USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 990 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 125 ASN : amide:sc= 0.823 K(o=3.1,f=-5.3!) USER MOD Set 1.2: A 129 LYS NZ :NH3+ 154:sc= 2.26 (180deg=1.1) USER MOD Set 2.1: A 11 ASN : amide:sc= -0.012 X(o=-0.93,f=-1.1) USER MOD Set 2.2: A 60 GLN : amide:sc= -0.918 X(o=-0.93,f=-0.9) USER MOD Set 3.1: A 5 MET CE :methyl 178:sc= -1.38 (180deg=-1.44) USER MOD Set 3.2: A 35 SER OG : rot -157:sc= 1.66 USER MOD Set 3.3: A 73 TYR OH : rot 130:sc= 0 USER MOD Single : A 1 MET CE :methyl -149:sc= 0 (180deg=-0.0934) USER MOD Single : A 1 MET N :NH3+ -107:sc= 0.0714 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 142:sc= 0.0126 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -158:sc= 1.23 (180deg=1.17) USER MOD Single : A 9 LYS NZ :NH3+ 169:sc= 0.988 (180deg=0.787) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0682 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 142:sc= 0.872 USER MOD Single : A 16 GLN : amide:sc= 1.42 K(o=1.4,f=-8.3!) USER MOD Single : A 17 MET CE :methyl -165:sc= -0.714 (180deg=-1.3) USER MOD Single : A 23 LYS NZ :NH3+ -160:sc= 2.5 (180deg=2.21) USER MOD Single : A 24 THR OG1 : rot -150:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc=-0.00262 USER MOD Single : A 34 SER OG : rot 174:sc= 0.539 USER MOD Single : A 39 SER OG : rot 180:sc= -0.289 USER MOD Single : A 40 SER OG : rot 180:sc= 0.191 USER MOD Single : A 43 HIS : no HE2:sc= 1.02 K(o=1,f=-9.9!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 148:sc= -1.24 (180deg=-2.68!) USER MOD Single : A 58 SER OG : rot 58:sc= 1.35 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 81:sc= 0.698 USER MOD Single : A 67 ASN : amide:sc= 1.02 K(o=1,f=-1.1) USER MOD Single : A 69 ASN : amide:sc= 0.174 K(o=0.17,f=-7.2!) USER MOD Single : A 78 SER OG : rot -147:sc= 0.635 USER MOD Single : A 82 SER OG : rot 180:sc= 0.0936 USER MOD Single : A 85 ASN : amide:sc= 0.913 K(o=0.91,f=-0.84) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= 0.604 K(o=0.6,f=-0.82) USER MOD Single : A 100 GLN : amide:sc= -0.275 X(o=-0.28,f=-0.28) USER MOD Single : A 107 GLN : amide:sc= 0.727 K(o=0.73,f=-0.019) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 87:sc= 0.628 USER MOD Single : A 118 GLN : amide:sc= 1.79 K(o=1.8,f=-4.9!) USER MOD Single : A 120 LYS NZ :NH3+ 175:sc= 1.24 (180deg=1.16) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.521 -0.497 0.519 1.00 0.00 N ATOM 2 CA MET A 1 1.788 -0.287 -0.939 1.00 0.00 C ATOM 3 C MET A 1 2.476 -1.524 -1.555 1.00 0.00 C ATOM 4 O MET A 1 3.128 -2.286 -0.841 1.00 0.00 O ATOM 5 CB MET A 1 2.525 1.059 -1.201 1.00 0.00 C ATOM 6 CG MET A 1 4.062 1.027 -1.101 1.00 0.00 C ATOM 7 SD MET A 1 4.856 2.646 -0.846 1.00 0.00 S ATOM 8 CE MET A 1 4.616 3.424 -2.468 1.00 0.00 C ATOM 0 H1 MET A 1 0.503 -0.649 0.667 1.00 0.00 H new ATOM 0 H2 MET A 1 2.047 -1.330 0.852 1.00 0.00 H new ATOM 0 H3 MET A 1 1.827 0.342 1.052 1.00 0.00 H new ATOM 0 HA MET A 1 0.836 -0.188 -1.461 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.254 1.409 -2.197 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.151 1.797 -0.491 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.343 0.369 -0.279 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.460 0.585 -2.014 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.445 4.102 -2.673 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.578 2.654 -3.239 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.681 3.984 -2.468 1.00 0.00 H new ATOM 18 N LYS A 2 2.332 -1.762 -2.868 1.00 0.00 N ATOM 19 CA LYS A 2 2.790 -3.016 -3.503 1.00 0.00 C ATOM 20 C LYS A 2 4.313 -2.979 -3.595 1.00 0.00 C ATOM 21 O LYS A 2 4.836 -2.034 -4.182 1.00 0.00 O ATOM 22 CB LYS A 2 2.107 -3.261 -4.871 1.00 0.00 C ATOM 23 CG LYS A 2 0.623 -2.839 -4.913 1.00 0.00 C ATOM 24 CD LYS A 2 0.001 -2.983 -6.312 1.00 0.00 C ATOM 25 CE LYS A 2 -1.211 -2.048 -6.496 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.447 -2.548 -5.831 1.00 0.00 N ATOM 0 H LYS A 2 1.901 -1.102 -3.516 1.00 0.00 H new ATOM 0 HA LYS A 2 2.495 -3.868 -2.890 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.652 -2.715 -5.641 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.181 -4.320 -5.118 1.00 0.00 H new ATOM 0 HG2 LYS A 2 0.058 -3.445 -4.205 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.535 -1.803 -4.587 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.752 -2.758 -7.069 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.309 -4.016 -6.468 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -0.965 -1.063 -6.098 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.405 -1.922 -7.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -2.969 -1.747 -5.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -3.047 -3.030 -6.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.189 -3.216 -5.077 1.00 0.00 H new ATOM 40 N LYS A 3 5.024 -3.954 -3.026 1.00 0.00 N ATOM 41 CA LYS A 3 6.484 -4.010 -3.150 1.00 0.00 C ATOM 42 C LYS A 3 6.822 -4.805 -4.395 1.00 0.00 C ATOM 43 O LYS A 3 6.228 -5.863 -4.615 1.00 0.00 O ATOM 44 CB LYS A 3 7.168 -4.564 -1.898 1.00 0.00 C ATOM 45 CG LYS A 3 6.796 -3.755 -0.657 1.00 0.00 C ATOM 46 CD LYS A 3 7.591 -4.213 0.565 1.00 0.00 C ATOM 47 CE LYS A 3 7.152 -3.343 1.748 1.00 0.00 C ATOM 48 NZ LYS A 3 7.818 -3.763 3.009 1.00 0.00 N ATOM 0 H LYS A 3 4.617 -4.712 -2.478 1.00 0.00 H new ATOM 0 HA LYS A 3 6.873 -2.996 -3.247 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.881 -5.606 -1.755 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.249 -4.548 -2.035 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.985 -2.697 -0.840 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.729 -3.859 -0.459 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.403 -5.266 0.773 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.661 -4.109 0.388 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.388 -2.299 1.541 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.070 -3.408 1.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.257 -3.438 3.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.894 -4.800 3.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.769 -3.345 3.055 1.00 0.00 H new ATOM 62 N VAL A 4 7.762 -4.287 -5.177 1.00 0.00 N ATOM 63 CA VAL A 4 8.095 -4.738 -6.518 1.00 0.00 C ATOM 64 C VAL A 4 9.575 -5.135 -6.576 1.00 0.00 C ATOM 65 O VAL A 4 10.421 -4.532 -5.913 1.00 0.00 O ATOM 66 CB VAL A 4 7.795 -3.615 -7.541 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.519 -4.165 -8.947 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.630 -2.680 -7.189 1.00 0.00 C ATOM 0 H VAL A 4 8.340 -3.502 -4.876 1.00 0.00 H new ATOM 0 HA VAL A 4 7.488 -5.608 -6.769 1.00 0.00 H new ATOM 0 HB VAL A 4 8.714 -3.030 -7.509 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.314 -3.338 -9.627 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.390 -4.717 -9.299 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.656 -4.830 -8.915 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.512 -1.934 -7.975 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.712 -3.261 -7.099 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.838 -2.180 -6.243 1.00 0.00 H new ATOM 78 N MET A 5 9.890 -6.090 -7.444 1.00 0.00 N ATOM 79 CA MET A 5 11.243 -6.464 -7.839 1.00 0.00 C ATOM 80 C MET A 5 11.239 -6.768 -9.332 1.00 0.00 C ATOM 81 O MET A 5 10.262 -7.317 -9.838 1.00 0.00 O ATOM 82 CB MET A 5 11.731 -7.722 -7.116 1.00 0.00 C ATOM 83 CG MET A 5 11.978 -7.539 -5.624 1.00 0.00 C ATOM 84 SD MET A 5 13.170 -8.737 -4.973 1.00 0.00 S ATOM 85 CE MET A 5 13.225 -8.191 -3.249 1.00 0.00 C ATOM 0 H MET A 5 9.177 -6.650 -7.912 1.00 0.00 H new ATOM 0 HA MET A 5 11.905 -5.637 -7.583 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.995 -8.514 -7.255 1.00 0.00 H new ATOM 0 HB3 MET A 5 12.655 -8.060 -7.585 1.00 0.00 H new ATOM 0 HG2 MET A 5 12.344 -6.529 -5.440 1.00 0.00 H new ATOM 0 HG3 MET A 5 11.035 -7.639 -5.087 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.889 -8.843 -2.682 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.596 -7.167 -3.203 1.00 0.00 H new ATOM 0 HE3 MET A 5 12.223 -8.233 -2.822 1.00 0.00 H new ATOM 95 N PHE A 6 12.351 -6.499 -10.009 1.00 0.00 N ATOM 96 CA PHE A 6 12.611 -6.906 -11.379 1.00 0.00 C ATOM 97 C PHE A 6 14.007 -7.499 -11.325 1.00 0.00 C ATOM 98 O PHE A 6 14.953 -6.774 -11.028 1.00 0.00 O ATOM 99 CB PHE A 6 12.556 -5.708 -12.340 1.00 0.00 C ATOM 100 CG PHE A 6 11.235 -4.978 -12.394 1.00 0.00 C ATOM 101 CD1 PHE A 6 10.916 -4.055 -11.385 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.335 -5.197 -13.454 1.00 0.00 C ATOM 103 CE1 PHE A 6 9.694 -3.372 -11.417 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.118 -4.491 -13.500 1.00 0.00 C ATOM 105 CZ PHE A 6 8.793 -3.586 -12.475 1.00 0.00 C ATOM 0 H PHE A 6 13.122 -5.972 -9.600 1.00 0.00 H new ATOM 0 HA PHE A 6 11.868 -7.611 -11.751 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.332 -4.998 -12.053 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.799 -6.058 -13.343 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.615 -3.871 -10.582 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.578 -5.906 -14.231 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.443 -2.679 -10.627 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.435 -4.645 -14.322 1.00 0.00 H new ATOM 0 HZ PHE A 6 7.853 -3.056 -12.500 1.00 0.00 H new ATOM 115 N VAL A 7 14.143 -8.801 -11.543 1.00 0.00 N ATOM 116 CA VAL A 7 15.387 -9.512 -11.294 1.00 0.00 C ATOM 117 C VAL A 7 15.562 -10.520 -12.428 1.00 0.00 C ATOM 118 O VAL A 7 14.645 -11.272 -12.735 1.00 0.00 O ATOM 119 CB VAL A 7 15.266 -10.137 -9.878 1.00 0.00 C ATOM 120 CG1 VAL A 7 16.271 -11.256 -9.587 1.00 0.00 C ATOM 121 CG2 VAL A 7 15.422 -9.082 -8.770 1.00 0.00 C ATOM 0 H VAL A 7 13.392 -9.393 -11.898 1.00 0.00 H new ATOM 0 HA VAL A 7 16.280 -8.887 -11.292 1.00 0.00 H new ATOM 0 HB VAL A 7 14.264 -10.566 -9.876 1.00 0.00 H new ATOM 0 HG11 VAL A 7 16.113 -11.633 -8.577 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.131 -12.066 -10.303 1.00 0.00 H new ATOM 0 HG13 VAL A 7 17.285 -10.866 -9.674 1.00 0.00 H new ATOM 0 HG21 VAL A 7 15.331 -9.562 -7.795 1.00 0.00 H new ATOM 0 HG22 VAL A 7 16.401 -8.610 -8.852 1.00 0.00 H new ATOM 0 HG23 VAL A 7 14.645 -8.325 -8.876 1.00 0.00 H new ATOM 131 N CYS A 8 16.713 -10.502 -13.099 1.00 0.00 N ATOM 132 CA CYS A 8 17.133 -11.531 -14.052 1.00 0.00 C ATOM 133 C CYS A 8 17.945 -12.556 -13.227 1.00 0.00 C ATOM 134 O CYS A 8 17.724 -12.683 -12.024 1.00 0.00 O ATOM 135 CB CYS A 8 17.885 -10.797 -15.189 1.00 0.00 C ATOM 136 SG CYS A 8 18.649 -11.763 -16.535 1.00 0.00 S ATOM 0 H CYS A 8 17.397 -9.753 -12.993 1.00 0.00 H new ATOM 0 HA CYS A 8 16.340 -12.094 -14.545 1.00 0.00 H new ATOM 0 HB2 CYS A 8 17.184 -10.099 -15.646 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.673 -10.201 -14.728 1.00 0.00 H new ATOM 141 N LYS A 9 18.911 -13.285 -13.810 1.00 0.00 N ATOM 142 CA LYS A 9 19.842 -14.088 -12.999 1.00 0.00 C ATOM 143 C LYS A 9 20.590 -13.165 -12.028 1.00 0.00 C ATOM 144 O LYS A 9 20.877 -13.561 -10.899 1.00 0.00 O ATOM 145 CB LYS A 9 20.796 -14.874 -13.922 1.00 0.00 C ATOM 146 CG LYS A 9 21.845 -15.707 -13.153 1.00 0.00 C ATOM 147 CD LYS A 9 22.695 -16.550 -14.117 1.00 0.00 C ATOM 148 CE LYS A 9 23.968 -17.130 -13.471 1.00 0.00 C ATOM 149 NZ LYS A 9 23.704 -18.081 -12.359 1.00 0.00 N ATOM 0 H LYS A 9 19.067 -13.336 -14.817 1.00 0.00 H new ATOM 0 HA LYS A 9 19.297 -14.821 -12.405 1.00 0.00 H new ATOM 0 HB2 LYS A 9 20.210 -15.538 -14.557 1.00 0.00 H new ATOM 0 HB3 LYS A 9 21.310 -14.175 -14.581 1.00 0.00 H new ATOM 0 HG2 LYS A 9 22.491 -15.043 -12.578 1.00 0.00 H new ATOM 0 HG3 LYS A 9 21.343 -16.360 -12.439 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.088 -17.369 -14.502 1.00 0.00 H new ATOM 0 HD3 LYS A 9 22.979 -15.935 -14.971 1.00 0.00 H new ATOM 0 HE2 LYS A 9 24.553 -17.638 -14.238 1.00 0.00 H new ATOM 0 HE3 LYS A 9 24.579 -16.309 -13.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 24.587 -18.567 -12.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 23.342 -17.560 -11.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 22.999 -18.783 -12.662 1.00 0.00 H new ATOM 163 N ARG A 10 20.895 -11.935 -12.463 1.00 0.00 N ATOM 164 CA ARG A 10 21.560 -10.895 -11.674 1.00 0.00 C ATOM 165 C ARG A 10 20.817 -9.572 -11.867 1.00 0.00 C ATOM 166 O ARG A 10 19.903 -9.489 -12.686 1.00 0.00 O ATOM 167 CB ARG A 10 23.047 -10.802 -12.102 1.00 0.00 C ATOM 168 CG ARG A 10 23.756 -12.158 -11.985 1.00 0.00 C ATOM 169 CD ARG A 10 25.284 -12.074 -11.990 1.00 0.00 C ATOM 170 NE ARG A 10 25.849 -13.394 -11.656 1.00 0.00 N ATOM 171 CZ ARG A 10 27.137 -13.750 -11.611 1.00 0.00 C ATOM 172 NH1 ARG A 10 28.106 -12.909 -11.966 1.00 0.00 N ATOM 173 NH2 ARG A 10 27.416 -14.982 -11.200 1.00 0.00 N ATOM 0 H ARG A 10 20.676 -11.628 -13.411 1.00 0.00 H new ATOM 0 HA ARG A 10 21.538 -11.138 -10.612 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.108 -10.447 -13.131 1.00 0.00 H new ATOM 0 HB3 ARG A 10 23.560 -10.068 -11.480 1.00 0.00 H new ATOM 0 HG2 ARG A 10 23.434 -12.645 -11.064 1.00 0.00 H new ATOM 0 HG3 ARG A 10 23.436 -12.794 -12.810 1.00 0.00 H new ATOM 0 HD2 ARG A 10 25.638 -11.752 -12.969 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.620 -11.329 -11.269 1.00 0.00 H new ATOM 0 HE ARG A 10 25.175 -14.126 -11.432 1.00 0.00 H new ATOM 0 HH11 ARG A 10 27.874 -11.967 -12.282 1.00 0.00 H new ATOM 0 HH12 ARG A 10 29.081 -13.206 -11.922 1.00 0.00 H new ATOM 0 HH21 ARG A 10 26.661 -15.614 -10.934 1.00 0.00 H new ATOM 0 HH22 ARG A 10 28.385 -15.296 -11.150 1.00 0.00 H new ATOM 187 N ASN A 11 21.248 -8.518 -11.169 1.00 0.00 N ATOM 188 CA ASN A 11 20.782 -7.139 -11.410 1.00 0.00 C ATOM 189 C ASN A 11 21.324 -6.590 -12.745 1.00 0.00 C ATOM 190 O ASN A 11 20.837 -5.592 -13.274 1.00 0.00 O ATOM 191 CB ASN A 11 21.181 -6.225 -10.237 1.00 0.00 C ATOM 192 CG ASN A 11 20.652 -4.792 -10.386 1.00 0.00 C ATOM 193 OD1 ASN A 11 19.524 -4.556 -10.809 1.00 0.00 O ATOM 194 ND2 ASN A 11 21.455 -3.800 -10.029 1.00 0.00 N ATOM 0 H ASN A 11 21.933 -8.592 -10.417 1.00 0.00 H new ATOM 0 HA ASN A 11 19.694 -7.157 -11.480 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.804 -6.651 -9.307 1.00 0.00 H new ATOM 0 HB3 ASN A 11 22.268 -6.199 -10.158 1.00 0.00 H new ATOM 0 HD21 ASN A 11 21.137 -2.834 -10.105 1.00 0.00 H new ATOM 0 HD22 ASN A 11 22.391 -4.003 -9.678 1.00 0.00 H new ATOM 201 N SER A 12 22.333 -7.257 -13.298 1.00 0.00 N ATOM 202 CA SER A 12 22.936 -7.000 -14.593 1.00 0.00 C ATOM 203 C SER A 12 21.914 -7.060 -15.738 1.00 0.00 C ATOM 204 O SER A 12 20.781 -7.526 -15.581 1.00 0.00 O ATOM 205 CB SER A 12 24.038 -8.056 -14.800 1.00 0.00 C ATOM 206 OG SER A 12 24.745 -8.297 -13.586 1.00 0.00 O ATOM 0 H SER A 12 22.776 -8.041 -12.819 1.00 0.00 H new ATOM 0 HA SER A 12 23.345 -5.990 -14.607 1.00 0.00 H new ATOM 0 HB2 SER A 12 23.594 -8.985 -15.158 1.00 0.00 H new ATOM 0 HB3 SER A 12 24.732 -7.717 -15.569 1.00 0.00 H new ATOM 0 HG SER A 12 25.439 -8.972 -13.740 1.00 0.00 H new ATOM 212 N SER A 13 22.350 -6.627 -16.917 1.00 0.00 N ATOM 213 CA SER A 13 21.661 -6.776 -18.191 1.00 0.00 C ATOM 214 C SER A 13 20.301 -6.060 -18.251 1.00 0.00 C ATOM 215 O SER A 13 20.261 -4.879 -18.595 1.00 0.00 O ATOM 216 CB SER A 13 21.679 -8.253 -18.632 1.00 0.00 C ATOM 217 OG SER A 13 22.975 -8.818 -18.463 1.00 0.00 O ATOM 0 H SER A 13 23.240 -6.138 -17.013 1.00 0.00 H new ATOM 0 HA SER A 13 22.216 -6.233 -18.956 1.00 0.00 H new ATOM 0 HB2 SER A 13 20.952 -8.819 -18.050 1.00 0.00 H new ATOM 0 HB3 SER A 13 21.378 -8.328 -19.677 1.00 0.00 H new ATOM 0 HG SER A 13 22.963 -9.756 -18.747 1.00 0.00 H new ATOM 223 N ARG A 14 19.182 -6.725 -17.930 1.00 0.00 N ATOM 224 CA ARG A 14 17.835 -6.141 -18.083 1.00 0.00 C ATOM 225 C ARG A 14 17.350 -5.454 -16.804 1.00 0.00 C ATOM 226 O ARG A 14 16.709 -4.407 -16.879 1.00 0.00 O ATOM 227 CB ARG A 14 16.845 -7.216 -18.597 1.00 0.00 C ATOM 228 CG ARG A 14 17.166 -7.670 -20.039 1.00 0.00 C ATOM 229 CD ARG A 14 17.637 -9.126 -20.190 1.00 0.00 C ATOM 230 NE ARG A 14 16.516 -10.101 -20.167 1.00 0.00 N ATOM 231 CZ ARG A 14 16.407 -11.200 -20.937 1.00 0.00 C ATOM 232 NH1 ARG A 14 17.382 -11.553 -21.772 1.00 0.00 N ATOM 233 NH2 ARG A 14 15.322 -11.965 -20.857 1.00 0.00 N ATOM 0 H ARG A 14 19.181 -7.675 -17.560 1.00 0.00 H new ATOM 0 HA ARG A 14 17.888 -5.351 -18.832 1.00 0.00 H new ATOM 0 HB2 ARG A 14 16.873 -8.079 -17.932 1.00 0.00 H new ATOM 0 HB3 ARG A 14 15.831 -6.819 -18.561 1.00 0.00 H new ATOM 0 HG2 ARG A 14 16.275 -7.530 -20.651 1.00 0.00 H new ATOM 0 HG3 ARG A 14 17.937 -7.014 -20.444 1.00 0.00 H new ATOM 0 HD2 ARG A 14 18.184 -9.230 -21.127 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.334 -9.362 -19.386 1.00 0.00 H new ATOM 0 HE ARG A 14 15.759 -9.921 -19.507 1.00 0.00 H new ATOM 0 HH11 ARG A 14 18.229 -10.988 -21.836 1.00 0.00 H new ATOM 0 HH12 ARG A 14 17.282 -12.389 -22.348 1.00 0.00 H new ATOM 0 HH21 ARG A 14 14.571 -11.719 -20.212 1.00 0.00 H new ATOM 0 HH22 ARG A 14 15.241 -12.797 -21.441 1.00 0.00 H new ATOM 247 N SER A 15 17.666 -5.995 -15.627 1.00 0.00 N ATOM 248 CA SER A 15 17.076 -5.552 -14.355 1.00 0.00 C ATOM 249 C SER A 15 17.354 -4.075 -14.068 1.00 0.00 C ATOM 250 O SER A 15 16.448 -3.359 -13.637 1.00 0.00 O ATOM 251 CB SER A 15 17.572 -6.466 -13.234 1.00 0.00 C ATOM 252 OG SER A 15 17.714 -7.803 -13.708 1.00 0.00 O ATOM 0 H SER A 15 18.339 -6.754 -15.524 1.00 0.00 H new ATOM 0 HA SER A 15 15.991 -5.631 -14.422 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.528 -6.104 -12.857 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.871 -6.442 -12.400 1.00 0.00 H new ATOM 0 HG SER A 15 18.513 -8.208 -13.310 1.00 0.00 H new ATOM 258 N GLN A 16 18.558 -3.605 -14.425 1.00 0.00 N ATOM 259 CA GLN A 16 18.981 -2.212 -14.311 1.00 0.00 C ATOM 260 C GLN A 16 17.924 -1.262 -14.878 1.00 0.00 C ATOM 261 O GLN A 16 17.581 -0.286 -14.221 1.00 0.00 O ATOM 262 CB GLN A 16 20.366 -2.021 -14.960 1.00 0.00 C ATOM 263 CG GLN A 16 20.519 -2.470 -16.431 1.00 0.00 C ATOM 264 CD GLN A 16 21.949 -2.326 -16.959 1.00 0.00 C ATOM 265 OE1 GLN A 16 22.791 -1.714 -16.314 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.253 -2.880 -18.125 1.00 0.00 N ATOM 0 H GLN A 16 19.284 -4.208 -14.813 1.00 0.00 H new ATOM 0 HA GLN A 16 19.080 -1.958 -13.256 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.626 -0.964 -14.900 1.00 0.00 H new ATOM 0 HB3 GLN A 16 21.098 -2.564 -14.362 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.208 -3.511 -16.521 1.00 0.00 H new ATOM 0 HG3 GLN A 16 19.847 -1.882 -17.056 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.540 -3.387 -18.650 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.200 -2.800 -18.497 1.00 0.00 H new ATOM 275 N MET A 17 17.369 -1.542 -16.062 1.00 0.00 N ATOM 276 CA MET A 17 16.427 -0.630 -16.696 1.00 0.00 C ATOM 277 C MET A 17 15.012 -0.850 -16.173 1.00 0.00 C ATOM 278 O MET A 17 14.279 0.109 -15.961 1.00 0.00 O ATOM 279 CB MET A 17 16.528 -0.738 -18.226 1.00 0.00 C ATOM 280 CG MET A 17 16.489 0.654 -18.862 1.00 0.00 C ATOM 281 SD MET A 17 15.072 1.697 -18.498 1.00 0.00 S ATOM 282 CE MET A 17 15.765 2.934 -17.352 1.00 0.00 C ATOM 0 H MET A 17 17.559 -2.391 -16.594 1.00 0.00 H new ATOM 0 HA MET A 17 16.690 0.394 -16.432 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.453 -1.245 -18.501 1.00 0.00 H new ATOM 0 HB3 MET A 17 15.707 -1.343 -18.609 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.387 1.189 -18.554 1.00 0.00 H new ATOM 0 HG3 MET A 17 16.546 0.531 -19.943 1.00 0.00 H new ATOM 0 HE1 MET A 17 14.953 3.462 -16.853 1.00 0.00 H new ATOM 0 HE2 MET A 17 16.384 2.434 -16.608 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.373 3.647 -17.910 1.00 0.00 H new ATOM 292 N ALA A 18 14.635 -2.107 -15.943 1.00 0.00 N ATOM 293 CA ALA A 18 13.268 -2.450 -15.556 1.00 0.00 C ATOM 294 C ALA A 18 12.889 -1.802 -14.233 1.00 0.00 C ATOM 295 O ALA A 18 11.858 -1.137 -14.141 1.00 0.00 O ATOM 296 CB ALA A 18 13.127 -3.969 -15.518 1.00 0.00 C ATOM 0 H ALA A 18 15.261 -2.908 -16.019 1.00 0.00 H new ATOM 0 HA ALA A 18 12.571 -2.057 -16.296 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.109 -4.233 -15.230 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.343 -4.379 -16.505 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.828 -4.381 -14.792 1.00 0.00 H new ATOM 302 N GLU A 19 13.750 -1.910 -13.223 1.00 0.00 N ATOM 303 CA GLU A 19 13.477 -1.237 -11.960 1.00 0.00 C ATOM 304 C GLU A 19 13.640 0.276 -12.129 1.00 0.00 C ATOM 305 O GLU A 19 12.934 1.054 -11.480 1.00 0.00 O ATOM 306 CB GLU A 19 14.356 -1.843 -10.863 1.00 0.00 C ATOM 307 CG GLU A 19 15.811 -1.365 -10.849 1.00 0.00 C ATOM 308 CD GLU A 19 16.013 -0.002 -10.152 1.00 0.00 C ATOM 309 OE1 GLU A 19 15.522 0.202 -9.019 1.00 0.00 O ATOM 310 OE2 GLU A 19 16.686 0.886 -10.726 1.00 0.00 O ATOM 0 H GLU A 19 14.619 -2.443 -13.253 1.00 0.00 H new ATOM 0 HA GLU A 19 12.444 -1.392 -11.650 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.908 -1.617 -9.895 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.349 -2.927 -10.972 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.425 -2.113 -10.347 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.170 -1.294 -11.876 1.00 0.00 H new ATOM 317 N GLY A 20 14.523 0.671 -13.057 1.00 0.00 N ATOM 318 CA GLY A 20 14.766 2.035 -13.490 1.00 0.00 C ATOM 319 C GLY A 20 13.456 2.731 -13.811 1.00 0.00 C ATOM 320 O GLY A 20 13.102 3.659 -13.099 1.00 0.00 O ATOM 0 H GLY A 20 15.116 0.001 -13.547 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.294 2.582 -12.709 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.410 2.035 -14.370 1.00 0.00 H new ATOM 324 N PHE A 21 12.691 2.262 -14.799 1.00 0.00 N ATOM 325 CA PHE A 21 11.380 2.854 -15.078 1.00 0.00 C ATOM 326 C PHE A 21 10.366 2.660 -13.973 1.00 0.00 C ATOM 327 O PHE A 21 9.482 3.505 -13.838 1.00 0.00 O ATOM 328 CB PHE A 21 10.762 2.305 -16.360 1.00 0.00 C ATOM 329 CG PHE A 21 11.163 3.121 -17.546 1.00 0.00 C ATOM 330 CD1 PHE A 21 10.783 4.473 -17.636 1.00 0.00 C ATOM 331 CD2 PHE A 21 11.993 2.541 -18.507 1.00 0.00 C ATOM 332 CE1 PHE A 21 11.233 5.235 -18.730 1.00 0.00 C ATOM 333 CE2 PHE A 21 12.485 3.316 -19.563 1.00 0.00 C ATOM 334 CZ PHE A 21 12.084 4.658 -19.692 1.00 0.00 C ATOM 0 H PHE A 21 12.950 1.488 -15.410 1.00 0.00 H new ATOM 0 HA PHE A 21 11.596 3.918 -15.174 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.075 1.271 -16.504 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.676 2.299 -16.270 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.156 4.918 -16.878 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.255 1.496 -18.435 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.925 6.265 -18.832 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.171 2.885 -20.277 1.00 0.00 H new ATOM 0 HZ PHE A 21 12.429 5.246 -20.529 1.00 0.00 H new ATOM 344 N ALA A 22 10.421 1.567 -13.216 1.00 0.00 N ATOM 345 CA ALA A 22 9.325 1.270 -12.307 1.00 0.00 C ATOM 346 C ALA A 22 9.201 2.318 -11.201 1.00 0.00 C ATOM 347 O ALA A 22 8.079 2.643 -10.830 1.00 0.00 O ATOM 348 CB ALA A 22 9.496 -0.139 -11.752 1.00 0.00 C ATOM 0 H ALA A 22 11.187 0.894 -13.213 1.00 0.00 H new ATOM 0 HA ALA A 22 8.387 1.312 -12.860 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.676 -0.364 -11.070 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.493 -0.856 -12.573 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.442 -0.206 -11.215 1.00 0.00 H new ATOM 354 N LYS A 23 10.304 2.917 -10.731 1.00 0.00 N ATOM 355 CA LYS A 23 10.209 4.034 -9.771 1.00 0.00 C ATOM 356 C LYS A 23 9.493 5.248 -10.383 1.00 0.00 C ATOM 357 O LYS A 23 8.776 5.947 -9.675 1.00 0.00 O ATOM 358 CB LYS A 23 11.607 4.402 -9.229 1.00 0.00 C ATOM 359 CG LYS A 23 12.461 5.146 -10.277 1.00 0.00 C ATOM 360 CD LYS A 23 13.988 5.020 -10.158 1.00 0.00 C ATOM 361 CE LYS A 23 14.471 3.558 -10.127 1.00 0.00 C ATOM 362 NZ LYS A 23 15.945 3.444 -9.994 1.00 0.00 N ATOM 0 H LYS A 23 11.255 2.657 -10.991 1.00 0.00 H new ATOM 0 HA LYS A 23 9.600 3.706 -8.928 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.498 5.026 -8.342 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.125 3.495 -8.919 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.169 4.790 -11.265 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.205 6.205 -10.231 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.456 5.534 -10.998 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.319 5.525 -9.251 1.00 0.00 H new ATOM 0 HE2 LYS A 23 13.994 3.040 -9.295 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.153 3.055 -11.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.250 2.502 -10.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.404 4.172 -10.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.215 3.578 -8.999 1.00 0.00 H new ATOM 376 N THR A 24 9.665 5.481 -11.685 1.00 0.00 N ATOM 377 CA THR A 24 9.107 6.602 -12.413 1.00 0.00 C ATOM 378 C THR A 24 7.614 6.378 -12.654 1.00 0.00 C ATOM 379 O THR A 24 6.780 7.197 -12.273 1.00 0.00 O ATOM 380 CB THR A 24 9.969 6.766 -13.675 1.00 0.00 C ATOM 381 OG1 THR A 24 11.206 7.338 -13.304 1.00 0.00 O ATOM 382 CG2 THR A 24 9.313 7.555 -14.798 1.00 0.00 C ATOM 0 H THR A 24 10.221 4.864 -12.277 1.00 0.00 H new ATOM 0 HA THR A 24 9.142 7.542 -11.863 1.00 0.00 H new ATOM 0 HB THR A 24 10.111 5.771 -14.096 1.00 0.00 H new ATOM 0 HG1 THR A 24 11.555 7.872 -14.047 1.00 0.00 H new ATOM 0 HG21 THR A 24 9.996 7.618 -15.645 1.00 0.00 H new ATOM 0 HG22 THR A 24 8.396 7.054 -15.107 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.077 8.559 -14.447 1.00 0.00 H new ATOM 390 N LEU A 25 7.277 5.241 -13.260 1.00 0.00 N ATOM 391 CA LEU A 25 5.917 4.925 -13.691 1.00 0.00 C ATOM 392 C LEU A 25 5.035 4.594 -12.485 1.00 0.00 C ATOM 393 O LEU A 25 3.853 4.931 -12.469 1.00 0.00 O ATOM 394 CB LEU A 25 5.967 3.729 -14.656 1.00 0.00 C ATOM 395 CG LEU A 25 6.737 3.979 -15.965 1.00 0.00 C ATOM 396 CD1 LEU A 25 6.878 2.643 -16.691 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.050 5.012 -16.862 1.00 0.00 C ATOM 0 H LEU A 25 7.950 4.504 -13.468 1.00 0.00 H new ATOM 0 HA LEU A 25 5.487 5.789 -14.197 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.423 2.884 -14.140 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.946 3.438 -14.903 1.00 0.00 H new ATOM 0 HG LEU A 25 7.716 4.393 -15.724 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.421 2.792 -17.624 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.425 1.942 -16.060 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.889 2.240 -16.907 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.635 5.150 -17.771 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.051 4.661 -17.122 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.974 5.961 -16.332 1.00 0.00 H new ATOM 409 N GLY A 26 5.610 3.933 -11.476 1.00 0.00 N ATOM 410 CA GLY A 26 4.919 3.453 -10.287 1.00 0.00 C ATOM 411 C GLY A 26 4.967 4.433 -9.118 1.00 0.00 C ATOM 412 O GLY A 26 4.540 4.063 -8.024 1.00 0.00 O ATOM 0 H GLY A 26 6.606 3.712 -11.470 1.00 0.00 H new ATOM 0 HA2 GLY A 26 3.878 3.250 -10.538 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.362 2.507 -9.976 1.00 0.00 H new ATOM 416 N ALA A 27 5.500 5.645 -9.323 1.00 0.00 N ATOM 417 CA ALA A 27 5.744 6.640 -8.284 1.00 0.00 C ATOM 418 C ALA A 27 4.502 6.828 -7.402 1.00 0.00 C ATOM 419 O ALA A 27 3.415 7.129 -7.900 1.00 0.00 O ATOM 420 CB ALA A 27 6.144 7.972 -8.937 1.00 0.00 C ATOM 0 H ALA A 27 5.781 5.965 -10.250 1.00 0.00 H new ATOM 0 HA ALA A 27 6.556 6.291 -7.646 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.327 8.717 -8.162 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.050 7.831 -9.526 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.339 8.315 -9.587 1.00 0.00 H new ATOM 426 N GLY A 28 4.672 6.642 -6.089 1.00 0.00 N ATOM 427 CA GLY A 28 3.624 6.806 -5.084 1.00 0.00 C ATOM 428 C GLY A 28 2.635 5.634 -4.999 1.00 0.00 C ATOM 429 O GLY A 28 1.923 5.528 -4.000 1.00 0.00 O ATOM 0 H GLY A 28 5.568 6.366 -5.688 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.091 6.942 -4.109 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.069 7.718 -5.302 1.00 0.00 H new ATOM 433 N LYS A 29 2.599 4.730 -5.990 1.00 0.00 N ATOM 434 CA LYS A 29 1.696 3.574 -5.996 1.00 0.00 C ATOM 435 C LYS A 29 2.402 2.345 -5.448 1.00 0.00 C ATOM 436 O LYS A 29 1.817 1.605 -4.660 1.00 0.00 O ATOM 437 CB LYS A 29 1.152 3.290 -7.415 1.00 0.00 C ATOM 438 CG LYS A 29 0.473 4.504 -8.070 1.00 0.00 C ATOM 439 CD LYS A 29 -0.061 4.141 -9.467 1.00 0.00 C ATOM 440 CE LYS A 29 -0.552 5.367 -10.251 1.00 0.00 C ATOM 441 NZ LYS A 29 -1.785 5.985 -9.686 1.00 0.00 N ATOM 0 H LYS A 29 3.199 4.783 -6.813 1.00 0.00 H new ATOM 0 HA LYS A 29 0.849 3.812 -5.353 1.00 0.00 H new ATOM 0 HB2 LYS A 29 1.973 2.958 -8.050 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.437 2.469 -7.363 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -0.347 4.852 -7.441 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.185 5.326 -8.150 1.00 0.00 H new ATOM 0 HD2 LYS A 29 0.726 3.643 -10.034 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.880 3.429 -9.365 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.241 6.114 -10.273 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.743 5.074 -11.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -2.058 6.805 -10.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -2.556 5.287 -9.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.602 6.295 -8.710 1.00 0.00 H new ATOM 455 N ILE A 30 3.642 2.101 -5.883 1.00 0.00 N ATOM 456 CA ILE A 30 4.364 0.855 -5.625 1.00 0.00 C ATOM 457 C ILE A 30 5.839 1.150 -5.321 1.00 0.00 C ATOM 458 O ILE A 30 6.374 2.173 -5.748 1.00 0.00 O ATOM 459 CB ILE A 30 4.141 -0.118 -6.812 1.00 0.00 C ATOM 460 CG1 ILE A 30 4.719 0.412 -8.142 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.644 -0.433 -6.975 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.499 -0.504 -9.353 1.00 0.00 C ATOM 0 H ILE A 30 4.178 2.773 -6.431 1.00 0.00 H new ATOM 0 HA ILE A 30 3.977 0.357 -4.736 1.00 0.00 H new ATOM 0 HB ILE A 30 4.684 -1.032 -6.571 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.272 1.383 -8.354 1.00 0.00 H new ATOM 0 HG13 ILE A 30 5.790 0.574 -8.017 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.505 -1.117 -7.812 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.268 -0.895 -6.062 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.097 0.490 -7.166 1.00 0.00 H new ATOM 0 HD11 ILE A 30 4.939 -0.047 -10.239 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.971 -1.469 -9.170 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.430 -0.647 -9.512 1.00 0.00 H new ATOM 474 N ALA A 31 6.484 0.266 -4.555 1.00 0.00 N ATOM 475 CA ALA A 31 7.839 0.431 -4.038 1.00 0.00 C ATOM 476 C ALA A 31 8.740 -0.606 -4.696 1.00 0.00 C ATOM 477 O ALA A 31 8.655 -1.779 -4.350 1.00 0.00 O ATOM 478 CB ALA A 31 7.815 0.232 -2.516 1.00 0.00 C ATOM 0 H ALA A 31 6.058 -0.616 -4.269 1.00 0.00 H new ATOM 0 HA ALA A 31 8.220 1.428 -4.260 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.822 0.353 -2.117 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.154 0.971 -2.063 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.451 -0.769 -2.286 1.00 0.00 H new ATOM 484 N VAL A 32 9.584 -0.216 -5.647 1.00 0.00 N ATOM 485 CA VAL A 32 10.540 -1.139 -6.256 1.00 0.00 C ATOM 486 C VAL A 32 11.839 -1.131 -5.442 1.00 0.00 C ATOM 487 O VAL A 32 12.370 -0.066 -5.121 1.00 0.00 O ATOM 488 CB VAL A 32 10.690 -0.819 -7.757 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.271 0.570 -8.066 1.00 0.00 C ATOM 490 CG2 VAL A 32 11.530 -1.893 -8.448 1.00 0.00 C ATOM 0 H VAL A 32 9.626 0.735 -6.014 1.00 0.00 H new ATOM 0 HA VAL A 32 10.185 -2.169 -6.225 1.00 0.00 H new ATOM 0 HB VAL A 32 9.673 -0.811 -8.149 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.339 0.704 -9.146 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.622 1.338 -7.645 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.265 0.655 -7.627 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.627 -1.654 -9.507 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.519 -1.930 -7.992 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.043 -2.862 -8.338 1.00 0.00 H new ATOM 500 N THR A 33 12.367 -2.316 -5.133 1.00 0.00 N ATOM 501 CA THR A 33 13.669 -2.503 -4.509 1.00 0.00 C ATOM 502 C THR A 33 14.143 -3.876 -4.971 1.00 0.00 C ATOM 503 O THR A 33 13.726 -4.888 -4.410 1.00 0.00 O ATOM 504 CB THR A 33 13.531 -2.457 -2.976 1.00 0.00 C ATOM 505 OG1 THR A 33 12.768 -1.350 -2.508 1.00 0.00 O ATOM 506 CG2 THR A 33 14.899 -2.446 -2.280 1.00 0.00 C ATOM 0 H THR A 33 11.883 -3.195 -5.317 1.00 0.00 H new ATOM 0 HA THR A 33 14.377 -1.722 -4.787 1.00 0.00 H new ATOM 0 HB THR A 33 12.993 -3.369 -2.718 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.716 -1.379 -1.530 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.757 -2.413 -1.200 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.450 -3.348 -2.547 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.462 -1.569 -2.599 1.00 0.00 H new ATOM 514 N SER A 34 14.950 -3.939 -6.031 1.00 0.00 N ATOM 515 CA SER A 34 15.263 -5.216 -6.658 1.00 0.00 C ATOM 516 C SER A 34 16.538 -5.819 -6.068 1.00 0.00 C ATOM 517 O SER A 34 17.599 -5.833 -6.695 1.00 0.00 O ATOM 518 CB SER A 34 15.265 -5.074 -8.179 1.00 0.00 C ATOM 519 OG SER A 34 13.982 -4.600 -8.576 1.00 0.00 O ATOM 0 H SER A 34 15.392 -3.129 -6.466 1.00 0.00 H new ATOM 0 HA SER A 34 14.481 -5.941 -6.432 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.043 -4.380 -8.496 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.481 -6.032 -8.651 1.00 0.00 H new ATOM 0 HG SER A 34 13.987 -4.407 -9.537 1.00 0.00 H new ATOM 525 N SER A 35 16.417 -6.299 -4.831 1.00 0.00 N ATOM 526 CA SER A 35 17.416 -7.099 -4.132 1.00 0.00 C ATOM 527 C SER A 35 17.686 -8.401 -4.912 1.00 0.00 C ATOM 528 O SER A 35 16.926 -8.756 -5.816 1.00 0.00 O ATOM 529 CB SER A 35 16.898 -7.358 -2.713 1.00 0.00 C ATOM 530 OG SER A 35 16.343 -6.155 -2.193 1.00 0.00 O ATOM 0 H SER A 35 15.584 -6.133 -4.267 1.00 0.00 H new ATOM 0 HA SER A 35 18.370 -6.576 -4.065 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.144 -8.145 -2.726 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.710 -7.705 -2.074 1.00 0.00 H new ATOM 0 HG SER A 35 16.347 -6.189 -1.214 1.00 0.00 H new ATOM 536 N GLY A 36 18.763 -9.130 -4.601 1.00 0.00 N ATOM 537 CA GLY A 36 19.216 -10.242 -5.415 1.00 0.00 C ATOM 538 C GLY A 36 20.129 -11.125 -4.589 1.00 0.00 C ATOM 539 O GLY A 36 20.063 -11.113 -3.364 1.00 0.00 O ATOM 0 H GLY A 36 19.339 -8.959 -3.777 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.362 -10.817 -5.774 1.00 0.00 H new ATOM 0 HA3 GLY A 36 19.745 -9.873 -6.294 1.00 0.00 H new ATOM 543 N LEU A 37 20.937 -11.948 -5.254 1.00 0.00 N ATOM 544 CA LEU A 37 21.706 -12.998 -4.615 1.00 0.00 C ATOM 545 C LEU A 37 23.145 -12.977 -5.121 1.00 0.00 C ATOM 546 O LEU A 37 24.071 -12.692 -4.364 1.00 0.00 O ATOM 547 CB LEU A 37 20.981 -14.331 -4.867 1.00 0.00 C ATOM 548 CG LEU A 37 19.709 -14.508 -4.009 1.00 0.00 C ATOM 549 CD1 LEU A 37 18.693 -15.383 -4.750 1.00 0.00 C ATOM 550 CD2 LEU A 37 20.043 -15.113 -2.642 1.00 0.00 C ATOM 0 H LEU A 37 21.073 -11.899 -6.264 1.00 0.00 H new ATOM 0 HA LEU A 37 21.773 -12.850 -3.537 1.00 0.00 H new ATOM 0 HB2 LEU A 37 20.711 -14.396 -5.921 1.00 0.00 H new ATOM 0 HB3 LEU A 37 21.666 -15.153 -4.662 1.00 0.00 H new ATOM 0 HG LEU A 37 19.272 -13.524 -3.839 1.00 0.00 H new ATOM 0 HD11 LEU A 37 17.800 -15.502 -4.137 1.00 0.00 H new ATOM 0 HD12 LEU A 37 18.425 -14.909 -5.694 1.00 0.00 H new ATOM 0 HD13 LEU A 37 19.131 -16.362 -4.947 1.00 0.00 H new ATOM 0 HD21 LEU A 37 19.128 -15.226 -2.061 1.00 0.00 H new ATOM 0 HD22 LEU A 37 20.508 -16.089 -2.780 1.00 0.00 H new ATOM 0 HD23 LEU A 37 20.731 -14.455 -2.111 1.00 0.00 H new ATOM 562 N GLU A 38 23.314 -13.203 -6.423 1.00 0.00 N ATOM 563 CA GLU A 38 24.607 -13.115 -7.110 1.00 0.00 C ATOM 564 C GLU A 38 24.971 -11.657 -7.435 1.00 0.00 C ATOM 565 O GLU A 38 26.128 -11.328 -7.708 1.00 0.00 O ATOM 566 CB GLU A 38 24.540 -13.889 -8.433 1.00 0.00 C ATOM 567 CG GLU A 38 23.954 -15.304 -8.328 1.00 0.00 C ATOM 568 CD GLU A 38 24.012 -16.103 -9.644 1.00 0.00 C ATOM 569 OE1 GLU A 38 24.786 -15.747 -10.565 1.00 0.00 O ATOM 570 OE2 GLU A 38 23.290 -17.121 -9.766 1.00 0.00 O ATOM 0 H GLU A 38 22.545 -13.457 -7.043 1.00 0.00 H new ATOM 0 HA GLU A 38 25.362 -13.536 -6.446 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.942 -13.316 -9.142 1.00 0.00 H new ATOM 0 HB3 GLU A 38 25.546 -13.958 -8.847 1.00 0.00 H new ATOM 0 HG2 GLU A 38 24.493 -15.854 -7.557 1.00 0.00 H new ATOM 0 HG3 GLU A 38 22.916 -15.234 -8.003 1.00 0.00 H new ATOM 577 N SER A 39 23.941 -10.809 -7.463 1.00 0.00 N ATOM 578 CA SER A 39 23.920 -9.440 -7.938 1.00 0.00 C ATOM 579 C SER A 39 24.845 -8.466 -7.217 1.00 0.00 C ATOM 580 O SER A 39 25.359 -8.729 -6.127 1.00 0.00 O ATOM 581 CB SER A 39 22.464 -9.005 -7.843 1.00 0.00 C ATOM 582 OG SER A 39 21.671 -9.893 -8.606 1.00 0.00 O ATOM 0 H SER A 39 23.024 -11.096 -7.122 1.00 0.00 H new ATOM 0 HA SER A 39 24.314 -9.416 -8.954 1.00 0.00 H new ATOM 0 HB2 SER A 39 22.137 -9.006 -6.803 1.00 0.00 H new ATOM 0 HB3 SER A 39 22.350 -7.986 -8.212 1.00 0.00 H new ATOM 0 HG SER A 39 20.731 -9.622 -8.550 1.00 0.00 H new ATOM 588 N SER A 40 25.009 -7.307 -7.867 1.00 0.00 N ATOM 589 CA SER A 40 26.015 -6.328 -7.510 1.00 0.00 C ATOM 590 C SER A 40 25.522 -4.898 -7.747 1.00 0.00 C ATOM 591 O SER A 40 24.796 -4.350 -6.917 1.00 0.00 O ATOM 592 CB SER A 40 27.258 -6.731 -8.313 1.00 0.00 C ATOM 593 OG SER A 40 27.001 -6.798 -9.713 1.00 0.00 O ATOM 0 H SER A 40 24.435 -7.030 -8.663 1.00 0.00 H new ATOM 0 HA SER A 40 26.252 -6.323 -6.446 1.00 0.00 H new ATOM 0 HB2 SER A 40 28.056 -6.013 -8.127 1.00 0.00 H new ATOM 0 HB3 SER A 40 27.614 -7.701 -7.965 1.00 0.00 H new ATOM 0 HG SER A 40 27.821 -7.056 -10.184 1.00 0.00 H new ATOM 599 N ARG A 41 25.864 -4.302 -8.892 1.00 0.00 N ATOM 600 CA ARG A 41 25.452 -2.961 -9.304 1.00 0.00 C ATOM 601 C ARG A 41 25.149 -2.963 -10.805 1.00 0.00 C ATOM 602 O ARG A 41 25.207 -4.007 -11.454 1.00 0.00 O ATOM 603 CB ARG A 41 26.536 -1.928 -8.912 1.00 0.00 C ATOM 604 CG ARG A 41 25.893 -0.761 -8.150 1.00 0.00 C ATOM 605 CD ARG A 41 26.911 0.272 -7.665 1.00 0.00 C ATOM 606 NE ARG A 41 26.215 1.423 -7.063 1.00 0.00 N ATOM 607 CZ ARG A 41 26.782 2.440 -6.401 1.00 0.00 C ATOM 608 NH1 ARG A 41 28.080 2.423 -6.100 1.00 0.00 N ATOM 609 NH2 ARG A 41 26.029 3.476 -6.052 1.00 0.00 N ATOM 0 H ARG A 41 26.459 -4.759 -9.583 1.00 0.00 H new ATOM 0 HA ARG A 41 24.539 -2.669 -8.786 1.00 0.00 H new ATOM 0 HB2 ARG A 41 27.297 -2.403 -8.293 1.00 0.00 H new ATOM 0 HB3 ARG A 41 27.038 -1.558 -9.806 1.00 0.00 H new ATOM 0 HG2 ARG A 41 25.166 -0.270 -8.796 1.00 0.00 H new ATOM 0 HG3 ARG A 41 25.345 -1.152 -7.293 1.00 0.00 H new ATOM 0 HD2 ARG A 41 27.581 -0.181 -6.934 1.00 0.00 H new ATOM 0 HD3 ARG A 41 27.528 0.606 -8.499 1.00 0.00 H new ATOM 0 HE ARG A 41 25.200 1.448 -7.160 1.00 0.00 H new ATOM 0 HH11 ARG A 41 28.657 1.628 -6.374 1.00 0.00 H new ATOM 0 HH12 ARG A 41 28.497 3.205 -5.595 1.00 0.00 H new ATOM 0 HH21 ARG A 41 25.037 3.488 -6.288 1.00 0.00 H new ATOM 0 HH22 ARG A 41 26.443 4.260 -5.547 1.00 0.00 H new ATOM 623 N VAL A 42 24.751 -1.808 -11.338 1.00 0.00 N ATOM 624 CA VAL A 42 24.312 -1.664 -12.720 1.00 0.00 C ATOM 625 C VAL A 42 25.528 -1.435 -13.646 1.00 0.00 C ATOM 626 O VAL A 42 26.665 -1.357 -13.173 1.00 0.00 O ATOM 627 CB VAL A 42 23.239 -0.562 -12.792 1.00 0.00 C ATOM 628 CG1 VAL A 42 22.171 -0.691 -11.694 1.00 0.00 C ATOM 629 CG2 VAL A 42 23.819 0.854 -12.785 1.00 0.00 C ATOM 0 H VAL A 42 24.725 -0.935 -10.811 1.00 0.00 H new ATOM 0 HA VAL A 42 23.844 -2.579 -13.082 1.00 0.00 H new ATOM 0 HB VAL A 42 22.758 -0.721 -13.757 1.00 0.00 H new ATOM 0 HG11 VAL A 42 21.443 0.114 -11.798 1.00 0.00 H new ATOM 0 HG12 VAL A 42 21.665 -1.652 -11.789 1.00 0.00 H new ATOM 0 HG13 VAL A 42 22.646 -0.627 -10.715 1.00 0.00 H new ATOM 0 HG21 VAL A 42 23.008 1.580 -12.838 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.386 1.010 -11.868 1.00 0.00 H new ATOM 0 HG23 VAL A 42 24.477 0.982 -13.645 1.00 0.00 H new ATOM 639 N HIS A 43 25.294 -1.309 -14.958 1.00 0.00 N ATOM 640 CA HIS A 43 26.356 -1.131 -15.958 1.00 0.00 C ATOM 641 C HIS A 43 26.675 0.368 -16.160 1.00 0.00 C ATOM 642 O HIS A 43 25.789 1.201 -15.965 1.00 0.00 O ATOM 643 CB HIS A 43 25.950 -1.837 -17.267 1.00 0.00 C ATOM 644 CG HIS A 43 25.802 -3.339 -17.150 1.00 0.00 C ATOM 645 ND1 HIS A 43 26.494 -4.274 -17.882 1.00 0.00 N ATOM 646 CD2 HIS A 43 24.935 -4.036 -16.349 1.00 0.00 C ATOM 647 CE1 HIS A 43 26.053 -5.494 -17.538 1.00 0.00 C ATOM 648 NE2 HIS A 43 25.090 -5.401 -16.606 1.00 0.00 N ATOM 0 H HIS A 43 24.356 -1.328 -15.359 1.00 0.00 H new ATOM 0 HA HIS A 43 27.278 -1.593 -15.604 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.006 -1.417 -17.614 1.00 0.00 H new ATOM 0 HB3 HIS A 43 26.696 -1.616 -18.030 1.00 0.00 H new ATOM 0 HD1 HIS A 43 27.220 -4.074 -18.570 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.247 -3.603 -15.638 1.00 0.00 H new ATOM 0 HE1 HIS A 43 26.421 -6.421 -17.953 1.00 0.00 H new ATOM 656 N PRO A 44 27.897 0.746 -16.587 1.00 0.00 N ATOM 657 CA PRO A 44 28.315 2.150 -16.680 1.00 0.00 C ATOM 658 C PRO A 44 27.529 2.941 -17.730 1.00 0.00 C ATOM 659 O PRO A 44 26.925 3.965 -17.405 1.00 0.00 O ATOM 660 CB PRO A 44 29.815 2.123 -17.004 1.00 0.00 C ATOM 661 CG PRO A 44 30.039 0.740 -17.616 1.00 0.00 C ATOM 662 CD PRO A 44 29.032 -0.128 -16.866 1.00 0.00 C ATOM 0 HA PRO A 44 28.113 2.666 -15.741 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.087 2.916 -17.701 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.419 2.265 -16.108 1.00 0.00 H new ATOM 0 HG2 PRO A 44 29.854 0.738 -18.690 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.062 0.393 -17.468 1.00 0.00 H new ATOM 0 HD2 PRO A 44 28.729 -0.986 -17.467 1.00 0.00 H new ATOM 0 HD3 PRO A 44 29.461 -0.520 -15.944 1.00 0.00 H new ATOM 670 N THR A 45 27.492 2.463 -18.979 1.00 0.00 N ATOM 671 CA THR A 45 26.831 3.172 -20.077 1.00 0.00 C ATOM 672 C THR A 45 25.312 3.197 -19.858 1.00 0.00 C ATOM 673 O THR A 45 24.644 4.130 -20.302 1.00 0.00 O ATOM 674 CB THR A 45 27.260 2.543 -21.413 1.00 0.00 C ATOM 675 OG1 THR A 45 28.669 2.355 -21.420 1.00 0.00 O ATOM 676 CG2 THR A 45 26.841 3.360 -22.644 1.00 0.00 C ATOM 0 H THR A 45 27.918 1.578 -19.255 1.00 0.00 H new ATOM 0 HA THR A 45 27.140 4.217 -20.105 1.00 0.00 H new ATOM 0 HB THR A 45 26.741 1.587 -21.487 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.941 1.953 -22.271 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.178 2.854 -23.549 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.755 3.456 -22.665 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.292 4.351 -22.593 1.00 0.00 H new ATOM 684 N ALA A 46 24.773 2.232 -19.094 1.00 0.00 N ATOM 685 CA ALA A 46 23.371 2.233 -18.699 1.00 0.00 C ATOM 686 C ALA A 46 23.036 3.528 -18.001 1.00 0.00 C ATOM 687 O ALA A 46 22.098 4.196 -18.404 1.00 0.00 O ATOM 688 CB ALA A 46 23.040 1.035 -17.788 1.00 0.00 C ATOM 0 H ALA A 46 25.302 1.436 -18.738 1.00 0.00 H new ATOM 0 HA ALA A 46 22.765 2.141 -19.601 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.986 1.068 -17.513 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.248 0.106 -18.319 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.652 1.083 -16.887 1.00 0.00 H new ATOM 694 N ILE A 47 23.807 3.905 -16.990 1.00 0.00 N ATOM 695 CA ILE A 47 23.473 5.055 -16.159 1.00 0.00 C ATOM 696 C ILE A 47 23.385 6.285 -17.051 1.00 0.00 C ATOM 697 O ILE A 47 22.436 7.049 -16.915 1.00 0.00 O ATOM 698 CB ILE A 47 24.555 5.239 -15.066 1.00 0.00 C ATOM 699 CG1 ILE A 47 24.555 4.056 -14.078 1.00 0.00 C ATOM 700 CG2 ILE A 47 24.377 6.563 -14.301 1.00 0.00 C ATOM 701 CD1 ILE A 47 25.912 3.845 -13.396 1.00 0.00 C ATOM 0 H ILE A 47 24.670 3.430 -16.725 1.00 0.00 H new ATOM 0 HA ILE A 47 22.515 4.903 -15.663 1.00 0.00 H new ATOM 0 HB ILE A 47 25.517 5.270 -15.577 1.00 0.00 H new ATOM 0 HG12 ILE A 47 23.794 4.226 -13.316 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.276 3.146 -14.609 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.156 6.653 -13.544 1.00 0.00 H new ATOM 0 HG22 ILE A 47 24.450 7.398 -14.998 1.00 0.00 H new ATOM 0 HG23 ILE A 47 23.399 6.576 -13.819 1.00 0.00 H new ATOM 0 HD11 ILE A 47 25.848 2.998 -12.713 1.00 0.00 H new ATOM 0 HD12 ILE A 47 26.672 3.645 -14.152 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.182 4.742 -12.838 1.00 0.00 H new ATOM 713 N ALA A 48 24.311 6.446 -17.996 1.00 0.00 N ATOM 714 CA ALA A 48 24.307 7.594 -18.879 1.00 0.00 C ATOM 715 C ALA A 48 23.035 7.622 -19.723 1.00 0.00 C ATOM 716 O ALA A 48 22.374 8.652 -19.789 1.00 0.00 O ATOM 717 CB ALA A 48 25.570 7.586 -19.751 1.00 0.00 C ATOM 0 H ALA A 48 25.073 5.789 -18.164 1.00 0.00 H new ATOM 0 HA ALA A 48 24.316 8.505 -18.281 1.00 0.00 H new ATOM 0 HB1 ALA A 48 25.561 8.452 -20.413 1.00 0.00 H new ATOM 0 HB2 ALA A 48 26.453 7.626 -19.113 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.595 6.674 -20.347 1.00 0.00 H new ATOM 723 N MET A 49 22.643 6.500 -20.331 1.00 0.00 N ATOM 724 CA MET A 49 21.469 6.464 -21.206 1.00 0.00 C ATOM 725 C MET A 49 20.169 6.563 -20.402 1.00 0.00 C ATOM 726 O MET A 49 19.180 7.168 -20.822 1.00 0.00 O ATOM 727 CB MET A 49 21.512 5.176 -22.041 1.00 0.00 C ATOM 728 CG MET A 49 22.728 5.159 -22.975 1.00 0.00 C ATOM 729 SD MET A 49 22.743 6.495 -24.198 1.00 0.00 S ATOM 730 CE MET A 49 24.338 7.218 -23.750 1.00 0.00 C ATOM 0 H MET A 49 23.121 5.604 -20.233 1.00 0.00 H new ATOM 0 HA MET A 49 21.491 7.327 -21.872 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.547 4.311 -21.378 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.598 5.090 -22.629 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.635 5.222 -22.374 1.00 0.00 H new ATOM 0 HG3 MET A 49 22.758 4.203 -23.497 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.544 8.072 -24.395 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.310 7.546 -22.711 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.123 6.472 -23.874 1.00 0.00 H new ATOM 740 N MET A 50 20.165 5.998 -19.203 1.00 0.00 N ATOM 741 CA MET A 50 18.993 6.011 -18.362 1.00 0.00 C ATOM 742 C MET A 50 18.853 7.426 -17.798 1.00 0.00 C ATOM 743 O MET A 50 17.739 7.927 -17.685 1.00 0.00 O ATOM 744 CB MET A 50 19.059 4.900 -17.303 1.00 0.00 C ATOM 745 CG MET A 50 19.199 3.450 -17.844 1.00 0.00 C ATOM 746 SD MET A 50 18.833 3.097 -19.603 1.00 0.00 S ATOM 747 CE MET A 50 19.506 1.405 -19.861 1.00 0.00 C ATOM 0 H MET A 50 20.970 5.523 -18.795 1.00 0.00 H new ATOM 0 HA MET A 50 18.088 5.783 -18.925 1.00 0.00 H new ATOM 0 HB2 MET A 50 19.903 5.104 -16.644 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.158 4.953 -16.693 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.223 3.129 -17.654 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.549 2.814 -17.243 1.00 0.00 H new ATOM 0 HE1 MET A 50 18.901 0.882 -20.601 1.00 0.00 H new ATOM 0 HE2 MET A 50 20.535 1.473 -20.215 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.482 0.856 -18.919 1.00 0.00 H new ATOM 757 N GLU A 51 19.959 8.137 -17.576 1.00 0.00 N ATOM 758 CA GLU A 51 19.947 9.531 -17.198 1.00 0.00 C ATOM 759 C GLU A 51 19.555 10.398 -18.398 1.00 0.00 C ATOM 760 O GLU A 51 19.010 11.485 -18.201 1.00 0.00 O ATOM 761 CB GLU A 51 21.300 9.921 -16.589 1.00 0.00 C ATOM 762 CG GLU A 51 21.321 11.355 -16.047 1.00 0.00 C ATOM 763 CD GLU A 51 22.635 11.645 -15.302 1.00 0.00 C ATOM 764 OE1 GLU A 51 23.657 11.951 -15.963 1.00 0.00 O ATOM 765 OE2 GLU A 51 22.650 11.597 -14.048 1.00 0.00 O ATOM 0 H GLU A 51 20.897 7.745 -17.658 1.00 0.00 H new ATOM 0 HA GLU A 51 19.194 9.703 -16.429 1.00 0.00 H new ATOM 0 HB2 GLU A 51 21.542 9.230 -15.782 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.078 9.813 -17.345 1.00 0.00 H new ATOM 0 HG2 GLU A 51 21.202 12.060 -16.870 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.477 11.505 -15.374 1.00 0.00 H new ATOM 772 N GLU A 52 19.732 9.919 -19.634 1.00 0.00 N ATOM 773 CA GLU A 52 19.209 10.619 -20.801 1.00 0.00 C ATOM 774 C GLU A 52 17.677 10.590 -20.797 1.00 0.00 C ATOM 775 O GLU A 52 17.060 11.550 -21.267 1.00 0.00 O ATOM 776 CB GLU A 52 19.809 10.127 -22.133 1.00 0.00 C ATOM 777 CG GLU A 52 21.249 10.605 -22.359 1.00 0.00 C ATOM 778 CD GLU A 52 21.314 12.102 -22.718 1.00 0.00 C ATOM 779 OE1 GLU A 52 21.152 12.449 -23.915 1.00 0.00 O ATOM 780 OE2 GLU A 52 21.533 12.947 -21.814 1.00 0.00 O ATOM 0 H GLU A 52 20.231 9.055 -19.846 1.00 0.00 H new ATOM 0 HA GLU A 52 19.529 11.658 -20.724 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.787 9.037 -22.154 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.184 10.474 -22.956 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.836 10.423 -21.459 1.00 0.00 H new ATOM 0 HG3 GLU A 52 21.703 10.021 -23.159 1.00 0.00 H new ATOM 787 N VAL A 53 17.056 9.546 -20.223 1.00 0.00 N ATOM 788 CA VAL A 53 15.607 9.547 -19.967 1.00 0.00 C ATOM 789 C VAL A 53 15.285 10.107 -18.559 1.00 0.00 C ATOM 790 O VAL A 53 14.146 10.040 -18.096 1.00 0.00 O ATOM 791 CB VAL A 53 14.958 8.202 -20.360 1.00 0.00 C ATOM 792 CG1 VAL A 53 15.216 7.061 -19.368 1.00 0.00 C ATOM 793 CG2 VAL A 53 13.452 8.323 -20.633 1.00 0.00 C ATOM 0 H VAL A 53 17.533 8.694 -19.929 1.00 0.00 H new ATOM 0 HA VAL A 53 15.113 10.254 -20.633 1.00 0.00 H new ATOM 0 HB VAL A 53 15.462 7.937 -21.289 1.00 0.00 H new ATOM 0 HG11 VAL A 53 14.725 6.154 -19.721 1.00 0.00 H new ATOM 0 HG12 VAL A 53 16.289 6.885 -19.287 1.00 0.00 H new ATOM 0 HG13 VAL A 53 14.818 7.332 -18.390 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.052 7.346 -20.904 1.00 0.00 H new ATOM 0 HG22 VAL A 53 12.948 8.686 -19.737 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.286 9.023 -21.451 1.00 0.00 H new ATOM 803 N GLY A 54 16.270 10.708 -17.880 1.00 0.00 N ATOM 804 CA GLY A 54 16.099 11.398 -16.606 1.00 0.00 C ATOM 805 C GLY A 54 15.992 10.454 -15.406 1.00 0.00 C ATOM 806 O GLY A 54 15.506 10.878 -14.354 1.00 0.00 O ATOM 0 H GLY A 54 17.233 10.725 -18.216 1.00 0.00 H new ATOM 0 HA2 GLY A 54 16.941 12.073 -16.452 1.00 0.00 H new ATOM 0 HA3 GLY A 54 15.201 12.014 -16.654 1.00 0.00 H new ATOM 810 N ILE A 55 16.409 9.190 -15.543 1.00 0.00 N ATOM 811 CA ILE A 55 16.278 8.158 -14.517 1.00 0.00 C ATOM 812 C ILE A 55 17.646 7.819 -13.922 1.00 0.00 C ATOM 813 O ILE A 55 18.628 7.647 -14.646 1.00 0.00 O ATOM 814 CB ILE A 55 15.522 6.941 -15.085 1.00 0.00 C ATOM 815 CG1 ILE A 55 14.054 7.342 -15.365 1.00 0.00 C ATOM 816 CG2 ILE A 55 15.613 5.696 -14.182 1.00 0.00 C ATOM 817 CD1 ILE A 55 13.094 6.168 -15.555 1.00 0.00 C ATOM 0 H ILE A 55 16.858 8.851 -16.394 1.00 0.00 H new ATOM 0 HA ILE A 55 15.677 8.529 -13.687 1.00 0.00 H new ATOM 0 HB ILE A 55 16.004 6.651 -16.019 1.00 0.00 H new ATOM 0 HG12 ILE A 55 13.696 7.956 -14.539 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.026 7.964 -16.260 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.060 4.875 -14.638 1.00 0.00 H new ATOM 0 HG22 ILE A 55 16.658 5.409 -14.063 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.185 5.923 -13.205 1.00 0.00 H new ATOM 0 HD11 ILE A 55 12.090 6.546 -15.746 1.00 0.00 H new ATOM 0 HD12 ILE A 55 13.421 5.564 -16.401 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.085 5.555 -14.653 1.00 0.00 H new ATOM 829 N ASP A 56 17.687 7.656 -12.597 1.00 0.00 N ATOM 830 CA ASP A 56 18.836 7.115 -11.878 1.00 0.00 C ATOM 831 C ASP A 56 18.686 5.598 -11.782 1.00 0.00 C ATOM 832 O ASP A 56 17.594 5.095 -11.503 1.00 0.00 O ATOM 833 CB ASP A 56 18.948 7.724 -10.474 1.00 0.00 C ATOM 834 CG ASP A 56 19.869 6.876 -9.581 1.00 0.00 C ATOM 835 OD1 ASP A 56 21.065 6.718 -9.921 1.00 0.00 O ATOM 836 OD2 ASP A 56 19.377 6.309 -8.578 1.00 0.00 O ATOM 0 H ASP A 56 16.908 7.901 -11.986 1.00 0.00 H new ATOM 0 HA ASP A 56 19.746 7.368 -12.422 1.00 0.00 H new ATOM 0 HB2 ASP A 56 19.337 8.740 -10.544 1.00 0.00 H new ATOM 0 HB3 ASP A 56 17.958 7.792 -10.022 1.00 0.00 H new ATOM 841 N ILE A 57 19.782 4.869 -11.983 1.00 0.00 N ATOM 842 CA ILE A 57 19.887 3.429 -11.719 1.00 0.00 C ATOM 843 C ILE A 57 21.144 3.133 -10.888 1.00 0.00 C ATOM 844 O ILE A 57 21.133 2.214 -10.077 1.00 0.00 O ATOM 845 CB ILE A 57 19.774 2.608 -13.023 1.00 0.00 C ATOM 846 CG1 ILE A 57 20.770 3.076 -14.100 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.344 2.682 -13.582 1.00 0.00 C ATOM 848 CD1 ILE A 57 21.024 2.002 -15.153 1.00 0.00 C ATOM 0 H ILE A 57 20.647 5.271 -12.344 1.00 0.00 H new ATOM 0 HA ILE A 57 19.041 3.106 -11.113 1.00 0.00 H new ATOM 0 HB ILE A 57 20.019 1.577 -12.767 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.385 3.973 -14.584 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.713 3.349 -13.627 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.282 2.098 -14.500 1.00 0.00 H new ATOM 0 HG22 ILE A 57 17.645 2.280 -12.848 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.090 3.720 -13.794 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.732 2.377 -15.892 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.435 1.113 -14.674 1.00 0.00 H new ATOM 0 HD13 ILE A 57 20.086 1.747 -15.647 1.00 0.00 H new ATOM 860 N SER A 58 22.197 3.936 -11.046 1.00 0.00 N ATOM 861 CA SER A 58 23.409 3.993 -10.219 1.00 0.00 C ATOM 862 C SER A 58 23.147 3.904 -8.710 1.00 0.00 C ATOM 863 O SER A 58 23.940 3.304 -7.985 1.00 0.00 O ATOM 864 CB SER A 58 24.134 5.326 -10.511 1.00 0.00 C ATOM 865 OG SER A 58 23.327 6.241 -11.248 1.00 0.00 O ATOM 0 H SER A 58 22.230 4.613 -11.809 1.00 0.00 H new ATOM 0 HA SER A 58 24.009 3.122 -10.482 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.431 5.787 -9.569 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.048 5.123 -11.069 1.00 0.00 H new ATOM 0 HG SER A 58 22.503 6.425 -10.750 1.00 0.00 H new ATOM 871 N GLY A 59 22.053 4.487 -8.229 1.00 0.00 N ATOM 872 CA GLY A 59 21.680 4.485 -6.820 1.00 0.00 C ATOM 873 C GLY A 59 21.346 3.093 -6.279 1.00 0.00 C ATOM 874 O GLY A 59 21.280 2.923 -5.059 1.00 0.00 O ATOM 0 H GLY A 59 21.388 4.984 -8.821 1.00 0.00 H new ATOM 0 HA2 GLY A 59 22.497 4.907 -6.235 1.00 0.00 H new ATOM 0 HA3 GLY A 59 20.818 5.137 -6.680 1.00 0.00 H new ATOM 878 N GLN A 60 21.152 2.093 -7.149 1.00 0.00 N ATOM 879 CA GLN A 60 20.987 0.719 -6.743 1.00 0.00 C ATOM 880 C GLN A 60 22.299 0.123 -6.259 1.00 0.00 C ATOM 881 O GLN A 60 23.384 0.459 -6.734 1.00 0.00 O ATOM 882 CB GLN A 60 20.538 -0.171 -7.911 1.00 0.00 C ATOM 883 CG GLN A 60 19.077 -0.042 -8.334 1.00 0.00 C ATOM 884 CD GLN A 60 18.677 -1.339 -9.033 1.00 0.00 C ATOM 885 OE1 GLN A 60 18.187 -2.268 -8.399 1.00 0.00 O ATOM 886 NE2 GLN A 60 18.963 -1.470 -10.323 1.00 0.00 N ATOM 0 H GLN A 60 21.107 2.231 -8.159 1.00 0.00 H new ATOM 0 HA GLN A 60 20.238 0.740 -5.952 1.00 0.00 H new ATOM 0 HB2 GLN A 60 21.165 0.053 -8.774 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.726 -1.210 -7.642 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.442 0.135 -7.466 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.947 0.808 -9.003 1.00 0.00 H new ATOM 0 HE21 GLN A 60 19.370 -0.689 -10.837 1.00 0.00 H new ATOM 0 HE22 GLN A 60 18.776 -2.352 -10.800 1.00 0.00 H new ATOM 895 N THR A 61 22.130 -0.876 -5.408 1.00 0.00 N ATOM 896 CA THR A 61 23.076 -1.834 -4.918 1.00 0.00 C ATOM 897 C THR A 61 22.208 -3.069 -4.595 1.00 0.00 C ATOM 898 O THR A 61 20.978 -2.960 -4.490 1.00 0.00 O ATOM 899 CB THR A 61 23.833 -1.309 -3.691 1.00 0.00 C ATOM 900 OG1 THR A 61 22.994 -0.566 -2.814 1.00 0.00 O ATOM 901 CG2 THR A 61 25.039 -0.450 -4.085 1.00 0.00 C ATOM 0 H THR A 61 21.209 -1.044 -5.002 1.00 0.00 H new ATOM 0 HA THR A 61 23.863 -2.061 -5.637 1.00 0.00 H new ATOM 0 HB THR A 61 24.187 -2.195 -3.164 1.00 0.00 H new ATOM 0 HG1 THR A 61 23.518 -0.253 -2.047 1.00 0.00 H new ATOM 0 HG21 THR A 61 25.545 -0.100 -3.186 1.00 0.00 H new ATOM 0 HG22 THR A 61 25.730 -1.045 -4.682 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.701 0.407 -4.668 1.00 0.00 H new ATOM 909 N SER A 62 22.815 -4.247 -4.471 1.00 0.00 N ATOM 910 CA SER A 62 22.089 -5.502 -4.370 1.00 0.00 C ATOM 911 C SER A 62 22.297 -6.078 -2.973 1.00 0.00 C ATOM 912 O SER A 62 23.325 -6.701 -2.692 1.00 0.00 O ATOM 913 CB SER A 62 22.559 -6.448 -5.470 1.00 0.00 C ATOM 914 OG SER A 62 22.348 -5.876 -6.753 1.00 0.00 O ATOM 0 H SER A 62 23.829 -4.354 -4.438 1.00 0.00 H new ATOM 0 HA SER A 62 21.019 -5.350 -4.512 1.00 0.00 H new ATOM 0 HB2 SER A 62 23.618 -6.671 -5.336 1.00 0.00 H new ATOM 0 HB3 SER A 62 22.022 -7.394 -5.396 1.00 0.00 H new ATOM 0 HG SER A 62 23.076 -5.253 -6.957 1.00 0.00 H new ATOM 920 N ASP A 63 21.336 -5.830 -2.084 1.00 0.00 N ATOM 921 CA ASP A 63 21.292 -6.509 -0.790 1.00 0.00 C ATOM 922 C ASP A 63 20.956 -7.978 -1.051 1.00 0.00 C ATOM 923 O ASP A 63 20.274 -8.274 -2.045 1.00 0.00 O ATOM 924 CB ASP A 63 20.236 -5.897 0.139 1.00 0.00 C ATOM 925 CG ASP A 63 20.869 -5.047 1.251 1.00 0.00 C ATOM 926 OD1 ASP A 63 21.275 -3.892 0.980 1.00 0.00 O ATOM 927 OD2 ASP A 63 20.945 -5.530 2.406 1.00 0.00 O ATOM 0 H ASP A 63 20.578 -5.164 -2.236 1.00 0.00 H new ATOM 0 HA ASP A 63 22.257 -6.402 -0.295 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.554 -5.279 -0.445 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.641 -6.694 0.586 1.00 0.00 H new ATOM 932 N PRO A 64 21.377 -8.905 -0.174 1.00 0.00 N ATOM 933 CA PRO A 64 20.920 -10.278 -0.245 1.00 0.00 C ATOM 934 C PRO A 64 19.397 -10.290 -0.093 1.00 0.00 C ATOM 935 O PRO A 64 18.852 -9.650 0.807 1.00 0.00 O ATOM 936 CB PRO A 64 21.639 -11.015 0.891 1.00 0.00 C ATOM 937 CG PRO A 64 21.935 -9.916 1.915 1.00 0.00 C ATOM 938 CD PRO A 64 22.137 -8.679 1.049 1.00 0.00 C ATOM 0 HA PRO A 64 21.144 -10.767 -1.193 1.00 0.00 H new ATOM 0 HB2 PRO A 64 21.014 -11.800 1.317 1.00 0.00 H new ATOM 0 HB3 PRO A 64 22.555 -11.492 0.541 1.00 0.00 H new ATOM 0 HG2 PRO A 64 21.111 -9.786 2.616 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.823 -10.144 2.505 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.788 -7.784 1.563 1.00 0.00 H new ATOM 0 HD3 PRO A 64 23.194 -8.528 0.828 1.00 0.00 H new ATOM 946 N ILE A 65 18.702 -11.070 -0.923 1.00 0.00 N ATOM 947 CA ILE A 65 17.239 -11.177 -0.906 1.00 0.00 C ATOM 948 C ILE A 65 16.747 -11.727 0.447 1.00 0.00 C ATOM 949 O ILE A 65 15.591 -11.555 0.829 1.00 0.00 O ATOM 950 CB ILE A 65 16.792 -12.017 -2.130 1.00 0.00 C ATOM 951 CG1 ILE A 65 15.537 -11.397 -2.776 1.00 0.00 C ATOM 952 CG2 ILE A 65 16.621 -13.516 -1.816 1.00 0.00 C ATOM 953 CD1 ILE A 65 15.120 -12.064 -4.093 1.00 0.00 C ATOM 0 H ILE A 65 19.143 -11.653 -1.635 1.00 0.00 H new ATOM 0 HA ILE A 65 16.775 -10.195 -0.997 1.00 0.00 H new ATOM 0 HB ILE A 65 17.601 -11.980 -2.860 1.00 0.00 H new ATOM 0 HG12 ILE A 65 14.709 -11.460 -2.070 1.00 0.00 H new ATOM 0 HG13 ILE A 65 15.720 -10.338 -2.959 1.00 0.00 H new ATOM 0 HG21 ILE A 65 16.307 -14.043 -2.717 1.00 0.00 H new ATOM 0 HG22 ILE A 65 17.569 -13.925 -1.468 1.00 0.00 H new ATOM 0 HG23 ILE A 65 15.865 -13.641 -1.041 1.00 0.00 H new ATOM 0 HD11 ILE A 65 14.230 -11.571 -4.484 1.00 0.00 H new ATOM 0 HD12 ILE A 65 15.930 -11.978 -4.817 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.903 -13.117 -3.915 1.00 0.00 H new ATOM 965 N GLU A 66 17.661 -12.367 1.181 1.00 0.00 N ATOM 966 CA GLU A 66 17.445 -12.961 2.491 1.00 0.00 C ATOM 967 C GLU A 66 17.151 -11.877 3.535 1.00 0.00 C ATOM 968 O GLU A 66 16.528 -12.137 4.567 1.00 0.00 O ATOM 969 CB GLU A 66 18.707 -13.721 2.937 1.00 0.00 C ATOM 970 CG GLU A 66 19.386 -14.506 1.809 1.00 0.00 C ATOM 971 CD GLU A 66 20.541 -15.376 2.333 1.00 0.00 C ATOM 972 OE1 GLU A 66 21.694 -14.884 2.405 1.00 0.00 O ATOM 973 OE2 GLU A 66 20.307 -16.565 2.662 1.00 0.00 O ATOM 0 H GLU A 66 18.620 -12.488 0.855 1.00 0.00 H new ATOM 0 HA GLU A 66 16.596 -13.640 2.415 1.00 0.00 H new ATOM 0 HB2 GLU A 66 19.421 -13.010 3.353 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.441 -14.411 3.738 1.00 0.00 H new ATOM 0 HG2 GLU A 66 18.650 -15.139 1.313 1.00 0.00 H new ATOM 0 HG3 GLU A 66 19.765 -13.811 1.060 1.00 0.00 H new ATOM 980 N ASN A 67 17.618 -10.654 3.259 1.00 0.00 N ATOM 981 CA ASN A 67 17.384 -9.465 4.080 1.00 0.00 C ATOM 982 C ASN A 67 15.912 -8.995 4.039 1.00 0.00 C ATOM 983 O ASN A 67 15.548 -8.004 4.676 1.00 0.00 O ATOM 984 CB ASN A 67 18.357 -8.334 3.706 1.00 0.00 C ATOM 985 CG ASN A 67 18.658 -7.384 4.869 1.00 0.00 C ATOM 986 OD1 ASN A 67 18.170 -7.525 5.990 1.00 0.00 O ATOM 987 ND2 ASN A 67 19.534 -6.418 4.653 1.00 0.00 N ATOM 0 H ASN A 67 18.185 -10.461 2.434 1.00 0.00 H new ATOM 0 HA ASN A 67 17.583 -9.748 5.114 1.00 0.00 H new ATOM 0 HB2 ASN A 67 19.291 -8.770 3.351 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.938 -7.762 2.878 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.803 -5.794 5.414 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.941 -6.297 3.726 1.00 0.00 H new ATOM 994 N PHE A 68 15.061 -9.696 3.281 1.00 0.00 N ATOM 995 CA PHE A 68 13.638 -9.441 3.069 1.00 0.00 C ATOM 996 C PHE A 68 12.896 -10.781 3.130 1.00 0.00 C ATOM 997 O PHE A 68 13.479 -11.817 3.470 1.00 0.00 O ATOM 998 CB PHE A 68 13.420 -8.771 1.696 1.00 0.00 C ATOM 999 CG PHE A 68 14.375 -7.637 1.402 1.00 0.00 C ATOM 1000 CD1 PHE A 68 15.633 -7.942 0.860 1.00 0.00 C ATOM 1001 CD2 PHE A 68 14.050 -6.308 1.730 1.00 0.00 C ATOM 1002 CE1 PHE A 68 16.587 -6.928 0.683 1.00 0.00 C ATOM 1003 CE2 PHE A 68 14.996 -5.286 1.523 1.00 0.00 C ATOM 1004 CZ PHE A 68 16.270 -5.598 1.013 1.00 0.00 C ATOM 0 H PHE A 68 15.376 -10.516 2.763 1.00 0.00 H new ATOM 0 HA PHE A 68 13.257 -8.770 3.839 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.519 -9.526 0.916 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.399 -8.393 1.647 1.00 0.00 H new ATOM 0 HD1 PHE A 68 15.867 -8.958 0.579 1.00 0.00 H new ATOM 0 HD2 PHE A 68 13.079 -6.073 2.139 1.00 0.00 H new ATOM 0 HE1 PHE A 68 17.565 -7.169 0.293 1.00 0.00 H new ATOM 0 HE2 PHE A 68 14.744 -4.262 1.756 1.00 0.00 H new ATOM 0 HZ PHE A 68 17.003 -4.817 0.875 1.00 0.00 H new ATOM 1014 N ASN A 69 11.607 -10.781 2.775 1.00 0.00 N ATOM 1015 CA ASN A 69 10.832 -11.989 2.570 1.00 0.00 C ATOM 1016 C ASN A 69 9.926 -11.757 1.378 1.00 0.00 C ATOM 1017 O ASN A 69 9.355 -10.672 1.257 1.00 0.00 O ATOM 1018 CB ASN A 69 9.974 -12.304 3.802 1.00 0.00 C ATOM 1019 CG ASN A 69 9.325 -13.688 3.794 1.00 0.00 C ATOM 1020 OD1 ASN A 69 9.303 -14.385 2.783 1.00 0.00 O ATOM 1021 ND2 ASN A 69 8.753 -14.104 4.911 1.00 0.00 N ATOM 0 H ASN A 69 11.074 -9.925 2.622 1.00 0.00 H new ATOM 0 HA ASN A 69 11.503 -12.831 2.400 1.00 0.00 H new ATOM 0 HB2 ASN A 69 10.596 -12.215 4.693 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.190 -11.551 3.884 1.00 0.00 H new ATOM 0 HD21 ASN A 69 8.288 -15.011 4.939 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.777 -13.518 5.745 1.00 0.00 H new ATOM 1028 N ALA A 70 9.723 -12.768 0.537 1.00 0.00 N ATOM 1029 CA ALA A 70 8.857 -12.606 -0.594 1.00 0.00 C ATOM 1030 C ALA A 70 7.428 -12.540 -0.105 1.00 0.00 C ATOM 1031 O ALA A 70 6.591 -11.915 -0.745 1.00 0.00 O ATOM 1032 CB ALA A 70 9.012 -13.765 -1.571 1.00 0.00 C ATOM 0 H ALA A 70 10.147 -13.691 0.627 1.00 0.00 H new ATOM 0 HA ALA A 70 9.122 -11.687 -1.116 1.00 0.00 H new ATOM 0 HB1 ALA A 70 8.344 -13.617 -2.420 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.042 -13.808 -1.924 1.00 0.00 H new ATOM 0 HB3 ALA A 70 8.760 -14.700 -1.070 1.00 0.00 H new ATOM 1038 N ASP A 71 7.137 -13.191 1.024 1.00 0.00 N ATOM 1039 CA ASP A 71 5.784 -13.215 1.531 1.00 0.00 C ATOM 1040 C ASP A 71 5.328 -11.802 1.961 1.00 0.00 C ATOM 1041 O ASP A 71 4.130 -11.524 2.026 1.00 0.00 O ATOM 1042 CB ASP A 71 5.656 -14.210 2.687 1.00 0.00 C ATOM 1043 CG ASP A 71 4.206 -14.300 3.191 1.00 0.00 C ATOM 1044 OD1 ASP A 71 3.339 -14.826 2.450 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.939 -13.893 4.349 1.00 0.00 O ATOM 0 H ASP A 71 7.817 -13.699 1.590 1.00 0.00 H new ATOM 0 HA ASP A 71 5.127 -13.546 0.727 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.991 -15.194 2.361 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.309 -13.906 3.505 1.00 0.00 H new ATOM 1050 N ASP A 72 6.283 -10.895 2.228 1.00 0.00 N ATOM 1051 CA ASP A 72 6.033 -9.491 2.523 1.00 0.00 C ATOM 1052 C ASP A 72 5.790 -8.675 1.246 1.00 0.00 C ATOM 1053 O ASP A 72 5.078 -7.665 1.266 1.00 0.00 O ATOM 1054 CB ASP A 72 7.228 -8.893 3.273 1.00 0.00 C ATOM 1055 CG ASP A 72 6.904 -7.478 3.777 1.00 0.00 C ATOM 1056 OD1 ASP A 72 6.008 -7.331 4.643 1.00 0.00 O ATOM 1057 OD2 ASP A 72 7.574 -6.508 3.348 1.00 0.00 O ATOM 0 H ASP A 72 7.274 -11.134 2.243 1.00 0.00 H new ATOM 0 HA ASP A 72 5.136 -9.443 3.140 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.491 -9.533 4.116 1.00 0.00 H new ATOM 0 HB3 ASP A 72 8.096 -8.859 2.615 1.00 0.00 H new ATOM 1062 N TYR A 73 6.388 -9.112 0.136 1.00 0.00 N ATOM 1063 CA TYR A 73 6.286 -8.487 -1.169 1.00 0.00 C ATOM 1064 C TYR A 73 4.952 -8.811 -1.853 1.00 0.00 C ATOM 1065 O TYR A 73 4.164 -9.635 -1.371 1.00 0.00 O ATOM 1066 CB TYR A 73 7.503 -8.849 -2.044 1.00 0.00 C ATOM 1067 CG TYR A 73 8.699 -7.938 -1.841 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.304 -7.832 -0.574 1.00 0.00 C ATOM 1069 CD2 TYR A 73 9.195 -7.174 -2.918 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.394 -6.974 -0.373 1.00 0.00 C ATOM 1071 CE2 TYR A 73 10.294 -6.315 -2.724 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.907 -6.222 -1.451 1.00 0.00 C ATOM 1073 OH TYR A 73 11.995 -5.427 -1.255 1.00 0.00 O ATOM 0 H TYR A 73 6.978 -9.944 0.129 1.00 0.00 H new ATOM 0 HA TYR A 73 6.299 -7.406 -1.029 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.800 -9.876 -1.829 1.00 0.00 H new ATOM 0 HB3 TYR A 73 7.207 -8.816 -3.093 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.925 -8.417 0.251 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.732 -7.248 -3.891 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.841 -6.889 0.606 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.670 -5.726 -3.548 1.00 0.00 H new ATOM 0 HH TYR A 73 12.662 -5.608 -1.950 1.00 0.00 H new ATOM 1083 N ASP A 74 4.676 -8.113 -2.963 1.00 0.00 N ATOM 1084 CA ASP A 74 3.466 -8.311 -3.759 1.00 0.00 C ATOM 1085 C ASP A 74 3.796 -8.767 -5.182 1.00 0.00 C ATOM 1086 O ASP A 74 3.110 -9.650 -5.707 1.00 0.00 O ATOM 1087 CB ASP A 74 2.648 -7.020 -3.793 1.00 0.00 C ATOM 1088 CG ASP A 74 1.340 -7.220 -4.580 1.00 0.00 C ATOM 1089 OD1 ASP A 74 0.350 -7.696 -3.974 1.00 0.00 O ATOM 1090 OD2 ASP A 74 1.291 -6.859 -5.778 1.00 0.00 O ATOM 0 H ASP A 74 5.294 -7.390 -3.333 1.00 0.00 H new ATOM 0 HA ASP A 74 2.879 -9.099 -3.288 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.420 -6.702 -2.776 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.235 -6.224 -4.252 1.00 0.00 H new ATOM 1095 N VAL A 75 4.844 -8.209 -5.802 1.00 0.00 N ATOM 1096 CA VAL A 75 5.124 -8.407 -7.212 1.00 0.00 C ATOM 1097 C VAL A 75 6.624 -8.587 -7.429 1.00 0.00 C ATOM 1098 O VAL A 75 7.442 -7.829 -6.910 1.00 0.00 O ATOM 1099 CB VAL A 75 4.511 -7.250 -8.033 1.00 0.00 C ATOM 1100 CG1 VAL A 75 4.496 -5.864 -7.361 1.00 0.00 C ATOM 1101 CG2 VAL A 75 5.120 -7.183 -9.443 1.00 0.00 C ATOM 0 H VAL A 75 5.518 -7.607 -5.329 1.00 0.00 H new ATOM 0 HA VAL A 75 4.654 -9.324 -7.568 1.00 0.00 H new ATOM 0 HB VAL A 75 3.455 -7.513 -8.101 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.042 -5.138 -8.035 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.918 -5.913 -6.438 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.517 -5.559 -7.133 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.668 -6.359 -9.996 1.00 0.00 H new ATOM 0 HG22 VAL A 75 6.196 -7.023 -9.368 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.928 -8.119 -9.967 1.00 0.00 H new ATOM 1111 N VAL A 76 6.997 -9.580 -8.232 1.00 0.00 N ATOM 1112 CA VAL A 76 8.379 -9.877 -8.551 1.00 0.00 C ATOM 1113 C VAL A 76 8.369 -10.368 -9.995 1.00 0.00 C ATOM 1114 O VAL A 76 7.573 -11.242 -10.350 1.00 0.00 O ATOM 1115 CB VAL A 76 8.901 -10.949 -7.578 1.00 0.00 C ATOM 1116 CG1 VAL A 76 10.313 -11.438 -7.942 1.00 0.00 C ATOM 1117 CG2 VAL A 76 8.900 -10.531 -6.091 1.00 0.00 C ATOM 0 H VAL A 76 6.332 -10.208 -8.684 1.00 0.00 H new ATOM 0 HA VAL A 76 9.038 -9.014 -8.451 1.00 0.00 H new ATOM 0 HB VAL A 76 8.180 -11.758 -7.695 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.633 -12.193 -7.224 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.302 -11.871 -8.942 1.00 0.00 H new ATOM 0 HG13 VAL A 76 11.007 -10.597 -7.918 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.284 -11.350 -5.483 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.533 -9.653 -5.959 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.882 -10.294 -5.780 1.00 0.00 H new ATOM 1127 N ILE A 77 9.234 -9.798 -10.832 1.00 0.00 N ATOM 1128 CA ILE A 77 9.404 -10.200 -12.219 1.00 0.00 C ATOM 1129 C ILE A 77 10.709 -10.988 -12.292 1.00 0.00 C ATOM 1130 O ILE A 77 11.738 -10.488 -11.823 1.00 0.00 O ATOM 1131 CB ILE A 77 9.477 -8.965 -13.141 1.00 0.00 C ATOM 1132 CG1 ILE A 77 8.452 -7.846 -12.835 1.00 0.00 C ATOM 1133 CG2 ILE A 77 9.439 -9.366 -14.623 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.976 -8.231 -12.757 1.00 0.00 C ATOM 0 H ILE A 77 9.846 -9.030 -10.556 1.00 0.00 H new ATOM 0 HA ILE A 77 8.559 -10.803 -12.551 1.00 0.00 H new ATOM 0 HB ILE A 77 10.446 -8.518 -12.917 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.729 -7.389 -11.885 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.557 -7.078 -13.601 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.492 -8.471 -15.243 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.287 -10.014 -14.847 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.511 -9.898 -14.832 1.00 0.00 H new ATOM 0 HD11 ILE A 77 6.380 -7.345 -12.536 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.659 -8.653 -13.711 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.834 -8.970 -11.968 1.00 0.00 H new ATOM 1146 N SER A 78 10.681 -12.164 -12.909 1.00 0.00 N ATOM 1147 CA SER A 78 11.876 -12.902 -13.251 1.00 0.00 C ATOM 1148 C SER A 78 12.143 -12.550 -14.701 1.00 0.00 C ATOM 1149 O SER A 78 11.615 -13.188 -15.605 1.00 0.00 O ATOM 1150 CB SER A 78 11.679 -14.404 -13.076 1.00 0.00 C ATOM 1151 OG SER A 78 11.632 -14.718 -11.695 1.00 0.00 O ATOM 0 H SER A 78 9.817 -12.630 -13.185 1.00 0.00 H new ATOM 0 HA SER A 78 12.712 -12.642 -12.602 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.756 -14.719 -13.563 1.00 0.00 H new ATOM 0 HB3 SER A 78 12.494 -14.946 -13.555 1.00 0.00 H new ATOM 0 HG SER A 78 12.025 -15.604 -11.547 1.00 0.00 H new ATOM 1157 N LEU A 79 12.937 -11.504 -14.940 1.00 0.00 N ATOM 1158 CA LEU A 79 13.206 -10.986 -16.284 1.00 0.00 C ATOM 1159 C LEU A 79 13.891 -12.010 -17.185 1.00 0.00 C ATOM 1160 O LEU A 79 14.024 -11.755 -18.381 1.00 0.00 O ATOM 1161 CB LEU A 79 14.120 -9.755 -16.184 1.00 0.00 C ATOM 1162 CG LEU A 79 13.385 -8.478 -15.781 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.444 -7.459 -15.396 1.00 0.00 C ATOM 1164 CD2 LEU A 79 12.535 -7.915 -16.924 1.00 0.00 C ATOM 0 H LEU A 79 13.415 -10.989 -14.201 1.00 0.00 H new ATOM 0 HA LEU A 79 12.241 -10.735 -16.724 1.00 0.00 H new ATOM 0 HB2 LEU A 79 14.907 -9.956 -15.457 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.607 -9.596 -17.146 1.00 0.00 H new ATOM 0 HG LEU A 79 12.706 -8.698 -14.957 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.962 -6.527 -15.100 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.033 -7.843 -14.563 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.098 -7.274 -16.248 1.00 0.00 H new ATOM 0 HD21 LEU A 79 12.032 -7.008 -16.590 1.00 0.00 H new ATOM 0 HD22 LEU A 79 13.176 -7.682 -17.774 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.791 -8.654 -17.222 1.00 0.00 H new ATOM 1176 N CYS A 80 14.391 -13.103 -16.613 1.00 0.00 N ATOM 1177 CA CYS A 80 15.056 -14.184 -17.304 1.00 0.00 C ATOM 1178 C CYS A 80 14.641 -15.467 -16.582 1.00 0.00 C ATOM 1179 O CYS A 80 14.692 -15.499 -15.349 1.00 0.00 O ATOM 1180 CB CYS A 80 16.577 -13.966 -17.202 1.00 0.00 C ATOM 1181 SG CYS A 80 17.143 -12.336 -17.776 1.00 0.00 S ATOM 0 H CYS A 80 14.336 -13.258 -15.606 1.00 0.00 H new ATOM 0 HA CYS A 80 14.790 -14.237 -18.360 1.00 0.00 H new ATOM 0 HB2 CYS A 80 16.882 -14.098 -16.164 1.00 0.00 H new ATOM 0 HB3 CYS A 80 17.082 -14.738 -17.783 1.00 0.00 H new ATOM 1186 N GLY A 81 14.274 -16.514 -17.328 1.00 0.00 N ATOM 1187 CA GLY A 81 13.877 -17.805 -16.766 1.00 0.00 C ATOM 1188 C GLY A 81 12.703 -17.665 -15.790 1.00 0.00 C ATOM 1189 O GLY A 81 11.832 -16.808 -15.965 1.00 0.00 O ATOM 0 H GLY A 81 14.245 -16.487 -18.347 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.600 -18.483 -17.573 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.726 -18.254 -16.251 1.00 0.00 H new ATOM 1193 N SER A 82 12.689 -18.507 -14.752 1.00 0.00 N ATOM 1194 CA SER A 82 11.723 -18.442 -13.660 1.00 0.00 C ATOM 1195 C SER A 82 12.481 -18.408 -12.332 1.00 0.00 C ATOM 1196 O SER A 82 12.884 -17.330 -11.894 1.00 0.00 O ATOM 1197 CB SER A 82 10.679 -19.563 -13.801 1.00 0.00 C ATOM 1198 OG SER A 82 11.302 -20.826 -14.001 1.00 0.00 O ATOM 0 H SER A 82 13.363 -19.266 -14.649 1.00 0.00 H new ATOM 0 HA SER A 82 11.137 -17.523 -13.695 1.00 0.00 H new ATOM 0 HB2 SER A 82 10.058 -19.599 -12.906 1.00 0.00 H new ATOM 0 HB3 SER A 82 10.018 -19.344 -14.640 1.00 0.00 H new ATOM 0 HG SER A 82 10.615 -21.520 -14.086 1.00 0.00 H new ATOM 1204 N GLY A 83 12.699 -19.570 -11.708 1.00 0.00 N ATOM 1205 CA GLY A 83 13.378 -19.686 -10.421 1.00 0.00 C ATOM 1206 C GLY A 83 14.877 -19.439 -10.529 1.00 0.00 C ATOM 1207 O GLY A 83 15.471 -18.968 -9.565 1.00 0.00 O ATOM 0 H GLY A 83 12.403 -20.468 -12.092 1.00 0.00 H new ATOM 0 HA2 GLY A 83 12.945 -18.973 -9.720 1.00 0.00 H new ATOM 0 HA3 GLY A 83 13.205 -20.681 -10.011 1.00 0.00 H new ATOM 1211 N VAL A 84 15.485 -19.706 -11.693 1.00 0.00 N ATOM 1212 CA VAL A 84 16.909 -19.524 -11.993 1.00 0.00 C ATOM 1213 C VAL A 84 17.826 -20.097 -10.890 1.00 0.00 C ATOM 1214 O VAL A 84 18.140 -21.290 -10.920 1.00 0.00 O ATOM 1215 CB VAL A 84 17.228 -18.094 -12.512 1.00 0.00 C ATOM 1216 CG1 VAL A 84 16.633 -17.908 -13.918 1.00 0.00 C ATOM 1217 CG2 VAL A 84 16.720 -16.921 -11.651 1.00 0.00 C ATOM 0 H VAL A 84 14.968 -20.074 -12.492 1.00 0.00 H new ATOM 0 HA VAL A 84 17.161 -20.147 -12.851 1.00 0.00 H new ATOM 0 HB VAL A 84 18.317 -18.049 -12.486 1.00 0.00 H new ATOM 0 HG11 VAL A 84 16.859 -16.904 -14.279 1.00 0.00 H new ATOM 0 HG12 VAL A 84 17.066 -18.643 -14.596 1.00 0.00 H new ATOM 0 HG13 VAL A 84 15.552 -18.044 -13.877 1.00 0.00 H new ATOM 0 HG21 VAL A 84 17.004 -15.978 -12.117 1.00 0.00 H new ATOM 0 HG22 VAL A 84 15.634 -16.973 -11.570 1.00 0.00 H new ATOM 0 HG23 VAL A 84 17.162 -16.982 -10.656 1.00 0.00 H new ATOM 1227 N ASN A 85 18.257 -19.280 -9.926 1.00 0.00 N ATOM 1228 CA ASN A 85 19.101 -19.656 -8.789 1.00 0.00 C ATOM 1229 C ASN A 85 18.631 -18.857 -7.561 1.00 0.00 C ATOM 1230 O ASN A 85 19.426 -18.219 -6.865 1.00 0.00 O ATOM 1231 CB ASN A 85 20.577 -19.389 -9.139 1.00 0.00 C ATOM 1232 CG ASN A 85 21.540 -19.839 -8.040 1.00 0.00 C ATOM 1233 OD1 ASN A 85 21.265 -20.762 -7.274 1.00 0.00 O ATOM 1234 ND2 ASN A 85 22.709 -19.221 -7.965 1.00 0.00 N ATOM 0 H ASN A 85 18.015 -18.289 -9.917 1.00 0.00 H new ATOM 0 HA ASN A 85 19.015 -20.718 -8.559 1.00 0.00 H new ATOM 0 HB2 ASN A 85 20.825 -19.906 -10.066 1.00 0.00 H new ATOM 0 HB3 ASN A 85 20.715 -18.323 -9.322 1.00 0.00 H new ATOM 0 HD21 ASN A 85 23.394 -19.509 -7.266 1.00 0.00 H new ATOM 0 HD22 ASN A 85 22.924 -18.457 -8.606 1.00 0.00 H new ATOM 1241 N LEU A 86 17.310 -18.804 -7.356 1.00 0.00 N ATOM 1242 CA LEU A 86 16.635 -17.925 -6.401 1.00 0.00 C ATOM 1243 C LEU A 86 15.430 -18.648 -5.752 1.00 0.00 C ATOM 1244 O LEU A 86 14.823 -19.489 -6.422 1.00 0.00 O ATOM 1245 CB LEU A 86 16.299 -16.635 -7.183 1.00 0.00 C ATOM 1246 CG LEU A 86 15.132 -15.781 -6.668 1.00 0.00 C ATOM 1247 CD1 LEU A 86 15.383 -14.300 -6.978 1.00 0.00 C ATOM 1248 CD2 LEU A 86 13.830 -16.184 -7.380 1.00 0.00 C ATOM 0 H LEU A 86 16.659 -19.396 -7.872 1.00 0.00 H new ATOM 0 HA LEU A 86 17.254 -17.655 -5.545 1.00 0.00 H new ATOM 0 HB2 LEU A 86 17.192 -16.010 -7.201 1.00 0.00 H new ATOM 0 HB3 LEU A 86 16.084 -16.913 -8.215 1.00 0.00 H new ATOM 0 HG LEU A 86 15.049 -15.939 -5.593 1.00 0.00 H new ATOM 0 HD11 LEU A 86 14.549 -13.704 -6.608 1.00 0.00 H new ATOM 0 HD12 LEU A 86 16.303 -13.977 -6.491 1.00 0.00 H new ATOM 0 HD13 LEU A 86 15.476 -14.164 -8.056 1.00 0.00 H new ATOM 0 HD21 LEU A 86 13.008 -15.573 -7.008 1.00 0.00 H new ATOM 0 HD22 LEU A 86 13.940 -16.030 -8.454 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.618 -17.235 -7.184 1.00 0.00 H new ATOM 1260 N PRO A 87 15.082 -18.375 -4.469 1.00 0.00 N ATOM 1261 CA PRO A 87 14.079 -19.166 -3.749 1.00 0.00 C ATOM 1262 C PRO A 87 12.655 -19.077 -4.333 1.00 0.00 C ATOM 1263 O PRO A 87 12.278 -18.035 -4.874 1.00 0.00 O ATOM 1264 CB PRO A 87 14.144 -18.740 -2.279 1.00 0.00 C ATOM 1265 CG PRO A 87 15.558 -18.189 -2.138 1.00 0.00 C ATOM 1266 CD PRO A 87 15.818 -17.562 -3.504 1.00 0.00 C ATOM 0 HA PRO A 87 14.317 -20.224 -3.858 1.00 0.00 H new ATOM 0 HB2 PRO A 87 13.393 -17.986 -2.045 1.00 0.00 H new ATOM 0 HB3 PRO A 87 13.971 -19.581 -1.608 1.00 0.00 H new ATOM 0 HG2 PRO A 87 15.627 -17.454 -1.336 1.00 0.00 H new ATOM 0 HG3 PRO A 87 16.277 -18.976 -1.911 1.00 0.00 H new ATOM 0 HD2 PRO A 87 15.479 -16.526 -3.528 1.00 0.00 H new ATOM 0 HD3 PRO A 87 16.884 -17.554 -3.733 1.00 0.00 H new ATOM 1274 N PRO A 88 11.826 -20.129 -4.197 1.00 0.00 N ATOM 1275 CA PRO A 88 10.556 -20.230 -4.905 1.00 0.00 C ATOM 1276 C PRO A 88 9.486 -19.227 -4.502 1.00 0.00 C ATOM 1277 O PRO A 88 8.757 -18.790 -5.388 1.00 0.00 O ATOM 1278 CB PRO A 88 10.091 -21.679 -4.723 1.00 0.00 C ATOM 1279 CG PRO A 88 10.759 -22.108 -3.417 1.00 0.00 C ATOM 1280 CD PRO A 88 12.090 -21.362 -3.466 1.00 0.00 C ATOM 0 HA PRO A 88 10.719 -19.969 -5.951 1.00 0.00 H new ATOM 0 HB2 PRO A 88 9.005 -21.747 -4.659 1.00 0.00 H new ATOM 0 HB3 PRO A 88 10.401 -22.308 -5.558 1.00 0.00 H new ATOM 0 HG2 PRO A 88 10.167 -21.825 -2.546 1.00 0.00 H new ATOM 0 HG3 PRO A 88 10.900 -23.188 -3.369 1.00 0.00 H new ATOM 0 HD2 PRO A 88 12.457 -21.150 -2.462 1.00 0.00 H new ATOM 0 HD3 PRO A 88 12.854 -21.957 -3.966 1.00 0.00 H new ATOM 1288 N GLU A 89 9.377 -18.788 -3.246 1.00 0.00 N ATOM 1289 CA GLU A 89 8.322 -17.843 -2.872 1.00 0.00 C ATOM 1290 C GLU A 89 8.468 -16.498 -3.600 1.00 0.00 C ATOM 1291 O GLU A 89 7.504 -15.732 -3.670 1.00 0.00 O ATOM 1292 CB GLU A 89 8.203 -17.674 -1.347 1.00 0.00 C ATOM 1293 CG GLU A 89 9.453 -17.152 -0.624 1.00 0.00 C ATOM 1294 CD GLU A 89 10.333 -18.299 -0.093 1.00 0.00 C ATOM 1295 OE1 GLU A 89 10.964 -19.010 -0.911 1.00 0.00 O ATOM 1296 OE2 GLU A 89 10.389 -18.496 1.145 1.00 0.00 O ATOM 0 H GLU A 89 9.994 -19.065 -2.483 1.00 0.00 H new ATOM 0 HA GLU A 89 7.380 -18.277 -3.206 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.378 -16.992 -1.141 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.935 -18.638 -0.915 1.00 0.00 H new ATOM 0 HG2 GLU A 89 10.036 -16.534 -1.307 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.152 -16.512 0.205 1.00 0.00 H new ATOM 1303 N TRP A 90 9.632 -16.227 -4.199 1.00 0.00 N ATOM 1304 CA TRP A 90 9.843 -15.041 -5.010 1.00 0.00 C ATOM 1305 C TRP A 90 9.199 -15.171 -6.392 1.00 0.00 C ATOM 1306 O TRP A 90 8.879 -14.151 -6.994 1.00 0.00 O ATOM 1307 CB TRP A 90 11.345 -14.756 -5.086 1.00 0.00 C ATOM 1308 CG TRP A 90 11.964 -14.283 -3.804 1.00 0.00 C ATOM 1309 CD1 TRP A 90 12.679 -15.022 -2.930 1.00 0.00 C ATOM 1310 CD2 TRP A 90 11.849 -12.967 -3.193 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.982 -14.263 -1.812 1.00 0.00 N ATOM 1312 CE2 TRP A 90 12.439 -12.996 -1.898 1.00 0.00 C ATOM 1313 CE3 TRP A 90 11.240 -11.771 -3.598 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 12.381 -11.892 -1.031 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 11.139 -10.672 -2.734 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.710 -10.730 -1.454 1.00 0.00 C ATOM 0 H TRP A 90 10.452 -16.830 -4.130 1.00 0.00 H new ATOM 0 HA TRP A 90 9.349 -14.190 -4.541 1.00 0.00 H new ATOM 0 HB2 TRP A 90 11.856 -15.664 -5.406 1.00 0.00 H new ATOM 0 HB3 TRP A 90 11.519 -14.004 -5.856 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.971 -16.051 -3.080 1.00 0.00 H new ATOM 0 HE1 TRP A 90 13.537 -14.598 -1.024 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.840 -11.695 -4.598 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.844 -11.935 -0.056 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.621 -9.780 -3.054 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.634 -9.880 -0.792 1.00 0.00 H new ATOM 1327 N VAL A 91 8.958 -16.385 -6.890 1.00 0.00 N ATOM 1328 CA VAL A 91 8.318 -16.645 -8.164 1.00 0.00 C ATOM 1329 C VAL A 91 6.868 -17.108 -8.025 1.00 0.00 C ATOM 1330 O VAL A 91 6.171 -17.181 -9.034 1.00 0.00 O ATOM 1331 CB VAL A 91 9.207 -17.548 -9.035 1.00 0.00 C ATOM 1332 CG1 VAL A 91 10.504 -16.809 -9.380 1.00 0.00 C ATOM 1333 CG2 VAL A 91 9.576 -18.895 -8.405 1.00 0.00 C ATOM 0 H VAL A 91 9.215 -17.238 -6.394 1.00 0.00 H new ATOM 0 HA VAL A 91 8.224 -15.701 -8.700 1.00 0.00 H new ATOM 0 HB VAL A 91 8.609 -17.772 -9.919 1.00 0.00 H new ATOM 0 HG11 VAL A 91 11.134 -17.449 -9.997 1.00 0.00 H new ATOM 0 HG12 VAL A 91 10.268 -15.896 -9.927 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.034 -16.555 -8.462 1.00 0.00 H new ATOM 0 HG21 VAL A 91 10.204 -19.459 -9.095 1.00 0.00 H new ATOM 0 HG22 VAL A 91 10.120 -18.725 -7.476 1.00 0.00 H new ATOM 0 HG23 VAL A 91 8.668 -19.460 -8.196 1.00 0.00 H new ATOM 1343 N THR A 92 6.381 -17.361 -6.808 1.00 0.00 N ATOM 1344 CA THR A 92 4.955 -17.577 -6.554 1.00 0.00 C ATOM 1345 C THR A 92 4.450 -16.394 -5.713 1.00 0.00 C ATOM 1346 O THR A 92 4.198 -16.475 -4.508 1.00 0.00 O ATOM 1347 CB THR A 92 4.690 -19.020 -6.064 1.00 0.00 C ATOM 1348 OG1 THR A 92 3.303 -19.260 -5.896 1.00 0.00 O ATOM 1349 CG2 THR A 92 5.455 -19.410 -4.796 1.00 0.00 C ATOM 0 H THR A 92 6.963 -17.422 -5.972 1.00 0.00 H new ATOM 0 HA THR A 92 4.338 -17.557 -7.453 1.00 0.00 H new ATOM 0 HB THR A 92 5.077 -19.660 -6.857 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.165 -20.180 -5.587 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.210 -20.437 -4.524 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.527 -19.329 -4.978 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.174 -18.742 -3.982 1.00 0.00 H new ATOM 1357 N GLN A 93 4.385 -15.242 -6.384 1.00 0.00 N ATOM 1358 CA GLN A 93 3.856 -13.983 -5.891 1.00 0.00 C ATOM 1359 C GLN A 93 2.434 -13.786 -6.440 1.00 0.00 C ATOM 1360 O GLN A 93 1.943 -14.625 -7.204 1.00 0.00 O ATOM 1361 CB GLN A 93 4.835 -12.871 -6.303 1.00 0.00 C ATOM 1362 CG GLN A 93 6.144 -12.944 -5.507 1.00 0.00 C ATOM 1363 CD GLN A 93 5.970 -12.446 -4.071 1.00 0.00 C ATOM 1364 OE1 GLN A 93 5.770 -11.254 -3.857 1.00 0.00 O ATOM 1365 NE2 GLN A 93 6.028 -13.323 -3.080 1.00 0.00 N ATOM 0 H GLN A 93 4.723 -15.166 -7.344 1.00 0.00 H new ATOM 0 HA GLN A 93 3.771 -13.965 -4.804 1.00 0.00 H new ATOM 0 HB2 GLN A 93 5.052 -12.953 -7.368 1.00 0.00 H new ATOM 0 HB3 GLN A 93 4.368 -11.899 -6.147 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.503 -13.973 -5.493 1.00 0.00 H new ATOM 0 HG3 GLN A 93 6.907 -12.347 -6.008 1.00 0.00 H new ATOM 0 HE21 GLN A 93 6.195 -14.309 -3.281 1.00 0.00 H new ATOM 0 HE22 GLN A 93 5.905 -13.012 -2.116 1.00 0.00 H new ATOM 1374 N GLU A 94 1.768 -12.680 -6.087 1.00 0.00 N ATOM 1375 CA GLU A 94 0.409 -12.401 -6.560 1.00 0.00 C ATOM 1376 C GLU A 94 0.389 -12.194 -8.085 1.00 0.00 C ATOM 1377 O GLU A 94 -0.635 -12.421 -8.734 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.188 -11.189 -5.825 1.00 0.00 C ATOM 1379 CG GLU A 94 -0.375 -11.413 -4.316 1.00 0.00 C ATOM 1380 CD GLU A 94 -1.332 -12.582 -4.003 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -2.568 -12.417 -4.155 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -0.857 -13.669 -3.589 1.00 0.00 O ATOM 0 H GLU A 94 2.151 -11.962 -5.473 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.213 -13.267 -6.335 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.461 -10.327 -5.978 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.153 -10.945 -6.269 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.595 -11.610 -3.859 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -0.762 -10.500 -3.862 1.00 0.00 H new ATOM 1389 N ILE A 95 1.528 -11.800 -8.665 1.00 0.00 N ATOM 1390 CA ILE A 95 1.778 -11.761 -10.097 1.00 0.00 C ATOM 1391 C ILE A 95 3.216 -12.262 -10.284 1.00 0.00 C ATOM 1392 O ILE A 95 4.131 -11.795 -9.600 1.00 0.00 O ATOM 1393 CB ILE A 95 1.497 -10.353 -10.686 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.949 -10.251 -12.161 1.00 0.00 C ATOM 1395 CG2 ILE A 95 2.135 -9.236 -9.839 1.00 0.00 C ATOM 1396 CD1 ILE A 95 1.337 -9.072 -12.940 1.00 0.00 C ATOM 0 H ILE A 95 2.331 -11.487 -8.119 1.00 0.00 H new ATOM 0 HA ILE A 95 1.100 -12.404 -10.658 1.00 0.00 H new ATOM 0 HB ILE A 95 0.417 -10.212 -10.656 1.00 0.00 H new ATOM 0 HG12 ILE A 95 3.035 -10.163 -12.189 1.00 0.00 H new ATOM 0 HG13 ILE A 95 1.691 -11.179 -12.671 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.913 -8.268 -10.288 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.729 -9.269 -8.828 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.215 -9.380 -9.801 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.710 -9.080 -13.964 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.251 -9.166 -12.949 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.616 -8.134 -12.459 1.00 0.00 H new ATOM 1408 N PHE A 96 3.406 -13.220 -11.192 1.00 0.00 N ATOM 1409 CA PHE A 96 4.709 -13.670 -11.664 1.00 0.00 C ATOM 1410 C PHE A 96 4.782 -13.256 -13.141 1.00 0.00 C ATOM 1411 O PHE A 96 3.807 -13.448 -13.874 1.00 0.00 O ATOM 1412 CB PHE A 96 4.873 -15.183 -11.478 1.00 0.00 C ATOM 1413 CG PHE A 96 6.018 -15.763 -12.288 1.00 0.00 C ATOM 1414 CD1 PHE A 96 7.343 -15.630 -11.832 1.00 0.00 C ATOM 1415 CD2 PHE A 96 5.767 -16.371 -13.533 1.00 0.00 C ATOM 1416 CE1 PHE A 96 8.408 -16.111 -12.614 1.00 0.00 C ATOM 1417 CE2 PHE A 96 6.835 -16.835 -14.321 1.00 0.00 C ATOM 1418 CZ PHE A 96 8.158 -16.699 -13.866 1.00 0.00 C ATOM 0 H PHE A 96 2.631 -13.717 -11.631 1.00 0.00 H new ATOM 0 HA PHE A 96 5.523 -13.221 -11.095 1.00 0.00 H new ATOM 0 HB2 PHE A 96 5.038 -15.397 -10.422 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.946 -15.680 -11.763 1.00 0.00 H new ATOM 0 HD1 PHE A 96 7.542 -15.158 -10.881 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.751 -16.481 -13.884 1.00 0.00 H new ATOM 0 HE1 PHE A 96 9.422 -16.028 -12.251 1.00 0.00 H new ATOM 0 HE2 PHE A 96 6.639 -17.297 -15.277 1.00 0.00 H new ATOM 0 HZ PHE A 96 8.979 -17.045 -14.476 1.00 0.00 H new ATOM 1428 N GLU A 97 5.911 -12.697 -13.578 1.00 0.00 N ATOM 1429 CA GLU A 97 6.134 -12.258 -14.954 1.00 0.00 C ATOM 1430 C GLU A 97 7.576 -12.553 -15.356 1.00 0.00 C ATOM 1431 O GLU A 97 8.432 -12.797 -14.504 1.00 0.00 O ATOM 1432 CB GLU A 97 5.840 -10.762 -15.103 1.00 0.00 C ATOM 1433 CG GLU A 97 4.363 -10.352 -15.112 1.00 0.00 C ATOM 1434 CD GLU A 97 3.630 -10.632 -16.442 1.00 0.00 C ATOM 1435 OE1 GLU A 97 4.004 -11.560 -17.198 1.00 0.00 O ATOM 1436 OE2 GLU A 97 2.652 -9.904 -16.741 1.00 0.00 O ATOM 0 H GLU A 97 6.714 -12.534 -12.970 1.00 0.00 H new ATOM 0 HA GLU A 97 5.456 -12.803 -15.610 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.335 -10.234 -14.288 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.296 -10.416 -16.031 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.847 -10.879 -14.309 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.293 -9.287 -14.890 1.00 0.00 H new ATOM 1443 N ASP A 98 7.816 -12.528 -16.665 1.00 0.00 N ATOM 1444 CA ASP A 98 9.018 -12.971 -17.356 1.00 0.00 C ATOM 1445 C ASP A 98 8.872 -12.559 -18.817 1.00 0.00 C ATOM 1446 O ASP A 98 7.824 -12.818 -19.421 1.00 0.00 O ATOM 1447 CB ASP A 98 9.180 -14.501 -17.286 1.00 0.00 C ATOM 1448 CG ASP A 98 10.139 -15.038 -18.374 1.00 0.00 C ATOM 1449 OD1 ASP A 98 11.258 -14.500 -18.562 1.00 0.00 O ATOM 1450 OD2 ASP A 98 9.756 -16.019 -19.061 1.00 0.00 O ATOM 0 H ASP A 98 7.119 -12.169 -17.318 1.00 0.00 H new ATOM 0 HA ASP A 98 9.893 -12.522 -16.887 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.557 -14.780 -16.302 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.204 -14.973 -17.399 1.00 0.00 H new ATOM 1455 N TRP A 99 9.892 -11.897 -19.372 1.00 0.00 N ATOM 1456 CA TRP A 99 9.802 -11.275 -20.690 1.00 0.00 C ATOM 1457 C TRP A 99 11.121 -11.364 -21.454 1.00 0.00 C ATOM 1458 O TRP A 99 12.201 -11.325 -20.862 1.00 0.00 O ATOM 1459 CB TRP A 99 9.397 -9.799 -20.552 1.00 0.00 C ATOM 1460 CG TRP A 99 8.095 -9.505 -19.867 1.00 0.00 C ATOM 1461 CD1 TRP A 99 6.874 -9.997 -20.184 1.00 0.00 C ATOM 1462 CD2 TRP A 99 7.872 -8.648 -18.714 1.00 0.00 C ATOM 1463 NE1 TRP A 99 5.930 -9.525 -19.288 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.489 -8.668 -18.372 1.00 0.00 C ATOM 1465 CE3 TRP A 99 8.720 -7.867 -17.911 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 5.970 -7.944 -17.290 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 8.216 -7.183 -16.796 1.00 0.00 C ATOM 1468 CH2 TRP A 99 6.851 -7.210 -16.486 1.00 0.00 C ATOM 0 H TRP A 99 10.799 -11.779 -18.920 1.00 0.00 H new ATOM 0 HA TRP A 99 9.044 -11.820 -21.253 1.00 0.00 H new ATOM 0 HB2 TRP A 99 10.188 -9.281 -20.010 1.00 0.00 H new ATOM 0 HB3 TRP A 99 9.358 -9.365 -21.551 1.00 0.00 H new ATOM 0 HD1 TRP A 99 6.667 -10.659 -21.012 1.00 0.00 H new ATOM 0 HE1 TRP A 99 4.943 -9.782 -19.306 1.00 0.00 H new ATOM 0 HE3 TRP A 99 9.769 -7.793 -18.155 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 4.911 -7.952 -17.080 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 8.892 -6.625 -16.165 1.00 0.00 H new ATOM 0 HH2 TRP A 99 6.479 -6.667 -15.630 1.00 0.00 H new ATOM 1479 N GLN A 100 11.033 -11.348 -22.788 1.00 0.00 N ATOM 1480 CA GLN A 100 12.179 -11.335 -23.693 1.00 0.00 C ATOM 1481 C GLN A 100 12.618 -9.882 -23.943 1.00 0.00 C ATOM 1482 O GLN A 100 12.724 -9.434 -25.087 1.00 0.00 O ATOM 1483 CB GLN A 100 11.866 -12.124 -24.982 1.00 0.00 C ATOM 1484 CG GLN A 100 11.620 -13.630 -24.765 1.00 0.00 C ATOM 1485 CD GLN A 100 10.221 -13.958 -24.231 1.00 0.00 C ATOM 1486 OE1 GLN A 100 10.037 -14.282 -23.060 1.00 0.00 O ATOM 1487 NE2 GLN A 100 9.196 -13.865 -25.071 1.00 0.00 N ATOM 0 H GLN A 100 10.138 -11.344 -23.277 1.00 0.00 H new ATOM 0 HA GLN A 100 13.026 -11.847 -23.237 1.00 0.00 H new ATOM 0 HB2 GLN A 100 10.985 -11.689 -25.454 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.695 -12.001 -25.679 1.00 0.00 H new ATOM 0 HG2 GLN A 100 11.770 -14.153 -25.710 1.00 0.00 H new ATOM 0 HG3 GLN A 100 12.364 -14.013 -24.067 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.355 -13.596 -26.042 1.00 0.00 H new ATOM 0 HE22 GLN A 100 8.250 -14.063 -24.745 1.00 0.00 H new ATOM 1496 N LEU A 101 12.832 -9.124 -22.860 1.00 0.00 N ATOM 1497 CA LEU A 101 13.456 -7.805 -22.936 1.00 0.00 C ATOM 1498 C LEU A 101 14.902 -8.034 -23.359 1.00 0.00 C ATOM 1499 O LEU A 101 15.567 -8.918 -22.826 1.00 0.00 O ATOM 1500 CB LEU A 101 13.369 -7.084 -21.568 1.00 0.00 C ATOM 1501 CG LEU A 101 12.257 -6.028 -21.411 1.00 0.00 C ATOM 1502 CD1 LEU A 101 10.933 -6.379 -22.082 1.00 0.00 C ATOM 1503 CD2 LEU A 101 11.986 -5.803 -19.918 1.00 0.00 C ATOM 0 H LEU A 101 12.578 -9.409 -21.914 1.00 0.00 H new ATOM 0 HA LEU A 101 12.947 -7.163 -23.655 1.00 0.00 H new ATOM 0 HB2 LEU A 101 13.233 -7.839 -20.794 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.327 -6.600 -21.377 1.00 0.00 H new ATOM 0 HG LEU A 101 12.632 -5.136 -21.912 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.216 -5.575 -21.915 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.091 -6.508 -23.153 1.00 0.00 H new ATOM 0 HD13 LEU A 101 10.545 -7.305 -21.658 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.200 -5.057 -19.799 1.00 0.00 H new ATOM 0 HD22 LEU A 101 11.669 -6.740 -19.461 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.896 -5.452 -19.432 1.00 0.00 H new ATOM 1515 N GLU A 102 15.390 -7.247 -24.313 1.00 0.00 N ATOM 1516 CA GLU A 102 16.776 -7.283 -24.752 1.00 0.00 C ATOM 1517 C GLU A 102 17.653 -6.435 -23.813 1.00 0.00 C ATOM 1518 O GLU A 102 17.142 -5.760 -22.918 1.00 0.00 O ATOM 1519 CB GLU A 102 16.866 -7.014 -26.263 1.00 0.00 C ATOM 1520 CG GLU A 102 16.460 -5.602 -26.671 1.00 0.00 C ATOM 1521 CD GLU A 102 15.986 -5.553 -28.135 1.00 0.00 C ATOM 1522 OE1 GLU A 102 16.840 -5.582 -29.054 1.00 0.00 O ATOM 1523 OE2 GLU A 102 14.753 -5.488 -28.362 1.00 0.00 O ATOM 0 H GLU A 102 14.824 -6.558 -24.808 1.00 0.00 H new ATOM 0 HA GLU A 102 17.207 -8.280 -24.658 1.00 0.00 H new ATOM 0 HB2 GLU A 102 17.889 -7.196 -26.593 1.00 0.00 H new ATOM 0 HB3 GLU A 102 16.231 -7.728 -26.786 1.00 0.00 H new ATOM 0 HG2 GLU A 102 15.663 -5.248 -26.017 1.00 0.00 H new ATOM 0 HG3 GLU A 102 17.305 -4.926 -26.538 1.00 0.00 H new ATOM 1530 N ASP A 103 18.975 -6.503 -23.976 1.00 0.00 N ATOM 1531 CA ASP A 103 19.975 -5.953 -23.072 1.00 0.00 C ATOM 1532 C ASP A 103 21.009 -5.147 -23.869 1.00 0.00 C ATOM 1533 O ASP A 103 21.479 -5.626 -24.909 1.00 0.00 O ATOM 1534 CB ASP A 103 20.642 -7.099 -22.295 1.00 0.00 C ATOM 1535 CG ASP A 103 22.124 -6.816 -21.996 1.00 0.00 C ATOM 1536 OD1 ASP A 103 22.399 -5.817 -21.296 1.00 0.00 O ATOM 1537 OD2 ASP A 103 22.986 -7.593 -22.470 1.00 0.00 O ATOM 0 H ASP A 103 19.393 -6.967 -24.783 1.00 0.00 H new ATOM 0 HA ASP A 103 19.501 -5.280 -22.358 1.00 0.00 H new ATOM 0 HB2 ASP A 103 20.109 -7.259 -21.358 1.00 0.00 H new ATOM 0 HB3 ASP A 103 20.559 -8.021 -22.870 1.00 0.00 H new ATOM 1542 N PRO A 104 21.361 -3.927 -23.421 1.00 0.00 N ATOM 1543 CA PRO A 104 22.244 -3.040 -24.155 1.00 0.00 C ATOM 1544 C PRO A 104 23.705 -3.089 -23.672 1.00 0.00 C ATOM 1545 O PRO A 104 24.506 -2.311 -24.185 1.00 0.00 O ATOM 1546 CB PRO A 104 21.615 -1.671 -23.928 1.00 0.00 C ATOM 1547 CG PRO A 104 21.198 -1.739 -22.460 1.00 0.00 C ATOM 1548 CD PRO A 104 20.772 -3.196 -22.301 1.00 0.00 C ATOM 0 HA PRO A 104 22.323 -3.317 -25.206 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.323 -0.863 -24.112 1.00 0.00 H new ATOM 0 HB3 PRO A 104 20.762 -1.502 -24.585 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.021 -1.482 -21.793 1.00 0.00 H new ATOM 0 HG3 PRO A 104 20.382 -1.052 -22.238 1.00 0.00 H new ATOM 0 HD2 PRO A 104 21.119 -3.600 -21.350 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.686 -3.285 -22.308 1.00 0.00 H new ATOM 1556 N ASP A 105 24.071 -3.933 -22.697 1.00 0.00 N ATOM 1557 CA ASP A 105 25.409 -3.949 -22.101 1.00 0.00 C ATOM 1558 C ASP A 105 26.492 -4.010 -23.192 1.00 0.00 C ATOM 1559 O ASP A 105 26.571 -4.992 -23.941 1.00 0.00 O ATOM 1560 CB ASP A 105 25.604 -5.156 -21.183 1.00 0.00 C ATOM 1561 CG ASP A 105 27.094 -5.303 -20.815 1.00 0.00 C ATOM 1562 OD1 ASP A 105 27.714 -4.301 -20.379 1.00 0.00 O ATOM 1563 OD2 ASP A 105 27.644 -6.427 -20.927 1.00 0.00 O ATOM 0 H ASP A 105 23.440 -4.628 -22.299 1.00 0.00 H new ATOM 0 HA ASP A 105 25.501 -3.030 -21.522 1.00 0.00 H new ATOM 0 HB2 ASP A 105 25.008 -5.036 -20.279 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.252 -6.061 -21.679 1.00 0.00 H new ATOM 1568 N GLY A 106 27.319 -2.961 -23.293 1.00 0.00 N ATOM 1569 CA GLY A 106 28.419 -2.888 -24.251 1.00 0.00 C ATOM 1570 C GLY A 106 27.982 -2.802 -25.722 1.00 0.00 C ATOM 1571 O GLY A 106 28.842 -2.853 -26.606 1.00 0.00 O ATOM 0 H GLY A 106 27.238 -2.133 -22.703 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.031 -2.017 -24.016 1.00 0.00 H new ATOM 0 HA3 GLY A 106 29.052 -3.766 -24.125 1.00 0.00 H new ATOM 1575 N GLN A 107 26.680 -2.688 -26.006 1.00 0.00 N ATOM 1576 CA GLN A 107 26.135 -2.566 -27.353 1.00 0.00 C ATOM 1577 C GLN A 107 26.109 -1.085 -27.775 1.00 0.00 C ATOM 1578 O GLN A 107 26.373 -0.183 -26.971 1.00 0.00 O ATOM 1579 CB GLN A 107 24.736 -3.214 -27.441 1.00 0.00 C ATOM 1580 CG GLN A 107 24.657 -4.667 -26.924 1.00 0.00 C ATOM 1581 CD GLN A 107 23.899 -5.613 -27.860 1.00 0.00 C ATOM 1582 OE1 GLN A 107 24.271 -5.792 -29.019 1.00 0.00 O ATOM 1583 NE2 GLN A 107 22.829 -6.248 -27.390 1.00 0.00 N ATOM 0 H GLN A 107 25.961 -2.678 -25.283 1.00 0.00 H new ATOM 0 HA GLN A 107 26.779 -3.104 -28.049 1.00 0.00 H new ATOM 0 HB2 GLN A 107 24.033 -2.604 -26.874 1.00 0.00 H new ATOM 0 HB3 GLN A 107 24.408 -3.196 -28.480 1.00 0.00 H new ATOM 0 HG2 GLN A 107 25.668 -5.047 -26.779 1.00 0.00 H new ATOM 0 HG3 GLN A 107 24.172 -4.670 -25.948 1.00 0.00 H new ATOM 0 HE21 GLN A 107 22.527 -6.095 -26.428 1.00 0.00 H new ATOM 0 HE22 GLN A 107 22.311 -6.888 -27.992 1.00 0.00 H new ATOM 1592 N SER A 108 25.780 -0.831 -29.043 1.00 0.00 N ATOM 1593 CA SER A 108 25.643 0.512 -29.593 1.00 0.00 C ATOM 1594 C SER A 108 24.412 1.217 -28.997 1.00 0.00 C ATOM 1595 O SER A 108 23.495 0.569 -28.486 1.00 0.00 O ATOM 1596 CB SER A 108 25.582 0.416 -31.129 1.00 0.00 C ATOM 1597 OG SER A 108 26.675 -0.351 -31.622 1.00 0.00 O ATOM 0 H SER A 108 25.599 -1.568 -29.725 1.00 0.00 H new ATOM 0 HA SER A 108 26.506 1.120 -29.324 1.00 0.00 H new ATOM 0 HB2 SER A 108 24.641 -0.042 -31.434 1.00 0.00 H new ATOM 0 HB3 SER A 108 25.606 1.415 -31.563 1.00 0.00 H new ATOM 0 HG SER A 108 26.622 -0.405 -32.599 1.00 0.00 H new ATOM 1603 N LEU A 109 24.358 2.553 -29.090 1.00 0.00 N ATOM 1604 CA LEU A 109 23.320 3.364 -28.437 1.00 0.00 C ATOM 1605 C LEU A 109 21.924 3.061 -28.967 1.00 0.00 C ATOM 1606 O LEU A 109 20.957 3.219 -28.228 1.00 0.00 O ATOM 1607 CB LEU A 109 23.632 4.870 -28.527 1.00 0.00 C ATOM 1608 CG LEU A 109 24.977 5.315 -27.909 1.00 0.00 C ATOM 1609 CD1 LEU A 109 25.011 6.844 -27.827 1.00 0.00 C ATOM 1610 CD2 LEU A 109 25.243 4.717 -26.519 1.00 0.00 C ATOM 0 H LEU A 109 25.034 3.103 -29.621 1.00 0.00 H new ATOM 0 HA LEU A 109 23.330 3.083 -27.384 1.00 0.00 H new ATOM 0 HB2 LEU A 109 23.622 5.162 -29.577 1.00 0.00 H new ATOM 0 HB3 LEU A 109 22.828 5.419 -28.036 1.00 0.00 H new ATOM 0 HG LEU A 109 25.765 4.940 -28.561 1.00 0.00 H new ATOM 0 HD11 LEU A 109 25.958 7.164 -27.392 1.00 0.00 H new ATOM 0 HD12 LEU A 109 24.911 7.264 -28.828 1.00 0.00 H new ATOM 0 HD13 LEU A 109 24.188 7.193 -27.203 1.00 0.00 H new ATOM 0 HD21 LEU A 109 26.204 5.073 -26.148 1.00 0.00 H new ATOM 0 HD22 LEU A 109 24.453 5.024 -25.834 1.00 0.00 H new ATOM 0 HD23 LEU A 109 25.261 3.629 -26.588 1.00 0.00 H new ATOM 1622 N GLU A 110 21.797 2.551 -30.194 1.00 0.00 N ATOM 1623 CA GLU A 110 20.524 2.073 -30.739 1.00 0.00 C ATOM 1624 C GLU A 110 19.892 1.020 -29.826 1.00 0.00 C ATOM 1625 O GLU A 110 18.675 1.011 -29.654 1.00 0.00 O ATOM 1626 CB GLU A 110 20.709 1.513 -32.162 1.00 0.00 C ATOM 1627 CG GLU A 110 21.912 0.584 -32.372 1.00 0.00 C ATOM 1628 CD GLU A 110 21.970 0.063 -33.821 1.00 0.00 C ATOM 1629 OE1 GLU A 110 21.316 -0.964 -34.131 1.00 0.00 O ATOM 1630 OE2 GLU A 110 22.677 0.670 -34.662 1.00 0.00 O ATOM 0 H GLU A 110 22.579 2.457 -30.842 1.00 0.00 H new ATOM 0 HA GLU A 110 19.847 2.926 -30.792 1.00 0.00 H new ATOM 0 HB2 GLU A 110 19.805 0.970 -32.437 1.00 0.00 H new ATOM 0 HB3 GLU A 110 20.799 2.352 -32.852 1.00 0.00 H new ATOM 0 HG2 GLU A 110 22.833 1.119 -32.138 1.00 0.00 H new ATOM 0 HG3 GLU A 110 21.849 -0.258 -31.683 1.00 0.00 H new ATOM 1637 N VAL A 111 20.699 0.178 -29.189 1.00 0.00 N ATOM 1638 CA VAL A 111 20.215 -0.879 -28.316 1.00 0.00 C ATOM 1639 C VAL A 111 19.793 -0.274 -26.984 1.00 0.00 C ATOM 1640 O VAL A 111 18.716 -0.603 -26.511 1.00 0.00 O ATOM 1641 CB VAL A 111 21.251 -2.012 -28.204 1.00 0.00 C ATOM 1642 CG1 VAL A 111 20.647 -3.256 -27.544 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.796 -2.402 -29.593 1.00 0.00 C ATOM 0 H VAL A 111 21.715 0.213 -29.267 1.00 0.00 H new ATOM 0 HA VAL A 111 19.328 -1.352 -28.738 1.00 0.00 H new ATOM 0 HB VAL A 111 22.066 -1.637 -27.585 1.00 0.00 H new ATOM 0 HG11 VAL A 111 21.404 -4.038 -27.480 1.00 0.00 H new ATOM 0 HG12 VAL A 111 20.300 -3.004 -26.542 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.807 -3.613 -28.140 1.00 0.00 H new ATOM 0 HG21 VAL A 111 22.526 -3.204 -29.485 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.975 -2.741 -30.224 1.00 0.00 H new ATOM 0 HG23 VAL A 111 22.273 -1.537 -30.053 1.00 0.00 H new ATOM 1653 N PHE A 112 20.544 0.671 -26.405 1.00 0.00 N ATOM 1654 CA PHE A 112 20.098 1.395 -25.208 1.00 0.00 C ATOM 1655 C PHE A 112 18.757 2.089 -25.475 1.00 0.00 C ATOM 1656 O PHE A 112 17.825 1.952 -24.686 1.00 0.00 O ATOM 1657 CB PHE A 112 21.176 2.401 -24.767 1.00 0.00 C ATOM 1658 CG PHE A 112 22.367 1.783 -24.054 1.00 0.00 C ATOM 1659 CD1 PHE A 112 22.269 1.468 -22.685 1.00 0.00 C ATOM 1660 CD2 PHE A 112 23.568 1.516 -24.739 1.00 0.00 C ATOM 1661 CE1 PHE A 112 23.343 0.841 -22.025 1.00 0.00 C ATOM 1662 CE2 PHE A 112 24.649 0.920 -24.067 1.00 0.00 C ATOM 1663 CZ PHE A 112 24.533 0.566 -22.715 1.00 0.00 C ATOM 0 H PHE A 112 21.463 0.952 -26.746 1.00 0.00 H new ATOM 0 HA PHE A 112 19.948 0.685 -24.394 1.00 0.00 H new ATOM 0 HB2 PHE A 112 21.534 2.938 -25.646 1.00 0.00 H new ATOM 0 HB3 PHE A 112 20.718 3.138 -24.108 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.368 1.708 -22.140 1.00 0.00 H new ATOM 0 HD2 PHE A 112 23.659 1.770 -25.785 1.00 0.00 H new ATOM 0 HE1 PHE A 112 23.250 0.571 -20.983 1.00 0.00 H new ATOM 0 HE2 PHE A 112 25.573 0.734 -24.594 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.356 0.084 -22.208 1.00 0.00 H new ATOM 1673 N ARG A 113 18.619 2.760 -26.621 1.00 0.00 N ATOM 1674 CA ARG A 113 17.385 3.460 -27.003 1.00 0.00 C ATOM 1675 C ARG A 113 16.231 2.468 -27.162 1.00 0.00 C ATOM 1676 O ARG A 113 15.145 2.693 -26.634 1.00 0.00 O ATOM 1677 CB ARG A 113 17.652 4.252 -28.298 1.00 0.00 C ATOM 1678 CG ARG A 113 18.611 5.437 -28.066 1.00 0.00 C ATOM 1679 CD ARG A 113 19.271 5.912 -29.367 1.00 0.00 C ATOM 1680 NE ARG A 113 20.176 7.054 -29.128 1.00 0.00 N ATOM 1681 CZ ARG A 113 20.938 7.666 -30.048 1.00 0.00 C ATOM 1682 NH1 ARG A 113 20.923 7.265 -31.318 1.00 0.00 N ATOM 1683 NH2 ARG A 113 21.720 8.681 -29.688 1.00 0.00 N ATOM 0 H ARG A 113 19.363 2.835 -27.315 1.00 0.00 H new ATOM 0 HA ARG A 113 17.089 4.159 -26.221 1.00 0.00 H new ATOM 0 HB2 ARG A 113 18.075 3.585 -29.049 1.00 0.00 H new ATOM 0 HB3 ARG A 113 16.708 4.623 -28.697 1.00 0.00 H new ATOM 0 HG2 ARG A 113 18.062 6.264 -27.616 1.00 0.00 H new ATOM 0 HG3 ARG A 113 19.383 5.143 -27.355 1.00 0.00 H new ATOM 0 HD2 ARG A 113 19.830 5.090 -29.814 1.00 0.00 H new ATOM 0 HD3 ARG A 113 18.501 6.200 -30.083 1.00 0.00 H new ATOM 0 HE ARG A 113 20.227 7.411 -28.174 1.00 0.00 H new ATOM 0 HH11 ARG A 113 20.328 6.486 -31.600 1.00 0.00 H new ATOM 0 HH12 ARG A 113 21.506 7.737 -32.009 1.00 0.00 H new ATOM 0 HH21 ARG A 113 21.739 8.991 -28.716 1.00 0.00 H new ATOM 0 HH22 ARG A 113 22.301 9.149 -30.384 1.00 0.00 H new ATOM 1697 N THR A 114 16.482 1.332 -27.813 1.00 0.00 N ATOM 1698 CA THR A 114 15.522 0.264 -28.000 1.00 0.00 C ATOM 1699 C THR A 114 15.097 -0.309 -26.648 1.00 0.00 C ATOM 1700 O THR A 114 13.902 -0.499 -26.410 1.00 0.00 O ATOM 1701 CB THR A 114 16.207 -0.779 -28.896 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.234 -0.330 -30.241 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.556 -2.149 -28.826 1.00 0.00 C ATOM 0 H THR A 114 17.389 1.132 -28.234 1.00 0.00 H new ATOM 0 HA THR A 114 14.605 0.613 -28.475 1.00 0.00 H new ATOM 0 HB THR A 114 17.223 -0.890 -28.517 1.00 0.00 H new ATOM 0 HG1 THR A 114 17.032 0.219 -30.387 1.00 0.00 H new ATOM 0 HG21 THR A 114 16.088 -2.838 -29.482 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.596 -2.519 -27.801 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.516 -2.074 -29.144 1.00 0.00 H new ATOM 1711 N VAL A 115 16.047 -0.569 -25.749 1.00 0.00 N ATOM 1712 CA VAL A 115 15.764 -1.213 -24.480 1.00 0.00 C ATOM 1713 C VAL A 115 14.928 -0.283 -23.623 1.00 0.00 C ATOM 1714 O VAL A 115 13.969 -0.746 -23.020 1.00 0.00 O ATOM 1715 CB VAL A 115 17.066 -1.719 -23.823 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.833 -2.206 -22.385 1.00 0.00 C ATOM 1717 CG2 VAL A 115 17.619 -2.898 -24.639 1.00 0.00 C ATOM 0 H VAL A 115 17.031 -0.337 -25.886 1.00 0.00 H new ATOM 0 HA VAL A 115 15.164 -2.112 -24.623 1.00 0.00 H new ATOM 0 HB VAL A 115 17.767 -0.884 -23.801 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.775 -2.553 -21.961 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.444 -1.386 -21.782 1.00 0.00 H new ATOM 0 HG13 VAL A 115 16.114 -3.025 -22.390 1.00 0.00 H new ATOM 0 HG21 VAL A 115 18.539 -3.259 -24.179 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.884 -3.702 -24.660 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.827 -2.570 -25.657 1.00 0.00 H new ATOM 1727 N ARG A 116 15.196 1.026 -23.625 1.00 0.00 N ATOM 1728 CA ARG A 116 14.340 1.962 -22.897 1.00 0.00 C ATOM 1729 C ARG A 116 12.889 1.855 -23.390 1.00 0.00 C ATOM 1730 O ARG A 116 11.987 1.772 -22.565 1.00 0.00 O ATOM 1731 CB ARG A 116 14.886 3.402 -22.987 1.00 0.00 C ATOM 1732 CG ARG A 116 16.142 3.586 -22.119 1.00 0.00 C ATOM 1733 CD ARG A 116 16.549 5.060 -21.983 1.00 0.00 C ATOM 1734 NE ARG A 116 17.193 5.607 -23.200 1.00 0.00 N ATOM 1735 CZ ARG A 116 16.703 6.521 -24.052 1.00 0.00 C ATOM 1736 NH1 ARG A 116 15.414 6.845 -24.052 1.00 0.00 N ATOM 1737 NH2 ARG A 116 17.519 7.112 -24.917 1.00 0.00 N ATOM 0 H ARG A 116 15.983 1.454 -24.113 1.00 0.00 H new ATOM 0 HA ARG A 116 14.346 1.693 -21.841 1.00 0.00 H new ATOM 0 HB2 ARG A 116 15.122 3.638 -24.025 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.116 4.104 -22.668 1.00 0.00 H new ATOM 0 HG2 ARG A 116 15.960 3.169 -21.128 1.00 0.00 H new ATOM 0 HG3 ARG A 116 16.967 3.023 -22.555 1.00 0.00 H new ATOM 0 HD2 ARG A 116 15.665 5.654 -21.751 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.233 5.164 -21.141 1.00 0.00 H new ATOM 0 HE ARG A 116 18.122 5.245 -23.417 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.775 6.396 -23.395 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.063 7.543 -24.709 1.00 0.00 H new ATOM 0 HH21 ARG A 116 18.510 6.870 -24.930 1.00 0.00 H new ATOM 0 HH22 ARG A 116 17.155 7.808 -25.568 1.00 0.00 H new ATOM 1751 N GLY A 117 12.669 1.762 -24.705 1.00 0.00 N ATOM 1752 CA GLY A 117 11.336 1.603 -25.291 1.00 0.00 C ATOM 1753 C GLY A 117 10.675 0.286 -24.870 1.00 0.00 C ATOM 1754 O GLY A 117 9.577 0.308 -24.311 1.00 0.00 O ATOM 0 H GLY A 117 13.417 1.795 -25.397 1.00 0.00 H new ATOM 0 HA2 GLY A 117 10.705 2.438 -24.987 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.411 1.639 -26.378 1.00 0.00 H new ATOM 1758 N GLN A 118 11.363 -0.846 -25.088 1.00 0.00 N ATOM 1759 CA GLN A 118 10.901 -2.189 -24.715 1.00 0.00 C ATOM 1760 C GLN A 118 10.484 -2.214 -23.249 1.00 0.00 C ATOM 1761 O GLN A 118 9.392 -2.654 -22.892 1.00 0.00 O ATOM 1762 CB GLN A 118 12.041 -3.211 -24.919 1.00 0.00 C ATOM 1763 CG GLN A 118 12.275 -3.650 -26.373 1.00 0.00 C ATOM 1764 CD GLN A 118 11.489 -4.908 -26.768 1.00 0.00 C ATOM 1765 OE1 GLN A 118 10.399 -5.187 -26.263 1.00 0.00 O ATOM 1766 NE2 GLN A 118 12.039 -5.718 -27.659 1.00 0.00 N ATOM 0 H GLN A 118 12.278 -0.851 -25.539 1.00 0.00 H new ATOM 0 HA GLN A 118 10.049 -2.448 -25.344 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.965 -2.782 -24.533 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.826 -4.096 -24.320 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.997 -2.834 -27.040 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.339 -3.835 -26.521 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.941 -5.483 -28.074 1.00 0.00 H new ATOM 0 HE22 GLN A 118 11.561 -6.577 -27.931 1.00 0.00 H new ATOM 1775 N VAL A 119 11.382 -1.733 -22.398 1.00 0.00 N ATOM 1776 CA VAL A 119 11.226 -1.807 -20.955 1.00 0.00 C ATOM 1777 C VAL A 119 10.070 -0.911 -20.516 1.00 0.00 C ATOM 1778 O VAL A 119 9.208 -1.388 -19.783 1.00 0.00 O ATOM 1779 CB VAL A 119 12.562 -1.461 -20.281 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.422 -1.404 -18.761 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.632 -2.525 -20.587 1.00 0.00 C ATOM 0 H VAL A 119 12.245 -1.277 -22.695 1.00 0.00 H new ATOM 0 HA VAL A 119 10.968 -2.819 -20.642 1.00 0.00 H new ATOM 0 HB VAL A 119 12.857 -0.489 -20.676 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.386 -1.157 -18.316 1.00 0.00 H new ATOM 0 HG12 VAL A 119 11.691 -0.641 -18.491 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.089 -2.373 -18.390 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.567 -2.253 -20.097 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.297 -3.494 -20.218 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.791 -2.582 -21.664 1.00 0.00 H new ATOM 1791 N LYS A 120 10.002 0.346 -20.974 1.00 0.00 N ATOM 1792 CA LYS A 120 8.983 1.291 -20.512 1.00 0.00 C ATOM 1793 C LYS A 120 7.600 0.694 -20.716 1.00 0.00 C ATOM 1794 O LYS A 120 6.796 0.683 -19.788 1.00 0.00 O ATOM 1795 CB LYS A 120 9.111 2.600 -21.308 1.00 0.00 C ATOM 1796 CG LYS A 120 8.131 3.681 -20.827 1.00 0.00 C ATOM 1797 CD LYS A 120 8.375 5.000 -21.582 1.00 0.00 C ATOM 1798 CE LYS A 120 7.379 6.109 -21.203 1.00 0.00 C ATOM 1799 NZ LYS A 120 6.026 5.909 -21.792 1.00 0.00 N ATOM 0 H LYS A 120 10.644 0.731 -21.667 1.00 0.00 H new ATOM 0 HA LYS A 120 9.126 1.496 -19.451 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.131 2.975 -21.222 1.00 0.00 H new ATOM 0 HB3 LYS A 120 8.934 2.398 -22.364 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.105 3.348 -20.986 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.252 3.840 -19.755 1.00 0.00 H new ATOM 0 HD2 LYS A 120 9.388 5.346 -21.378 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.311 4.814 -22.654 1.00 0.00 H new ATOM 0 HE2 LYS A 120 7.292 6.155 -20.117 1.00 0.00 H new ATOM 0 HE3 LYS A 120 7.773 7.070 -21.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 5.379 6.640 -21.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 6.085 5.977 -22.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 5.667 4.969 -21.527 1.00 0.00 H new ATOM 1813 N GLU A 121 7.353 0.150 -21.905 1.00 0.00 N ATOM 1814 CA GLU A 121 6.053 -0.371 -22.278 1.00 0.00 C ATOM 1815 C GLU A 121 5.667 -1.578 -21.408 1.00 0.00 C ATOM 1816 O GLU A 121 4.534 -1.648 -20.922 1.00 0.00 O ATOM 1817 CB GLU A 121 6.124 -0.699 -23.774 1.00 0.00 C ATOM 1818 CG GLU A 121 4.803 -1.260 -24.313 1.00 0.00 C ATOM 1819 CD GLU A 121 4.849 -1.444 -25.841 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.248 -2.537 -26.312 1.00 0.00 O ATOM 1821 OE2 GLU A 121 4.465 -0.503 -26.577 1.00 0.00 O ATOM 0 H GLU A 121 8.058 0.061 -22.637 1.00 0.00 H new ATOM 0 HA GLU A 121 5.263 0.359 -22.104 1.00 0.00 H new ATOM 0 HB2 GLU A 121 6.386 0.202 -24.329 1.00 0.00 H new ATOM 0 HB3 GLU A 121 6.920 -1.423 -23.947 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.592 -2.217 -23.837 1.00 0.00 H new ATOM 0 HG3 GLU A 121 3.987 -0.587 -24.051 1.00 0.00 H new ATOM 1828 N ARG A 122 6.592 -2.509 -21.150 1.00 0.00 N ATOM 1829 CA ARG A 122 6.262 -3.701 -20.357 1.00 0.00 C ATOM 1830 C ARG A 122 6.143 -3.373 -18.872 1.00 0.00 C ATOM 1831 O ARG A 122 5.279 -3.929 -18.195 1.00 0.00 O ATOM 1832 CB ARG A 122 7.218 -4.856 -20.663 1.00 0.00 C ATOM 1833 CG ARG A 122 7.125 -5.174 -22.167 1.00 0.00 C ATOM 1834 CD ARG A 122 7.557 -6.597 -22.482 1.00 0.00 C ATOM 1835 NE ARG A 122 8.144 -6.653 -23.840 1.00 0.00 N ATOM 1836 CZ ARG A 122 8.081 -7.652 -24.728 1.00 0.00 C ATOM 1837 NH1 ARG A 122 7.412 -8.769 -24.454 1.00 0.00 N ATOM 1838 NH2 ARG A 122 8.707 -7.518 -25.892 1.00 0.00 N ATOM 0 H ARG A 122 7.559 -2.464 -21.472 1.00 0.00 H new ATOM 0 HA ARG A 122 5.273 -4.049 -20.657 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.239 -4.585 -20.394 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.955 -5.733 -20.072 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.100 -5.024 -22.505 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.750 -4.475 -22.723 1.00 0.00 H new ATOM 0 HD2 ARG A 122 8.286 -6.937 -21.746 1.00 0.00 H new ATOM 0 HD3 ARG A 122 6.702 -7.269 -22.417 1.00 0.00 H new ATOM 0 HE ARG A 122 8.662 -5.826 -24.136 1.00 0.00 H new ATOM 0 HH11 ARG A 122 6.938 -8.873 -23.557 1.00 0.00 H new ATOM 0 HH12 ARG A 122 7.373 -9.522 -25.141 1.00 0.00 H new ATOM 0 HH21 ARG A 122 9.225 -6.664 -26.097 1.00 0.00 H new ATOM 0 HH22 ARG A 122 8.670 -8.269 -26.581 1.00 0.00 H new ATOM 1852 N VAL A 123 6.936 -2.431 -18.368 1.00 0.00 N ATOM 1853 CA VAL A 123 6.800 -1.957 -16.995 1.00 0.00 C ATOM 1854 C VAL A 123 5.466 -1.207 -16.865 1.00 0.00 C ATOM 1855 O VAL A 123 4.760 -1.426 -15.883 1.00 0.00 O ATOM 1856 CB VAL A 123 8.039 -1.154 -16.561 1.00 0.00 C ATOM 1857 CG1 VAL A 123 7.934 -0.645 -15.118 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.349 -1.963 -16.630 1.00 0.00 C ATOM 0 H VAL A 123 7.684 -1.979 -18.894 1.00 0.00 H new ATOM 0 HA VAL A 123 6.764 -2.792 -16.295 1.00 0.00 H new ATOM 0 HB VAL A 123 8.066 -0.327 -17.271 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.834 -0.085 -14.863 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.064 0.005 -15.024 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.829 -1.492 -14.440 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.181 -1.336 -16.311 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.276 -2.831 -15.974 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.518 -2.296 -17.654 1.00 0.00 H new ATOM 1868 N GLU A 124 5.051 -0.405 -17.854 1.00 0.00 N ATOM 1869 CA GLU A 124 3.735 0.232 -17.838 1.00 0.00 C ATOM 1870 C GLU A 124 2.635 -0.822 -17.781 1.00 0.00 C ATOM 1871 O GLU A 124 1.694 -0.674 -17.007 1.00 0.00 O ATOM 1872 CB GLU A 124 3.509 1.139 -19.063 1.00 0.00 C ATOM 1873 CG GLU A 124 4.069 2.555 -18.899 1.00 0.00 C ATOM 1874 CD GLU A 124 3.607 3.485 -20.032 1.00 0.00 C ATOM 1875 OE1 GLU A 124 2.424 3.904 -20.034 1.00 0.00 O ATOM 1876 OE2 GLU A 124 4.439 3.841 -20.902 1.00 0.00 O ATOM 0 H GLU A 124 5.612 -0.184 -18.676 1.00 0.00 H new ATOM 0 HA GLU A 124 3.698 0.857 -16.946 1.00 0.00 H new ATOM 0 HB2 GLU A 124 3.969 0.676 -19.936 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.439 1.203 -19.263 1.00 0.00 H new ATOM 0 HG2 GLU A 124 3.750 2.964 -17.940 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.158 2.516 -18.882 1.00 0.00 H new ATOM 1883 N ASN A 125 2.763 -1.895 -18.560 1.00 0.00 N ATOM 1884 CA ASN A 125 1.771 -2.963 -18.616 1.00 0.00 C ATOM 1885 C ASN A 125 1.642 -3.678 -17.264 1.00 0.00 C ATOM 1886 O ASN A 125 0.532 -3.913 -16.793 1.00 0.00 O ATOM 1887 CB ASN A 125 2.129 -3.954 -19.731 1.00 0.00 C ATOM 1888 CG ASN A 125 1.118 -5.089 -19.797 1.00 0.00 C ATOM 1889 OD1 ASN A 125 1.357 -6.170 -19.269 1.00 0.00 O ATOM 1890 ND2 ASN A 125 -0.030 -4.870 -20.424 1.00 0.00 N ATOM 0 H ASN A 125 3.564 -2.047 -19.173 1.00 0.00 H new ATOM 0 HA ASN A 125 0.801 -2.519 -18.841 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.160 -3.434 -20.688 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.125 -4.360 -19.556 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.733 -5.607 -20.473 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.210 -3.964 -20.857 1.00 0.00 H new ATOM 1897 N LEU A 126 2.763 -3.975 -16.606 1.00 0.00 N ATOM 1898 CA LEU A 126 2.821 -4.560 -15.274 1.00 0.00 C ATOM 1899 C LEU A 126 2.119 -3.666 -14.254 1.00 0.00 C ATOM 1900 O LEU A 126 1.294 -4.141 -13.478 1.00 0.00 O ATOM 1901 CB LEU A 126 4.303 -4.776 -14.944 1.00 0.00 C ATOM 1902 CG LEU A 126 4.642 -5.402 -13.583 1.00 0.00 C ATOM 1903 CD1 LEU A 126 4.815 -4.353 -12.478 1.00 0.00 C ATOM 1904 CD2 LEU A 126 3.682 -6.513 -13.161 1.00 0.00 C ATOM 0 H LEU A 126 3.687 -3.807 -17.004 1.00 0.00 H new ATOM 0 HA LEU A 126 2.295 -5.514 -15.238 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.732 -5.408 -15.721 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.805 -3.811 -15.005 1.00 0.00 H new ATOM 0 HG LEU A 126 5.610 -5.881 -13.729 1.00 0.00 H new ATOM 0 HD11 LEU A 126 5.053 -4.851 -11.538 1.00 0.00 H new ATOM 0 HD12 LEU A 126 5.625 -3.674 -12.745 1.00 0.00 H new ATOM 0 HD13 LEU A 126 3.890 -3.788 -12.365 1.00 0.00 H new ATOM 0 HD21 LEU A 126 3.985 -6.907 -12.191 1.00 0.00 H new ATOM 0 HD22 LEU A 126 2.671 -6.113 -13.090 1.00 0.00 H new ATOM 0 HD23 LEU A 126 3.705 -7.314 -13.900 1.00 0.00 H new ATOM 1916 N ILE A 127 2.400 -2.366 -14.266 1.00 0.00 N ATOM 1917 CA ILE A 127 1.807 -1.398 -13.354 1.00 0.00 C ATOM 1918 C ILE A 127 0.307 -1.320 -13.645 1.00 0.00 C ATOM 1919 O ILE A 127 -0.488 -1.415 -12.718 1.00 0.00 O ATOM 1920 CB ILE A 127 2.569 -0.078 -13.556 1.00 0.00 C ATOM 1921 CG1 ILE A 127 3.995 -0.289 -12.998 1.00 0.00 C ATOM 1922 CG2 ILE A 127 1.873 1.095 -12.851 1.00 0.00 C ATOM 1923 CD1 ILE A 127 4.943 0.858 -13.303 1.00 0.00 C ATOM 0 H ILE A 127 3.059 -1.950 -14.924 1.00 0.00 H new ATOM 0 HA ILE A 127 1.893 -1.670 -12.302 1.00 0.00 H new ATOM 0 HB ILE A 127 2.598 0.179 -14.615 1.00 0.00 H new ATOM 0 HG12 ILE A 127 3.937 -0.424 -11.918 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.406 -1.209 -13.413 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.442 2.009 -13.018 1.00 0.00 H new ATOM 0 HG22 ILE A 127 0.867 1.216 -13.253 1.00 0.00 H new ATOM 0 HG23 ILE A 127 1.815 0.894 -11.781 1.00 0.00 H new ATOM 0 HD11 ILE A 127 5.924 0.641 -12.881 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.031 0.980 -14.383 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.555 1.777 -12.864 1.00 0.00 H new ATOM 1935 N ALA A 128 -0.091 -1.228 -14.916 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.493 -1.209 -15.320 1.00 0.00 C ATOM 1937 C ALA A 128 -2.242 -2.479 -14.872 1.00 0.00 C ATOM 1938 O ALA A 128 -3.448 -2.409 -14.616 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.578 -1.021 -16.839 1.00 0.00 C ATOM 0 H ALA A 128 0.560 -1.164 -15.699 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.984 -0.372 -14.824 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.624 -1.006 -17.146 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -1.105 -0.079 -17.116 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -1.066 -1.844 -17.337 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.561 -3.631 -14.757 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.146 -4.844 -14.194 1.00 0.00 C ATOM 1947 C LYS A 129 -2.386 -4.673 -12.698 1.00 0.00 C ATOM 1948 O LYS A 129 -3.510 -4.885 -12.235 1.00 0.00 O ATOM 1949 CB LYS A 129 -1.271 -6.082 -14.478 1.00 0.00 C ATOM 1950 CG LYS A 129 -1.391 -6.570 -15.927 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.227 -7.500 -16.298 1.00 0.00 C ATOM 1952 CE LYS A 129 -0.517 -8.184 -17.641 1.00 0.00 C ATOM 1953 NZ LYS A 129 0.712 -8.719 -18.278 1.00 0.00 N ATOM 0 H LYS A 129 -0.591 -3.740 -15.053 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.107 -5.011 -14.681 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.229 -5.843 -14.264 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.558 -6.888 -13.802 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.336 -7.096 -16.059 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -1.405 -5.714 -16.602 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.700 -6.930 -16.362 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -0.087 -8.250 -15.520 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -1.227 -8.997 -17.486 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.991 -7.470 -18.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 0.462 -9.513 -18.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 1.168 -7.969 -18.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 1.368 -9.050 -17.542 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.348 -4.322 -11.937 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.424 -4.352 -10.484 1.00 0.00 C ATOM 1969 C ILE A 130 -2.155 -3.161 -9.852 1.00 0.00 C ATOM 1970 O ILE A 130 -2.837 -3.347 -8.841 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.035 -4.586 -9.870 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.939 -3.427 -10.141 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.519 -5.944 -10.342 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.363 -3.662 -9.644 1.00 0.00 C ATOM 0 H ILE A 130 -0.448 -4.015 -12.306 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.058 -5.204 -10.237 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.144 -4.616 -8.786 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.970 -3.239 -11.214 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.549 -2.525 -9.671 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.504 -6.107 -9.905 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.154 -6.741 -10.027 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.600 -5.946 -11.429 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.978 -2.793 -9.878 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.351 -3.818 -8.565 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.778 -4.543 -10.133 1.00 0.00 H new ATOM 1986 N SER A 131 -2.002 -1.962 -10.408 1.00 0.00 N ATOM 1987 CA SER A 131 -2.434 -0.702 -9.850 1.00 0.00 C ATOM 1988 C SER A 131 -3.713 -0.255 -10.555 1.00 0.00 C ATOM 1989 O SER A 131 -4.799 -0.371 -9.941 1.00 0.00 O ATOM 1990 CB SER A 131 -1.290 0.306 -9.945 1.00 0.00 C ATOM 1991 OG SER A 131 -0.222 -0.126 -9.109 1.00 0.00 O ATOM 1992 OXT SER A 131 -3.649 0.197 -11.723 1.00 0.00 O ATOM 0 H SER A 131 -1.545 -1.847 -11.313 1.00 0.00 H new ATOM 0 HA SER A 131 -2.679 -0.795 -8.792 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.949 0.393 -10.977 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.632 1.294 -9.638 1.00 0.00 H new ATOM 0 HG SER A 131 0.517 0.515 -9.165 1.00 0.00 H new TER 1998 SER A 131