USER MOD reduce.3.24.130724 H: found=0, std=0, add=833, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 837 hydrogens (34 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: C 80 MET CE :methyl 176:sc= -4.47! (180deg=-3.75!) USER MOD Set 1.2: C 81 MET CE :methyl -179:sc= -0.812 (180deg=-0.263) USER MOD Set 2.1: C 45 MET CE :methyl 172:sc= -3.89! (180deg=-4.01!) USER MOD Set 2.2: C 50 GLN : amide:sc= -0.394 X(o=-4.3,f=-4) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ -146:sc= -0.167 (180deg=-0.917) USER MOD Single : C 5 TYR OH : rot 30:sc= -0.791 USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 13 THR OG1 : rot -160:sc= 0.00228 USER MOD Single : C 16 GLN : amide:sc= -14.7! C(o=-15!,f=-21!) USER MOD Single : C 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 18 ASN : amide:sc= -1.58 K(o=-1.6,f=-2.5!) USER MOD Single : C 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 35 CYS SG : rot -73:sc= 0.254 USER MOD Single : C 37 SER OG : rot 180:sc=-0.00213 USER MOD Single : C 38 THR OG1 : rot -179:sc= -0.111 USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 47 MET CE :methyl 166:sc= -5.5! (180deg=-6.11!) USER MOD Single : C 51 ASN : amide:sc= -2.31! K(o=-2.3!,f=-0.8) USER MOD Single : C 53 THR OG1 : rot 180:sc= 0.666 USER MOD Single : C 58 GLN : amide:sc= -3.85! K(o=-3.9!,f=-2.1) USER MOD Single : C 60 MET CE :methyl -142:sc= -9.76! (180deg=-11.5!) USER MOD Single : C 71 THR OG1 : rot 180:sc= 0 USER MOD Single : C 84 CYS SG : rot 81:sc= 0.776 USER MOD Single : C 85 MET CE :methyl 160:sc= -0.295 (180deg=-1.57) USER MOD Single : C 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 89 SER OG : rot 66:sc= 0.00352 USER MOD Single : I 149 SER OG : rot 180:sc= 0.0256 USER MOD Single : I 153 MET CE :methyl 162:sc= -0.154 (180deg=-0.841) USER MOD Single : I 154 MET CE :methyl -131:sc= -2.85 (180deg=-3.54!) USER MOD Single : I 155 GLN : amide:sc= -0.772 X(o=-0.77,f=-0.29) USER MOD Single : I 163 LYS NZ :NH3+ -147:sc= -0.103 (180deg=-0.987) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 83.743 -19.381 -6.005 1.00 0.00 N ATOM 2 CA MET C 1 84.648 -18.482 -6.776 1.00 0.00 C ATOM 3 C MET C 1 85.506 -17.673 -5.808 1.00 0.00 C ATOM 4 O MET C 1 86.732 -17.638 -5.922 1.00 0.00 O ATOM 5 CB MET C 1 83.812 -17.530 -7.633 1.00 0.00 C ATOM 6 CG MET C 1 83.047 -18.330 -8.689 1.00 0.00 C ATOM 7 SD MET C 1 81.435 -17.561 -8.979 1.00 0.00 S ATOM 8 CE MET C 1 80.713 -18.908 -9.948 1.00 0.00 C ATOM 0 H1 MET C 1 83.604 -20.267 -6.531 1.00 0.00 H new ATOM 0 H2 MET C 1 84.168 -19.591 -5.079 1.00 0.00 H new ATOM 0 H3 MET C 1 82.825 -18.913 -5.866 1.00 0.00 H new ATOM 0 HA MET C 1 85.292 -19.081 -7.420 1.00 0.00 H new ATOM 0 HB2 MET C 1 83.114 -16.977 -7.005 1.00 0.00 H new ATOM 0 HB3 MET C 1 84.458 -16.796 -8.115 1.00 0.00 H new ATOM 0 HG2 MET C 1 83.617 -18.365 -9.617 1.00 0.00 H new ATOM 0 HG3 MET C 1 82.916 -19.360 -8.356 1.00 0.00 H new ATOM 0 HE1 MET C 1 79.697 -18.642 -10.240 1.00 0.00 H new ATOM 0 HE2 MET C 1 81.314 -19.077 -10.841 1.00 0.00 H new ATOM 0 HE3 MET C 1 80.692 -19.818 -9.348 1.00 0.00 H new ATOM 20 N ASP C 2 84.847 -17.019 -4.856 1.00 0.00 N ATOM 21 CA ASP C 2 85.558 -16.206 -3.873 1.00 0.00 C ATOM 22 C ASP C 2 85.664 -16.942 -2.539 1.00 0.00 C ATOM 23 O ASP C 2 85.081 -16.526 -1.538 1.00 0.00 O ATOM 24 CB ASP C 2 84.831 -14.878 -3.652 1.00 0.00 C ATOM 25 CG ASP C 2 84.624 -14.183 -4.994 1.00 0.00 C ATOM 26 OD1 ASP C 2 85.537 -14.215 -5.801 1.00 0.00 O ATOM 27 OD2 ASP C 2 83.555 -13.629 -5.194 1.00 0.00 O ATOM 0 H ASP C 2 83.833 -17.035 -4.744 1.00 0.00 H new ATOM 0 HA ASP C 2 86.559 -16.015 -4.260 1.00 0.00 H new ATOM 0 HB2 ASP C 2 83.870 -15.053 -3.169 1.00 0.00 H new ATOM 0 HB3 ASP C 2 85.411 -14.240 -2.985 1.00 0.00 H new ATOM 32 N ASP C 3 86.418 -18.039 -2.537 1.00 0.00 N ATOM 33 CA ASP C 3 86.596 -18.825 -1.317 1.00 0.00 C ATOM 34 C ASP C 3 87.463 -18.065 -0.319 1.00 0.00 C ATOM 35 O ASP C 3 86.985 -17.616 0.723 1.00 0.00 O ATOM 36 CB ASP C 3 87.258 -20.166 -1.632 1.00 0.00 C ATOM 37 CG ASP C 3 87.437 -20.960 -0.342 1.00 0.00 C ATOM 38 OD1 ASP C 3 86.755 -20.649 0.621 1.00 0.00 O ATOM 39 OD2 ASP C 3 88.253 -21.867 -0.336 1.00 0.00 O ATOM 0 H ASP C 3 86.910 -18.401 -3.354 1.00 0.00 H new ATOM 0 HA ASP C 3 85.611 -19.002 -0.885 1.00 0.00 H new ATOM 0 HB2 ASP C 3 86.646 -20.729 -2.336 1.00 0.00 H new ATOM 0 HB3 ASP C 3 88.225 -20.003 -2.109 1.00 0.00 H new ATOM 44 N ILE C 4 88.744 -17.922 -0.650 1.00 0.00 N ATOM 45 CA ILE C 4 89.669 -17.206 0.225 1.00 0.00 C ATOM 46 C ILE C 4 88.972 -15.991 0.827 1.00 0.00 C ATOM 47 O ILE C 4 89.255 -15.588 1.955 1.00 0.00 O ATOM 48 CB ILE C 4 90.900 -16.746 -0.556 1.00 0.00 C ATOM 49 CG1 ILE C 4 90.449 -15.928 -1.769 1.00 0.00 C ATOM 50 CG2 ILE C 4 91.693 -17.969 -1.022 1.00 0.00 C ATOM 51 CD1 ILE C 4 91.611 -15.775 -2.752 1.00 0.00 C ATOM 0 H ILE C 4 89.161 -18.287 -1.506 1.00 0.00 H new ATOM 0 HA ILE C 4 89.986 -17.881 1.020 1.00 0.00 H new ATOM 0 HB ILE C 4 91.533 -16.130 0.082 1.00 0.00 H new ATOM 0 HG12 ILE C 4 89.609 -16.420 -2.259 1.00 0.00 H new ATOM 0 HG13 ILE C 4 90.101 -14.946 -1.448 1.00 0.00 H new ATOM 0 HG21 ILE C 4 92.571 -17.643 -1.579 1.00 0.00 H new ATOM 0 HG22 ILE C 4 92.008 -18.550 -0.155 1.00 0.00 H new ATOM 0 HG23 ILE C 4 91.065 -18.587 -1.664 1.00 0.00 H new ATOM 0 HD11 ILE C 4 91.285 -15.192 -3.613 1.00 0.00 H new ATOM 0 HD12 ILE C 4 92.439 -15.264 -2.260 1.00 0.00 H new ATOM 0 HD13 ILE C 4 91.939 -16.760 -3.084 1.00 0.00 H new ATOM 63 N TYR C 5 88.044 -15.423 0.060 1.00 0.00 N ATOM 64 CA TYR C 5 87.291 -14.262 0.524 1.00 0.00 C ATOM 65 C TYR C 5 86.124 -14.720 1.392 1.00 0.00 C ATOM 66 O TYR C 5 85.874 -14.173 2.466 1.00 0.00 O ATOM 67 CB TYR C 5 86.742 -13.464 -0.661 1.00 0.00 C ATOM 68 CG TYR C 5 87.882 -13.007 -1.540 1.00 0.00 C ATOM 69 CD1 TYR C 5 88.384 -13.857 -2.533 1.00 0.00 C ATOM 70 CD2 TYR C 5 88.436 -11.734 -1.363 1.00 0.00 C ATOM 71 CE1 TYR C 5 89.440 -13.435 -3.348 1.00 0.00 C ATOM 72 CE2 TYR C 5 89.493 -11.311 -2.179 1.00 0.00 C ATOM 73 CZ TYR C 5 89.995 -12.162 -3.171 1.00 0.00 C ATOM 74 OH TYR C 5 91.036 -11.745 -3.975 1.00 0.00 O ATOM 0 H TYR C 5 87.798 -15.744 -0.876 1.00 0.00 H new ATOM 0 HA TYR C 5 87.963 -13.627 1.102 1.00 0.00 H new ATOM 0 HB2 TYR C 5 86.050 -14.079 -1.237 1.00 0.00 H new ATOM 0 HB3 TYR C 5 86.179 -12.602 -0.302 1.00 0.00 H new ATOM 0 HD1 TYR C 5 87.956 -14.839 -2.670 1.00 0.00 H new ATOM 0 HD2 TYR C 5 88.049 -11.078 -0.597 1.00 0.00 H new ATOM 0 HE1 TYR C 5 89.827 -14.091 -4.114 1.00 0.00 H new ATOM 0 HE2 TYR C 5 89.921 -10.329 -2.043 1.00 0.00 H new ATOM 0 HH TYR C 5 90.963 -12.173 -4.853 1.00 0.00 H new ATOM 84 N LYS C 6 85.416 -15.738 0.909 1.00 0.00 N ATOM 85 CA LYS C 6 84.275 -16.279 1.640 1.00 0.00 C ATOM 86 C LYS C 6 84.649 -16.523 3.098 1.00 0.00 C ATOM 87 O LYS C 6 83.950 -16.091 4.014 1.00 0.00 O ATOM 88 CB LYS C 6 83.816 -17.598 1.014 1.00 0.00 C ATOM 89 CG LYS C 6 82.780 -17.314 -0.076 1.00 0.00 C ATOM 90 CD LYS C 6 81.439 -16.968 0.574 1.00 0.00 C ATOM 91 CE LYS C 6 80.623 -16.089 -0.377 1.00 0.00 C ATOM 92 NZ LYS C 6 79.523 -15.427 0.379 1.00 0.00 N ATOM 0 H LYS C 6 85.611 -16.201 0.021 1.00 0.00 H new ATOM 0 HA LYS C 6 83.464 -15.553 1.589 1.00 0.00 H new ATOM 0 HB2 LYS C 6 84.669 -18.128 0.590 1.00 0.00 H new ATOM 0 HB3 LYS C 6 83.387 -18.245 1.779 1.00 0.00 H new ATOM 0 HG2 LYS C 6 83.115 -16.489 -0.705 1.00 0.00 H new ATOM 0 HG3 LYS C 6 82.669 -18.184 -0.723 1.00 0.00 H new ATOM 0 HD2 LYS C 6 80.889 -17.880 0.806 1.00 0.00 H new ATOM 0 HD3 LYS C 6 81.604 -16.447 1.517 1.00 0.00 H new ATOM 0 HE2 LYS C 6 81.266 -15.338 -0.837 1.00 0.00 H new ATOM 0 HE3 LYS C 6 80.211 -16.694 -1.185 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 78.968 -14.830 -0.267 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 78.905 -16.151 0.798 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 79.927 -14.838 1.135 1.00 0.00 H new ATOM 106 N ALA C 7 85.765 -17.219 3.300 1.00 0.00 N ATOM 107 CA ALA C 7 86.232 -17.515 4.650 1.00 0.00 C ATOM 108 C ALA C 7 86.553 -16.220 5.388 1.00 0.00 C ATOM 109 O ALA C 7 86.157 -16.029 6.538 1.00 0.00 O ATOM 110 CB ALA C 7 87.486 -18.391 4.605 1.00 0.00 C ATOM 0 H ALA C 7 86.357 -17.585 2.554 1.00 0.00 H new ATOM 0 HA ALA C 7 85.441 -18.050 5.175 1.00 0.00 H new ATOM 0 HB1 ALA C 7 87.820 -18.601 5.621 1.00 0.00 H new ATOM 0 HB2 ALA C 7 87.257 -19.328 4.097 1.00 0.00 H new ATOM 0 HB3 ALA C 7 88.276 -17.869 4.065 1.00 0.00 H new ATOM 116 N ALA C 8 87.268 -15.329 4.707 1.00 0.00 N ATOM 117 CA ALA C 8 87.632 -14.046 5.301 1.00 0.00 C ATOM 118 C ALA C 8 86.374 -13.234 5.595 1.00 0.00 C ATOM 119 O ALA C 8 86.297 -12.518 6.594 1.00 0.00 O ATOM 120 CB ALA C 8 88.530 -13.250 4.352 1.00 0.00 C ATOM 0 H ALA C 8 87.604 -15.469 3.754 1.00 0.00 H new ATOM 0 HA ALA C 8 88.173 -14.239 6.228 1.00 0.00 H new ATOM 0 HB1 ALA C 8 88.791 -12.297 4.812 1.00 0.00 H new ATOM 0 HB2 ALA C 8 89.439 -13.817 4.150 1.00 0.00 H new ATOM 0 HB3 ALA C 8 88.001 -13.069 3.417 1.00 0.00 H new ATOM 126 N VAL C 9 85.387 -13.362 4.713 1.00 0.00 N ATOM 127 CA VAL C 9 84.127 -12.644 4.882 1.00 0.00 C ATOM 128 C VAL C 9 83.266 -13.344 5.931 1.00 0.00 C ATOM 129 O VAL C 9 82.407 -12.728 6.563 1.00 0.00 O ATOM 130 CB VAL C 9 83.369 -12.578 3.550 1.00 0.00 C ATOM 131 CG1 VAL C 9 81.897 -12.231 3.795 1.00 0.00 C ATOM 132 CG2 VAL C 9 83.998 -11.498 2.667 1.00 0.00 C ATOM 0 H VAL C 9 85.434 -13.950 3.881 1.00 0.00 H new ATOM 0 HA VAL C 9 84.345 -11.629 5.214 1.00 0.00 H new ATOM 0 HB VAL C 9 83.430 -13.549 3.058 1.00 0.00 H new ATOM 0 HG11 VAL C 9 81.370 -12.187 2.842 1.00 0.00 H new ATOM 0 HG12 VAL C 9 81.443 -12.995 4.426 1.00 0.00 H new ATOM 0 HG13 VAL C 9 81.829 -11.263 4.292 1.00 0.00 H new ATOM 0 HG21 VAL C 9 83.463 -11.446 1.719 1.00 0.00 H new ATOM 0 HG22 VAL C 9 83.936 -10.534 3.171 1.00 0.00 H new ATOM 0 HG23 VAL C 9 85.044 -11.743 2.481 1.00 0.00 H new ATOM 142 N GLU C 10 83.513 -14.638 6.113 1.00 0.00 N ATOM 143 CA GLU C 10 82.764 -15.416 7.094 1.00 0.00 C ATOM 144 C GLU C 10 83.392 -15.251 8.472 1.00 0.00 C ATOM 145 O GLU C 10 82.706 -15.259 9.494 1.00 0.00 O ATOM 146 CB GLU C 10 82.760 -16.898 6.717 1.00 0.00 C ATOM 147 CG GLU C 10 81.974 -17.092 5.419 1.00 0.00 C ATOM 148 CD GLU C 10 80.590 -17.645 5.741 1.00 0.00 C ATOM 149 OE1 GLU C 10 79.840 -16.955 6.411 1.00 0.00 O ATOM 150 OE2 GLU C 10 80.301 -18.750 5.313 1.00 0.00 O ATOM 0 H GLU C 10 84.219 -15.166 5.600 1.00 0.00 H new ATOM 0 HA GLU C 10 81.737 -15.051 7.110 1.00 0.00 H new ATOM 0 HB2 GLU C 10 83.782 -17.255 6.592 1.00 0.00 H new ATOM 0 HB3 GLU C 10 82.312 -17.487 7.517 1.00 0.00 H new ATOM 0 HG2 GLU C 10 81.884 -16.143 4.890 1.00 0.00 H new ATOM 0 HG3 GLU C 10 82.506 -17.776 4.758 1.00 0.00 H new ATOM 157 N GLN C 11 84.711 -15.090 8.480 1.00 0.00 N ATOM 158 CA GLN C 11 85.443 -14.909 9.728 1.00 0.00 C ATOM 159 C GLN C 11 84.896 -13.709 10.487 1.00 0.00 C ATOM 160 O GLN C 11 84.791 -13.718 11.713 1.00 0.00 O ATOM 161 CB GLN C 11 86.922 -14.660 9.438 1.00 0.00 C ATOM 162 CG GLN C 11 87.542 -15.913 8.815 1.00 0.00 C ATOM 163 CD GLN C 11 88.722 -16.375 9.662 1.00 0.00 C ATOM 164 OE1 GLN C 11 89.845 -15.903 9.484 1.00 0.00 O ATOM 165 NE2 GLN C 11 88.534 -17.279 10.584 1.00 0.00 N ATOM 0 H GLN C 11 85.292 -15.081 7.642 1.00 0.00 H new ATOM 0 HA GLN C 11 85.326 -15.813 10.326 1.00 0.00 H new ATOM 0 HB2 GLN C 11 87.032 -13.813 8.761 1.00 0.00 H new ATOM 0 HB3 GLN C 11 87.445 -14.403 10.359 1.00 0.00 H new ATOM 0 HG2 GLN C 11 86.797 -16.705 8.749 1.00 0.00 H new ATOM 0 HG3 GLN C 11 87.872 -15.700 7.798 1.00 0.00 H new ATOM 0 HE21 GLN C 11 87.604 -17.671 10.732 1.00 0.00 H new ATOM 0 HE22 GLN C 11 89.317 -17.594 11.157 1.00 0.00 H new ATOM 174 N LEU C 12 84.560 -12.670 9.733 1.00 0.00 N ATOM 175 CA LEU C 12 84.035 -11.447 10.323 1.00 0.00 C ATOM 176 C LEU C 12 82.754 -11.720 11.101 1.00 0.00 C ATOM 177 O LEU C 12 82.002 -12.643 10.790 1.00 0.00 O ATOM 178 CB LEU C 12 83.746 -10.416 9.231 1.00 0.00 C ATOM 179 CG LEU C 12 85.021 -10.152 8.423 1.00 0.00 C ATOM 180 CD1 LEU C 12 84.857 -8.860 7.623 1.00 0.00 C ATOM 181 CD2 LEU C 12 86.216 -10.011 9.373 1.00 0.00 C ATOM 0 H LEU C 12 84.641 -12.650 8.716 1.00 0.00 H new ATOM 0 HA LEU C 12 84.788 -11.058 11.008 1.00 0.00 H new ATOM 0 HB2 LEU C 12 82.956 -10.779 8.574 1.00 0.00 H new ATOM 0 HB3 LEU C 12 83.388 -9.489 9.678 1.00 0.00 H new ATOM 0 HG LEU C 12 85.195 -10.986 7.743 1.00 0.00 H new ATOM 0 HD11 LEU C 12 85.763 -8.671 7.048 1.00 0.00 H new ATOM 0 HD12 LEU C 12 84.010 -8.957 6.944 1.00 0.00 H new ATOM 0 HD13 LEU C 12 84.681 -8.029 8.306 1.00 0.00 H new ATOM 0 HD21 LEU C 12 87.121 -9.823 8.794 1.00 0.00 H new ATOM 0 HD22 LEU C 12 86.042 -9.179 10.055 1.00 0.00 H new ATOM 0 HD23 LEU C 12 86.336 -10.931 9.946 1.00 0.00 H new ATOM 193 N THR C 13 82.516 -10.895 12.116 1.00 0.00 N ATOM 194 CA THR C 13 81.323 -11.037 12.942 1.00 0.00 C ATOM 195 C THR C 13 80.336 -9.919 12.629 1.00 0.00 C ATOM 196 O THR C 13 80.699 -8.899 12.043 1.00 0.00 O ATOM 197 CB THR C 13 81.689 -10.977 14.427 1.00 0.00 C ATOM 198 OG1 THR C 13 82.586 -9.897 14.650 1.00 0.00 O ATOM 199 CG2 THR C 13 82.354 -12.290 14.843 1.00 0.00 C ATOM 0 H THR C 13 83.130 -10.126 12.385 1.00 0.00 H new ATOM 0 HA THR C 13 80.868 -12.003 12.722 1.00 0.00 H new ATOM 0 HB THR C 13 80.786 -10.826 15.018 1.00 0.00 H new ATOM 0 HG1 THR C 13 83.063 -10.037 15.495 1.00 0.00 H new ATOM 0 HG21 THR C 13 82.614 -12.247 15.901 1.00 0.00 H new ATOM 0 HG22 THR C 13 81.665 -13.117 14.673 1.00 0.00 H new ATOM 0 HG23 THR C 13 83.257 -12.443 14.253 1.00 0.00 H new ATOM 207 N GLU C 14 79.082 -10.117 13.026 1.00 0.00 N ATOM 208 CA GLU C 14 78.051 -9.112 12.780 1.00 0.00 C ATOM 209 C GLU C 14 78.538 -7.733 13.221 1.00 0.00 C ATOM 210 O GLU C 14 78.046 -6.706 12.754 1.00 0.00 O ATOM 211 CB GLU C 14 76.769 -9.459 13.540 1.00 0.00 C ATOM 212 CG GLU C 14 76.022 -10.572 12.801 1.00 0.00 C ATOM 213 CD GLU C 14 74.794 -9.992 12.107 1.00 0.00 C ATOM 214 OE1 GLU C 14 74.615 -8.787 12.171 1.00 0.00 O ATOM 215 OE2 GLU C 14 74.050 -10.762 11.522 1.00 0.00 O ATOM 0 H GLU C 14 78.757 -10.952 13.513 1.00 0.00 H new ATOM 0 HA GLU C 14 77.841 -9.098 11.710 1.00 0.00 H new ATOM 0 HB2 GLU C 14 77.010 -9.779 14.554 1.00 0.00 H new ATOM 0 HB3 GLU C 14 76.135 -8.577 13.627 1.00 0.00 H new ATOM 0 HG2 GLU C 14 76.679 -11.040 12.068 1.00 0.00 H new ATOM 0 HG3 GLU C 14 75.722 -11.350 13.503 1.00 0.00 H new ATOM 222 N GLU C 15 79.514 -7.723 14.127 1.00 0.00 N ATOM 223 CA GLU C 15 80.066 -6.467 14.626 1.00 0.00 C ATOM 224 C GLU C 15 80.698 -5.670 13.490 1.00 0.00 C ATOM 225 O GLU C 15 80.158 -4.655 13.051 1.00 0.00 O ATOM 226 CB GLU C 15 81.130 -6.733 15.692 1.00 0.00 C ATOM 227 CG GLU C 15 80.555 -7.650 16.772 1.00 0.00 C ATOM 228 CD GLU C 15 81.663 -8.537 17.330 1.00 0.00 C ATOM 229 OE1 GLU C 15 82.799 -8.094 17.342 1.00 0.00 O ATOM 230 OE2 GLU C 15 81.358 -9.646 17.738 1.00 0.00 O ATOM 0 H GLU C 15 79.935 -8.562 14.527 1.00 0.00 H new ATOM 0 HA GLU C 15 79.247 -5.895 15.062 1.00 0.00 H new ATOM 0 HB2 GLU C 15 82.007 -7.194 15.238 1.00 0.00 H new ATOM 0 HB3 GLU C 15 81.458 -5.793 16.136 1.00 0.00 H new ATOM 0 HG2 GLU C 15 80.114 -7.055 17.572 1.00 0.00 H new ATOM 0 HG3 GLU C 15 79.758 -8.265 16.355 1.00 0.00 H new ATOM 237 N GLN C 16 81.852 -6.138 13.019 1.00 0.00 N ATOM 238 CA GLN C 16 82.545 -5.451 11.936 1.00 0.00 C ATOM 239 C GLN C 16 81.614 -5.291 10.735 1.00 0.00 C ATOM 240 O GLN C 16 81.647 -4.280 10.036 1.00 0.00 O ATOM 241 CB GLN C 16 83.815 -6.215 11.524 1.00 0.00 C ATOM 242 CG GLN C 16 83.478 -7.311 10.511 1.00 0.00 C ATOM 243 CD GLN C 16 83.457 -6.715 9.108 1.00 0.00 C ATOM 244 OE1 GLN C 16 82.431 -6.741 8.430 1.00 0.00 O ATOM 245 NE2 GLN C 16 84.541 -6.169 8.628 1.00 0.00 N ATOM 0 H GLN C 16 82.319 -6.976 13.364 1.00 0.00 H new ATOM 0 HA GLN C 16 82.841 -4.464 12.291 1.00 0.00 H new ATOM 0 HB2 GLN C 16 84.538 -5.523 11.093 1.00 0.00 H new ATOM 0 HB3 GLN C 16 84.282 -6.657 12.404 1.00 0.00 H new ATOM 0 HG2 GLN C 16 84.215 -8.112 10.567 1.00 0.00 H new ATOM 0 HG3 GLN C 16 82.509 -7.752 10.745 1.00 0.00 H new ATOM 0 HE21 GLN C 16 85.392 -6.147 9.189 1.00 0.00 H new ATOM 0 HE22 GLN C 16 84.537 -5.764 7.692 1.00 0.00 H new ATOM 254 N LYS C 17 80.780 -6.304 10.511 1.00 0.00 N ATOM 255 CA LYS C 17 79.835 -6.274 9.398 1.00 0.00 C ATOM 256 C LYS C 17 78.977 -5.015 9.462 1.00 0.00 C ATOM 257 O LYS C 17 78.906 -4.246 8.504 1.00 0.00 O ATOM 258 CB LYS C 17 78.920 -7.498 9.444 1.00 0.00 C ATOM 259 CG LYS C 17 79.727 -8.749 9.098 1.00 0.00 C ATOM 260 CD LYS C 17 80.236 -8.639 7.661 1.00 0.00 C ATOM 261 CE LYS C 17 80.163 -10.009 6.985 1.00 0.00 C ATOM 262 NZ LYS C 17 79.855 -9.830 5.538 1.00 0.00 N ATOM 0 H LYS C 17 80.739 -7.149 11.080 1.00 0.00 H new ATOM 0 HA LYS C 17 80.407 -6.279 8.470 1.00 0.00 H new ATOM 0 HB2 LYS C 17 78.479 -7.599 10.436 1.00 0.00 H new ATOM 0 HB3 LYS C 17 78.097 -7.377 8.740 1.00 0.00 H new ATOM 0 HG2 LYS C 17 80.566 -8.857 9.786 1.00 0.00 H new ATOM 0 HG3 LYS C 17 79.107 -9.638 9.209 1.00 0.00 H new ATOM 0 HD2 LYS C 17 79.637 -7.916 7.107 1.00 0.00 H new ATOM 0 HD3 LYS C 17 81.263 -8.274 7.655 1.00 0.00 H new ATOM 0 HE2 LYS C 17 81.109 -10.537 7.104 1.00 0.00 H new ATOM 0 HE3 LYS C 17 79.395 -10.620 7.459 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 79.805 -10.760 5.076 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 78.942 -9.343 5.435 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 80.603 -9.262 5.092 1.00 0.00 H new ATOM 276 N ASN C 18 78.327 -4.817 10.604 1.00 0.00 N ATOM 277 CA ASN C 18 77.473 -3.647 10.788 1.00 0.00 C ATOM 278 C ASN C 18 78.254 -2.370 10.495 1.00 0.00 C ATOM 279 O ASN C 18 78.042 -1.714 9.475 1.00 0.00 O ATOM 280 CB ASN C 18 76.942 -3.591 12.223 1.00 0.00 C ATOM 281 CG ASN C 18 76.054 -4.803 12.488 1.00 0.00 C ATOM 282 OD1 ASN C 18 75.429 -5.336 11.571 1.00 0.00 O ATOM 283 ND2 ASN C 18 75.958 -5.272 13.702 1.00 0.00 N ATOM 0 H ASN C 18 78.373 -5.443 11.408 1.00 0.00 H new ATOM 0 HA ASN C 18 76.635 -3.728 10.096 1.00 0.00 H new ATOM 0 HB2 ASN C 18 77.773 -3.575 12.928 1.00 0.00 H new ATOM 0 HB3 ASN C 18 76.376 -2.672 12.376 1.00 0.00 H new ATOM 0 HD21 ASN C 18 75.365 -6.080 13.891 1.00 0.00 H new ATOM 0 HD22 ASN C 18 76.476 -4.830 14.462 1.00 0.00 H new ATOM 290 N GLU C 19 79.159 -2.025 11.406 1.00 0.00 N ATOM 291 CA GLU C 19 79.971 -0.821 11.245 1.00 0.00 C ATOM 292 C GLU C 19 80.385 -0.634 9.788 1.00 0.00 C ATOM 293 O GLU C 19 80.453 0.489 9.288 1.00 0.00 O ATOM 294 CB GLU C 19 81.227 -0.902 12.116 1.00 0.00 C ATOM 295 CG GLU C 19 82.022 -2.158 11.756 1.00 0.00 C ATOM 296 CD GLU C 19 83.307 -2.196 12.575 1.00 0.00 C ATOM 297 OE1 GLU C 19 84.270 -1.573 12.159 1.00 0.00 O ATOM 298 OE2 GLU C 19 83.309 -2.848 13.607 1.00 0.00 O ATOM 0 H GLU C 19 79.348 -2.556 12.256 1.00 0.00 H new ATOM 0 HA GLU C 19 79.366 0.031 11.556 1.00 0.00 H new ATOM 0 HB2 GLU C 19 81.843 -0.015 11.967 1.00 0.00 H new ATOM 0 HB3 GLU C 19 80.950 -0.925 13.170 1.00 0.00 H new ATOM 0 HG2 GLU C 19 81.425 -3.049 11.954 1.00 0.00 H new ATOM 0 HG3 GLU C 19 82.256 -2.161 10.691 1.00 0.00 H new ATOM 305 N PHE C 20 80.664 -1.745 9.111 1.00 0.00 N ATOM 306 CA PHE C 20 81.074 -1.686 7.709 1.00 0.00 C ATOM 307 C PHE C 20 79.925 -1.191 6.836 1.00 0.00 C ATOM 308 O PHE C 20 80.055 -0.205 6.112 1.00 0.00 O ATOM 309 CB PHE C 20 81.508 -3.069 7.217 1.00 0.00 C ATOM 310 CG PHE C 20 82.619 -2.931 6.199 1.00 0.00 C ATOM 311 CD1 PHE C 20 82.821 -1.714 5.533 1.00 0.00 C ATOM 312 CD2 PHE C 20 83.449 -4.024 5.922 1.00 0.00 C ATOM 313 CE1 PHE C 20 83.851 -1.593 4.593 1.00 0.00 C ATOM 314 CE2 PHE C 20 84.478 -3.902 4.982 1.00 0.00 C ATOM 315 CZ PHE C 20 84.679 -2.686 4.317 1.00 0.00 C ATOM 0 H PHE C 20 80.615 -2.685 9.503 1.00 0.00 H new ATOM 0 HA PHE C 20 81.913 -0.994 7.636 1.00 0.00 H new ATOM 0 HB2 PHE C 20 81.847 -3.673 8.058 1.00 0.00 H new ATOM 0 HB3 PHE C 20 80.659 -3.589 6.773 1.00 0.00 H new ATOM 0 HD1 PHE C 20 82.182 -0.870 5.745 1.00 0.00 H new ATOM 0 HD2 PHE C 20 83.295 -4.962 6.434 1.00 0.00 H new ATOM 0 HE1 PHE C 20 84.007 -0.655 4.081 1.00 0.00 H new ATOM 0 HE2 PHE C 20 85.118 -4.746 4.769 1.00 0.00 H new ATOM 0 HZ PHE C 20 85.473 -2.592 3.591 1.00 0.00 H new ATOM 325 N LYS C 21 78.798 -1.891 6.913 1.00 0.00 N ATOM 326 CA LYS C 21 77.626 -1.522 6.125 1.00 0.00 C ATOM 327 C LYS C 21 77.319 -0.036 6.282 1.00 0.00 C ATOM 328 O LYS C 21 76.811 0.610 5.366 1.00 0.00 O ATOM 329 CB LYS C 21 76.412 -2.334 6.569 1.00 0.00 C ATOM 330 CG LYS C 21 76.740 -3.824 6.471 1.00 0.00 C ATOM 331 CD LYS C 21 75.533 -4.576 5.908 1.00 0.00 C ATOM 332 CE LYS C 21 75.953 -5.990 5.501 1.00 0.00 C ATOM 333 NZ LYS C 21 74.885 -6.603 4.662 1.00 0.00 N ATOM 0 H LYS C 21 78.671 -2.710 7.507 1.00 0.00 H new ATOM 0 HA LYS C 21 77.843 -1.734 5.078 1.00 0.00 H new ATOM 0 HB2 LYS C 21 76.142 -2.076 7.593 1.00 0.00 H new ATOM 0 HB3 LYS C 21 75.552 -2.097 5.943 1.00 0.00 H new ATOM 0 HG2 LYS C 21 77.608 -3.975 5.829 1.00 0.00 H new ATOM 0 HG3 LYS C 21 76.999 -4.216 7.455 1.00 0.00 H new ATOM 0 HD2 LYS C 21 74.740 -4.622 6.654 1.00 0.00 H new ATOM 0 HD3 LYS C 21 75.130 -4.044 5.047 1.00 0.00 H new ATOM 0 HE2 LYS C 21 76.891 -5.957 4.947 1.00 0.00 H new ATOM 0 HE3 LYS C 21 76.128 -6.599 6.388 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 75.170 -7.564 4.385 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 73.999 -6.647 5.205 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 74.739 -6.026 3.809 1.00 0.00 H new ATOM 347 N ALA C 22 77.634 0.499 7.456 1.00 0.00 N ATOM 348 CA ALA C 22 77.390 1.915 7.728 1.00 0.00 C ATOM 349 C ALA C 22 77.944 2.776 6.597 1.00 0.00 C ATOM 350 O ALA C 22 77.201 3.484 5.917 1.00 0.00 O ATOM 351 CB ALA C 22 78.050 2.330 9.045 1.00 0.00 C ATOM 0 H ALA C 22 78.054 -0.018 8.229 1.00 0.00 H new ATOM 0 HA ALA C 22 76.313 2.064 7.803 1.00 0.00 H new ATOM 0 HB1 ALA C 22 77.858 3.387 9.231 1.00 0.00 H new ATOM 0 HB2 ALA C 22 77.638 1.737 9.861 1.00 0.00 H new ATOM 0 HB3 ALA C 22 79.125 2.162 8.982 1.00 0.00 H new ATOM 357 N ALA C 23 79.258 2.707 6.400 1.00 0.00 N ATOM 358 CA ALA C 23 79.898 3.485 5.343 1.00 0.00 C ATOM 359 C ALA C 23 79.345 3.081 3.982 1.00 0.00 C ATOM 360 O ALA C 23 79.434 3.830 3.010 1.00 0.00 O ATOM 361 CB ALA C 23 81.409 3.263 5.351 1.00 0.00 C ATOM 0 H ALA C 23 79.893 2.129 6.950 1.00 0.00 H new ATOM 0 HA ALA C 23 79.688 4.539 5.526 1.00 0.00 H new ATOM 0 HB1 ALA C 23 81.867 3.851 4.556 1.00 0.00 H new ATOM 0 HB2 ALA C 23 81.817 3.573 6.313 1.00 0.00 H new ATOM 0 HB3 ALA C 23 81.622 2.206 5.189 1.00 0.00 H new ATOM 367 N PHE C 24 78.769 1.886 3.927 1.00 0.00 N ATOM 368 CA PHE C 24 78.197 1.387 2.682 1.00 0.00 C ATOM 369 C PHE C 24 76.982 2.223 2.295 1.00 0.00 C ATOM 370 O PHE C 24 76.628 2.328 1.123 1.00 0.00 O ATOM 371 CB PHE C 24 77.772 -0.072 2.839 1.00 0.00 C ATOM 372 CG PHE C 24 78.647 -0.949 1.979 1.00 0.00 C ATOM 373 CD1 PHE C 24 78.345 -1.119 0.625 1.00 0.00 C ATOM 374 CD2 PHE C 24 79.756 -1.597 2.536 1.00 0.00 C ATOM 375 CE1 PHE C 24 79.151 -1.936 -0.175 1.00 0.00 C ATOM 376 CE2 PHE C 24 80.564 -2.414 1.736 1.00 0.00 C ATOM 377 CZ PHE C 24 80.260 -2.584 0.379 1.00 0.00 C ATOM 0 H PHE C 24 78.686 1.250 4.720 1.00 0.00 H new ATOM 0 HA PHE C 24 78.955 1.459 1.902 1.00 0.00 H new ATOM 0 HB2 PHE C 24 77.851 -0.374 3.883 1.00 0.00 H new ATOM 0 HB3 PHE C 24 76.727 -0.190 2.552 1.00 0.00 H new ATOM 0 HD1 PHE C 24 77.489 -0.619 0.196 1.00 0.00 H new ATOM 0 HD2 PHE C 24 79.988 -1.467 3.583 1.00 0.00 H new ATOM 0 HE1 PHE C 24 78.917 -2.067 -1.221 1.00 0.00 H new ATOM 0 HE2 PHE C 24 81.421 -2.913 2.165 1.00 0.00 H new ATOM 0 HZ PHE C 24 80.882 -3.215 -0.239 1.00 0.00 H new ATOM 387 N ASP C 25 76.349 2.823 3.297 1.00 0.00 N ATOM 388 CA ASP C 25 75.177 3.655 3.051 1.00 0.00 C ATOM 389 C ASP C 25 75.599 5.083 2.715 1.00 0.00 C ATOM 390 O ASP C 25 74.770 5.992 2.657 1.00 0.00 O ATOM 391 CB ASP C 25 74.267 3.676 4.281 1.00 0.00 C ATOM 392 CG ASP C 25 73.122 2.689 4.082 1.00 0.00 C ATOM 393 OD1 ASP C 25 73.367 1.499 4.187 1.00 0.00 O ATOM 394 OD2 ASP C 25 72.017 3.137 3.826 1.00 0.00 O ATOM 0 H ASP C 25 76.624 2.750 4.277 1.00 0.00 H new ATOM 0 HA ASP C 25 74.633 3.230 2.207 1.00 0.00 H new ATOM 0 HB2 ASP C 25 74.837 3.414 5.173 1.00 0.00 H new ATOM 0 HB3 ASP C 25 73.873 4.680 4.438 1.00 0.00 H new ATOM 399 N ILE C 26 76.900 5.272 2.497 1.00 0.00 N ATOM 400 CA ILE C 26 77.420 6.599 2.170 1.00 0.00 C ATOM 401 C ILE C 26 78.183 6.570 0.850 1.00 0.00 C ATOM 402 O ILE C 26 78.125 7.516 0.064 1.00 0.00 O ATOM 403 CB ILE C 26 78.360 7.119 3.266 1.00 0.00 C ATOM 404 CG1 ILE C 26 78.300 6.197 4.490 1.00 0.00 C ATOM 405 CG2 ILE C 26 77.935 8.533 3.666 1.00 0.00 C ATOM 406 CD1 ILE C 26 77.007 6.442 5.267 1.00 0.00 C ATOM 0 H ILE C 26 77.604 4.535 2.540 1.00 0.00 H new ATOM 0 HA ILE C 26 76.561 7.265 2.088 1.00 0.00 H new ATOM 0 HB ILE C 26 79.382 7.136 2.886 1.00 0.00 H new ATOM 0 HG12 ILE C 26 78.352 5.155 4.174 1.00 0.00 H new ATOM 0 HG13 ILE C 26 79.161 6.378 5.134 1.00 0.00 H new ATOM 0 HG21 ILE C 26 78.600 8.906 4.445 1.00 0.00 H new ATOM 0 HG22 ILE C 26 77.989 9.189 2.797 1.00 0.00 H new ATOM 0 HG23 ILE C 26 76.912 8.513 4.042 1.00 0.00 H new ATOM 0 HD11 ILE C 26 76.973 5.783 6.134 1.00 0.00 H new ATOM 0 HD12 ILE C 26 76.973 7.480 5.598 1.00 0.00 H new ATOM 0 HD13 ILE C 26 76.151 6.238 4.623 1.00 0.00 H new ATOM 418 N PHE C 27 78.905 5.478 0.615 1.00 0.00 N ATOM 419 CA PHE C 27 79.682 5.346 -0.614 1.00 0.00 C ATOM 420 C PHE C 27 78.762 5.210 -1.827 1.00 0.00 C ATOM 421 O PHE C 27 79.211 5.253 -2.972 1.00 0.00 O ATOM 422 CB PHE C 27 80.634 4.145 -0.522 1.00 0.00 C ATOM 423 CG PHE C 27 79.933 2.864 -0.915 1.00 0.00 C ATOM 424 CD1 PHE C 27 78.603 2.638 -0.540 1.00 0.00 C ATOM 425 CD2 PHE C 27 80.625 1.899 -1.656 1.00 0.00 C ATOM 426 CE1 PHE C 27 77.967 1.444 -0.911 1.00 0.00 C ATOM 427 CE2 PHE C 27 79.990 0.709 -2.025 1.00 0.00 C ATOM 428 CZ PHE C 27 78.662 0.482 -1.653 1.00 0.00 C ATOM 0 H PHE C 27 78.969 4.682 1.249 1.00 0.00 H new ATOM 0 HA PHE C 27 80.277 6.250 -0.739 1.00 0.00 H new ATOM 0 HB2 PHE C 27 81.493 4.307 -1.173 1.00 0.00 H new ATOM 0 HB3 PHE C 27 81.016 4.057 0.495 1.00 0.00 H new ATOM 0 HD1 PHE C 27 78.068 3.381 0.033 1.00 0.00 H new ATOM 0 HD2 PHE C 27 81.651 2.074 -1.943 1.00 0.00 H new ATOM 0 HE1 PHE C 27 76.941 1.267 -0.624 1.00 0.00 H new ATOM 0 HE2 PHE C 27 80.525 -0.034 -2.597 1.00 0.00 H new ATOM 0 HZ PHE C 27 78.171 -0.437 -1.938 1.00 0.00 H new ATOM 438 N VAL C 28 77.466 5.068 -1.562 1.00 0.00 N ATOM 439 CA VAL C 28 76.481 4.951 -2.635 1.00 0.00 C ATOM 440 C VAL C 28 75.174 5.611 -2.210 1.00 0.00 C ATOM 441 O VAL C 28 74.098 5.264 -2.697 1.00 0.00 O ATOM 442 CB VAL C 28 76.199 3.485 -2.978 1.00 0.00 C ATOM 443 CG1 VAL C 28 77.495 2.783 -3.391 1.00 0.00 C ATOM 444 CG2 VAL C 28 75.603 2.783 -1.757 1.00 0.00 C ATOM 0 H VAL C 28 77.075 5.031 -0.621 1.00 0.00 H new ATOM 0 HA VAL C 28 76.891 5.446 -3.515 1.00 0.00 H new ATOM 0 HB VAL C 28 75.493 3.442 -3.807 1.00 0.00 H new ATOM 0 HG11 VAL C 28 77.283 1.741 -3.633 1.00 0.00 H new ATOM 0 HG12 VAL C 28 77.916 3.280 -4.265 1.00 0.00 H new ATOM 0 HG13 VAL C 28 78.210 2.827 -2.570 1.00 0.00 H new ATOM 0 HG21 VAL C 28 75.402 1.740 -1.999 1.00 0.00 H new ATOM 0 HG22 VAL C 28 76.309 2.833 -0.928 1.00 0.00 H new ATOM 0 HG23 VAL C 28 74.673 3.275 -1.472 1.00 0.00 H new ATOM 454 N LEU C 29 75.278 6.565 -1.285 1.00 0.00 N ATOM 455 CA LEU C 29 74.095 7.264 -0.792 1.00 0.00 C ATOM 456 C LEU C 29 73.381 7.982 -1.936 1.00 0.00 C ATOM 457 O LEU C 29 72.230 8.399 -1.809 1.00 0.00 O ATOM 458 CB LEU C 29 74.486 8.246 0.338 1.00 0.00 C ATOM 459 CG LEU C 29 74.675 9.683 -0.179 1.00 0.00 C ATOM 460 CD1 LEU C 29 75.518 9.680 -1.456 1.00 0.00 C ATOM 461 CD2 LEU C 29 73.309 10.319 -0.461 1.00 0.00 C ATOM 0 H LEU C 29 76.158 6.868 -0.867 1.00 0.00 H new ATOM 0 HA LEU C 29 73.400 6.534 -0.377 1.00 0.00 H new ATOM 0 HB2 LEU C 29 73.714 8.237 1.108 1.00 0.00 H new ATOM 0 HB3 LEU C 29 75.409 7.907 0.808 1.00 0.00 H new ATOM 0 HG LEU C 29 75.192 10.265 0.584 1.00 0.00 H new ATOM 0 HD11 LEU C 29 75.644 10.703 -1.811 1.00 0.00 H new ATOM 0 HD12 LEU C 29 76.495 9.246 -1.246 1.00 0.00 H new ATOM 0 HD13 LEU C 29 75.016 9.089 -2.222 1.00 0.00 H new ATOM 0 HD21 LEU C 29 73.450 11.336 -0.827 1.00 0.00 H new ATOM 0 HD22 LEU C 29 72.783 9.732 -1.214 1.00 0.00 H new ATOM 0 HD23 LEU C 29 72.722 10.341 0.457 1.00 0.00 H new ATOM 473 N GLY C 30 74.083 8.114 -3.055 1.00 0.00 N ATOM 474 CA GLY C 30 73.521 8.776 -4.230 1.00 0.00 C ATOM 475 C GLY C 30 73.481 7.820 -5.418 1.00 0.00 C ATOM 476 O GLY C 30 72.777 8.055 -6.400 1.00 0.00 O ATOM 0 H GLY C 30 75.037 7.774 -3.175 1.00 0.00 H new ATOM 0 HA2 GLY C 30 72.514 9.130 -4.008 1.00 0.00 H new ATOM 0 HA3 GLY C 30 74.119 9.652 -4.481 1.00 0.00 H new ATOM 480 N ALA C 31 74.246 6.736 -5.315 1.00 0.00 N ATOM 481 CA ALA C 31 74.295 5.742 -6.384 1.00 0.00 C ATOM 482 C ALA C 31 72.940 5.063 -6.541 1.00 0.00 C ATOM 483 O ALA C 31 72.182 4.922 -5.581 1.00 0.00 O ATOM 484 CB ALA C 31 75.353 4.680 -6.079 1.00 0.00 C ATOM 0 H ALA C 31 74.836 6.524 -4.510 1.00 0.00 H new ATOM 0 HA ALA C 31 74.554 6.256 -7.310 1.00 0.00 H new ATOM 0 HB1 ALA C 31 75.376 3.947 -6.886 1.00 0.00 H new ATOM 0 HB2 ALA C 31 76.330 5.155 -5.992 1.00 0.00 H new ATOM 0 HB3 ALA C 31 75.107 4.180 -5.142 1.00 0.00 H new ATOM 490 N GLU C 32 72.647 4.646 -7.767 1.00 0.00 N ATOM 491 CA GLU C 32 71.382 3.980 -8.056 1.00 0.00 C ATOM 492 C GLU C 32 71.043 2.970 -6.963 1.00 0.00 C ATOM 493 O GLU C 32 70.124 3.177 -6.170 1.00 0.00 O ATOM 494 CB GLU C 32 71.464 3.257 -9.399 1.00 0.00 C ATOM 495 CG GLU C 32 70.229 3.594 -10.238 1.00 0.00 C ATOM 496 CD GLU C 32 70.667 4.060 -11.621 1.00 0.00 C ATOM 497 OE1 GLU C 32 71.148 5.176 -11.724 1.00 0.00 O ATOM 498 OE2 GLU C 32 70.517 3.293 -12.558 1.00 0.00 O ATOM 0 H GLU C 32 73.263 4.756 -8.572 1.00 0.00 H new ATOM 0 HA GLU C 32 70.600 4.739 -8.095 1.00 0.00 H new ATOM 0 HB2 GLU C 32 72.369 3.554 -9.929 1.00 0.00 H new ATOM 0 HB3 GLU C 32 71.526 2.180 -9.241 1.00 0.00 H new ATOM 0 HG2 GLU C 32 69.585 2.719 -10.324 1.00 0.00 H new ATOM 0 HG3 GLU C 32 69.645 4.373 -9.748 1.00 0.00 H new ATOM 505 N ASP C 33 71.794 1.871 -6.932 1.00 0.00 N ATOM 506 CA ASP C 33 71.564 0.829 -5.934 1.00 0.00 C ATOM 507 C ASP C 33 72.698 0.806 -4.914 1.00 0.00 C ATOM 508 O ASP C 33 72.512 1.148 -3.747 1.00 0.00 O ATOM 509 CB ASP C 33 71.470 -0.545 -6.601 1.00 0.00 C ATOM 510 CG ASP C 33 72.337 -0.566 -7.856 1.00 0.00 C ATOM 511 OD1 ASP C 33 73.543 -0.688 -7.718 1.00 0.00 O ATOM 512 OD2 ASP C 33 71.782 -0.461 -8.938 1.00 0.00 O ATOM 0 H ASP C 33 72.559 1.680 -7.579 1.00 0.00 H new ATOM 0 HA ASP C 33 70.624 1.053 -5.430 1.00 0.00 H new ATOM 0 HB2 ASP C 33 71.797 -1.320 -5.908 1.00 0.00 H new ATOM 0 HB3 ASP C 33 70.434 -0.765 -6.859 1.00 0.00 H new ATOM 517 N GLY C 34 73.877 0.397 -5.372 1.00 0.00 N ATOM 518 CA GLY C 34 75.045 0.329 -4.500 1.00 0.00 C ATOM 519 C GLY C 34 76.318 0.272 -5.334 1.00 0.00 C ATOM 520 O GLY C 34 77.141 -0.631 -5.183 1.00 0.00 O ATOM 0 H GLY C 34 74.049 0.109 -6.335 1.00 0.00 H new ATOM 0 HA2 GLY C 34 75.070 1.199 -3.844 1.00 0.00 H new ATOM 0 HA3 GLY C 34 74.980 -0.551 -3.860 1.00 0.00 H new ATOM 524 N CYS C 35 76.462 1.250 -6.222 1.00 0.00 N ATOM 525 CA CYS C 35 77.632 1.314 -7.093 1.00 0.00 C ATOM 526 C CYS C 35 78.431 2.583 -6.820 1.00 0.00 C ATOM 527 O CYS C 35 77.870 3.666 -6.655 1.00 0.00 O ATOM 528 CB CYS C 35 77.228 1.291 -8.575 1.00 0.00 C ATOM 529 SG CYS C 35 75.509 1.834 -8.779 1.00 0.00 S ATOM 0 H CYS C 35 75.789 2.004 -6.358 1.00 0.00 H new ATOM 0 HA CYS C 35 78.244 0.438 -6.879 1.00 0.00 H new ATOM 0 HB2 CYS C 35 77.890 1.940 -9.148 1.00 0.00 H new ATOM 0 HB3 CYS C 35 77.346 0.283 -8.974 1.00 0.00 H new ATOM 0 HG CYS C 35 74.706 0.899 -8.364 1.00 0.00 H new ATOM 535 N ILE C 36 79.752 2.435 -6.775 1.00 0.00 N ATOM 536 CA ILE C 36 80.631 3.572 -6.522 1.00 0.00 C ATOM 537 C ILE C 36 81.134 4.164 -7.833 1.00 0.00 C ATOM 538 O ILE C 36 81.067 3.530 -8.886 1.00 0.00 O ATOM 539 CB ILE C 36 81.837 3.141 -5.685 1.00 0.00 C ATOM 540 CG1 ILE C 36 81.368 2.238 -4.545 1.00 0.00 C ATOM 541 CG2 ILE C 36 82.526 4.378 -5.105 1.00 0.00 C ATOM 542 CD1 ILE C 36 82.542 1.392 -4.048 1.00 0.00 C ATOM 0 H ILE C 36 80.234 1.546 -6.909 1.00 0.00 H new ATOM 0 HA ILE C 36 80.056 4.322 -5.979 1.00 0.00 H new ATOM 0 HB ILE C 36 82.540 2.597 -6.315 1.00 0.00 H new ATOM 0 HG12 ILE C 36 80.970 2.841 -3.729 1.00 0.00 H new ATOM 0 HG13 ILE C 36 80.560 1.592 -4.888 1.00 0.00 H new ATOM 0 HG21 ILE C 36 83.385 4.070 -4.509 1.00 0.00 H new ATOM 0 HG22 ILE C 36 82.861 5.023 -5.918 1.00 0.00 H new ATOM 0 HG23 ILE C 36 81.824 4.924 -4.475 1.00 0.00 H new ATOM 0 HD11 ILE C 36 82.208 0.748 -3.235 1.00 0.00 H new ATOM 0 HD12 ILE C 36 82.920 0.778 -4.866 1.00 0.00 H new ATOM 0 HD13 ILE C 36 83.336 2.047 -3.689 1.00 0.00 H new ATOM 554 N SER C 37 81.649 5.386 -7.751 1.00 0.00 N ATOM 555 CA SER C 37 82.175 6.063 -8.931 1.00 0.00 C ATOM 556 C SER C 37 83.287 7.024 -8.527 1.00 0.00 C ATOM 557 O SER C 37 83.254 7.616 -7.448 1.00 0.00 O ATOM 558 CB SER C 37 81.073 6.844 -9.646 1.00 0.00 C ATOM 559 OG SER C 37 81.664 7.748 -10.571 1.00 0.00 O ATOM 0 H SER C 37 81.713 5.925 -6.887 1.00 0.00 H new ATOM 0 HA SER C 37 82.569 5.306 -9.609 1.00 0.00 H new ATOM 0 HB2 SER C 37 80.404 6.158 -10.166 1.00 0.00 H new ATOM 0 HB3 SER C 37 80.469 7.390 -8.921 1.00 0.00 H new ATOM 0 HG SER C 37 80.960 8.250 -11.033 1.00 0.00 H new ATOM 565 N THR C 38 84.272 7.170 -9.406 1.00 0.00 N ATOM 566 CA THR C 38 85.398 8.061 -9.130 1.00 0.00 C ATOM 567 C THR C 38 84.914 9.324 -8.427 1.00 0.00 C ATOM 568 O THR C 38 85.608 9.889 -7.582 1.00 0.00 O ATOM 569 CB THR C 38 86.105 8.466 -10.429 1.00 0.00 C ATOM 570 OG1 THR C 38 85.397 9.539 -11.033 1.00 0.00 O ATOM 571 CG2 THR C 38 86.151 7.279 -11.393 1.00 0.00 C ATOM 0 H THR C 38 84.317 6.691 -10.305 1.00 0.00 H new ATOM 0 HA THR C 38 86.096 7.522 -8.489 1.00 0.00 H new ATOM 0 HB THR C 38 87.124 8.778 -10.201 1.00 0.00 H new ATOM 0 HG1 THR C 38 85.838 9.791 -11.871 1.00 0.00 H new ATOM 0 HG21 THR C 38 86.655 7.576 -12.313 1.00 0.00 H new ATOM 0 HG22 THR C 38 86.696 6.456 -10.931 1.00 0.00 H new ATOM 0 HG23 THR C 38 85.135 6.958 -11.623 1.00 0.00 H new ATOM 579 N LYS C 39 83.713 9.762 -8.791 1.00 0.00 N ATOM 580 CA LYS C 39 83.139 10.965 -8.195 1.00 0.00 C ATOM 581 C LYS C 39 82.367 10.626 -6.922 1.00 0.00 C ATOM 582 O LYS C 39 82.355 11.398 -5.964 1.00 0.00 O ATOM 583 CB LYS C 39 82.192 11.649 -9.182 1.00 0.00 C ATOM 584 CG LYS C 39 82.164 13.152 -8.901 1.00 0.00 C ATOM 585 CD LYS C 39 82.917 13.894 -10.007 1.00 0.00 C ATOM 586 CE LYS C 39 82.078 15.078 -10.489 1.00 0.00 C ATOM 587 NZ LYS C 39 81.163 14.628 -11.576 1.00 0.00 N ATOM 0 H LYS C 39 83.123 9.308 -9.488 1.00 0.00 H new ATOM 0 HA LYS C 39 83.961 11.637 -7.948 1.00 0.00 H new ATOM 0 HB2 LYS C 39 82.521 11.465 -10.205 1.00 0.00 H new ATOM 0 HB3 LYS C 39 81.189 11.232 -9.089 1.00 0.00 H new ATOM 0 HG2 LYS C 39 81.134 13.504 -8.849 1.00 0.00 H new ATOM 0 HG3 LYS C 39 82.621 13.360 -7.933 1.00 0.00 H new ATOM 0 HD2 LYS C 39 83.880 14.244 -9.634 1.00 0.00 H new ATOM 0 HD3 LYS C 39 83.123 13.219 -10.837 1.00 0.00 H new ATOM 0 HE2 LYS C 39 81.501 15.490 -9.661 1.00 0.00 H new ATOM 0 HE3 LYS C 39 82.728 15.874 -10.852 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 80.592 15.433 -11.904 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 81.723 14.254 -12.369 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 80.535 13.882 -11.214 1.00 0.00 H new ATOM 601 N GLU C 40 81.721 9.463 -6.924 1.00 0.00 N ATOM 602 CA GLU C 40 80.946 9.033 -5.761 1.00 0.00 C ATOM 603 C GLU C 40 81.858 8.820 -4.558 1.00 0.00 C ATOM 604 O GLU C 40 81.784 9.548 -3.567 1.00 0.00 O ATOM 605 CB GLU C 40 80.207 7.727 -6.061 1.00 0.00 C ATOM 606 CG GLU C 40 78.698 7.961 -5.975 1.00 0.00 C ATOM 607 CD GLU C 40 78.310 8.257 -4.531 1.00 0.00 C ATOM 608 OE1 GLU C 40 79.194 8.578 -3.755 1.00 0.00 O ATOM 609 OE2 GLU C 40 77.134 8.157 -4.222 1.00 0.00 O ATOM 0 H GLU C 40 81.717 8.808 -7.706 1.00 0.00 H new ATOM 0 HA GLU C 40 80.223 9.816 -5.534 1.00 0.00 H new ATOM 0 HB2 GLU C 40 80.473 7.366 -7.055 1.00 0.00 H new ATOM 0 HB3 GLU C 40 80.507 6.956 -5.351 1.00 0.00 H new ATOM 0 HG2 GLU C 40 78.411 8.794 -6.618 1.00 0.00 H new ATOM 0 HG3 GLU C 40 78.162 7.082 -6.334 1.00 0.00 H new ATOM 616 N LEU C 41 82.717 7.809 -4.654 1.00 0.00 N ATOM 617 CA LEU C 41 83.641 7.496 -3.567 1.00 0.00 C ATOM 618 C LEU C 41 84.143 8.775 -2.902 1.00 0.00 C ATOM 619 O LEU C 41 84.184 8.879 -1.676 1.00 0.00 O ATOM 620 CB LEU C 41 84.840 6.705 -4.094 1.00 0.00 C ATOM 621 CG LEU C 41 85.809 6.427 -2.945 1.00 0.00 C ATOM 622 CD1 LEU C 41 85.106 5.586 -1.879 1.00 0.00 C ATOM 623 CD2 LEU C 41 87.025 5.664 -3.474 1.00 0.00 C ATOM 0 H LEU C 41 82.793 7.197 -5.466 1.00 0.00 H new ATOM 0 HA LEU C 41 83.102 6.895 -2.834 1.00 0.00 H new ATOM 0 HB2 LEU C 41 84.505 5.767 -4.537 1.00 0.00 H new ATOM 0 HB3 LEU C 41 85.343 7.267 -4.881 1.00 0.00 H new ATOM 0 HG LEU C 41 86.135 7.371 -2.509 1.00 0.00 H new ATOM 0 HD11 LEU C 41 85.796 5.387 -1.059 1.00 0.00 H new ATOM 0 HD12 LEU C 41 84.240 6.128 -1.501 1.00 0.00 H new ATOM 0 HD13 LEU C 41 84.781 4.642 -2.316 1.00 0.00 H new ATOM 0 HD21 LEU C 41 87.715 5.466 -2.654 1.00 0.00 H new ATOM 0 HD22 LEU C 41 86.700 4.720 -3.911 1.00 0.00 H new ATOM 0 HD23 LEU C 41 87.527 6.262 -4.235 1.00 0.00 H new ATOM 635 N GLY C 42 84.529 9.744 -3.726 1.00 0.00 N ATOM 636 CA GLY C 42 85.033 11.015 -3.211 1.00 0.00 C ATOM 637 C GLY C 42 84.179 11.518 -2.051 1.00 0.00 C ATOM 638 O GLY C 42 84.668 12.206 -1.155 1.00 0.00 O ATOM 0 H GLY C 42 84.504 9.676 -4.743 1.00 0.00 H new ATOM 0 HA2 GLY C 42 86.064 10.893 -2.880 1.00 0.00 H new ATOM 0 HA3 GLY C 42 85.040 11.757 -4.010 1.00 0.00 H new ATOM 642 N LYS C 43 82.895 11.175 -2.082 1.00 0.00 N ATOM 643 CA LYS C 43 81.976 11.606 -1.031 1.00 0.00 C ATOM 644 C LYS C 43 82.403 11.057 0.327 1.00 0.00 C ATOM 645 O LYS C 43 82.686 11.814 1.257 1.00 0.00 O ATOM 646 CB LYS C 43 80.555 11.129 -1.335 1.00 0.00 C ATOM 647 CG LYS C 43 80.115 11.680 -2.691 1.00 0.00 C ATOM 648 CD LYS C 43 78.718 12.288 -2.566 1.00 0.00 C ATOM 649 CE LYS C 43 78.667 13.611 -3.331 1.00 0.00 C ATOM 650 NZ LYS C 43 78.933 14.738 -2.394 1.00 0.00 N ATOM 0 H LYS C 43 82.470 10.606 -2.814 1.00 0.00 H new ATOM 0 HA LYS C 43 81.999 12.695 -0.999 1.00 0.00 H new ATOM 0 HB2 LYS C 43 80.519 10.040 -1.343 1.00 0.00 H new ATOM 0 HB3 LYS C 43 79.872 11.464 -0.555 1.00 0.00 H new ATOM 0 HG2 LYS C 43 80.822 12.435 -3.035 1.00 0.00 H new ATOM 0 HG3 LYS C 43 80.111 10.884 -3.435 1.00 0.00 H new ATOM 0 HD2 LYS C 43 77.973 11.598 -2.962 1.00 0.00 H new ATOM 0 HD3 LYS C 43 78.474 12.453 -1.516 1.00 0.00 H new ATOM 0 HE2 LYS C 43 79.406 13.608 -4.132 1.00 0.00 H new ATOM 0 HE3 LYS C 43 77.690 13.736 -3.798 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 78.898 15.638 -2.914 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 78.212 14.744 -1.644 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 79.875 14.621 -1.968 1.00 0.00 H new ATOM 664 N VAL C 44 82.439 9.732 0.436 1.00 0.00 N ATOM 665 CA VAL C 44 82.824 9.091 1.691 1.00 0.00 C ATOM 666 C VAL C 44 84.146 9.656 2.201 1.00 0.00 C ATOM 667 O VAL C 44 84.214 10.214 3.296 1.00 0.00 O ATOM 668 CB VAL C 44 82.964 7.581 1.504 1.00 0.00 C ATOM 669 CG1 VAL C 44 83.311 6.931 2.844 1.00 0.00 C ATOM 670 CG2 VAL C 44 81.641 7.011 0.990 1.00 0.00 C ATOM 0 H VAL C 44 82.209 9.087 -0.320 1.00 0.00 H new ATOM 0 HA VAL C 44 82.040 9.293 2.421 1.00 0.00 H new ATOM 0 HB VAL C 44 83.756 7.374 0.785 1.00 0.00 H new ATOM 0 HG11 VAL C 44 83.411 5.854 2.711 1.00 0.00 H new ATOM 0 HG12 VAL C 44 84.251 7.340 3.214 1.00 0.00 H new ATOM 0 HG13 VAL C 44 82.518 7.136 3.564 1.00 0.00 H new ATOM 0 HG21 VAL C 44 81.737 5.934 0.855 1.00 0.00 H new ATOM 0 HG22 VAL C 44 80.851 7.218 1.712 1.00 0.00 H new ATOM 0 HG23 VAL C 44 81.391 7.475 0.036 1.00 0.00 H new ATOM 680 N MET C 45 85.195 9.504 1.397 1.00 0.00 N ATOM 681 CA MET C 45 86.513 10.005 1.779 1.00 0.00 C ATOM 682 C MET C 45 86.381 11.336 2.513 1.00 0.00 C ATOM 683 O MET C 45 86.877 11.502 3.626 1.00 0.00 O ATOM 684 CB MET C 45 87.388 10.208 0.539 1.00 0.00 C ATOM 685 CG MET C 45 87.811 8.849 -0.018 1.00 0.00 C ATOM 686 SD MET C 45 89.566 8.574 0.331 1.00 0.00 S ATOM 687 CE MET C 45 89.351 7.711 1.907 1.00 0.00 C ATOM 0 H MET C 45 85.160 9.044 0.487 1.00 0.00 H new ATOM 0 HA MET C 45 86.977 9.269 2.435 1.00 0.00 H new ATOM 0 HB2 MET C 45 86.839 10.768 -0.218 1.00 0.00 H new ATOM 0 HB3 MET C 45 88.268 10.797 0.795 1.00 0.00 H new ATOM 0 HG2 MET C 45 87.211 8.057 0.431 1.00 0.00 H new ATOM 0 HG3 MET C 45 87.633 8.813 -1.093 1.00 0.00 H new ATOM 0 HE1 MET C 45 90.311 7.318 2.241 1.00 0.00 H new ATOM 0 HE2 MET C 45 88.965 8.406 2.653 1.00 0.00 H new ATOM 0 HE3 MET C 45 88.647 6.889 1.778 1.00 0.00 H new ATOM 697 N ARG C 46 85.705 12.281 1.866 1.00 0.00 N ATOM 698 CA ARG C 46 85.504 13.606 2.448 1.00 0.00 C ATOM 699 C ARG C 46 85.275 13.511 3.954 1.00 0.00 C ATOM 700 O ARG C 46 86.096 13.963 4.752 1.00 0.00 O ATOM 701 CB ARG C 46 84.295 14.286 1.805 1.00 0.00 C ATOM 702 CG ARG C 46 84.514 15.799 1.768 1.00 0.00 C ATOM 703 CD ARG C 46 83.185 16.496 1.475 1.00 0.00 C ATOM 704 NE ARG C 46 83.246 17.902 1.862 1.00 0.00 N ATOM 705 CZ ARG C 46 83.376 18.256 3.137 1.00 0.00 C ATOM 706 NH1 ARG C 46 83.439 17.340 4.066 1.00 0.00 N ATOM 707 NH2 ARG C 46 83.435 19.518 3.460 1.00 0.00 N ATOM 0 H ARG C 46 85.289 12.156 0.943 1.00 0.00 H new ATOM 0 HA ARG C 46 86.403 14.193 2.260 1.00 0.00 H new ATOM 0 HB2 ARG C 46 84.146 13.906 0.794 1.00 0.00 H new ATOM 0 HB3 ARG C 46 83.392 14.053 2.369 1.00 0.00 H new ATOM 0 HG2 ARG C 46 84.916 16.143 2.721 1.00 0.00 H new ATOM 0 HG3 ARG C 46 85.247 16.053 1.003 1.00 0.00 H new ATOM 0 HD2 ARG C 46 82.952 16.415 0.413 1.00 0.00 H new ATOM 0 HD3 ARG C 46 82.380 15.999 2.016 1.00 0.00 H new ATOM 0 HE ARG C 46 83.188 18.624 1.144 1.00 0.00 H new ATOM 0 HH11 ARG C 46 83.388 16.353 3.813 1.00 0.00 H new ATOM 0 HH12 ARG C 46 83.539 17.612 5.044 1.00 0.00 H new ATOM 0 HH21 ARG C 46 83.381 20.233 2.735 1.00 0.00 H new ATOM 0 HH22 ARG C 46 83.535 19.790 4.438 1.00 0.00 H new ATOM 721 N MET C 47 84.144 12.923 4.331 1.00 0.00 N ATOM 722 CA MET C 47 83.802 12.778 5.745 1.00 0.00 C ATOM 723 C MET C 47 84.994 12.256 6.545 1.00 0.00 C ATOM 724 O MET C 47 85.079 12.457 7.756 1.00 0.00 O ATOM 725 CB MET C 47 82.629 11.811 5.911 1.00 0.00 C ATOM 726 CG MET C 47 81.366 12.598 6.265 1.00 0.00 C ATOM 727 SD MET C 47 80.279 12.682 4.819 1.00 0.00 S ATOM 728 CE MET C 47 79.919 10.913 4.695 1.00 0.00 C ATOM 0 H MET C 47 83.453 12.542 3.685 1.00 0.00 H new ATOM 0 HA MET C 47 83.524 13.762 6.122 1.00 0.00 H new ATOM 0 HB2 MET C 47 82.474 11.249 4.990 1.00 0.00 H new ATOM 0 HB3 MET C 47 82.850 11.086 6.694 1.00 0.00 H new ATOM 0 HG2 MET C 47 80.847 12.119 7.095 1.00 0.00 H new ATOM 0 HG3 MET C 47 81.631 13.603 6.592 1.00 0.00 H new ATOM 0 HE1 MET C 47 79.072 10.760 4.026 1.00 0.00 H new ATOM 0 HE2 MET C 47 80.791 10.391 4.302 1.00 0.00 H new ATOM 0 HE3 MET C 47 79.676 10.521 5.683 1.00 0.00 H new ATOM 738 N LEU C 48 85.912 11.580 5.858 1.00 0.00 N ATOM 739 CA LEU C 48 87.093 11.030 6.522 1.00 0.00 C ATOM 740 C LEU C 48 88.230 12.051 6.549 1.00 0.00 C ATOM 741 O LEU C 48 89.404 11.688 6.632 1.00 0.00 O ATOM 742 CB LEU C 48 87.571 9.768 5.801 1.00 0.00 C ATOM 743 CG LEU C 48 86.366 9.012 5.234 1.00 0.00 C ATOM 744 CD1 LEU C 48 86.798 7.604 4.824 1.00 0.00 C ATOM 745 CD2 LEU C 48 85.270 8.915 6.300 1.00 0.00 C ATOM 0 H LEU C 48 85.864 11.401 4.855 1.00 0.00 H new ATOM 0 HA LEU C 48 86.812 10.783 7.546 1.00 0.00 H new ATOM 0 HB2 LEU C 48 88.257 10.034 4.997 1.00 0.00 H new ATOM 0 HB3 LEU C 48 88.122 9.129 6.491 1.00 0.00 H new ATOM 0 HG LEU C 48 85.981 9.546 4.365 1.00 0.00 H new ATOM 0 HD11 LEU C 48 85.942 7.064 4.420 1.00 0.00 H new ATOM 0 HD12 LEU C 48 87.577 7.669 4.065 1.00 0.00 H new ATOM 0 HD13 LEU C 48 87.184 7.074 5.695 1.00 0.00 H new ATOM 0 HD21 LEU C 48 84.414 8.377 5.894 1.00 0.00 H new ATOM 0 HD22 LEU C 48 85.654 8.382 7.170 1.00 0.00 H new ATOM 0 HD23 LEU C 48 84.961 9.917 6.596 1.00 0.00 H new ATOM 757 N GLY C 49 87.870 13.331 6.486 1.00 0.00 N ATOM 758 CA GLY C 49 88.869 14.397 6.511 1.00 0.00 C ATOM 759 C GLY C 49 89.733 14.371 5.254 1.00 0.00 C ATOM 760 O GLY C 49 90.807 14.971 5.211 1.00 0.00 O ATOM 0 H GLY C 49 86.905 13.653 6.418 1.00 0.00 H new ATOM 0 HA2 GLY C 49 88.372 15.363 6.594 1.00 0.00 H new ATOM 0 HA3 GLY C 49 89.501 14.287 7.392 1.00 0.00 H new ATOM 764 N GLN C 50 89.252 13.672 4.231 1.00 0.00 N ATOM 765 CA GLN C 50 89.989 13.576 2.973 1.00 0.00 C ATOM 766 C GLN C 50 89.045 13.768 1.791 1.00 0.00 C ATOM 767 O GLN C 50 88.059 13.049 1.643 1.00 0.00 O ATOM 768 CB GLN C 50 90.671 12.211 2.854 1.00 0.00 C ATOM 769 CG GLN C 50 91.889 12.167 3.779 1.00 0.00 C ATOM 770 CD GLN C 50 92.395 10.732 3.881 1.00 0.00 C ATOM 771 OE1 GLN C 50 93.589 10.475 3.721 1.00 0.00 O ATOM 772 NE2 GLN C 50 91.550 9.773 4.140 1.00 0.00 N ATOM 0 H GLN C 50 88.365 13.168 4.245 1.00 0.00 H new ATOM 0 HA GLN C 50 90.747 14.359 2.964 1.00 0.00 H new ATOM 0 HB2 GLN C 50 89.971 11.419 3.119 1.00 0.00 H new ATOM 0 HB3 GLN C 50 90.977 12.034 1.823 1.00 0.00 H new ATOM 0 HG2 GLN C 50 92.676 12.815 3.394 1.00 0.00 H new ATOM 0 HG3 GLN C 50 91.623 12.542 4.767 1.00 0.00 H new ATOM 0 HE21 GLN C 50 90.561 9.986 4.272 1.00 0.00 H new ATOM 0 HE22 GLN C 50 91.878 8.810 4.210 1.00 0.00 H new ATOM 781 N ASN C 51 89.353 14.753 0.953 1.00 0.00 N ATOM 782 CA ASN C 51 88.517 15.035 -0.212 1.00 0.00 C ATOM 783 C ASN C 51 89.335 14.951 -1.498 1.00 0.00 C ATOM 784 O ASN C 51 89.868 15.951 -1.977 1.00 0.00 O ATOM 785 CB ASN C 51 87.907 16.434 -0.103 1.00 0.00 C ATOM 786 CG ASN C 51 87.209 16.793 -1.411 1.00 0.00 C ATOM 787 OD1 ASN C 51 86.998 17.970 -1.705 1.00 0.00 O ATOM 788 ND2 ASN C 51 86.833 15.842 -2.222 1.00 0.00 N ATOM 0 H ASN C 51 90.164 15.363 1.055 1.00 0.00 H new ATOM 0 HA ASN C 51 87.723 14.289 -0.241 1.00 0.00 H new ATOM 0 HB2 ASN C 51 87.195 16.468 0.722 1.00 0.00 H new ATOM 0 HB3 ASN C 51 88.685 17.165 0.118 1.00 0.00 H new ATOM 0 HD21 ASN C 51 86.365 16.074 -3.098 1.00 0.00 H new ATOM 0 HD22 ASN C 51 87.007 14.867 -1.980 1.00 0.00 H new ATOM 795 N PRO C 52 89.432 13.752 -2.067 1.00 0.00 N ATOM 796 CA PRO C 52 90.184 13.525 -3.313 1.00 0.00 C ATOM 797 C PRO C 52 89.382 13.901 -4.558 1.00 0.00 C ATOM 798 O PRO C 52 88.280 14.442 -4.464 1.00 0.00 O ATOM 799 CB PRO C 52 90.441 12.024 -3.264 1.00 0.00 C ATOM 800 CG PRO C 52 89.363 11.418 -2.371 1.00 0.00 C ATOM 801 CD PRO C 52 88.799 12.547 -1.501 1.00 0.00 C ATOM 0 HA PRO C 52 91.086 14.134 -3.379 1.00 0.00 H new ATOM 0 HB2 PRO C 52 90.401 11.593 -4.264 1.00 0.00 H new ATOM 0 HB3 PRO C 52 91.434 11.815 -2.866 1.00 0.00 H new ATOM 0 HG2 PRO C 52 88.574 10.967 -2.974 1.00 0.00 H new ATOM 0 HG3 PRO C 52 89.781 10.626 -1.749 1.00 0.00 H new ATOM 0 HD2 PRO C 52 87.712 12.597 -1.560 1.00 0.00 H new ATOM 0 HD3 PRO C 52 89.055 12.413 -0.450 1.00 0.00 H new ATOM 809 N THR C 53 89.950 13.609 -5.725 1.00 0.00 N ATOM 810 CA THR C 53 89.282 13.921 -6.988 1.00 0.00 C ATOM 811 C THR C 53 88.852 12.635 -7.687 1.00 0.00 C ATOM 812 O THR C 53 89.123 11.533 -7.210 1.00 0.00 O ATOM 813 CB THR C 53 90.213 14.712 -7.921 1.00 0.00 C ATOM 814 OG1 THR C 53 90.764 13.836 -8.895 1.00 0.00 O ATOM 815 CG2 THR C 53 91.347 15.352 -7.115 1.00 0.00 C ATOM 0 H THR C 53 90.861 13.162 -5.824 1.00 0.00 H new ATOM 0 HA THR C 53 88.406 14.529 -6.762 1.00 0.00 H new ATOM 0 HB THR C 53 89.638 15.496 -8.414 1.00 0.00 H new ATOM 0 HG1 THR C 53 91.356 14.340 -9.491 1.00 0.00 H new ATOM 0 HG21 THR C 53 92.000 15.910 -7.786 1.00 0.00 H new ATOM 0 HG22 THR C 53 90.927 16.029 -6.371 1.00 0.00 H new ATOM 0 HG23 THR C 53 91.922 14.573 -6.614 1.00 0.00 H new ATOM 823 N PRO C 54 88.181 12.769 -8.828 1.00 0.00 N ATOM 824 CA PRO C 54 87.709 11.612 -9.607 1.00 0.00 C ATOM 825 C PRO C 54 88.819 11.001 -10.459 1.00 0.00 C ATOM 826 O PRO C 54 88.650 9.940 -11.060 1.00 0.00 O ATOM 827 CB PRO C 54 86.626 12.232 -10.482 1.00 0.00 C ATOM 828 CG PRO C 54 86.940 13.720 -10.592 1.00 0.00 C ATOM 829 CD PRO C 54 87.852 14.083 -9.414 1.00 0.00 C ATOM 0 HA PRO C 54 87.360 10.790 -8.982 1.00 0.00 H new ATOM 0 HB2 PRO C 54 86.613 11.767 -11.468 1.00 0.00 H new ATOM 0 HB3 PRO C 54 85.640 12.077 -10.043 1.00 0.00 H new ATOM 0 HG2 PRO C 54 87.431 13.940 -11.540 1.00 0.00 H new ATOM 0 HG3 PRO C 54 86.023 14.309 -10.564 1.00 0.00 H new ATOM 0 HD2 PRO C 54 88.746 14.612 -9.744 1.00 0.00 H new ATOM 0 HD3 PRO C 54 87.346 14.729 -8.697 1.00 0.00 H new ATOM 837 N GLU C 55 89.958 11.686 -10.495 1.00 0.00 N ATOM 838 CA GLU C 55 91.101 11.211 -11.266 1.00 0.00 C ATOM 839 C GLU C 55 91.923 10.232 -10.436 1.00 0.00 C ATOM 840 O GLU C 55 92.301 9.159 -10.906 1.00 0.00 O ATOM 841 CB GLU C 55 91.991 12.383 -11.682 1.00 0.00 C ATOM 842 CG GLU C 55 91.145 13.438 -12.397 1.00 0.00 C ATOM 843 CD GLU C 55 91.319 13.293 -13.905 1.00 0.00 C ATOM 844 OE1 GLU C 55 92.026 12.388 -14.316 1.00 0.00 O ATOM 845 OE2 GLU C 55 90.742 14.090 -14.627 1.00 0.00 O ATOM 0 H GLU C 55 90.113 12.566 -10.003 1.00 0.00 H new ATOM 0 HA GLU C 55 90.725 10.710 -12.158 1.00 0.00 H new ATOM 0 HB2 GLU C 55 92.470 12.819 -10.805 1.00 0.00 H new ATOM 0 HB3 GLU C 55 92.787 12.033 -12.339 1.00 0.00 H new ATOM 0 HG2 GLU C 55 90.095 13.321 -12.128 1.00 0.00 H new ATOM 0 HG3 GLU C 55 91.446 14.437 -12.080 1.00 0.00 H new ATOM 852 N GLU C 56 92.189 10.614 -9.189 1.00 0.00 N ATOM 853 CA GLU C 56 92.962 9.762 -8.291 1.00 0.00 C ATOM 854 C GLU C 56 92.126 8.563 -7.859 1.00 0.00 C ATOM 855 O GLU C 56 92.639 7.458 -7.687 1.00 0.00 O ATOM 856 CB GLU C 56 93.396 10.543 -7.048 1.00 0.00 C ATOM 857 CG GLU C 56 93.918 11.919 -7.467 1.00 0.00 C ATOM 858 CD GLU C 56 94.841 12.464 -6.383 1.00 0.00 C ATOM 859 OE1 GLU C 56 94.393 12.584 -5.255 1.00 0.00 O ATOM 860 OE2 GLU C 56 95.984 12.754 -6.697 1.00 0.00 O ATOM 0 H GLU C 56 91.884 11.498 -8.781 1.00 0.00 H new ATOM 0 HA GLU C 56 93.848 9.419 -8.826 1.00 0.00 H new ATOM 0 HB2 GLU C 56 92.555 10.654 -6.363 1.00 0.00 H new ATOM 0 HB3 GLU C 56 94.172 9.995 -6.514 1.00 0.00 H new ATOM 0 HG2 GLU C 56 94.455 11.844 -8.413 1.00 0.00 H new ATOM 0 HG3 GLU C 56 93.084 12.603 -7.627 1.00 0.00 H new ATOM 867 N LEU C 57 90.827 8.795 -7.691 1.00 0.00 N ATOM 868 CA LEU C 57 89.920 7.727 -7.285 1.00 0.00 C ATOM 869 C LEU C 57 89.822 6.675 -8.385 1.00 0.00 C ATOM 870 O LEU C 57 89.978 5.480 -8.136 1.00 0.00 O ATOM 871 CB LEU C 57 88.523 8.284 -6.999 1.00 0.00 C ATOM 872 CG LEU C 57 88.548 9.078 -5.693 1.00 0.00 C ATOM 873 CD1 LEU C 57 87.139 9.578 -5.373 1.00 0.00 C ATOM 874 CD2 LEU C 57 89.038 8.176 -4.557 1.00 0.00 C ATOM 0 H LEU C 57 90.383 9.703 -7.828 1.00 0.00 H new ATOM 0 HA LEU C 57 90.317 7.273 -6.377 1.00 0.00 H new ATOM 0 HB2 LEU C 57 88.200 8.924 -7.820 1.00 0.00 H new ATOM 0 HB3 LEU C 57 87.803 7.469 -6.928 1.00 0.00 H new ATOM 0 HG LEU C 57 89.221 9.929 -5.799 1.00 0.00 H new ATOM 0 HD11 LEU C 57 87.157 10.144 -4.442 1.00 0.00 H new ATOM 0 HD12 LEU C 57 86.788 10.220 -6.181 1.00 0.00 H new ATOM 0 HD13 LEU C 57 86.466 8.727 -5.268 1.00 0.00 H new ATOM 0 HD21 LEU C 57 89.056 8.742 -3.625 1.00 0.00 H new ATOM 0 HD22 LEU C 57 88.365 7.325 -4.452 1.00 0.00 H new ATOM 0 HD23 LEU C 57 90.042 7.818 -4.784 1.00 0.00 H new ATOM 886 N GLN C 58 89.569 7.136 -9.608 1.00 0.00 N ATOM 887 CA GLN C 58 89.461 6.227 -10.745 1.00 0.00 C ATOM 888 C GLN C 58 90.505 5.123 -10.629 1.00 0.00 C ATOM 889 O GLN C 58 90.195 3.938 -10.760 1.00 0.00 O ATOM 890 CB GLN C 58 89.677 6.980 -12.059 1.00 0.00 C ATOM 891 CG GLN C 58 89.014 6.212 -13.204 1.00 0.00 C ATOM 892 CD GLN C 58 89.921 5.067 -13.643 1.00 0.00 C ATOM 893 OE1 GLN C 58 90.850 5.269 -14.425 1.00 0.00 O ATOM 894 NE2 GLN C 58 89.705 3.865 -13.183 1.00 0.00 N ATOM 0 H GLN C 58 89.436 8.122 -9.835 1.00 0.00 H new ATOM 0 HA GLN C 58 88.461 5.793 -10.741 1.00 0.00 H new ATOM 0 HB2 GLN C 58 89.256 7.983 -11.989 1.00 0.00 H new ATOM 0 HB3 GLN C 58 90.743 7.094 -12.254 1.00 0.00 H new ATOM 0 HG2 GLN C 58 88.048 5.822 -12.883 1.00 0.00 H new ATOM 0 HG3 GLN C 58 88.824 6.882 -14.043 1.00 0.00 H new ATOM 0 HE21 GLN C 58 88.935 3.698 -12.535 1.00 0.00 H new ATOM 0 HE22 GLN C 58 90.306 3.093 -13.471 1.00 0.00 H new ATOM 903 N GLU C 59 91.747 5.526 -10.375 1.00 0.00 N ATOM 904 CA GLU C 59 92.832 4.562 -10.235 1.00 0.00 C ATOM 905 C GLU C 59 92.431 3.470 -9.251 1.00 0.00 C ATOM 906 O GLU C 59 92.662 2.284 -9.487 1.00 0.00 O ATOM 907 CB GLU C 59 94.101 5.253 -9.731 1.00 0.00 C ATOM 908 CG GLU C 59 94.899 5.787 -10.923 1.00 0.00 C ATOM 909 CD GLU C 59 94.330 7.135 -11.354 1.00 0.00 C ATOM 910 OE1 GLU C 59 93.374 7.137 -12.113 1.00 0.00 O ATOM 911 OE2 GLU C 59 94.858 8.144 -10.919 1.00 0.00 O ATOM 0 H GLU C 59 92.024 6.501 -10.263 1.00 0.00 H new ATOM 0 HA GLU C 59 93.030 4.122 -11.212 1.00 0.00 H new ATOM 0 HB2 GLU C 59 93.840 6.070 -9.059 1.00 0.00 H new ATOM 0 HB3 GLU C 59 94.707 4.551 -9.159 1.00 0.00 H new ATOM 0 HG2 GLU C 59 95.949 5.894 -10.652 1.00 0.00 H new ATOM 0 HG3 GLU C 59 94.853 5.080 -11.751 1.00 0.00 H new ATOM 918 N MET C 60 91.816 3.886 -8.148 1.00 0.00 N ATOM 919 CA MET C 60 91.369 2.937 -7.133 1.00 0.00 C ATOM 920 C MET C 60 90.169 2.155 -7.651 1.00 0.00 C ATOM 921 O MET C 60 89.891 1.042 -7.206 1.00 0.00 O ATOM 922 CB MET C 60 90.970 3.668 -5.849 1.00 0.00 C ATOM 923 CG MET C 60 92.192 4.377 -5.261 1.00 0.00 C ATOM 924 SD MET C 60 91.705 6.011 -4.654 1.00 0.00 S ATOM 925 CE MET C 60 91.276 5.507 -2.970 1.00 0.00 C ATOM 0 H MET C 60 91.617 4.863 -7.935 1.00 0.00 H new ATOM 0 HA MET C 60 92.192 2.256 -6.915 1.00 0.00 H new ATOM 0 HB2 MET C 60 90.183 4.392 -6.060 1.00 0.00 H new ATOM 0 HB3 MET C 60 90.565 2.960 -5.126 1.00 0.00 H new ATOM 0 HG2 MET C 60 92.613 3.786 -4.448 1.00 0.00 H new ATOM 0 HG3 MET C 60 92.969 4.475 -6.019 1.00 0.00 H new ATOM 0 HE1 MET C 60 90.399 6.062 -2.637 1.00 0.00 H new ATOM 0 HE2 MET C 60 91.058 4.439 -2.954 1.00 0.00 H new ATOM 0 HE3 MET C 60 92.113 5.716 -2.303 1.00 0.00 H new ATOM 935 N ILE C 61 89.463 2.757 -8.605 1.00 0.00 N ATOM 936 CA ILE C 61 88.290 2.118 -9.191 1.00 0.00 C ATOM 937 C ILE C 61 88.718 0.980 -10.112 1.00 0.00 C ATOM 938 O ILE C 61 88.029 -0.032 -10.236 1.00 0.00 O ATOM 939 CB ILE C 61 87.472 3.136 -9.989 1.00 0.00 C ATOM 940 CG1 ILE C 61 87.078 4.296 -9.071 1.00 0.00 C ATOM 941 CG2 ILE C 61 86.209 2.467 -10.535 1.00 0.00 C ATOM 942 CD1 ILE C 61 86.019 3.824 -8.074 1.00 0.00 C ATOM 0 H ILE C 61 89.681 3.678 -8.985 1.00 0.00 H new ATOM 0 HA ILE C 61 87.676 1.719 -8.384 1.00 0.00 H new ATOM 0 HB ILE C 61 88.069 3.511 -10.821 1.00 0.00 H new ATOM 0 HG12 ILE C 61 87.954 4.665 -8.538 1.00 0.00 H new ATOM 0 HG13 ILE C 61 86.691 5.126 -9.662 1.00 0.00 H new ATOM 0 HG21 ILE C 61 85.628 3.194 -11.103 1.00 0.00 H new ATOM 0 HG22 ILE C 61 86.488 1.638 -11.186 1.00 0.00 H new ATOM 0 HG23 ILE C 61 85.609 2.091 -9.706 1.00 0.00 H new ATOM 0 HD11 ILE C 61 85.740 4.651 -7.421 1.00 0.00 H new ATOM 0 HD12 ILE C 61 85.139 3.476 -8.615 1.00 0.00 H new ATOM 0 HD13 ILE C 61 86.422 3.008 -7.474 1.00 0.00 H new ATOM 954 N ASP C 62 89.872 1.156 -10.751 1.00 0.00 N ATOM 955 CA ASP C 62 90.396 0.137 -11.655 1.00 0.00 C ATOM 956 C ASP C 62 90.701 -1.144 -10.884 1.00 0.00 C ATOM 957 O ASP C 62 90.684 -2.242 -11.440 1.00 0.00 O ATOM 958 CB ASP C 62 91.677 0.629 -12.334 1.00 0.00 C ATOM 959 CG ASP C 62 91.695 0.167 -13.787 1.00 0.00 C ATOM 960 OD1 ASP C 62 90.728 0.430 -14.484 1.00 0.00 O ATOM 961 OD2 ASP C 62 92.675 -0.441 -14.183 1.00 0.00 O ATOM 0 H ASP C 62 90.457 1.987 -10.661 1.00 0.00 H new ATOM 0 HA ASP C 62 89.640 -0.064 -12.415 1.00 0.00 H new ATOM 0 HB2 ASP C 62 91.731 1.717 -12.287 1.00 0.00 H new ATOM 0 HB3 ASP C 62 92.551 0.243 -11.808 1.00 0.00 H new ATOM 966 N GLU C 63 90.975 -0.988 -9.591 1.00 0.00 N ATOM 967 CA GLU C 63 91.279 -2.140 -8.743 1.00 0.00 C ATOM 968 C GLU C 63 90.086 -3.085 -8.699 1.00 0.00 C ATOM 969 O GLU C 63 90.240 -4.301 -8.586 1.00 0.00 O ATOM 970 CB GLU C 63 91.603 -1.705 -7.308 1.00 0.00 C ATOM 971 CG GLU C 63 92.430 -0.417 -7.311 1.00 0.00 C ATOM 972 CD GLU C 63 93.674 -0.605 -8.174 1.00 0.00 C ATOM 973 OE1 GLU C 63 93.907 -1.719 -8.612 1.00 0.00 O ATOM 974 OE2 GLU C 63 94.379 0.369 -8.382 1.00 0.00 O ATOM 0 H GLU C 63 90.993 -0.088 -9.111 1.00 0.00 H new ATOM 0 HA GLU C 63 92.147 -2.641 -9.171 1.00 0.00 H new ATOM 0 HB2 GLU C 63 90.679 -1.549 -6.752 1.00 0.00 H new ATOM 0 HB3 GLU C 63 92.153 -2.496 -6.798 1.00 0.00 H new ATOM 0 HG2 GLU C 63 91.832 0.410 -7.694 1.00 0.00 H new ATOM 0 HG3 GLU C 63 92.718 -0.156 -6.293 1.00 0.00 H new ATOM 981 N VAL C 64 88.894 -2.506 -8.779 1.00 0.00 N ATOM 982 CA VAL C 64 87.667 -3.293 -8.738 1.00 0.00 C ATOM 983 C VAL C 64 87.016 -3.346 -10.117 1.00 0.00 C ATOM 984 O VAL C 64 86.461 -4.369 -10.517 1.00 0.00 O ATOM 985 CB VAL C 64 86.686 -2.681 -7.740 1.00 0.00 C ATOM 986 CG1 VAL C 64 87.157 -2.982 -6.316 1.00 0.00 C ATOM 987 CG2 VAL C 64 86.636 -1.166 -7.947 1.00 0.00 C ATOM 0 H VAL C 64 88.751 -1.500 -8.872 1.00 0.00 H new ATOM 0 HA VAL C 64 87.922 -4.306 -8.427 1.00 0.00 H new ATOM 0 HB VAL C 64 85.694 -3.106 -7.894 1.00 0.00 H new ATOM 0 HG11 VAL C 64 86.458 -2.546 -5.602 1.00 0.00 H new ATOM 0 HG12 VAL C 64 87.201 -4.061 -6.168 1.00 0.00 H new ATOM 0 HG13 VAL C 64 88.147 -2.554 -6.162 1.00 0.00 H new ATOM 0 HG21 VAL C 64 85.937 -0.725 -7.237 1.00 0.00 H new ATOM 0 HG22 VAL C 64 87.629 -0.744 -7.789 1.00 0.00 H new ATOM 0 HG23 VAL C 64 86.307 -0.948 -8.963 1.00 0.00 H new ATOM 997 N ASP C 65 87.091 -2.232 -10.840 1.00 0.00 N ATOM 998 CA ASP C 65 86.505 -2.164 -12.176 1.00 0.00 C ATOM 999 C ASP C 65 87.302 -3.028 -13.149 1.00 0.00 C ATOM 1000 O ASP C 65 87.918 -2.525 -14.088 1.00 0.00 O ATOM 1001 CB ASP C 65 86.491 -0.722 -12.687 1.00 0.00 C ATOM 1002 CG ASP C 65 85.136 -0.090 -12.389 1.00 0.00 C ATOM 1003 OD1 ASP C 65 84.416 -0.638 -11.573 1.00 0.00 O ATOM 1004 OD2 ASP C 65 84.839 0.934 -12.983 1.00 0.00 O ATOM 0 H ASP C 65 87.546 -1.374 -10.529 1.00 0.00 H new ATOM 0 HA ASP C 65 85.481 -2.533 -12.112 1.00 0.00 H new ATOM 0 HB2 ASP C 65 87.285 -0.148 -12.209 1.00 0.00 H new ATOM 0 HB3 ASP C 65 86.685 -0.703 -13.759 1.00 0.00 H new ATOM 1009 N GLU C 66 87.283 -4.337 -12.910 1.00 0.00 N ATOM 1010 CA GLU C 66 88.008 -5.269 -13.770 1.00 0.00 C ATOM 1011 C GLU C 66 87.171 -5.637 -14.991 1.00 0.00 C ATOM 1012 O GLU C 66 87.668 -6.241 -15.941 1.00 0.00 O ATOM 1013 CB GLU C 66 88.354 -6.546 -13.002 1.00 0.00 C ATOM 1014 CG GLU C 66 89.784 -6.450 -12.468 1.00 0.00 C ATOM 1015 CD GLU C 66 90.762 -6.912 -13.543 1.00 0.00 C ATOM 1016 OE1 GLU C 66 90.498 -6.656 -14.706 1.00 0.00 O ATOM 1017 OE2 GLU C 66 91.762 -7.514 -13.187 1.00 0.00 O ATOM 0 H GLU C 66 86.780 -4.773 -12.137 1.00 0.00 H new ATOM 0 HA GLU C 66 88.925 -4.778 -14.095 1.00 0.00 H new ATOM 0 HB2 GLU C 66 87.655 -6.687 -12.177 1.00 0.00 H new ATOM 0 HB3 GLU C 66 88.256 -7.413 -13.655 1.00 0.00 H new ATOM 0 HG2 GLU C 66 90.006 -5.423 -12.176 1.00 0.00 H new ATOM 0 HG3 GLU C 66 89.892 -7.065 -11.575 1.00 0.00 H new ATOM 1024 N ASP C 67 85.894 -5.269 -14.955 1.00 0.00 N ATOM 1025 CA ASP C 67 84.995 -5.568 -16.067 1.00 0.00 C ATOM 1026 C ASP C 67 84.681 -4.305 -16.863 1.00 0.00 C ATOM 1027 O ASP C 67 83.811 -4.306 -17.734 1.00 0.00 O ATOM 1028 CB ASP C 67 83.685 -6.165 -15.550 1.00 0.00 C ATOM 1029 CG ASP C 67 83.263 -5.439 -14.276 1.00 0.00 C ATOM 1030 OD1 ASP C 67 83.747 -4.341 -14.054 1.00 0.00 O ATOM 1031 OD2 ASP C 67 82.462 -5.993 -13.542 1.00 0.00 O ATOM 0 H ASP C 67 85.461 -4.769 -14.178 1.00 0.00 H new ATOM 0 HA ASP C 67 85.496 -6.288 -16.714 1.00 0.00 H new ATOM 0 HB2 ASP C 67 82.907 -6.074 -16.308 1.00 0.00 H new ATOM 0 HB3 ASP C 67 83.812 -7.229 -15.350 1.00 0.00 H new ATOM 1036 N GLY C 68 85.396 -3.227 -16.556 1.00 0.00 N ATOM 1037 CA GLY C 68 85.179 -1.962 -17.252 1.00 0.00 C ATOM 1038 C GLY C 68 83.739 -1.492 -17.075 1.00 0.00 C ATOM 1039 O GLY C 68 83.194 -0.781 -17.919 1.00 0.00 O ATOM 0 H GLY C 68 86.122 -3.202 -15.840 1.00 0.00 H new ATOM 0 HA2 GLY C 68 85.864 -1.207 -16.867 1.00 0.00 H new ATOM 0 HA3 GLY C 68 85.400 -2.082 -18.313 1.00 0.00 H new ATOM 1043 N SER C 69 83.130 -1.899 -15.964 1.00 0.00 N ATOM 1044 CA SER C 69 81.750 -1.516 -15.678 1.00 0.00 C ATOM 1045 C SER C 69 81.650 -0.010 -15.466 1.00 0.00 C ATOM 1046 O SER C 69 80.670 0.624 -15.857 1.00 0.00 O ATOM 1047 CB SER C 69 81.245 -2.230 -14.424 1.00 0.00 C ATOM 1048 OG SER C 69 82.276 -2.249 -13.446 1.00 0.00 O ATOM 0 H SER C 69 83.565 -2.488 -15.254 1.00 0.00 H new ATOM 0 HA SER C 69 81.136 -1.805 -16.531 1.00 0.00 H new ATOM 0 HB2 SER C 69 80.365 -1.721 -14.031 1.00 0.00 H new ATOM 0 HB3 SER C 69 80.941 -3.248 -14.669 1.00 0.00 H new ATOM 1054 N GLY C 70 82.678 0.557 -14.840 1.00 0.00 N ATOM 1055 CA GLY C 70 82.698 1.992 -14.577 1.00 0.00 C ATOM 1056 C GLY C 70 82.118 2.302 -13.200 1.00 0.00 C ATOM 1057 O GLY C 70 81.968 3.465 -12.824 1.00 0.00 O ATOM 0 H GLY C 70 83.499 0.051 -14.509 1.00 0.00 H new ATOM 0 HA2 GLY C 70 83.721 2.362 -14.637 1.00 0.00 H new ATOM 0 HA3 GLY C 70 82.125 2.514 -15.343 1.00 0.00 H new ATOM 1061 N THR C 71 81.791 1.251 -12.453 1.00 0.00 N ATOM 1062 CA THR C 71 81.224 1.427 -11.119 1.00 0.00 C ATOM 1063 C THR C 71 81.648 0.286 -10.198 1.00 0.00 C ATOM 1064 O THR C 71 82.286 -0.675 -10.629 1.00 0.00 O ATOM 1065 CB THR C 71 79.698 1.468 -11.188 1.00 0.00 C ATOM 1066 OG1 THR C 71 79.224 0.294 -11.832 1.00 0.00 O ATOM 1067 CG2 THR C 71 79.251 2.702 -11.975 1.00 0.00 C ATOM 0 H THR C 71 81.907 0.280 -12.744 1.00 0.00 H new ATOM 0 HA THR C 71 81.597 2.370 -10.720 1.00 0.00 H new ATOM 0 HB THR C 71 79.290 1.519 -10.179 1.00 0.00 H new ATOM 0 HG1 THR C 71 78.245 0.317 -11.876 1.00 0.00 H new ATOM 0 HG21 THR C 71 78.162 2.729 -12.023 1.00 0.00 H new ATOM 0 HG22 THR C 71 79.615 3.602 -11.478 1.00 0.00 H new ATOM 0 HG23 THR C 71 79.657 2.656 -12.985 1.00 0.00 H new ATOM 1075 N VAL C 72 81.286 0.406 -8.923 1.00 0.00 N ATOM 1076 CA VAL C 72 81.634 -0.617 -7.940 1.00 0.00 C ATOM 1077 C VAL C 72 80.401 -1.032 -7.140 1.00 0.00 C ATOM 1078 O VAL C 72 80.034 -0.385 -6.159 1.00 0.00 O ATOM 1079 CB VAL C 72 82.702 -0.089 -6.980 1.00 0.00 C ATOM 1080 CG1 VAL C 72 83.159 -1.214 -6.049 1.00 0.00 C ATOM 1081 CG2 VAL C 72 83.898 0.423 -7.786 1.00 0.00 C ATOM 0 H VAL C 72 80.757 1.194 -8.549 1.00 0.00 H new ATOM 0 HA VAL C 72 82.023 -1.483 -8.475 1.00 0.00 H new ATOM 0 HB VAL C 72 82.285 0.724 -6.385 1.00 0.00 H new ATOM 0 HG11 VAL C 72 83.920 -0.835 -5.366 1.00 0.00 H new ATOM 0 HG12 VAL C 72 82.307 -1.581 -5.476 1.00 0.00 H new ATOM 0 HG13 VAL C 72 83.576 -2.029 -6.641 1.00 0.00 H new ATOM 0 HG21 VAL C 72 84.661 0.800 -7.105 1.00 0.00 H new ATOM 0 HG22 VAL C 72 84.312 -0.392 -8.380 1.00 0.00 H new ATOM 0 HG23 VAL C 72 83.574 1.226 -8.448 1.00 0.00 H new ATOM 1091 N ASP C 73 79.767 -2.117 -7.575 1.00 0.00 N ATOM 1092 CA ASP C 73 78.570 -2.617 -6.901 1.00 0.00 C ATOM 1093 C ASP C 73 78.844 -2.873 -5.420 1.00 0.00 C ATOM 1094 O ASP C 73 79.905 -2.531 -4.898 1.00 0.00 O ATOM 1095 CB ASP C 73 78.094 -3.918 -7.553 1.00 0.00 C ATOM 1096 CG ASP C 73 79.295 -4.801 -7.868 1.00 0.00 C ATOM 1097 OD1 ASP C 73 79.706 -5.544 -6.991 1.00 0.00 O ATOM 1098 OD2 ASP C 73 79.787 -4.723 -8.981 1.00 0.00 O ATOM 0 H ASP C 73 80.058 -2.664 -8.385 1.00 0.00 H new ATOM 0 HA ASP C 73 77.795 -1.856 -6.994 1.00 0.00 H new ATOM 0 HB2 ASP C 73 77.410 -4.442 -6.886 1.00 0.00 H new ATOM 0 HB3 ASP C 73 77.542 -3.698 -8.467 1.00 0.00 H new ATOM 1103 N PHE C 74 77.860 -3.470 -4.754 1.00 0.00 N ATOM 1104 CA PHE C 74 77.971 -3.770 -3.327 1.00 0.00 C ATOM 1105 C PHE C 74 78.795 -5.036 -3.092 1.00 0.00 C ATOM 1106 O PHE C 74 78.953 -5.486 -1.958 1.00 0.00 O ATOM 1107 CB PHE C 74 76.569 -3.965 -2.736 1.00 0.00 C ATOM 1108 CG PHE C 74 76.664 -4.486 -1.321 1.00 0.00 C ATOM 1109 CD1 PHE C 74 76.816 -3.589 -0.259 1.00 0.00 C ATOM 1110 CD2 PHE C 74 76.592 -5.862 -1.071 1.00 0.00 C ATOM 1111 CE1 PHE C 74 76.898 -4.066 1.055 1.00 0.00 C ATOM 1112 CE2 PHE C 74 76.673 -6.340 0.242 1.00 0.00 C ATOM 1113 CZ PHE C 74 76.828 -5.442 1.306 1.00 0.00 C ATOM 0 H PHE C 74 76.977 -3.756 -5.177 1.00 0.00 H new ATOM 0 HA PHE C 74 78.473 -2.934 -2.840 1.00 0.00 H new ATOM 0 HB2 PHE C 74 76.028 -3.019 -2.747 1.00 0.00 H new ATOM 0 HB3 PHE C 74 76.002 -4.664 -3.351 1.00 0.00 H new ATOM 0 HD1 PHE C 74 76.870 -2.528 -0.452 1.00 0.00 H new ATOM 0 HD2 PHE C 74 76.474 -6.554 -1.891 1.00 0.00 H new ATOM 0 HE1 PHE C 74 77.015 -3.373 1.875 1.00 0.00 H new ATOM 0 HE2 PHE C 74 76.616 -7.401 0.435 1.00 0.00 H new ATOM 0 HZ PHE C 74 76.893 -5.811 2.319 1.00 0.00 H new ATOM 1123 N ASP C 75 79.313 -5.611 -4.173 1.00 0.00 N ATOM 1124 CA ASP C 75 80.108 -6.834 -4.060 1.00 0.00 C ATOM 1125 C ASP C 75 81.603 -6.537 -4.143 1.00 0.00 C ATOM 1126 O ASP C 75 82.316 -6.572 -3.140 1.00 0.00 O ATOM 1127 CB ASP C 75 79.739 -7.809 -5.180 1.00 0.00 C ATOM 1128 CG ASP C 75 78.941 -8.972 -4.601 1.00 0.00 C ATOM 1129 OD1 ASP C 75 79.552 -9.843 -4.004 1.00 0.00 O ATOM 1130 OD2 ASP C 75 77.732 -8.974 -4.763 1.00 0.00 O ATOM 0 H ASP C 75 79.201 -5.259 -5.124 1.00 0.00 H new ATOM 0 HA ASP C 75 79.889 -7.277 -3.088 1.00 0.00 H new ATOM 0 HB2 ASP C 75 79.153 -7.297 -5.944 1.00 0.00 H new ATOM 0 HB3 ASP C 75 80.642 -8.180 -5.666 1.00 0.00 H new ATOM 1135 N GLU C 76 82.070 -6.269 -5.358 1.00 0.00 N ATOM 1136 CA GLU C 76 83.488 -5.992 -5.586 1.00 0.00 C ATOM 1137 C GLU C 76 84.064 -5.087 -4.500 1.00 0.00 C ATOM 1138 O GLU C 76 85.242 -5.188 -4.158 1.00 0.00 O ATOM 1139 CB GLU C 76 83.698 -5.323 -6.947 1.00 0.00 C ATOM 1140 CG GLU C 76 82.612 -4.272 -7.186 1.00 0.00 C ATOM 1141 CD GLU C 76 82.737 -3.731 -8.607 1.00 0.00 C ATOM 1142 OE1 GLU C 76 83.562 -2.858 -8.816 1.00 0.00 O ATOM 1143 OE2 GLU C 76 82.009 -4.202 -9.465 1.00 0.00 O ATOM 0 H GLU C 76 81.492 -6.237 -6.198 1.00 0.00 H new ATOM 0 HA GLU C 76 84.007 -6.950 -5.561 1.00 0.00 H new ATOM 0 HB2 GLU C 76 84.682 -4.856 -6.984 1.00 0.00 H new ATOM 0 HB3 GLU C 76 83.671 -6.072 -7.738 1.00 0.00 H new ATOM 0 HG2 GLU C 76 81.626 -4.712 -7.038 1.00 0.00 H new ATOM 0 HG3 GLU C 76 82.711 -3.460 -6.466 1.00 0.00 H new ATOM 1150 N PHE C 77 83.234 -4.198 -3.962 1.00 0.00 N ATOM 1151 CA PHE C 77 83.704 -3.287 -2.921 1.00 0.00 C ATOM 1152 C PHE C 77 84.382 -4.064 -1.796 1.00 0.00 C ATOM 1153 O PHE C 77 85.608 -4.085 -1.687 1.00 0.00 O ATOM 1154 CB PHE C 77 82.545 -2.478 -2.336 1.00 0.00 C ATOM 1155 CG PHE C 77 83.056 -1.642 -1.185 1.00 0.00 C ATOM 1156 CD1 PHE C 77 83.551 -0.354 -1.421 1.00 0.00 C ATOM 1157 CD2 PHE C 77 83.040 -2.157 0.117 1.00 0.00 C ATOM 1158 CE1 PHE C 77 84.029 0.419 -0.355 1.00 0.00 C ATOM 1159 CE2 PHE C 77 83.518 -1.385 1.182 1.00 0.00 C ATOM 1160 CZ PHE C 77 84.013 -0.096 0.946 1.00 0.00 C ATOM 0 H PHE C 77 82.254 -4.089 -4.221 1.00 0.00 H new ATOM 0 HA PHE C 77 84.420 -2.606 -3.380 1.00 0.00 H new ATOM 0 HB2 PHE C 77 82.110 -1.837 -3.102 1.00 0.00 H new ATOM 0 HB3 PHE C 77 81.755 -3.146 -1.993 1.00 0.00 H new ATOM 0 HD1 PHE C 77 83.564 0.044 -2.425 1.00 0.00 H new ATOM 0 HD2 PHE C 77 82.658 -3.151 0.300 1.00 0.00 H new ATOM 0 HE1 PHE C 77 84.410 1.413 -0.537 1.00 0.00 H new ATOM 0 HE2 PHE C 77 83.505 -1.783 2.186 1.00 0.00 H new ATOM 0 HZ PHE C 77 84.382 0.500 1.768 1.00 0.00 H new ATOM 1170 N LEU C 78 83.567 -4.699 -0.959 1.00 0.00 N ATOM 1171 CA LEU C 78 84.091 -5.475 0.164 1.00 0.00 C ATOM 1172 C LEU C 78 85.348 -6.238 -0.247 1.00 0.00 C ATOM 1173 O LEU C 78 86.418 -6.058 0.334 1.00 0.00 O ATOM 1174 CB LEU C 78 83.041 -6.470 0.665 1.00 0.00 C ATOM 1175 CG LEU C 78 81.981 -5.727 1.484 1.00 0.00 C ATOM 1176 CD1 LEU C 78 80.594 -6.275 1.146 1.00 0.00 C ATOM 1177 CD2 LEU C 78 82.253 -5.930 2.977 1.00 0.00 C ATOM 0 H LEU C 78 82.550 -4.693 -1.034 1.00 0.00 H new ATOM 0 HA LEU C 78 84.340 -4.778 0.964 1.00 0.00 H new ATOM 0 HB2 LEU C 78 82.574 -6.977 -0.179 1.00 0.00 H new ATOM 0 HB3 LEU C 78 83.515 -7.238 1.276 1.00 0.00 H new ATOM 0 HG LEU C 78 82.022 -4.664 1.245 1.00 0.00 H new ATOM 0 HD11 LEU C 78 79.841 -5.745 1.730 1.00 0.00 H new ATOM 0 HD12 LEU C 78 80.396 -6.133 0.084 1.00 0.00 H new ATOM 0 HD13 LEU C 78 80.555 -7.338 1.383 1.00 0.00 H new ATOM 0 HD21 LEU C 78 81.499 -5.401 3.559 1.00 0.00 H new ATOM 0 HD22 LEU C 78 82.214 -6.993 3.213 1.00 0.00 H new ATOM 0 HD23 LEU C 78 83.241 -5.540 3.223 1.00 0.00 H new ATOM 1189 N VAL C 79 85.207 -7.096 -1.254 1.00 0.00 N ATOM 1190 CA VAL C 79 86.339 -7.886 -1.733 1.00 0.00 C ATOM 1191 C VAL C 79 87.610 -7.040 -1.761 1.00 0.00 C ATOM 1192 O VAL C 79 88.545 -7.275 -0.996 1.00 0.00 O ATOM 1193 CB VAL C 79 86.060 -8.427 -3.138 1.00 0.00 C ATOM 1194 CG1 VAL C 79 87.347 -9.002 -3.735 1.00 0.00 C ATOM 1195 CG2 VAL C 79 85.005 -9.532 -3.054 1.00 0.00 C ATOM 0 H VAL C 79 84.331 -7.261 -1.750 1.00 0.00 H new ATOM 0 HA VAL C 79 86.479 -8.722 -1.047 1.00 0.00 H new ATOM 0 HB VAL C 79 85.697 -7.617 -3.771 1.00 0.00 H new ATOM 0 HG11 VAL C 79 87.144 -9.386 -4.735 1.00 0.00 H new ATOM 0 HG12 VAL C 79 88.103 -8.219 -3.793 1.00 0.00 H new ATOM 0 HG13 VAL C 79 87.712 -9.811 -3.102 1.00 0.00 H new ATOM 0 HG21 VAL C 79 84.804 -9.920 -4.053 1.00 0.00 H new ATOM 0 HG22 VAL C 79 85.372 -10.338 -2.419 1.00 0.00 H new ATOM 0 HG23 VAL C 79 84.086 -9.126 -2.630 1.00 0.00 H new ATOM 1205 N MET C 80 87.634 -6.056 -2.656 1.00 0.00 N ATOM 1206 CA MET C 80 88.798 -5.182 -2.780 1.00 0.00 C ATOM 1207 C MET C 80 89.275 -4.726 -1.404 1.00 0.00 C ATOM 1208 O MET C 80 90.461 -4.470 -1.195 1.00 0.00 O ATOM 1209 CB MET C 80 88.457 -3.950 -3.622 1.00 0.00 C ATOM 1210 CG MET C 80 89.734 -3.395 -4.258 1.00 0.00 C ATOM 1211 SD MET C 80 90.276 -1.931 -3.343 1.00 0.00 S ATOM 1212 CE MET C 80 88.820 -0.908 -3.670 1.00 0.00 C ATOM 0 H MET C 80 86.871 -5.845 -3.299 1.00 0.00 H new ATOM 0 HA MET C 80 89.590 -5.748 -3.269 1.00 0.00 H new ATOM 0 HB2 MET C 80 87.738 -4.214 -4.397 1.00 0.00 H new ATOM 0 HB3 MET C 80 87.988 -3.189 -2.998 1.00 0.00 H new ATOM 0 HG2 MET C 80 90.517 -4.153 -4.249 1.00 0.00 H new ATOM 0 HG3 MET C 80 89.551 -3.138 -5.301 1.00 0.00 H new ATOM 0 HE1 MET C 80 88.909 0.035 -3.131 1.00 0.00 H new ATOM 0 HE2 MET C 80 88.748 -0.709 -4.739 1.00 0.00 H new ATOM 0 HE3 MET C 80 87.924 -1.433 -3.337 1.00 0.00 H new ATOM 1222 N MET C 81 88.336 -4.626 -0.468 1.00 0.00 N ATOM 1223 CA MET C 81 88.667 -4.197 0.887 1.00 0.00 C ATOM 1224 C MET C 81 89.286 -5.345 1.680 1.00 0.00 C ATOM 1225 O MET C 81 90.151 -5.136 2.531 1.00 0.00 O ATOM 1226 CB MET C 81 87.414 -3.710 1.617 1.00 0.00 C ATOM 1227 CG MET C 81 86.727 -2.627 0.783 1.00 0.00 C ATOM 1228 SD MET C 81 87.477 -1.021 1.148 1.00 0.00 S ATOM 1229 CE MET C 81 88.359 -0.822 -0.419 1.00 0.00 C ATOM 0 H MET C 81 87.349 -4.834 -0.620 1.00 0.00 H new ATOM 0 HA MET C 81 89.385 -3.381 0.810 1.00 0.00 H new ATOM 0 HB2 MET C 81 86.731 -4.543 1.785 1.00 0.00 H new ATOM 0 HB3 MET C 81 87.681 -3.315 2.597 1.00 0.00 H new ATOM 0 HG2 MET C 81 86.825 -2.853 -0.279 1.00 0.00 H new ATOM 0 HG3 MET C 81 85.661 -2.602 1.007 1.00 0.00 H new ATOM 0 HE1 MET C 81 88.917 0.114 -0.406 1.00 0.00 H new ATOM 0 HE2 MET C 81 89.050 -1.654 -0.556 1.00 0.00 H new ATOM 0 HE3 MET C 81 87.643 -0.806 -1.240 1.00 0.00 H new ATOM 1239 N VAL C 82 88.829 -6.561 1.394 1.00 0.00 N ATOM 1240 CA VAL C 82 89.341 -7.740 2.090 1.00 0.00 C ATOM 1241 C VAL C 82 90.690 -8.159 1.515 1.00 0.00 C ATOM 1242 O VAL C 82 91.419 -8.949 2.116 1.00 0.00 O ATOM 1243 CB VAL C 82 88.363 -8.908 1.958 1.00 0.00 C ATOM 1244 CG1 VAL C 82 88.764 -10.022 2.927 1.00 0.00 C ATOM 1245 CG2 VAL C 82 86.950 -8.428 2.294 1.00 0.00 C ATOM 0 H VAL C 82 88.114 -6.756 0.694 1.00 0.00 H new ATOM 0 HA VAL C 82 89.459 -7.480 3.142 1.00 0.00 H new ATOM 0 HB VAL C 82 88.387 -9.288 0.937 1.00 0.00 H new ATOM 0 HG11 VAL C 82 88.067 -10.855 2.833 1.00 0.00 H new ATOM 0 HG12 VAL C 82 89.772 -10.364 2.691 1.00 0.00 H new ATOM 0 HG13 VAL C 82 88.740 -9.642 3.948 1.00 0.00 H new ATOM 0 HG21 VAL C 82 86.251 -9.259 2.200 1.00 0.00 H new ATOM 0 HG22 VAL C 82 86.928 -8.049 3.316 1.00 0.00 H new ATOM 0 HG23 VAL C 82 86.662 -7.633 1.606 1.00 0.00 H new ATOM 1255 N ARG C 83 91.013 -7.622 0.343 1.00 0.00 N ATOM 1256 CA ARG C 83 92.278 -7.949 -0.308 1.00 0.00 C ATOM 1257 C ARG C 83 93.401 -7.068 0.231 1.00 0.00 C ATOM 1258 O ARG C 83 94.500 -7.545 0.516 1.00 0.00 O ATOM 1259 CB ARG C 83 92.169 -7.748 -1.820 1.00 0.00 C ATOM 1260 CG ARG C 83 92.829 -8.924 -2.543 1.00 0.00 C ATOM 1261 CD ARG C 83 92.319 -8.989 -3.983 1.00 0.00 C ATOM 1262 NE ARG C 83 93.273 -9.691 -4.838 1.00 0.00 N ATOM 1263 CZ ARG C 83 93.111 -9.728 -6.158 1.00 0.00 C ATOM 1264 NH1 ARG C 83 92.088 -9.133 -6.707 1.00 0.00 N ATOM 1265 NH2 ARG C 83 93.976 -10.360 -6.903 1.00 0.00 N ATOM 0 H ARG C 83 90.425 -6.966 -0.171 1.00 0.00 H new ATOM 0 HA ARG C 83 92.504 -8.994 -0.096 1.00 0.00 H new ATOM 0 HB2 ARG C 83 91.122 -7.670 -2.112 1.00 0.00 H new ATOM 0 HB3 ARG C 83 92.651 -6.814 -2.109 1.00 0.00 H new ATOM 0 HG2 ARG C 83 93.913 -8.808 -2.535 1.00 0.00 H new ATOM 0 HG3 ARG C 83 92.604 -9.856 -2.024 1.00 0.00 H new ATOM 0 HD2 ARG C 83 91.356 -9.498 -4.010 1.00 0.00 H new ATOM 0 HD3 ARG C 83 92.157 -7.980 -4.362 1.00 0.00 H new ATOM 0 HE ARG C 83 94.075 -10.160 -4.417 1.00 0.00 H new ATOM 0 HH11 ARG C 83 91.412 -8.639 -6.124 1.00 0.00 H new ATOM 0 HH12 ARG C 83 91.964 -9.162 -7.719 1.00 0.00 H new ATOM 0 HH21 ARG C 83 94.776 -10.825 -6.473 1.00 0.00 H new ATOM 0 HH22 ARG C 83 93.853 -10.389 -7.915 1.00 0.00 H new ATOM 1279 N CYS C 84 93.113 -5.776 0.367 1.00 0.00 N ATOM 1280 CA CYS C 84 94.108 -4.833 0.872 1.00 0.00 C ATOM 1281 C CYS C 84 94.276 -4.989 2.380 1.00 0.00 C ATOM 1282 O CYS C 84 95.316 -4.643 2.942 1.00 0.00 O ATOM 1283 CB CYS C 84 93.691 -3.393 0.564 1.00 0.00 C ATOM 1284 SG CYS C 84 93.357 -3.227 -1.207 1.00 0.00 S ATOM 0 H CYS C 84 92.210 -5.361 0.138 1.00 0.00 H new ATOM 0 HA CYS C 84 95.054 -5.050 0.376 1.00 0.00 H new ATOM 0 HB2 CYS C 84 92.803 -3.129 1.139 1.00 0.00 H new ATOM 0 HB3 CYS C 84 94.480 -2.703 0.862 1.00 0.00 H new ATOM 0 HG CYS C 84 92.164 -3.672 -1.467 1.00 0.00 H new ATOM 1290 N MET C 85 93.242 -5.515 3.029 1.00 0.00 N ATOM 1291 CA MET C 85 93.284 -5.716 4.475 1.00 0.00 C ATOM 1292 C MET C 85 94.214 -6.872 4.825 1.00 0.00 C ATOM 1293 O MET C 85 94.727 -6.960 5.940 1.00 0.00 O ATOM 1294 CB MET C 85 91.885 -6.022 5.014 1.00 0.00 C ATOM 1295 CG MET C 85 91.119 -4.713 5.210 1.00 0.00 C ATOM 1296 SD MET C 85 89.514 -5.059 5.971 1.00 0.00 S ATOM 1297 CE MET C 85 88.667 -3.562 5.406 1.00 0.00 C ATOM 0 H MET C 85 92.373 -5.808 2.583 1.00 0.00 H new ATOM 0 HA MET C 85 93.656 -4.799 4.931 1.00 0.00 H new ATOM 0 HB2 MET C 85 91.349 -6.669 4.320 1.00 0.00 H new ATOM 0 HB3 MET C 85 91.957 -6.559 5.960 1.00 0.00 H new ATOM 0 HG2 MET C 85 91.693 -4.034 5.841 1.00 0.00 H new ATOM 0 HG3 MET C 85 90.978 -4.215 4.251 1.00 0.00 H new ATOM 0 HE1 MET C 85 87.589 -3.716 5.448 1.00 0.00 H new ATOM 0 HE2 MET C 85 88.940 -2.725 6.049 1.00 0.00 H new ATOM 0 HE3 MET C 85 88.962 -3.342 4.380 1.00 0.00 H new ATOM 1307 N LYS C 86 94.426 -7.758 3.857 1.00 0.00 N ATOM 1308 CA LYS C 86 95.297 -8.910 4.070 1.00 0.00 C ATOM 1309 C LYS C 86 96.733 -8.571 3.684 1.00 0.00 C ATOM 1310 O LYS C 86 97.597 -8.394 4.542 1.00 0.00 O ATOM 1311 CB LYS C 86 94.825 -10.100 3.234 1.00 0.00 C ATOM 1312 CG LYS C 86 93.718 -10.842 3.984 1.00 0.00 C ATOM 1313 CD LYS C 86 93.469 -12.197 3.320 1.00 0.00 C ATOM 1314 CE LYS C 86 93.718 -13.317 4.332 1.00 0.00 C ATOM 1315 NZ LYS C 86 94.961 -14.054 3.964 1.00 0.00 N ATOM 0 H LYS C 86 94.012 -7.703 2.927 1.00 0.00 H new ATOM 0 HA LYS C 86 95.257 -9.171 5.128 1.00 0.00 H new ATOM 0 HB2 LYS C 86 94.457 -9.756 2.267 1.00 0.00 H new ATOM 0 HB3 LYS C 86 95.659 -10.773 3.036 1.00 0.00 H new ATOM 0 HG2 LYS C 86 94.003 -10.983 5.027 1.00 0.00 H new ATOM 0 HG3 LYS C 86 92.803 -10.250 3.981 1.00 0.00 H new ATOM 0 HD2 LYS C 86 92.445 -12.249 2.949 1.00 0.00 H new ATOM 0 HD3 LYS C 86 94.127 -12.318 2.459 1.00 0.00 H new ATOM 0 HE2 LYS C 86 93.813 -12.901 5.335 1.00 0.00 H new ATOM 0 HE3 LYS C 86 92.869 -14.001 4.350 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 95.130 -14.815 4.652 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 94.853 -14.464 3.014 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 95.768 -13.398 3.969 1.00 0.00 H new ATOM 1329 N ASP C 87 96.976 -8.483 2.380 1.00 0.00 N ATOM 1330 CA ASP C 87 98.312 -8.164 1.884 1.00 0.00 C ATOM 1331 C ASP C 87 98.407 -6.686 1.522 1.00 0.00 C ATOM 1332 O ASP C 87 98.747 -6.328 0.394 1.00 0.00 O ATOM 1333 CB ASP C 87 98.638 -9.003 0.647 1.00 0.00 C ATOM 1334 CG ASP C 87 99.804 -9.935 0.957 1.00 0.00 C ATOM 1335 OD1 ASP C 87 99.718 -10.651 1.942 1.00 0.00 O ATOM 1336 OD2 ASP C 87 100.766 -9.919 0.207 1.00 0.00 O ATOM 0 H ASP C 87 96.274 -8.626 1.654 1.00 0.00 H new ATOM 0 HA ASP C 87 99.028 -8.391 2.674 1.00 0.00 H new ATOM 0 HB2 ASP C 87 97.765 -9.583 0.347 1.00 0.00 H new ATOM 0 HB3 ASP C 87 98.891 -8.353 -0.190 1.00 0.00 H new ATOM 1341 N ASP C 88 98.101 -5.831 2.493 1.00 0.00 N ATOM 1342 CA ASP C 88 98.155 -4.388 2.271 1.00 0.00 C ATOM 1343 C ASP C 88 99.525 -3.983 1.736 1.00 0.00 C ATOM 1344 O ASP C 88 100.559 -4.349 2.297 1.00 0.00 O ATOM 1345 CB ASP C 88 97.888 -3.635 3.576 1.00 0.00 C ATOM 1346 CG ASP C 88 97.367 -2.238 3.258 1.00 0.00 C ATOM 1347 OD1 ASP C 88 96.436 -2.139 2.476 1.00 0.00 O ATOM 1348 OD2 ASP C 88 97.907 -1.288 3.801 1.00 0.00 O ATOM 0 H ASP C 88 97.816 -6.107 3.433 1.00 0.00 H new ATOM 0 HA ASP C 88 97.388 -4.131 1.540 1.00 0.00 H new ATOM 0 HB2 ASP C 88 97.160 -4.178 4.179 1.00 0.00 H new ATOM 0 HB3 ASP C 88 98.803 -3.568 4.164 1.00 0.00 H new ATOM 1353 N SER C 89 99.523 -3.223 0.645 1.00 0.00 N ATOM 1354 CA SER C 89 100.773 -2.773 0.041 1.00 0.00 C ATOM 1355 C SER C 89 100.713 -1.279 -0.262 1.00 0.00 C ATOM 1356 O SER C 89 99.643 -0.808 -0.611 1.00 0.00 O ATOM 1357 CB SER C 89 101.046 -3.533 -1.257 1.00 0.00 C ATOM 1358 OG SER C 89 101.440 -4.864 -0.947 1.00 0.00 O ATOM 1359 OXT SER C 89 101.739 -0.629 -0.143 1.00 0.00 O ATOM 0 H SER C 89 98.680 -2.908 0.165 1.00 0.00 H new ATOM 0 HA SER C 89 101.577 -2.968 0.751 1.00 0.00 H new ATOM 0 HB2 SER C 89 100.153 -3.542 -1.882 1.00 0.00 H new ATOM 0 HB3 SER C 89 101.829 -3.033 -1.827 1.00 0.00 H new ATOM 0 HG SER C 89 100.690 -5.339 -0.532 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 147 95.141 3.034 3.261 1.00 0.00 N ATOM 1367 CA ARG I 147 95.337 2.381 4.587 1.00 0.00 C ATOM 1368 C ARG I 147 94.233 1.355 4.817 1.00 0.00 C ATOM 1369 O ARG I 147 94.484 0.247 5.291 1.00 0.00 O ATOM 1370 CB ARG I 147 95.286 3.442 5.690 1.00 0.00 C ATOM 1371 CG ARG I 147 96.582 3.400 6.503 1.00 0.00 C ATOM 1372 CD ARG I 147 96.320 3.938 7.912 1.00 0.00 C ATOM 1373 NE ARG I 147 96.167 2.840 8.863 1.00 0.00 N ATOM 1374 CZ ARG I 147 95.644 3.047 10.069 1.00 0.00 C ATOM 1375 NH1 ARG I 147 95.245 4.240 10.411 1.00 0.00 N ATOM 1376 NH2 ARG I 147 95.526 2.054 10.907 1.00 0.00 N ATOM 0 HA ARG I 147 96.306 1.882 4.607 1.00 0.00 H new ATOM 0 HB2 ARG I 147 95.152 4.431 5.251 1.00 0.00 H new ATOM 0 HB3 ARG I 147 94.430 3.263 6.341 1.00 0.00 H new ATOM 0 HG2 ARG I 147 96.957 2.378 6.557 1.00 0.00 H new ATOM 0 HG3 ARG I 147 97.351 3.996 6.012 1.00 0.00 H new ATOM 0 HD2 ARG I 147 97.144 4.581 8.220 1.00 0.00 H new ATOM 0 HD3 ARG I 147 95.420 4.553 7.911 1.00 0.00 H new ATOM 0 HE ARG I 147 96.465 1.901 8.599 1.00 0.00 H new ATOM 0 HH11 ARG I 147 95.334 5.015 9.754 1.00 0.00 H new ATOM 0 HH12 ARG I 147 94.844 4.398 11.336 1.00 0.00 H new ATOM 0 HH21 ARG I 147 95.835 1.120 10.638 1.00 0.00 H new ATOM 0 HH22 ARG I 147 95.125 2.212 11.832 1.00 0.00 H new ATOM 1392 N ILE I 148 93.005 1.737 4.477 1.00 0.00 N ATOM 1393 CA ILE I 148 91.864 0.843 4.651 1.00 0.00 C ATOM 1394 C ILE I 148 91.842 0.280 6.069 1.00 0.00 C ATOM 1395 O ILE I 148 92.223 -0.866 6.305 1.00 0.00 O ATOM 1396 CB ILE I 148 91.929 -0.317 3.656 1.00 0.00 C ATOM 1397 CG1 ILE I 148 91.982 0.237 2.230 1.00 0.00 C ATOM 1398 CG2 ILE I 148 90.687 -1.197 3.815 1.00 0.00 C ATOM 1399 CD1 ILE I 148 90.806 1.190 2.008 1.00 0.00 C ATOM 0 H ILE I 148 92.776 2.650 4.083 1.00 0.00 H new ATOM 0 HA ILE I 148 90.957 1.420 4.472 1.00 0.00 H new ATOM 0 HB ILE I 148 92.822 -0.911 3.849 1.00 0.00 H new ATOM 0 HG12 ILE I 148 92.924 0.761 2.067 1.00 0.00 H new ATOM 0 HG13 ILE I 148 91.943 -0.580 1.510 1.00 0.00 H new ATOM 0 HG21 ILE I 148 90.733 -2.024 3.106 1.00 0.00 H new ATOM 0 HG22 ILE I 148 90.648 -1.592 4.830 1.00 0.00 H new ATOM 0 HG23 ILE I 148 89.793 -0.603 3.622 1.00 0.00 H new ATOM 0 HD11 ILE I 148 90.844 1.584 0.993 1.00 0.00 H new ATOM 0 HD12 ILE I 148 89.869 0.652 2.154 1.00 0.00 H new ATOM 0 HD13 ILE I 148 90.866 2.014 2.720 1.00 0.00 H new ATOM 1411 N SER I 149 91.391 1.104 7.010 1.00 0.00 N ATOM 1412 CA SER I 149 91.321 0.684 8.407 1.00 0.00 C ATOM 1413 C SER I 149 89.868 0.587 8.862 1.00 0.00 C ATOM 1414 O SER I 149 89.260 -0.483 8.825 1.00 0.00 O ATOM 1415 CB SER I 149 92.056 1.680 9.304 1.00 0.00 C ATOM 1416 OG SER I 149 91.991 2.975 8.722 1.00 0.00 O ATOM 0 H SER I 149 91.071 2.057 6.834 1.00 0.00 H new ATOM 0 HA SER I 149 91.794 -0.295 8.487 1.00 0.00 H new ATOM 0 HB2 SER I 149 91.607 1.692 10.297 1.00 0.00 H new ATOM 0 HB3 SER I 149 93.096 1.377 9.428 1.00 0.00 H new ATOM 0 HG SER I 149 92.460 3.616 9.296 1.00 0.00 H new ATOM 1422 N ALA I 150 89.319 1.720 9.291 1.00 0.00 N ATOM 1423 CA ALA I 150 87.934 1.759 9.753 1.00 0.00 C ATOM 1424 C ALA I 150 87.690 3.008 10.593 1.00 0.00 C ATOM 1425 O ALA I 150 86.731 3.747 10.369 1.00 0.00 O ATOM 1426 CB ALA I 150 87.612 0.522 10.594 1.00 0.00 C ATOM 0 H ALA I 150 89.806 2.615 9.329 1.00 0.00 H new ATOM 0 HA ALA I 150 87.288 1.777 8.876 1.00 0.00 H new ATOM 0 HB1 ALA I 150 86.576 0.569 10.929 1.00 0.00 H new ATOM 0 HB2 ALA I 150 87.758 -0.375 9.992 1.00 0.00 H new ATOM 0 HB3 ALA I 150 88.272 0.489 11.461 1.00 0.00 H new ATOM 1432 N ASP I 151 88.571 3.237 11.563 1.00 0.00 N ATOM 1433 CA ASP I 151 88.445 4.403 12.434 1.00 0.00 C ATOM 1434 C ASP I 151 88.401 5.681 11.603 1.00 0.00 C ATOM 1435 O ASP I 151 87.959 6.730 12.073 1.00 0.00 O ATOM 1436 CB ASP I 151 89.626 4.479 13.405 1.00 0.00 C ATOM 1437 CG ASP I 151 90.934 4.466 12.621 1.00 0.00 C ATOM 1438 OD1 ASP I 151 90.936 4.951 11.501 1.00 0.00 O ATOM 1439 OD2 ASP I 151 91.915 3.973 13.152 1.00 0.00 O ATOM 0 H ASP I 151 89.372 2.638 11.765 1.00 0.00 H new ATOM 0 HA ASP I 151 87.519 4.303 13.000 1.00 0.00 H new ATOM 0 HB2 ASP I 151 89.559 5.387 14.005 1.00 0.00 H new ATOM 0 HB3 ASP I 151 89.596 3.637 14.096 1.00 0.00 H new ATOM 1444 N ALA I 152 88.864 5.580 10.360 1.00 0.00 N ATOM 1445 CA ALA I 152 88.876 6.733 9.464 1.00 0.00 C ATOM 1446 C ALA I 152 87.524 6.887 8.776 1.00 0.00 C ATOM 1447 O ALA I 152 86.920 7.960 8.794 1.00 0.00 O ATOM 1448 CB ALA I 152 89.961 6.571 8.397 1.00 0.00 C ATOM 0 H ALA I 152 89.233 4.720 9.953 1.00 0.00 H new ATOM 0 HA ALA I 152 89.084 7.621 10.062 1.00 0.00 H new ATOM 0 HB1 ALA I 152 89.956 7.439 7.738 1.00 0.00 H new ATOM 0 HB2 ALA I 152 90.935 6.487 8.879 1.00 0.00 H new ATOM 0 HB3 ALA I 152 89.766 5.671 7.813 1.00 0.00 H new ATOM 1454 N MET I 153 87.055 5.800 8.171 1.00 0.00 N ATOM 1455 CA MET I 153 85.770 5.818 7.478 1.00 0.00 C ATOM 1456 C MET I 153 84.633 6.013 8.476 1.00 0.00 C ATOM 1457 O MET I 153 83.620 6.644 8.172 1.00 0.00 O ATOM 1458 CB MET I 153 85.553 4.506 6.722 1.00 0.00 C ATOM 1459 CG MET I 153 84.255 4.590 5.916 1.00 0.00 C ATOM 1460 SD MET I 153 84.529 3.915 4.259 1.00 0.00 S ATOM 1461 CE MET I 153 85.067 2.267 4.775 1.00 0.00 C ATOM 0 H MET I 153 87.540 4.903 8.146 1.00 0.00 H new ATOM 0 HA MET I 153 85.778 6.646 6.770 1.00 0.00 H new ATOM 0 HB2 MET I 153 86.395 4.314 6.057 1.00 0.00 H new ATOM 0 HB3 MET I 153 85.505 3.673 7.424 1.00 0.00 H new ATOM 0 HG2 MET I 153 83.465 4.034 6.421 1.00 0.00 H new ATOM 0 HG3 MET I 153 83.923 5.626 5.848 1.00 0.00 H new ATOM 0 HE1 MET I 153 84.987 1.578 3.934 1.00 0.00 H new ATOM 0 HE2 MET I 153 86.103 2.311 5.111 1.00 0.00 H new ATOM 0 HE3 MET I 153 84.435 1.917 5.592 1.00 0.00 H new ATOM 1471 N MET I 154 84.814 5.463 9.673 1.00 0.00 N ATOM 1472 CA MET I 154 83.799 5.581 10.717 1.00 0.00 C ATOM 1473 C MET I 154 83.327 7.025 10.841 1.00 0.00 C ATOM 1474 O MET I 154 82.159 7.291 11.128 1.00 0.00 O ATOM 1475 CB MET I 154 84.364 5.128 12.063 1.00 0.00 C ATOM 1476 CG MET I 154 83.410 4.122 12.706 1.00 0.00 C ATOM 1477 SD MET I 154 84.264 2.542 12.932 1.00 0.00 S ATOM 1478 CE MET I 154 84.296 2.050 11.191 1.00 0.00 C ATOM 0 H MET I 154 85.645 4.936 9.943 1.00 0.00 H new ATOM 0 HA MET I 154 82.958 4.945 10.441 1.00 0.00 H new ATOM 0 HB2 MET I 154 85.346 4.676 11.923 1.00 0.00 H new ATOM 0 HB3 MET I 154 84.500 5.987 12.720 1.00 0.00 H new ATOM 0 HG2 MET I 154 83.060 4.499 13.667 1.00 0.00 H new ATOM 0 HG3 MET I 154 82.530 3.986 12.077 1.00 0.00 H new ATOM 0 HE1 MET I 154 83.938 1.025 11.096 1.00 0.00 H new ATOM 0 HE2 MET I 154 83.653 2.714 10.613 1.00 0.00 H new ATOM 0 HE3 MET I 154 85.316 2.115 10.813 1.00 0.00 H new ATOM 1488 N GLN I 155 84.250 7.956 10.622 1.00 0.00 N ATOM 1489 CA GLN I 155 83.926 9.377 10.711 1.00 0.00 C ATOM 1490 C GLN I 155 82.660 9.688 9.920 1.00 0.00 C ATOM 1491 O GLN I 155 81.838 10.508 10.330 1.00 0.00 O ATOM 1492 CB GLN I 155 85.076 10.222 10.161 1.00 0.00 C ATOM 1493 CG GLN I 155 86.195 10.302 11.200 1.00 0.00 C ATOM 1494 CD GLN I 155 85.753 11.191 12.357 1.00 0.00 C ATOM 1495 OE1 GLN I 155 85.883 12.414 12.293 1.00 0.00 O ATOM 1496 NE2 GLN I 155 85.233 10.646 13.422 1.00 0.00 N ATOM 0 H GLN I 155 85.221 7.755 10.383 1.00 0.00 H new ATOM 0 HA GLN I 155 83.765 9.619 11.762 1.00 0.00 H new ATOM 0 HB2 GLN I 155 85.454 9.783 9.238 1.00 0.00 H new ATOM 0 HB3 GLN I 155 84.721 11.223 9.916 1.00 0.00 H new ATOM 0 HG2 GLN I 155 86.438 9.304 11.566 1.00 0.00 H new ATOM 0 HG3 GLN I 155 87.100 10.703 10.745 1.00 0.00 H new ATOM 0 HE21 GLN I 155 85.125 9.633 13.476 1.00 0.00 H new ATOM 0 HE22 GLN I 155 84.934 11.233 14.201 1.00 0.00 H new ATOM 1505 N ALA I 156 82.513 9.022 8.779 1.00 0.00 N ATOM 1506 CA ALA I 156 81.344 9.233 7.932 1.00 0.00 C ATOM 1507 C ALA I 156 80.136 8.481 8.483 1.00 0.00 C ATOM 1508 O ALA I 156 79.022 8.622 7.980 1.00 0.00 O ATOM 1509 CB ALA I 156 81.625 8.749 6.507 1.00 0.00 C ATOM 0 H ALA I 156 83.181 8.339 8.422 1.00 0.00 H new ATOM 0 HA ALA I 156 81.128 10.301 7.920 1.00 0.00 H new ATOM 0 HB1 ALA I 156 80.744 8.913 5.887 1.00 0.00 H new ATOM 0 HB2 ALA I 156 82.468 9.303 6.094 1.00 0.00 H new ATOM 0 HB3 ALA I 156 81.864 7.686 6.524 1.00 0.00 H new ATOM 1515 N LEU I 157 80.366 7.687 9.530 1.00 0.00 N ATOM 1516 CA LEU I 157 79.288 6.919 10.145 1.00 0.00 C ATOM 1517 C LEU I 157 79.213 7.223 11.637 1.00 0.00 C ATOM 1518 O LEU I 157 78.475 6.578 12.382 1.00 0.00 O ATOM 1519 CB LEU I 157 79.523 5.416 9.963 1.00 0.00 C ATOM 1520 CG LEU I 157 79.624 5.077 8.472 1.00 0.00 C ATOM 1521 CD1 LEU I 157 78.418 5.657 7.730 1.00 0.00 C ATOM 1522 CD2 LEU I 157 80.914 5.669 7.897 1.00 0.00 C ATOM 0 H LEU I 157 81.280 7.561 9.965 1.00 0.00 H new ATOM 0 HA LEU I 157 78.354 7.202 9.659 1.00 0.00 H new ATOM 0 HB2 LEU I 157 80.438 5.118 10.475 1.00 0.00 H new ATOM 0 HB3 LEU I 157 78.707 4.854 10.417 1.00 0.00 H new ATOM 0 HG LEU I 157 79.637 3.994 8.348 1.00 0.00 H new ATOM 0 HD11 LEU I 157 78.492 5.415 6.670 1.00 0.00 H new ATOM 0 HD12 LEU I 157 77.501 5.230 8.137 1.00 0.00 H new ATOM 0 HD13 LEU I 157 78.401 6.740 7.854 1.00 0.00 H new ATOM 0 HD21 LEU I 157 80.984 5.427 6.837 1.00 0.00 H new ATOM 0 HD22 LEU I 157 80.905 6.752 8.022 1.00 0.00 H new ATOM 0 HD23 LEU I 157 81.772 5.250 8.422 1.00 0.00 H new ATOM 1534 N LEU I 158 79.993 8.211 12.064 1.00 0.00 N ATOM 1535 CA LEU I 158 80.020 8.594 13.467 1.00 0.00 C ATOM 1536 C LEU I 158 79.332 9.942 13.664 1.00 0.00 C ATOM 1537 O LEU I 158 79.983 10.985 13.724 1.00 0.00 O ATOM 1538 CB LEU I 158 81.463 8.693 13.958 1.00 0.00 C ATOM 1539 CG LEU I 158 81.464 9.182 15.401 1.00 0.00 C ATOM 1540 CD1 LEU I 158 82.179 8.162 16.289 1.00 0.00 C ATOM 1541 CD2 LEU I 158 82.185 10.529 15.485 1.00 0.00 C ATOM 0 H LEU I 158 80.610 8.756 11.462 1.00 0.00 H new ATOM 0 HA LEU I 158 79.491 7.832 14.039 1.00 0.00 H new ATOM 0 HB2 LEU I 158 81.951 7.721 13.890 1.00 0.00 H new ATOM 0 HB3 LEU I 158 82.029 9.379 13.328 1.00 0.00 H new ATOM 0 HG LEU I 158 80.436 9.300 15.743 1.00 0.00 H new ATOM 0 HD11 LEU I 158 82.178 8.514 17.321 1.00 0.00 H new ATOM 0 HD12 LEU I 158 81.662 7.204 16.232 1.00 0.00 H new ATOM 0 HD13 LEU I 158 83.207 8.040 15.948 1.00 0.00 H new ATOM 0 HD21 LEU I 158 82.185 10.878 16.518 1.00 0.00 H new ATOM 0 HD22 LEU I 158 83.213 10.414 15.141 1.00 0.00 H new ATOM 0 HD23 LEU I 158 81.671 11.256 14.856 1.00 0.00 H new ATOM 1553 N GLY I 159 78.006 9.907 13.764 1.00 0.00 N ATOM 1554 CA GLY I 159 77.234 11.132 13.954 1.00 0.00 C ATOM 1555 C GLY I 159 76.096 11.216 12.943 1.00 0.00 C ATOM 1556 O GLY I 159 75.111 11.924 13.153 1.00 0.00 O ATOM 0 H GLY I 159 77.448 9.054 13.717 1.00 0.00 H new ATOM 0 HA2 GLY I 159 76.830 11.160 14.966 1.00 0.00 H new ATOM 0 HA3 GLY I 159 77.886 11.999 13.847 1.00 0.00 H new ATOM 1560 N ALA I 160 76.244 10.484 11.844 1.00 0.00 N ATOM 1561 CA ALA I 160 75.223 10.478 10.800 1.00 0.00 C ATOM 1562 C ALA I 160 74.122 9.477 11.136 1.00 0.00 C ATOM 1563 O ALA I 160 74.387 8.300 11.381 1.00 0.00 O ATOM 1564 CB ALA I 160 75.838 10.103 9.450 1.00 0.00 C ATOM 0 H ALA I 160 77.052 9.892 11.653 1.00 0.00 H new ATOM 0 HA ALA I 160 74.799 11.480 10.741 1.00 0.00 H new ATOM 0 HB1 ALA I 160 75.062 10.104 8.684 1.00 0.00 H new ATOM 0 HB2 ALA I 160 76.608 10.828 9.187 1.00 0.00 H new ATOM 0 HB3 ALA I 160 76.282 9.110 9.516 1.00 0.00 H new ATOM 1570 N ARG I 161 72.883 9.960 11.140 1.00 0.00 N ATOM 1571 CA ARG I 161 71.740 9.102 11.442 1.00 0.00 C ATOM 1572 C ARG I 161 71.767 8.651 12.899 1.00 0.00 C ATOM 1573 O ARG I 161 70.989 7.791 13.310 1.00 0.00 O ATOM 1574 CB ARG I 161 71.749 7.867 10.541 1.00 0.00 C ATOM 1575 CG ARG I 161 71.682 8.305 9.077 1.00 0.00 C ATOM 1576 CD ARG I 161 70.221 8.355 8.626 1.00 0.00 C ATOM 1577 NE ARG I 161 69.741 7.019 8.286 1.00 0.00 N ATOM 1578 CZ ARG I 161 68.524 6.833 7.782 1.00 0.00 C ATOM 1579 NH1 ARG I 161 67.732 7.854 7.593 1.00 0.00 N ATOM 1580 NH2 ARG I 161 68.122 5.630 7.479 1.00 0.00 N ATOM 0 H ARG I 161 72.645 10.931 10.940 1.00 0.00 H new ATOM 0 HA ARG I 161 70.834 9.682 11.263 1.00 0.00 H new ATOM 0 HB2 ARG I 161 72.652 7.282 10.716 1.00 0.00 H new ATOM 0 HB3 ARG I 161 70.902 7.224 10.779 1.00 0.00 H new ATOM 0 HG2 ARG I 161 72.144 9.285 8.958 1.00 0.00 H new ATOM 0 HG3 ARG I 161 72.243 7.610 8.452 1.00 0.00 H new ATOM 0 HD2 ARG I 161 69.604 8.778 9.419 1.00 0.00 H new ATOM 0 HD3 ARG I 161 70.124 9.013 7.762 1.00 0.00 H new ATOM 0 HE ARG I 161 70.349 6.214 8.437 1.00 0.00 H new ATOM 0 HH11 ARG I 161 68.046 8.794 7.832 1.00 0.00 H new ATOM 0 HH12 ARG I 161 66.799 7.711 7.207 1.00 0.00 H new ATOM 0 HH21 ARG I 161 68.740 4.833 7.629 1.00 0.00 H new ATOM 0 HH22 ARG I 161 67.189 5.486 7.093 1.00 0.00 H new ATOM 1594 N ALA I 162 72.670 9.242 13.677 1.00 0.00 N ATOM 1595 CA ALA I 162 72.786 8.891 15.089 1.00 0.00 C ATOM 1596 C ALA I 162 71.710 9.605 15.901 1.00 0.00 C ATOM 1597 O ALA I 162 71.581 10.828 15.849 1.00 0.00 O ATOM 1598 CB ALA I 162 74.162 9.284 15.629 1.00 0.00 C ATOM 0 H ALA I 162 73.324 9.957 13.359 1.00 0.00 H new ATOM 0 HA ALA I 162 72.658 7.812 15.181 1.00 0.00 H new ATOM 0 HB1 ALA I 162 74.230 9.015 16.683 1.00 0.00 H new ATOM 0 HB2 ALA I 162 74.936 8.759 15.070 1.00 0.00 H new ATOM 0 HB3 ALA I 162 74.302 10.359 15.520 1.00 0.00 H new ATOM 1604 N LYS I 163 70.937 8.825 16.651 1.00 0.00 N ATOM 1605 CA LYS I 163 69.870 9.390 17.472 1.00 0.00 C ATOM 1606 C LYS I 163 70.242 9.320 18.950 1.00 0.00 C ATOM 1607 O LYS I 163 70.518 8.228 19.420 1.00 0.00 O ATOM 1608 CB LYS I 163 68.563 8.629 17.247 1.00 0.00 C ATOM 1609 CG LYS I 163 67.426 9.626 17.011 1.00 0.00 C ATOM 1610 CD LYS I 163 66.086 8.888 17.028 1.00 0.00 C ATOM 1611 CE LYS I 163 65.233 9.349 15.844 1.00 0.00 C ATOM 1612 NZ LYS I 163 65.169 10.838 15.827 1.00 0.00 N ATOM 1613 OXT LYS I 163 70.246 10.359 19.589 1.00 0.00 O ATOM 0 H LYS I 163 71.027 7.811 16.708 1.00 0.00 H new ATOM 0 HA LYS I 163 69.736 10.432 17.182 1.00 0.00 H new ATOM 0 HB2 LYS I 163 68.661 7.963 16.390 1.00 0.00 H new ATOM 0 HB3 LYS I 163 68.340 8.005 18.112 1.00 0.00 H new ATOM 0 HG2 LYS I 163 67.438 10.397 17.782 1.00 0.00 H new ATOM 0 HG3 LYS I 163 67.563 10.130 16.054 1.00 0.00 H new ATOM 0 HD2 LYS I 163 66.251 7.812 16.974 1.00 0.00 H new ATOM 0 HD3 LYS I 163 65.563 9.083 17.964 1.00 0.00 H new ATOM 0 HE2 LYS I 163 65.659 8.982 14.910 1.00 0.00 H new ATOM 0 HE3 LYS I 163 64.229 8.932 15.921 1.00 0.00 H new ATOM 0 HZ1 LYS I 163 64.245 11.142 15.460 1.00 0.00 H new ATOM 0 HZ2 LYS I 163 65.294 11.202 16.793 1.00 0.00 H new ATOM 0 HZ3 LYS I 163 65.924 11.211 15.216 1.00 0.00 H new TER 1627 LYS I 163 HETATM 1628 CA CA C 93 83.261 -3.107 -11.593 1.00 0.00 CA HETATM 1629 C1 BEP C 92 90.805 2.085 -1.829 1.00 0.00 C HETATM 1630 C2 BEP C 92 90.350 3.103 -0.781 1.00 0.00 C HETATM 1631 C3 BEP C 92 88.944 3.696 -1.152 1.00 0.00 C HETATM 1632 O1 BEP C 92 92.049 2.527 -2.431 1.00 0.00 O HETATM 1633 N2 BEP C 92 91.351 4.199 -0.649 1.00 0.00 N HETATM 1634 N3 BEP C 92 87.903 2.631 -1.242 1.00 0.00 N HETATM 1635 C4 BEP C 92 92.729 1.540 -3.249 1.00 0.00 C HETATM 1636 C5 BEP C 92 93.971 1.039 -2.508 1.00 0.00 C HETATM 1637 C6 BEP C 92 93.560 0.458 -1.154 1.00 0.00 C HETATM 1638 C7 BEP C 92 94.939 2.203 -2.288 1.00 0.00 C HETATM 1639 C8 BEP C 92 90.911 5.485 -0.040 1.00 0.00 C HETATM 1640 C9 BEP C 92 92.105 5.970 0.800 1.00 0.00 C HETATM 1641 C10 BEP C 92 93.300 5.188 0.234 1.00 0.00 C HETATM 1642 C11 BEP C 92 92.705 3.850 -0.161 1.00 0.00 C HETATM 1643 C12 BEP C 92 86.835 2.626 -0.205 1.00 0.00 C HETATM 1644 C13 BEP C 92 87.193 3.277 1.155 1.00 0.00 C HETATM 1645 C14 BEP C 92 87.809 2.514 2.155 1.00 0.00 C HETATM 1646 C15 BEP C 92 88.135 3.102 3.384 1.00 0.00 C HETATM 1647 C16 BEP C 92 87.844 4.453 3.613 1.00 0.00 C HETATM 1648 C17 BEP C 92 87.227 5.216 2.613 1.00 0.00 C HETATM 1649 C18 BEP C 92 86.902 4.629 1.384 1.00 0.00 C HETATM 1650 C19 BEP C 92 87.508 2.163 -2.597 1.00 0.00 C HETATM 1651 C20 BEP C 92 88.120 2.690 -3.748 1.00 0.00 C HETATM 1652 C21 BEP C 92 87.734 2.237 -5.016 1.00 0.00 C HETATM 1653 C22 BEP C 92 86.740 1.260 -5.139 1.00 0.00 C HETATM 1654 C23 BEP C 92 86.129 0.734 -3.995 1.00 0.00 C HETATM 1655 C24 BEP C 92 86.512 1.185 -2.725 1.00 0.00 C HETATM 0 H241 BEP C 92 86.035 0.775 -1.835 1.00 0.00 H new HETATM 0 H231 BEP C 92 85.355 -0.027 -4.092 1.00 0.00 H new HETATM 0 H221 BEP C 92 86.441 0.908 -6.127 1.00 0.00 H new HETATM 0 H211 BEP C 92 88.209 2.646 -5.908 1.00 0.00 H new HETATM 0 H201 BEP C 92 88.895 3.451 -3.654 1.00 0.00 H new HETATM 0 H181 BEP C 92 86.423 5.223 0.606 1.00 0.00 H new HETATM 0 H171 BEP C 92 87.000 6.267 2.792 1.00 0.00 H new HETATM 0 H161 BEP C 92 88.098 4.911 4.569 1.00 0.00 H new HETATM 0 H151 BEP C 92 88.615 2.508 4.162 1.00 0.00 H new HETATM 0 H141 BEP C 92 88.035 1.463 1.977 1.00 0.00 H new HETATM 0 H122 BEP C 92 85.963 3.139 -0.610 1.00 0.00 H new HETATM 0 H121 BEP C 92 86.541 1.592 -0.022 1.00 0.00 H new HETATM 0 H112 BEP C 92 92.661 3.165 0.686 1.00 0.00 H new HETATM 0 H111 BEP C 92 93.296 3.362 -0.935 1.00 0.00 H new HETATM 0 H102 BEP C 92 93.742 5.698 -0.622 1.00 0.00 H new HETATM 0 H101 BEP C 92 94.089 5.071 0.977 1.00 0.00 H new HETATM 0 H92 BEP C 92 92.250 7.046 0.703 1.00 0.00 H new HETATM 0 H91 BEP C 92 91.958 5.762 1.860 1.00 0.00 H new HETATM 0 H82 BEP C 92 90.649 6.213 -0.807 1.00 0.00 H new HETATM 0 H81 BEP C 92 90.026 5.343 0.580 1.00 0.00 H new HETATM 0 H73 BEP C 92 95.234 2.618 -3.252 1.00 0.00 H new HETATM 0 H72 BEP C 92 94.450 2.976 -1.695 1.00 0.00 H new HETATM 0 H71 BEP C 92 95.823 1.846 -1.760 1.00 0.00 H new HETATM 0 H63 BEP C 92 93.071 1.230 -0.560 1.00 0.00 H new HETATM 0 H62 BEP C 92 92.871 -0.372 -1.308 1.00 0.00 H new HETATM 0 H61 BEP C 92 94.445 0.102 -0.627 1.00 0.00 H new HETATM 0 H51 BEP C 92 94.459 0.266 -3.102 1.00 0.00 H new HETATM 0 H42 BEP C 92 92.060 0.707 -3.466 1.00 0.00 H new HETATM 0 H41 BEP C 92 93.014 1.978 -4.206 1.00 0.00 H new HETATM 0 H32 BEP C 92 88.649 4.431 -0.402 1.00 0.00 H new HETATM 0 H31 BEP C 92 89.010 4.222 -2.105 1.00 0.00 H new HETATM 0 H21 BEP C 92 90.265 2.588 0.176 1.00 0.00 H new HETATM 0 H12 BEP C 92 90.941 1.108 -1.366 1.00 0.00 H new HETATM 0 H11 BEP C 92 90.039 1.971 -2.596 1.00 0.00 H new