 HA3 GLY A 117 9.121 -1.860 -26.377 1.00 0.00 H new ATOM 1760 N GLN A 118 10.126 -4.117 -24.729 1.00 0.00 N ATOM 1761 CA GLN A 118 9.977 -5.425 -24.072 1.00 0.00 C ATOM 1762 C GLN A 118 10.088 -5.290 -22.552 1.00 0.00 C ATOM 1763 O GLN A 118 9.307 -5.897 -21.821 1.00 0.00 O ATOM 1764 CB GLN A 118 10.988 -6.465 -24.613 1.00 0.00 C ATOM 1765 CG GLN A 118 11.097 -6.611 -26.142 1.00 0.00 C ATOM 1766 CD GLN A 118 9.767 -6.534 -26.890 1.00 0.00 C ATOM 1767 OE1 GLN A 118 8.928 -7.418 -26.808 1.00 0.00 O ATOM 1768 NE2 GLN A 118 9.522 -5.473 -27.636 1.00 0.00 N ATOM 0 H GLN A 118 11.009 -4.001 -25.227 1.00 0.00 H new ATOM 0 HA GLN A 118 8.979 -5.794 -24.310 1.00 0.00 H new ATOM 0 HB2 GLN A 118 11.975 -6.209 -24.227 1.00 0.00 H new ATOM 0 HB3 GLN A 118 10.726 -7.438 -24.199 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.757 -5.830 -26.521 1.00 0.00 H new ATOM 0 HG3 GLN A 118 11.570 -7.566 -26.369 1.00 0.00 H new ATOM 0 HE21 GLN A 118 10.217 -4.730 -27.710 1.00 0.00 H new ATOM 0 HE22 GLN A 118 8.638 -5.396 -28.138 1.00 0.00 H new ATOM 1777 N VAL A 119 11.004 -4.447 -22.072 1.00 0.00 N ATOM 1778 CA VAL A 119 11.089 -4.054 -20.651 1.00 0.00 C ATOM 1779 C VAL A 119 9.837 -3.278 -20.232 1.00 0.00 C ATOM 1780 O VAL A 119 9.196 -3.668 -19.263 1.00 0.00 O ATOM 1781 CB VAL A 119 12.370 -3.237 -20.397 1.00 0.00 C ATOM 1782 CG1 VAL A 119 12.464 -2.701 -18.965 1.00 0.00 C ATOM 1783 CG2 VAL A 119 13.625 -4.080 -20.639 1.00 0.00 C ATOM 0 H VAL A 119 11.716 -4.011 -22.657 1.00 0.00 H new ATOM 0 HA VAL A 119 11.140 -4.955 -20.039 1.00 0.00 H new ATOM 0 HB VAL A 119 12.314 -2.402 -21.096 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.388 -2.134 -18.849 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.612 -2.052 -18.763 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.459 -3.535 -18.263 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.512 -3.475 -20.451 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.622 -4.938 -19.967 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.636 -4.429 -21.672 1.00 0.00 H new ATOM 1793 N LYS A 120 9.441 -2.238 -20.982 1.00 0.00 N ATOM 1794 CA LYS A 120 8.247 -1.410 -20.724 1.00 0.00 C ATOM 1795 C LYS A 120 6.981 -2.243 -20.600 1.00 0.00 C ATOM 1796 O LYS A 120 6.288 -2.072 -19.614 1.00 0.00 O ATOM 1797 CB LYS A 120 8.141 -0.330 -21.819 1.00 0.00 C ATOM 1798 CG LYS A 120 6.982 0.663 -21.619 1.00 0.00 C ATOM 1799 CD LYS A 120 5.704 0.316 -22.404 1.00 0.00 C ATOM 1800 CE LYS A 120 4.704 1.477 -22.276 1.00 0.00 C ATOM 1801 NZ LYS A 120 3.414 1.181 -22.961 1.00 0.00 N ATOM 0 H LYS A 120 9.956 -1.939 -21.810 1.00 0.00 H new ATOM 0 HA LYS A 120 8.358 -0.919 -19.757 1.00 0.00 H new ATOM 0 HB2 LYS A 120 9.078 0.226 -21.857 1.00 0.00 H new ATOM 0 HB3 LYS A 120 8.022 -0.820 -22.786 1.00 0.00 H new ATOM 0 HG2 LYS A 120 6.740 0.711 -20.557 1.00 0.00 H new ATOM 0 HG3 LYS A 120 7.317 1.657 -21.915 1.00 0.00 H new ATOM 0 HD2 LYS A 120 5.943 0.140 -23.453 1.00 0.00 H new ATOM 0 HD3 LYS A 120 5.264 -0.604 -22.018 1.00 0.00 H new ATOM 0 HE2 LYS A 120 4.516 1.679 -21.221 1.00 0.00 H new ATOM 0 HE3 LYS A 120 5.141 2.381 -22.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 2.849 2.052 -23.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 3.604 0.817 -23.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 2.888 0.468 -22.417 1.00 0.00 H new ATOM 1815 N GLU A 121 6.687 -3.181 -21.498 1.00 0.00 N ATOM 1816 CA GLU A 121 5.445 -3.976 -21.381 1.00 0.00 C ATOM 1817 C GLU A 121 5.464 -4.928 -20.171 1.00 0.00 C ATOM 1818 O GLU A 121 4.418 -5.225 -19.594 1.00 0.00 O ATOM 1819 CB GLU A 121 5.129 -4.704 -22.697 1.00 0.00 C ATOM 1820 CG GLU A 121 6.066 -5.878 -23.013 1.00 0.00 C ATOM 1821 CD GLU A 121 5.751 -6.602 -24.343 1.00 0.00 C ATOM 1822 OE1 GLU A 121 4.958 -6.105 -25.179 1.00 0.00 O ATOM 1823 OE2 GLU A 121 6.316 -7.704 -24.555 1.00 0.00 O ATOM 0 H GLU A 121 7.271 -3.414 -22.301 1.00 0.00 H new ATOM 0 HA GLU A 121 4.630 -3.277 -21.192 1.00 0.00 H new ATOM 0 HB2 GLU A 121 4.104 -5.073 -22.657 1.00 0.00 H new ATOM 0 HB3 GLU A 121 5.177 -3.986 -23.516 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.092 -5.510 -23.047 1.00 0.00 H new ATOM 0 HG3 GLU A 121 6.013 -6.600 -22.198 1.00 0.00 H new ATOM 1830 N ARG A 122 6.657 -5.351 -19.727 1.00 0.00 N ATOM 1831 CA ARG A 122 6.839 -6.179 -18.522 1.00 0.00 C ATOM 1832 C ARG A 122 6.678 -5.361 -17.242 1.00 0.00 C ATOM 1833 O ARG A 122 5.875 -5.736 -16.390 1.00 0.00 O ATOM 1834 CB ARG A 122 8.163 -6.962 -18.621 1.00 0.00 C ATOM 1835 CG ARG A 122 8.010 -8.109 -19.636 1.00 0.00 C ATOM 1836 CD ARG A 122 9.347 -8.663 -20.149 1.00 0.00 C ATOM 1837 NE ARG A 122 9.117 -9.716 -21.168 1.00 0.00 N ATOM 1838 CZ ARG A 122 8.610 -9.559 -22.382 1.00 0.00 C ATOM 1839 NH1 ARG A 122 8.367 -8.383 -22.875 1.00 0.00 N ATOM 1840 NH2 ARG A 122 8.313 -10.581 -23.128 1.00 0.00 N ATOM 0 H ARG A 122 7.533 -5.126 -20.199 1.00 0.00 H new ATOM 0 HA ARG A 122 6.044 -6.923 -18.466 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.969 -6.296 -18.929 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.435 -7.361 -17.644 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.445 -8.918 -19.173 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.424 -7.756 -20.484 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.941 -7.856 -20.579 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.921 -9.073 -19.318 1.00 0.00 H new ATOM 0 HE ARG A 122 9.378 -10.666 -20.905 1.00 0.00 H new ATOM 0 HH11 ARG A 122 8.567 -7.548 -22.324 1.00 0.00 H new ATOM 0 HH12 ARG A 122 7.976 -8.294 -23.813 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.469 -11.528 -22.782 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.924 -10.436 -24.060 1.00 0.00 H new ATOM 1854 N VAL A 123 7.321 -4.191 -17.139 1.00 0.00 N ATOM 1855 CA VAL A 123 7.037 -3.252 -16.033 1.00 0.00 C ATOM 1856 C VAL A 123 5.581 -2.774 -16.037 1.00 0.00 C ATOM 1857 O VAL A 123 4.988 -2.679 -14.971 1.00 0.00 O ATOM 1858 CB VAL A 123 8.019 -2.070 -15.964 1.00 0.00 C ATOM 1859 CG1 VAL A 123 9.447 -2.568 -15.721 1.00 0.00 C ATOM 1860 CG2 VAL A 123 8.033 -1.160 -17.169 1.00 0.00 C ATOM 0 H VAL A 123 8.033 -3.870 -17.795 1.00 0.00 H new ATOM 0 HA VAL A 123 7.192 -3.828 -15.120 1.00 0.00 H new ATOM 0 HB VAL A 123 7.650 -1.472 -15.131 1.00 0.00 H new ATOM 0 HG11 VAL A 123 10.126 -1.717 -15.675 1.00 0.00 H new ATOM 0 HG12 VAL A 123 9.486 -3.115 -14.779 1.00 0.00 H new ATOM 0 HG13 VAL A 123 9.746 -3.228 -16.536 1.00 0.00 H new ATOM 0 HG21 VAL A 123 8.760 -0.362 -17.014 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.307 -1.733 -18.055 1.00 0.00 H new ATOM 0 HG23 VAL A 123 7.043 -0.727 -17.309 1.00 0.00 H new ATOM 1870 N GLU A 124 4.955 -2.557 -17.196 1.00 0.00 N ATOM 1871 CA GLU A 124 3.554 -2.177 -17.297 1.00 0.00 C ATOM 1872 C GLU A 124 2.628 -3.253 -16.717 1.00 0.00 C ATOM 1873 O GLU A 124 1.782 -2.929 -15.886 1.00 0.00 O ATOM 1874 CB GLU A 124 3.217 -1.905 -18.770 1.00 0.00 C ATOM 1875 CG GLU A 124 2.017 -0.984 -18.883 1.00 0.00 C ATOM 1876 CD GLU A 124 1.429 -1.002 -20.305 1.00 0.00 C ATOM 1877 OE1 GLU A 124 2.096 -0.509 -21.246 1.00 0.00 O ATOM 1878 OE2 GLU A 124 0.294 -1.507 -20.490 1.00 0.00 O ATOM 0 H GLU A 124 5.418 -2.643 -18.101 1.00 0.00 H new ATOM 0 HA GLU A 124 3.394 -1.274 -16.709 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.076 -1.455 -19.268 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.010 -2.845 -19.281 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.253 -1.289 -18.168 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.311 0.033 -18.622 1.00 0.00 H new ATOM 1885 N ASN A 125 2.832 -4.532 -17.072 1.00 0.00 N ATOM 1886 CA ASN A 125 2.036 -5.625 -16.502 1.00 0.00 C ATOM 1887 C ASN A 125 2.269 -5.748 -14.987 1.00 0.00 C ATOM 1888 O ASN A 125 1.311 -5.911 -14.234 1.00 0.00 O ATOM 1889 CB ASN A 125 2.211 -6.936 -17.312 1.00 0.00 C ATOM 1890 CG ASN A 125 3.177 -7.981 -16.751 1.00 0.00 C ATOM 1891 OD1 ASN A 125 3.093 -8.412 -15.609 1.00 0.00 O ATOM 1892 ND2 ASN A 125 4.081 -8.491 -17.554 1.00 0.00 N ATOM 0 H ASN A 125 3.537 -4.831 -17.746 1.00 0.00 H new ATOM 0 HA ASN A 125 0.977 -5.388 -16.600 1.00 0.00 H new ATOM 0 HB2 ASN A 125 1.231 -7.403 -17.415 1.00 0.00 H new ATOM 0 HB3 ASN A 125 2.545 -6.671 -18.315 1.00 0.00 H new ATOM 0 HD21 ASN A 125 4.697 -9.233 -17.222 1.00 0.00 H new ATOM 0 HD22 ASN A 125 4.167 -8.146 -18.510 1.00 0.00 H new ATOM 1899 N LEU A 126 3.521 -5.588 -14.538 1.00 0.00 N ATOM 1900 CA LEU A 126 3.885 -5.598 -13.121 1.00 0.00 C ATOM 1901 C LEU A 126 3.146 -4.512 -12.350 1.00 0.00 C ATOM 1902 O LEU A 126 2.568 -4.790 -11.307 1.00 0.00 O ATOM 1903 CB LEU A 126 5.417 -5.481 -12.997 1.00 0.00 C ATOM 1904 CG LEU A 126 6.047 -5.508 -11.590 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.993 -4.167 -10.856 1.00 0.00 C ATOM 1906 CD2 LEU A 126 5.463 -6.590 -10.683 1.00 0.00 C ATOM 0 H LEU A 126 4.317 -5.446 -15.159 1.00 0.00 H new ATOM 0 HA LEU A 126 3.577 -6.541 -12.669 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.859 -6.294 -13.573 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.718 -4.550 -13.477 1.00 0.00 H new ATOM 0 HG LEU A 126 7.092 -5.743 -11.793 1.00 0.00 H new ATOM 0 HD11 LEU A 126 6.456 -4.270 -9.875 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.530 -3.414 -11.433 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.954 -3.859 -10.736 1.00 0.00 H new ATOM 0 HD21 LEU A 126 5.952 -6.552 -9.710 1.00 0.00 H new ATOM 0 HD22 LEU A 126 4.393 -6.422 -10.559 1.00 0.00 H new ATOM 0 HD23 LEU A 126 5.627 -7.569 -11.133 1.00 0.00 H new ATOM 1918 N ILE A 127 3.138 -3.282 -12.857 1.00 0.00 N ATOM 1919 CA ILE A 127 2.528 -2.156 -12.148 1.00 0.00 C ATOM 1920 C ILE A 127 0.999 -2.265 -12.195 1.00 0.00 C ATOM 1921 O ILE A 127 0.354 -2.197 -11.152 1.00 0.00 O ATOM 1922 CB ILE A 127 3.056 -0.830 -12.730 1.00 0.00 C ATOM 1923 CG1 ILE A 127 4.578 -0.688 -12.465 1.00 0.00 C ATOM 1924 CG2 ILE A 127 2.322 0.392 -12.143 1.00 0.00 C ATOM 1925 CD1 ILE A 127 5.283 0.241 -13.459 1.00 0.00 C ATOM 0 H ILE A 127 3.548 -3.037 -13.758 1.00 0.00 H new ATOM 0 HA ILE A 127 2.808 -2.180 -11.095 1.00 0.00 H new ATOM 0 HB ILE A 127 2.868 -0.858 -13.803 1.00 0.00 H new ATOM 0 HG12 ILE A 127 4.730 -0.309 -11.454 1.00 0.00 H new ATOM 0 HG13 ILE A 127 5.041 -1.674 -12.509 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.726 1.304 -12.581 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.258 0.321 -12.370 1.00 0.00 H new ATOM 0 HG23 ILE A 127 2.462 0.416 -11.062 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.344 0.295 -13.216 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.161 -0.148 -14.470 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.846 1.238 -13.399 1.00 0.00 H new ATOM 1937 N ALA A 128 0.417 -2.515 -13.371 1.00 0.00 N ATOM 1938 CA ALA A 128 -1.034 -2.522 -13.570 1.00 0.00 C ATOM 1939 C ALA A 128 -1.774 -3.613 -12.768 1.00 0.00 C ATOM 1940 O ALA A 128 -2.949 -3.435 -12.438 1.00 0.00 O ATOM 1941 CB ALA A 128 -1.310 -2.654 -15.074 1.00 0.00 C ATOM 0 H ALA A 128 0.945 -2.720 -14.219 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.429 -1.582 -13.183 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.386 -2.661 -15.247 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.863 -1.811 -15.601 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.877 -3.583 -15.443 1.00 0.00 H new ATOM 1947 N LYS A 129 -1.090 -4.715 -12.421 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.640 -5.788 -11.573 1.00 0.00 C ATOM 1949 C LYS A 129 -1.448 -5.567 -10.061 1.00 0.00 C ATOM 1950 O LYS A 129 -2.013 -6.337 -9.283 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.157 -7.165 -12.068 1.00 0.00 C ATOM 1952 CG LYS A 129 0.275 -7.533 -11.657 1.00 0.00 C ATOM 1953 CD LYS A 129 0.794 -8.693 -12.517 1.00 0.00 C ATOM 1954 CE LYS A 129 2.245 -9.018 -12.155 1.00 0.00 C ATOM 1955 NZ LYS A 129 2.873 -9.890 -13.182 1.00 0.00 N ATOM 0 H LYS A 129 -0.131 -4.889 -12.723 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.724 -5.758 -11.687 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -1.836 -7.929 -11.690 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.225 -7.188 -13.156 1.00 0.00 H new ATOM 0 HG2 LYS A 129 0.927 -6.667 -11.770 1.00 0.00 H new ATOM 0 HG3 LYS A 129 0.298 -7.813 -10.604 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.169 -9.573 -12.367 1.00 0.00 H new ATOM 0 HD3 LYS A 129 0.726 -8.430 -13.573 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.815 -8.094 -12.061 1.00 0.00 H new ATOM 0 HE3 LYS A 129 2.278 -9.513 -11.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 3.791 -10.232 -12.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 2.252 -10.702 -13.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 3.016 -9.348 -14.058 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.690 -4.541 -9.637 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.403 -4.280 -8.204 1.00 0.00 C ATOM 1971 C ILE A 130 -0.789 -2.872 -7.705 1.00 0.00 C ATOM 1972 O ILE A 130 -0.901 -2.684 -6.489 1.00 0.00 O ATOM 1973 CB ILE A 130 1.060 -4.641 -7.832 1.00 0.00 C ATOM 1974 CG1 ILE A 130 2.083 -3.551 -8.232 1.00 0.00 C ATOM 1975 CG2 ILE A 130 1.433 -6.034 -8.366 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.541 -3.881 -7.888 1.00 0.00 C ATOM 0 H ILE A 130 -0.258 -3.868 -10.270 1.00 0.00 H new ATOM 0 HA ILE A 130 -1.070 -4.954 -7.666 1.00 0.00 H new ATOM 0 HB ILE A 130 1.110 -4.681 -6.744 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.008 -3.378 -9.306 1.00 0.00 H new ATOM 0 HG13 ILE A 130 1.810 -2.618 -7.739 1.00 0.00 H new ATOM 0 HG21 ILE A 130 2.463 -6.265 -8.093 1.00 0.00 H new ATOM 0 HG22 ILE A 130 0.767 -6.780 -7.933 1.00 0.00 H new ATOM 0 HG23 ILE A 130 1.334 -6.046 -9.451 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.184 -3.060 -8.205 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.638 -4.023 -6.812 1.00 0.00 H new ATOM 0 HD13 ILE A 130 3.838 -4.795 -8.402 1.00 0.00 H new ATOM 1988 N SER A 131 -0.984 -1.894 -8.598 1.00 0.00 N ATOM 1989 CA SER A 131 -1.392 -0.511 -8.270 1.00 0.00 C ATOM 1990 C SER A 131 -2.781 -0.417 -7.616 1.00 0.00 C ATOM 1991 O SER A 131 -2.897 0.248 -6.562 1.00 0.00 O ATOM 1992 CB SER A 131 -1.301 0.383 -9.512 1.00 0.00 C ATOM 1993 OG SER A 131 -2.110 -0.122 -10.565 1.00 0.00 O ATOM 1994 OXT SER A 131 -3.758 -0.985 -8.160 1.00 0.00 O ATOM 0 H SER A 131 -0.860 -2.041 -9.600 1.00 0.00 H new ATOM 0 HA SER A 131 -0.689 -0.151 -7.519 1.00 0.00 H new ATOM 0 HB2 SER A 131 -1.617 1.395 -9.259 1.00 0.00 H new ATOM 0 HB3 SER A 131 -0.265 0.446 -9.844 1.00 0.00 H new ATOM 0 HG SER A 131 -2.874 -0.606 -10.187 1.00 0.00 H new TER 2000 SER A 131