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 Single : C 1 MET CE :methyl -144:sc= -1.25 (180deg=-4.34!) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 TYR OH : rot 180:sc= 0 USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 GLN : amide:sc= -0.0397 X(o=-0.04,f=0) USER MOD Single : C 13 THR OG1 : rot 180:sc= 0.0036 USER MOD Single : C 16 GLN : amide:sc= -4.03 K(o=-4,f=-1.5) USER MOD Single : C 17 LYS NZ :NH3+ 137:sc= -0.739 (180deg=-1.44) USER MOD Single : C 18 ASN : amide:sc= -2.25! C(o=-2.2!,f=-4.5!) USER MOD Single : C 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 35 CYS SG : rot 79:sc= -0.223 USER MOD Single : C 37 SER OG : rot 180:sc= -0.0393 USER MOD Single : C 38 THR OG1 : rot 180:sc= -0.178 USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ 161:sc= -0.0569 (180deg=-0.214) USER MOD Single : C 45 MET CE :methyl 152:sc= -8.91! (180deg=-12.3!) USER MOD Single : C 47 MET CE :methyl 140:sc= -5.23! (180deg=-8.75!) USER MOD Single : C 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 51 ASN : amide:sc= -0.468 K(o=-0.47,f=-2.5!) USER MOD Single : C 53 THR OG1 : rot 180:sc= 0 USER MOD Single : C 58 GLN : amide:sc= -1.03 K(o=-1,f=-2.3!) USER MOD Single : C 60 MET CE :methyl -120:sc= -12.4! (180deg=-18.6!) USER MOD Single : C 71 THR OG1 : rot 180:sc= -0.111 USER MOD Single : C 80 MET CE :methyl -147:sc= -2.43! (180deg=-5.27!) USER MOD Single : C 81 MET CE :methyl -113:sc= -4.11! (180deg=-8.4!) USER MOD Single : C 84 CYS SG : rot 77:sc= -3.65 USER MOD Single : C 85 MET CE :methyl 141:sc= -6.31! (180deg=-10!) USER MOD Single : C 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 89 SER OG : rot 180:sc= 0 USER MOD Single : I 149 SER OG : rot 94:sc= 0.0705 USER MOD Single : I 153 MET CE :methyl -110:sc= -4.16 (180deg=-7.84!) USER MOD Single : I 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : I 155 GLN : amide:sc= -0.266 K(o=-0.27,f=-1.8!) USER MOD Single : I 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 86.390 -18.179 -7.447 1.00 0.00 N ATOM 2 CA MET C 1 87.235 -17.497 -6.426 1.00 0.00 C ATOM 3 C MET C 1 86.344 -16.696 -5.484 1.00 0.00 C ATOM 4 O MET C 1 86.475 -15.478 -5.366 1.00 0.00 O ATOM 5 CB MET C 1 88.217 -16.552 -7.122 1.00 0.00 C ATOM 6 CG MET C 1 89.438 -17.341 -7.597 1.00 0.00 C ATOM 7 SD MET C 1 90.944 -16.414 -7.207 1.00 0.00 S ATOM 8 CE MET C 1 91.699 -17.652 -6.124 1.00 0.00 C ATOM 0 H1 MET C 1 86.997 -18.726 -8.091 1.00 0.00 H new ATOM 0 H2 MET C 1 85.722 -18.820 -6.973 1.00 0.00 H new ATOM 0 H3 MET C 1 85.861 -17.468 -7.991 1.00 0.00 H new ATOM 0 HA MET C 1 87.790 -18.243 -5.858 1.00 0.00 H new ATOM 0 HB2 MET C 1 87.732 -16.067 -7.969 1.00 0.00 H new ATOM 0 HB3 MET C 1 88.525 -15.762 -6.437 1.00 0.00 H new ATOM 0 HG2 MET C 1 89.464 -18.318 -7.114 1.00 0.00 H new ATOM 0 HG3 MET C 1 89.375 -17.518 -8.671 1.00 0.00 H new ATOM 0 HE1 MET C 1 92.227 -17.152 -5.312 1.00 0.00 H new ATOM 0 HE2 MET C 1 90.922 -18.295 -5.709 1.00 0.00 H new ATOM 0 HE3 MET C 1 92.402 -18.256 -6.697 1.00 0.00 H new ATOM 20 N ASP C 2 85.433 -17.396 -4.815 1.00 0.00 N ATOM 21 CA ASP C 2 84.519 -16.743 -3.882 1.00 0.00 C ATOM 22 C ASP C 2 84.815 -17.178 -2.452 1.00 0.00 C ATOM 23 O ASP C 2 84.792 -16.369 -1.527 1.00 0.00 O ATOM 24 CB ASP C 2 83.068 -17.094 -4.217 1.00 0.00 C ATOM 25 CG ASP C 2 82.678 -16.448 -5.541 1.00 0.00 C ATOM 26 OD1 ASP C 2 83.196 -15.384 -5.835 1.00 0.00 O ATOM 27 OD2 ASP C 2 81.865 -17.028 -6.243 1.00 0.00 O ATOM 0 H ASP C 2 85.308 -18.405 -4.899 1.00 0.00 H new ATOM 0 HA ASP C 2 84.662 -15.666 -3.972 1.00 0.00 H new ATOM 0 HB2 ASP C 2 82.950 -18.176 -4.280 1.00 0.00 H new ATOM 0 HB3 ASP C 2 82.407 -16.747 -3.423 1.00 0.00 H new ATOM 32 N ASP C 3 85.090 -18.467 -2.282 1.00 0.00 N ATOM 33 CA ASP C 3 85.387 -19.007 -0.957 1.00 0.00 C ATOM 34 C ASP C 3 86.394 -18.125 -0.227 1.00 0.00 C ATOM 35 O ASP C 3 86.057 -17.449 0.744 1.00 0.00 O ATOM 36 CB ASP C 3 85.958 -20.419 -1.073 1.00 0.00 C ATOM 37 CG ASP C 3 86.277 -20.955 0.318 1.00 0.00 C ATOM 38 OD1 ASP C 3 85.355 -21.385 0.992 1.00 0.00 O ATOM 39 OD2 ASP C 3 87.439 -20.928 0.690 1.00 0.00 O ATOM 0 H ASP C 3 85.114 -19.153 -3.036 1.00 0.00 H new ATOM 0 HA ASP C 3 84.455 -19.033 -0.392 1.00 0.00 H new ATOM 0 HB2 ASP C 3 85.242 -21.073 -1.571 1.00 0.00 H new ATOM 0 HB3 ASP C 3 86.859 -20.409 -1.686 1.00 0.00 H new ATOM 44 N ILE C 4 87.637 -18.144 -0.704 1.00 0.00 N ATOM 45 CA ILE C 4 88.690 -17.342 -0.087 1.00 0.00 C ATOM 46 C ILE C 4 88.133 -15.994 0.357 1.00 0.00 C ATOM 47 O ILE C 4 88.568 -15.423 1.357 1.00 0.00 O ATOM 48 CB ILE C 4 89.837 -17.113 -1.072 1.00 0.00 C ATOM 49 CG1 ILE C 4 89.292 -16.435 -2.332 1.00 0.00 C ATOM 50 CG2 ILE C 4 90.468 -18.457 -1.441 1.00 0.00 C ATOM 51 CD1 ILE C 4 90.309 -16.556 -3.469 1.00 0.00 C ATOM 0 H ILE C 4 87.937 -18.699 -1.506 1.00 0.00 H new ATOM 0 HA ILE C 4 89.066 -17.884 0.780 1.00 0.00 H new ATOM 0 HB ILE C 4 90.593 -16.475 -0.614 1.00 0.00 H new ATOM 0 HG12 ILE C 4 88.349 -16.897 -2.625 1.00 0.00 H new ATOM 0 HG13 ILE C 4 89.083 -15.385 -2.129 1.00 0.00 H new ATOM 0 HG21 ILE C 4 91.286 -18.294 -2.143 1.00 0.00 H new ATOM 0 HG22 ILE C 4 90.852 -18.938 -0.541 1.00 0.00 H new ATOM 0 HG23 ILE C 4 89.716 -19.098 -1.902 1.00 0.00 H new ATOM 0 HD11 ILE C 4 89.915 -16.072 -4.363 1.00 0.00 H new ATOM 0 HD12 ILE C 4 91.242 -16.074 -3.176 1.00 0.00 H new ATOM 0 HD13 ILE C 4 90.496 -17.609 -3.680 1.00 0.00 H new ATOM 63 N TYR C 5 87.154 -15.498 -0.395 1.00 0.00 N ATOM 64 CA TYR C 5 86.526 -14.220 -0.068 1.00 0.00 C ATOM 65 C TYR C 5 85.407 -14.440 0.943 1.00 0.00 C ATOM 66 O TYR C 5 85.263 -13.692 1.909 1.00 0.00 O ATOM 67 CB TYR C 5 85.941 -13.568 -1.324 1.00 0.00 C ATOM 68 CG TYR C 5 87.053 -13.267 -2.299 1.00 0.00 C ATOM 69 CD1 TYR C 5 87.442 -14.230 -3.238 1.00 0.00 C ATOM 70 CD2 TYR C 5 87.696 -12.024 -2.264 1.00 0.00 C ATOM 71 CE1 TYR C 5 88.475 -13.951 -4.141 1.00 0.00 C ATOM 72 CE2 TYR C 5 88.729 -11.744 -3.167 1.00 0.00 C ATOM 73 CZ TYR C 5 89.119 -12.707 -4.105 1.00 0.00 C ATOM 74 OH TYR C 5 90.138 -12.431 -4.995 1.00 0.00 O ATOM 0 H TYR C 5 86.781 -15.956 -1.227 1.00 0.00 H new ATOM 0 HA TYR C 5 87.286 -13.563 0.354 1.00 0.00 H new ATOM 0 HB2 TYR C 5 85.209 -14.232 -1.784 1.00 0.00 H new ATOM 0 HB3 TYR C 5 85.416 -12.650 -1.059 1.00 0.00 H new ATOM 0 HD1 TYR C 5 86.945 -15.188 -3.266 1.00 0.00 H new ATOM 0 HD2 TYR C 5 87.395 -11.281 -1.540 1.00 0.00 H new ATOM 0 HE1 TYR C 5 88.775 -14.694 -4.865 1.00 0.00 H new ATOM 0 HE2 TYR C 5 89.225 -10.785 -3.140 1.00 0.00 H new ATOM 0 HH TYR C 5 90.475 -11.525 -4.835 1.00 0.00 H new ATOM 84 N LYS C 6 84.620 -15.487 0.705 1.00 0.00 N ATOM 85 CA LYS C 6 83.513 -15.818 1.594 1.00 0.00 C ATOM 86 C LYS C 6 84.009 -15.920 3.032 1.00 0.00 C ATOM 87 O LYS C 6 83.628 -15.127 3.892 1.00 0.00 O ATOM 88 CB LYS C 6 82.876 -17.150 1.183 1.00 0.00 C ATOM 89 CG LYS C 6 82.040 -16.946 -0.082 1.00 0.00 C ATOM 90 CD LYS C 6 80.721 -16.257 0.280 1.00 0.00 C ATOM 91 CE LYS C 6 80.276 -15.364 -0.880 1.00 0.00 C ATOM 92 NZ LYS C 6 78.872 -14.917 -0.654 1.00 0.00 N ATOM 0 H LYS C 6 84.728 -16.116 -0.091 1.00 0.00 H new ATOM 0 HA LYS C 6 82.767 -15.027 1.521 1.00 0.00 H new ATOM 0 HB2 LYS C 6 83.650 -17.896 1.004 1.00 0.00 H new ATOM 0 HB3 LYS C 6 82.248 -17.530 1.989 1.00 0.00 H new ATOM 0 HG2 LYS C 6 82.592 -16.342 -0.802 1.00 0.00 H new ATOM 0 HG3 LYS C 6 81.842 -17.906 -0.558 1.00 0.00 H new ATOM 0 HD2 LYS C 6 79.955 -17.003 0.493 1.00 0.00 H new ATOM 0 HD3 LYS C 6 80.846 -15.661 1.184 1.00 0.00 H new ATOM 0 HE2 LYS C 6 80.935 -14.500 -0.961 1.00 0.00 H new ATOM 0 HE3 LYS C 6 80.348 -15.909 -1.821 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 78.570 -14.310 -1.443 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 78.248 -15.747 -0.597 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 78.817 -14.381 0.236 1.00 0.00 H new ATOM 106 N ALA C 7 84.872 -16.902 3.280 1.00 0.00 N ATOM 107 CA ALA C 7 85.424 -17.091 4.618 1.00 0.00 C ATOM 108 C ALA C 7 85.929 -15.759 5.161 1.00 0.00 C ATOM 109 O ALA C 7 85.535 -15.323 6.242 1.00 0.00 O ATOM 110 CB ALA C 7 86.580 -18.092 4.588 1.00 0.00 C ATOM 0 H ALA C 7 85.200 -17.570 2.583 1.00 0.00 H new ATOM 0 HA ALA C 7 84.636 -17.479 5.263 1.00 0.00 H new ATOM 0 HB1 ALA C 7 86.978 -18.219 5.595 1.00 0.00 H new ATOM 0 HB2 ALA C 7 86.221 -19.052 4.216 1.00 0.00 H new ATOM 0 HB3 ALA C 7 87.367 -17.720 3.932 1.00 0.00 H new ATOM 116 N ALA C 8 86.799 -15.113 4.389 1.00 0.00 N ATOM 117 CA ALA C 8 87.345 -13.822 4.794 1.00 0.00 C ATOM 118 C ALA C 8 86.209 -12.846 5.076 1.00 0.00 C ATOM 119 O ALA C 8 86.338 -11.935 5.894 1.00 0.00 O ATOM 120 CB ALA C 8 88.241 -13.246 3.696 1.00 0.00 C ATOM 0 H ALA C 8 87.137 -15.457 3.490 1.00 0.00 H new ATOM 0 HA ALA C 8 87.939 -13.969 5.696 1.00 0.00 H new ATOM 0 HB1 ALA C 8 88.638 -12.283 4.018 1.00 0.00 H new ATOM 0 HB2 ALA C 8 89.066 -13.932 3.502 1.00 0.00 H new ATOM 0 HB3 ALA C 8 87.659 -13.112 2.784 1.00 0.00 H new ATOM 126 N VAL C 9 85.088 -13.059 4.391 1.00 0.00 N ATOM 127 CA VAL C 9 83.919 -12.206 4.574 1.00 0.00 C ATOM 128 C VAL C 9 83.076 -12.728 5.731 1.00 0.00 C ATOM 129 O VAL C 9 82.282 -11.997 6.323 1.00 0.00 O ATOM 130 CB VAL C 9 83.067 -12.182 3.302 1.00 0.00 C ATOM 131 CG1 VAL C 9 81.712 -11.535 3.599 1.00 0.00 C ATOM 132 CG2 VAL C 9 83.787 -11.375 2.220 1.00 0.00 C ATOM 0 H VAL C 9 84.966 -13.808 3.710 1.00 0.00 H new ATOM 0 HA VAL C 9 84.261 -11.194 4.792 1.00 0.00 H new ATOM 0 HB VAL C 9 82.912 -13.204 2.955 1.00 0.00 H new ATOM 0 HG11 VAL C 9 81.109 -11.520 2.691 1.00 0.00 H new ATOM 0 HG12 VAL C 9 81.195 -12.109 4.368 1.00 0.00 H new ATOM 0 HG13 VAL C 9 81.865 -10.514 3.950 1.00 0.00 H new ATOM 0 HG21 VAL C 9 83.180 -11.358 1.315 1.00 0.00 H new ATOM 0 HG22 VAL C 9 83.944 -10.355 2.571 1.00 0.00 H new ATOM 0 HG23 VAL C 9 84.750 -11.836 2.003 1.00 0.00 H new ATOM 142 N GLU C 10 83.265 -14.006 6.047 1.00 0.00 N ATOM 143 CA GLU C 10 82.525 -14.627 7.139 1.00 0.00 C ATOM 144 C GLU C 10 83.249 -14.393 8.458 1.00 0.00 C ATOM 145 O GLU C 10 82.636 -14.045 9.468 1.00 0.00 O ATOM 146 CB GLU C 10 82.385 -16.133 6.906 1.00 0.00 C ATOM 147 CG GLU C 10 81.437 -16.382 5.732 1.00 0.00 C ATOM 148 CD GLU C 10 81.084 -17.864 5.672 1.00 0.00 C ATOM 149 OE1 GLU C 10 81.674 -18.624 6.423 1.00 0.00 O ATOM 150 OE2 GLU C 10 80.229 -18.218 4.877 1.00 0.00 O ATOM 0 H GLU C 10 83.918 -14.626 5.567 1.00 0.00 H new ATOM 0 HA GLU C 10 81.533 -14.177 7.178 1.00 0.00 H new ATOM 0 HB2 GLU C 10 83.361 -16.572 6.698 1.00 0.00 H new ATOM 0 HB3 GLU C 10 82.003 -16.617 7.805 1.00 0.00 H new ATOM 0 HG2 GLU C 10 80.532 -15.786 5.848 1.00 0.00 H new ATOM 0 HG3 GLU C 10 81.906 -16.071 4.799 1.00 0.00 H new ATOM 157 N GLN C 11 84.564 -14.585 8.435 1.00 0.00 N ATOM 158 CA GLN C 11 85.373 -14.389 9.634 1.00 0.00 C ATOM 159 C GLN C 11 85.040 -13.051 10.283 1.00 0.00 C ATOM 160 O GLN C 11 84.913 -12.951 11.503 1.00 0.00 O ATOM 161 CB GLN C 11 86.861 -14.405 9.288 1.00 0.00 C ATOM 162 CG GLN C 11 87.264 -15.804 8.816 1.00 0.00 C ATOM 163 CD GLN C 11 88.749 -15.816 8.470 1.00 0.00 C ATOM 164 OE1 GLN C 11 89.600 -15.794 9.360 1.00 0.00 O ATOM 165 NE2 GLN C 11 89.116 -15.847 7.218 1.00 0.00 N ATOM 0 H GLN C 11 85.088 -14.873 7.609 1.00 0.00 H new ATOM 0 HA GLN C 11 85.150 -15.203 10.324 1.00 0.00 H new ATOM 0 HB2 GLN C 11 87.071 -13.673 8.508 1.00 0.00 H new ATOM 0 HB3 GLN C 11 87.450 -14.121 10.160 1.00 0.00 H new ATOM 0 HG2 GLN C 11 87.056 -16.537 9.596 1.00 0.00 H new ATOM 0 HG3 GLN C 11 86.674 -16.089 7.945 1.00 0.00 H new ATOM 0 HE21 GLN C 11 88.412 -15.865 6.480 1.00 0.00 H new ATOM 0 HE22 GLN C 11 90.107 -15.853 6.977 1.00 0.00 H new ATOM 174 N LEU C 12 84.907 -12.021 9.451 1.00 0.00 N ATOM 175 CA LEU C 12 84.597 -10.690 9.958 1.00 0.00 C ATOM 176 C LEU C 12 83.463 -10.760 10.974 1.00 0.00 C ATOM 177 O LEU C 12 82.624 -11.660 10.930 1.00 0.00 O ATOM 178 CB LEU C 12 84.183 -9.753 8.820 1.00 0.00 C ATOM 179 CG LEU C 12 85.078 -9.984 7.599 1.00 0.00 C ATOM 180 CD1 LEU C 12 84.933 -8.805 6.635 1.00 0.00 C ATOM 181 CD2 LEU C 12 86.539 -10.096 8.042 1.00 0.00 C ATOM 0 H LEU C 12 85.007 -12.081 8.438 1.00 0.00 H new ATOM 0 HA LEU C 12 85.497 -10.300 10.434 1.00 0.00 H new ATOM 0 HB2 LEU C 12 83.140 -9.928 8.555 1.00 0.00 H new ATOM 0 HB3 LEU C 12 84.259 -8.716 9.146 1.00 0.00 H new ATOM 0 HG LEU C 12 84.779 -10.907 7.102 1.00 0.00 H new ATOM 0 HD11 LEU C 12 85.569 -8.966 5.765 1.00 0.00 H new ATOM 0 HD12 LEU C 12 83.894 -8.722 6.315 1.00 0.00 H new ATOM 0 HD13 LEU C 12 85.232 -7.885 7.138 1.00 0.00 H new ATOM 0 HD21 LEU C 12 87.172 -10.260 7.170 1.00 0.00 H new ATOM 0 HD22 LEU C 12 86.840 -9.174 8.540 1.00 0.00 H new ATOM 0 HD23 LEU C 12 86.647 -10.933 8.732 1.00 0.00 H new ATOM 193 N THR C 13 83.445 -9.796 11.889 1.00 0.00 N ATOM 194 CA THR C 13 82.407 -9.753 12.914 1.00 0.00 C ATOM 195 C THR C 13 81.380 -8.676 12.579 1.00 0.00 C ATOM 196 O THR C 13 81.655 -7.754 11.812 1.00 0.00 O ATOM 197 CB THR C 13 83.019 -9.453 14.283 1.00 0.00 C ATOM 198 OG1 THR C 13 83.883 -8.330 14.179 1.00 0.00 O ATOM 199 CG2 THR C 13 83.814 -10.669 14.764 1.00 0.00 C ATOM 0 H THR C 13 84.129 -9.041 11.943 1.00 0.00 H new ATOM 0 HA THR C 13 81.918 -10.727 12.944 1.00 0.00 H new ATOM 0 HB THR C 13 82.225 -9.234 14.997 1.00 0.00 H new ATOM 0 HG1 THR C 13 84.274 -8.136 15.056 1.00 0.00 H new ATOM 0 HG21 THR C 13 84.250 -10.456 15.740 1.00 0.00 H new ATOM 0 HG22 THR C 13 83.150 -11.530 14.844 1.00 0.00 H new ATOM 0 HG23 THR C 13 84.609 -10.889 14.051 1.00 0.00 H new ATOM 207 N GLU C 14 80.191 -8.806 13.161 1.00 0.00 N ATOM 208 CA GLU C 14 79.127 -7.838 12.913 1.00 0.00 C ATOM 209 C GLU C 14 79.681 -6.417 12.954 1.00 0.00 C ATOM 210 O GLU C 14 79.164 -5.514 12.296 1.00 0.00 O ATOM 211 CB GLU C 14 78.017 -7.976 13.958 1.00 0.00 C ATOM 212 CG GLU C 14 78.593 -7.738 15.354 1.00 0.00 C ATOM 213 CD GLU C 14 77.575 -6.985 16.202 1.00 0.00 C ATOM 214 OE1 GLU C 14 76.877 -6.149 15.651 1.00 0.00 O ATOM 215 OE2 GLU C 14 77.506 -7.256 17.389 1.00 0.00 O ATOM 0 H GLU C 14 79.942 -9.562 13.799 1.00 0.00 H new ATOM 0 HA GLU C 14 78.714 -8.038 11.924 1.00 0.00 H new ATOM 0 HB2 GLU C 14 77.222 -7.259 13.755 1.00 0.00 H new ATOM 0 HB3 GLU C 14 77.572 -8.970 13.902 1.00 0.00 H new ATOM 0 HG2 GLU C 14 78.841 -8.690 15.824 1.00 0.00 H new ATOM 0 HG3 GLU C 14 79.518 -7.166 15.285 1.00 0.00 H new ATOM 222 N GLU C 15 80.744 -6.231 13.732 1.00 0.00 N ATOM 223 CA GLU C 15 81.367 -4.916 13.848 1.00 0.00 C ATOM 224 C GLU C 15 81.702 -4.371 12.473 1.00 0.00 C ATOM 225 O GLU C 15 81.442 -3.209 12.164 1.00 0.00 O ATOM 226 CB GLU C 15 82.665 -4.996 14.645 1.00 0.00 C ATOM 227 CG GLU C 15 82.395 -5.635 16.009 1.00 0.00 C ATOM 228 CD GLU C 15 83.069 -4.808 17.099 1.00 0.00 C ATOM 229 OE1 GLU C 15 84.282 -4.883 17.207 1.00 0.00 O ATOM 230 OE2 GLU C 15 82.363 -4.113 17.811 1.00 0.00 O ATOM 0 H GLU C 15 81.187 -6.964 14.285 1.00 0.00 H new ATOM 0 HA GLU C 15 80.658 -4.263 14.357 1.00 0.00 H new ATOM 0 HB2 GLU C 15 83.403 -5.582 14.098 1.00 0.00 H new ATOM 0 HB3 GLU C 15 83.084 -3.998 14.777 1.00 0.00 H new ATOM 0 HG2 GLU C 15 81.322 -5.690 16.191 1.00 0.00 H new ATOM 0 HG3 GLU C 15 82.774 -6.657 16.026 1.00 0.00 H new ATOM 237 N GLN C 16 82.292 -5.229 11.649 1.00 0.00 N ATOM 238 CA GLN C 16 82.667 -4.818 10.303 1.00 0.00 C ATOM 239 C GLN C 16 81.474 -4.952 9.365 1.00 0.00 C ATOM 240 O GLN C 16 81.209 -4.075 8.542 1.00 0.00 O ATOM 241 CB GLN C 16 83.843 -5.641 9.744 1.00 0.00 C ATOM 242 CG GLN C 16 84.321 -6.680 10.763 1.00 0.00 C ATOM 243 CD GLN C 16 85.739 -7.115 10.411 1.00 0.00 C ATOM 244 OE1 GLN C 16 86.483 -7.585 11.272 1.00 0.00 O ATOM 245 NE2 GLN C 16 86.162 -6.984 9.183 1.00 0.00 N ATOM 0 H GLN C 16 82.517 -6.196 11.883 1.00 0.00 H new ATOM 0 HA GLN C 16 82.986 -3.778 10.366 1.00 0.00 H new ATOM 0 HB2 GLN C 16 83.537 -6.142 8.826 1.00 0.00 H new ATOM 0 HB3 GLN C 16 84.666 -4.975 9.485 1.00 0.00 H new ATOM 0 HG2 GLN C 16 84.296 -6.259 11.768 1.00 0.00 H new ATOM 0 HG3 GLN C 16 83.653 -7.541 10.762 1.00 0.00 H new ATOM 0 HE21 GLN C 16 85.545 -6.595 8.470 1.00 0.00 H new ATOM 0 HE22 GLN C 16 87.109 -7.271 8.937 1.00 0.00 H new ATOM 254 N LYS C 17 80.750 -6.059 9.505 1.00 0.00 N ATOM 255 CA LYS C 17 79.578 -6.300 8.670 1.00 0.00 C ATOM 256 C LYS C 17 78.600 -5.135 8.791 1.00 0.00 C ATOM 257 O LYS C 17 77.811 -4.870 7.884 1.00 0.00 O ATOM 258 CB LYS C 17 78.874 -7.591 9.092 1.00 0.00 C ATOM 259 CG LYS C 17 79.858 -8.760 9.006 1.00 0.00 C ATOM 260 CD LYS C 17 80.141 -9.081 7.537 1.00 0.00 C ATOM 261 CE LYS C 17 79.328 -10.308 7.117 1.00 0.00 C ATOM 262 NZ LYS C 17 79.582 -10.604 5.679 1.00 0.00 N ATOM 0 H LYS C 17 80.951 -6.796 10.181 1.00 0.00 H new ATOM 0 HA LYS C 17 79.910 -6.395 7.636 1.00 0.00 H new ATOM 0 HB2 LYS C 17 78.495 -7.495 10.109 1.00 0.00 H new ATOM 0 HB3 LYS C 17 78.015 -7.777 8.448 1.00 0.00 H new ATOM 0 HG2 LYS C 17 80.786 -8.507 9.519 1.00 0.00 H new ATOM 0 HG3 LYS C 17 79.445 -9.635 9.508 1.00 0.00 H new ATOM 0 HD2 LYS C 17 79.881 -8.228 6.911 1.00 0.00 H new ATOM 0 HD3 LYS C 17 81.205 -9.270 7.393 1.00 0.00 H new ATOM 0 HE2 LYS C 17 79.602 -11.167 7.730 1.00 0.00 H new ATOM 0 HE3 LYS C 17 78.266 -10.127 7.280 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 79.704 -11.629 5.552 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 78.775 -10.278 5.110 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 80.445 -10.112 5.370 1.00 0.00 H new ATOM 276 N ASN C 18 78.669 -4.440 9.924 1.00 0.00 N ATOM 277 CA ASN C 18 77.792 -3.296 10.161 1.00 0.00 C ATOM 278 C ASN C 18 78.371 -2.046 9.508 1.00 0.00 C ATOM 279 O ASN C 18 77.866 -1.566 8.493 1.00 0.00 O ATOM 280 CB ASN C 18 77.632 -3.038 11.660 1.00 0.00 C ATOM 281 CG ASN C 18 76.931 -4.223 12.314 1.00 0.00 C ATOM 282 OD1 ASN C 18 76.368 -5.076 11.628 1.00 0.00 O ATOM 283 ND2 ASN C 18 76.931 -4.327 13.615 1.00 0.00 N ATOM 0 H ASN C 18 79.316 -4.646 10.685 1.00 0.00 H new ATOM 0 HA ASN C 18 76.818 -3.525 9.728 1.00 0.00 H new ATOM 0 HB2 ASN C 18 78.609 -2.883 12.118 1.00 0.00 H new ATOM 0 HB3 ASN C 18 77.055 -2.127 11.822 1.00 0.00 H new ATOM 0 HD21 ASN C 18 76.464 -5.115 14.064 1.00 0.00 H new ATOM 0 HD22 ASN C 18 77.398 -3.620 14.183 1.00 0.00 H new ATOM 290 N GLU C 19 79.443 -1.528 10.104 1.00 0.00 N ATOM 291 CA GLU C 19 80.094 -0.334 9.574 1.00 0.00 C ATOM 292 C GLU C 19 80.168 -0.405 8.053 1.00 0.00 C ATOM 293 O GLU C 19 79.935 0.583 7.358 1.00 0.00 O ATOM 294 CB GLU C 19 81.512 -0.203 10.135 1.00 0.00 C ATOM 295 CG GLU C 19 82.290 -1.491 9.859 1.00 0.00 C ATOM 296 CD GLU C 19 83.665 -1.409 10.512 1.00 0.00 C ATOM 297 OE1 GLU C 19 83.724 -1.450 11.730 1.00 0.00 O ATOM 298 OE2 GLU C 19 84.639 -1.307 9.785 1.00 0.00 O ATOM 0 H GLU C 19 79.875 -1.912 10.945 1.00 0.00 H new ATOM 0 HA GLU C 19 79.505 0.533 9.872 1.00 0.00 H new ATOM 0 HB2 GLU C 19 82.019 0.646 9.677 1.00 0.00 H new ATOM 0 HB3 GLU C 19 81.474 -0.011 11.207 1.00 0.00 H new ATOM 0 HG2 GLU C 19 81.742 -2.349 10.248 1.00 0.00 H new ATOM 0 HG3 GLU C 19 82.395 -1.641 8.784 1.00 0.00 H new ATOM 305 N PHE C 20 80.496 -1.591 7.545 1.00 0.00 N ATOM 306 CA PHE C 20 80.598 -1.789 6.101 1.00 0.00 C ATOM 307 C PHE C 20 79.334 -1.294 5.407 1.00 0.00 C ATOM 308 O PHE C 20 79.393 -0.494 4.475 1.00 0.00 O ATOM 309 CB PHE C 20 80.801 -3.270 5.776 1.00 0.00 C ATOM 310 CG PHE C 20 82.278 -3.558 5.642 1.00 0.00 C ATOM 311 CD1 PHE C 20 83.097 -2.690 4.909 1.00 0.00 C ATOM 312 CD2 PHE C 20 82.828 -4.692 6.251 1.00 0.00 C ATOM 313 CE1 PHE C 20 84.466 -2.958 4.784 1.00 0.00 C ATOM 314 CE2 PHE C 20 84.197 -4.959 6.127 1.00 0.00 C ATOM 315 CZ PHE C 20 85.016 -4.092 5.394 1.00 0.00 C ATOM 0 H PHE C 20 80.694 -2.421 8.104 1.00 0.00 H new ATOM 0 HA PHE C 20 81.456 -1.220 5.742 1.00 0.00 H new ATOM 0 HB2 PHE C 20 80.369 -3.889 6.563 1.00 0.00 H new ATOM 0 HB3 PHE C 20 80.284 -3.524 4.850 1.00 0.00 H new ATOM 0 HD1 PHE C 20 82.673 -1.814 4.440 1.00 0.00 H new ATOM 0 HD2 PHE C 20 82.196 -5.361 6.817 1.00 0.00 H new ATOM 0 HE1 PHE C 20 85.097 -2.290 4.217 1.00 0.00 H new ATOM 0 HE2 PHE C 20 84.621 -5.834 6.597 1.00 0.00 H new ATOM 0 HZ PHE C 20 86.072 -4.298 5.299 1.00 0.00 H new ATOM 325 N LYS C 21 78.187 -1.777 5.878 1.00 0.00 N ATOM 326 CA LYS C 21 76.909 -1.373 5.299 1.00 0.00 C ATOM 327 C LYS C 21 76.692 0.121 5.505 1.00 0.00 C ATOM 328 O LYS C 21 76.374 0.854 4.569 1.00 0.00 O ATOM 329 CB LYS C 21 75.757 -2.140 5.952 1.00 0.00 C ATOM 330 CG LYS C 21 75.909 -3.633 5.659 1.00 0.00 C ATOM 331 CD LYS C 21 74.894 -4.049 4.593 1.00 0.00 C ATOM 332 CE LYS C 21 75.119 -5.515 4.220 1.00 0.00 C ATOM 333 NZ LYS C 21 74.013 -6.345 4.775 1.00 0.00 N ATOM 0 H LYS C 21 78.116 -2.440 6.649 1.00 0.00 H new ATOM 0 HA LYS C 21 76.931 -1.598 4.233 1.00 0.00 H new ATOM 0 HB2 LYS C 21 75.755 -1.968 7.028 1.00 0.00 H new ATOM 0 HB3 LYS C 21 74.802 -1.779 5.570 1.00 0.00 H new ATOM 0 HG2 LYS C 21 76.921 -3.846 5.315 1.00 0.00 H new ATOM 0 HG3 LYS C 21 75.753 -4.211 6.570 1.00 0.00 H new ATOM 0 HD2 LYS C 21 73.880 -3.909 4.967 1.00 0.00 H new ATOM 0 HD3 LYS C 21 74.998 -3.418 3.710 1.00 0.00 H new ATOM 0 HE2 LYS C 21 75.160 -5.623 3.136 1.00 0.00 H new ATOM 0 HE3 LYS C 21 76.077 -5.858 4.611 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 74.166 -7.342 4.521 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 73.994 -6.250 5.810 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 73.106 -6.023 4.381 1.00 0.00 H new ATOM 347 N ALA C 22 76.878 0.563 6.745 1.00 0.00 N ATOM 348 CA ALA C 22 76.712 1.975 7.070 1.00 0.00 C ATOM 349 C ALA C 22 77.611 2.822 6.181 1.00 0.00 C ATOM 350 O ALA C 22 77.379 4.015 5.995 1.00 0.00 O ATOM 351 CB ALA C 22 77.065 2.231 8.535 1.00 0.00 C ATOM 0 H ALA C 22 77.141 -0.029 7.533 1.00 0.00 H new ATOM 0 HA ALA C 22 75.670 2.247 6.901 1.00 0.00 H new ATOM 0 HB1 ALA C 22 76.936 3.289 8.761 1.00 0.00 H new ATOM 0 HB2 ALA C 22 76.410 1.641 9.176 1.00 0.00 H new ATOM 0 HB3 ALA C 22 78.102 1.946 8.715 1.00 0.00 H new ATOM 357 N ALA C 23 78.640 2.187 5.629 1.00 0.00 N ATOM 358 CA ALA C 23 79.570 2.887 4.750 1.00 0.00 C ATOM 359 C ALA C 23 79.106 2.777 3.303 1.00 0.00 C ATOM 360 O ALA C 23 79.473 3.590 2.454 1.00 0.00 O ATOM 361 CB ALA C 23 80.975 2.301 4.874 1.00 0.00 C ATOM 0 H ALA C 23 78.850 1.199 5.773 1.00 0.00 H new ATOM 0 HA ALA C 23 79.595 3.935 5.048 1.00 0.00 H new ATOM 0 HB1 ALA C 23 81.653 2.837 4.210 1.00 0.00 H new ATOM 0 HB2 ALA C 23 81.321 2.400 5.903 1.00 0.00 H new ATOM 0 HB3 ALA C 23 80.955 1.247 4.598 1.00 0.00 H new ATOM 367 N PHE C 24 78.284 1.768 3.033 1.00 0.00 N ATOM 368 CA PHE C 24 77.764 1.568 1.685 1.00 0.00 C ATOM 369 C PHE C 24 76.766 2.669 1.349 1.00 0.00 C ATOM 370 O PHE C 24 76.572 3.021 0.185 1.00 0.00 O ATOM 371 CB PHE C 24 77.073 0.208 1.568 1.00 0.00 C ATOM 372 CG PHE C 24 78.010 -0.769 0.901 1.00 0.00 C ATOM 373 CD1 PHE C 24 78.373 -0.586 -0.438 1.00 0.00 C ATOM 374 CD2 PHE C 24 78.520 -1.855 1.623 1.00 0.00 C ATOM 375 CE1 PHE C 24 79.244 -1.489 -1.057 1.00 0.00 C ATOM 376 CE2 PHE C 24 79.392 -2.759 1.004 1.00 0.00 C ATOM 377 CZ PHE C 24 79.755 -2.575 -0.336 1.00 0.00 C ATOM 0 H PHE C 24 77.967 1.084 3.720 1.00 0.00 H new ATOM 0 HA PHE C 24 78.600 1.600 0.986 1.00 0.00 H new ATOM 0 HB2 PHE C 24 76.791 -0.156 2.556 1.00 0.00 H new ATOM 0 HB3 PHE C 24 76.154 0.302 0.989 1.00 0.00 H new ATOM 0 HD1 PHE C 24 77.981 0.253 -0.994 1.00 0.00 H new ATOM 0 HD2 PHE C 24 78.241 -1.995 2.657 1.00 0.00 H new ATOM 0 HE1 PHE C 24 79.522 -1.348 -2.091 1.00 0.00 H new ATOM 0 HE2 PHE C 24 79.784 -3.598 1.560 1.00 0.00 H new ATOM 0 HZ PHE C 24 80.429 -3.271 -0.813 1.00 0.00 H new ATOM 387 N ASP C 25 76.142 3.216 2.389 1.00 0.00 N ATOM 388 CA ASP C 25 75.171 4.288 2.206 1.00 0.00 C ATOM 389 C ASP C 25 75.886 5.624 2.022 1.00 0.00 C ATOM 390 O ASP C 25 75.249 6.666 1.859 1.00 0.00 O ATOM 391 CB ASP C 25 74.245 4.385 3.420 1.00 0.00 C ATOM 392 CG ASP C 25 72.919 3.700 3.108 1.00 0.00 C ATOM 393 OD1 ASP C 25 72.933 2.738 2.358 1.00 0.00 O ATOM 394 OD2 ASP C 25 71.908 4.149 3.623 1.00 0.00 O ATOM 0 H ASP C 25 76.290 2.937 3.359 1.00 0.00 H new ATOM 0 HA ASP C 25 74.582 4.062 1.317 1.00 0.00 H new ATOM 0 HB2 ASP C 25 74.713 3.916 4.286 1.00 0.00 H new ATOM 0 HB3 ASP C 25 74.074 5.430 3.677 1.00 0.00 H new ATOM 399 N ILE C 26 77.218 5.584 2.044 1.00 0.00 N ATOM 400 CA ILE C 26 78.007 6.799 1.874 1.00 0.00 C ATOM 401 C ILE C 26 78.697 6.777 0.515 1.00 0.00 C ATOM 402 O ILE C 26 78.678 7.762 -0.224 1.00 0.00 O ATOM 403 CB ILE C 26 79.065 6.942 2.974 1.00 0.00 C ATOM 404 CG1 ILE C 26 78.745 5.997 4.135 1.00 0.00 C ATOM 405 CG2 ILE C 26 79.066 8.384 3.483 1.00 0.00 C ATOM 406 CD1 ILE C 26 77.464 6.450 4.835 1.00 0.00 C ATOM 0 H ILE C 26 77.766 4.734 2.176 1.00 0.00 H new ATOM 0 HA ILE C 26 77.328 7.649 1.939 1.00 0.00 H new ATOM 0 HB ILE C 26 80.044 6.689 2.567 1.00 0.00 H new ATOM 0 HG12 ILE C 26 78.627 4.979 3.765 1.00 0.00 H new ATOM 0 HG13 ILE C 26 79.573 5.985 4.844 1.00 0.00 H new ATOM 0 HG21 ILE C 26 79.816 8.493 4.266 1.00 0.00 H new ATOM 0 HG22 ILE C 26 79.299 9.060 2.660 1.00 0.00 H new ATOM 0 HG23 ILE C 26 78.083 8.628 3.886 1.00 0.00 H new ATOM 0 HD11 ILE C 26 77.242 5.774 5.660 1.00 0.00 H new ATOM 0 HD12 ILE C 26 77.598 7.461 5.220 1.00 0.00 H new ATOM 0 HD13 ILE C 26 76.638 6.439 4.124 1.00 0.00 H new ATOM 418 N PHE C 27 79.293 5.633 0.184 1.00 0.00 N ATOM 419 CA PHE C 27 79.970 5.485 -1.100 1.00 0.00 C ATOM 420 C PHE C 27 78.976 5.734 -2.228 1.00 0.00 C ATOM 421 O PHE C 27 79.254 6.467 -3.177 1.00 0.00 O ATOM 422 CB PHE C 27 80.548 4.076 -1.246 1.00 0.00 C ATOM 423 CG PHE C 27 81.680 3.889 -0.264 1.00 0.00 C ATOM 424 CD1 PHE C 27 82.800 4.725 -0.321 1.00 0.00 C ATOM 425 CD2 PHE C 27 81.609 2.879 0.703 1.00 0.00 C ATOM 426 CE1 PHE C 27 83.850 4.552 0.587 1.00 0.00 C ATOM 427 CE2 PHE C 27 82.659 2.705 1.612 1.00 0.00 C ATOM 428 CZ PHE C 27 83.780 3.542 1.555 1.00 0.00 C ATOM 0 H PHE C 27 79.321 4.805 0.780 1.00 0.00 H new ATOM 0 HA PHE C 27 80.784 6.208 -1.149 1.00 0.00 H new ATOM 0 HB2 PHE C 27 79.771 3.333 -1.067 1.00 0.00 H new ATOM 0 HB3 PHE C 27 80.907 3.923 -2.264 1.00 0.00 H new ATOM 0 HD1 PHE C 27 82.854 5.505 -1.067 1.00 0.00 H new ATOM 0 HD2 PHE C 27 80.744 2.234 0.748 1.00 0.00 H new ATOM 0 HE1 PHE C 27 84.715 5.197 0.542 1.00 0.00 H new ATOM 0 HE2 PHE C 27 82.605 1.925 2.357 1.00 0.00 H new ATOM 0 HZ PHE C 27 84.590 3.409 2.257 1.00 0.00 H new ATOM 438 N VAL C 28 77.802 5.121 -2.096 1.00 0.00 N ATOM 439 CA VAL C 28 76.746 5.281 -3.089 1.00 0.00 C ATOM 440 C VAL C 28 75.586 6.059 -2.478 1.00 0.00 C ATOM 441 O VAL C 28 74.418 5.791 -2.758 1.00 0.00 O ATOM 442 CB VAL C 28 76.240 3.917 -3.567 1.00 0.00 C ATOM 443 CG1 VAL C 28 77.298 3.259 -4.454 1.00 0.00 C ATOM 444 CG2 VAL C 28 75.965 3.021 -2.357 1.00 0.00 C ATOM 0 H VAL C 28 77.560 4.512 -1.314 1.00 0.00 H new ATOM 0 HA VAL C 28 77.153 5.824 -3.942 1.00 0.00 H new ATOM 0 HB VAL C 28 75.321 4.053 -4.137 1.00 0.00 H new ATOM 0 HG11 VAL C 28 76.936 2.288 -4.793 1.00 0.00 H new ATOM 0 HG12 VAL C 28 77.495 3.895 -5.317 1.00 0.00 H new ATOM 0 HG13 VAL C 28 78.218 3.124 -3.885 1.00 0.00 H new ATOM 0 HG21 VAL C 28 75.605 2.050 -2.697 1.00 0.00 H new ATOM 0 HG22 VAL C 28 76.884 2.887 -1.787 1.00 0.00 H new ATOM 0 HG23 VAL C 28 75.210 3.486 -1.724 1.00 0.00 H new ATOM 454 N LEU C 29 75.932 7.024 -1.628 1.00 0.00 N ATOM 455 CA LEU C 29 74.925 7.844 -0.960 1.00 0.00 C ATOM 456 C LEU C 29 74.071 8.592 -1.981 1.00 0.00 C ATOM 457 O LEU C 29 73.009 9.125 -1.656 1.00 0.00 O ATOM 458 CB LEU C 29 75.599 8.843 -0.009 1.00 0.00 C ATOM 459 CG LEU C 29 76.099 10.062 -0.791 1.00 0.00 C ATOM 460 CD1 LEU C 29 75.079 11.196 -0.676 1.00 0.00 C ATOM 461 CD2 LEU C 29 77.439 10.522 -0.213 1.00 0.00 C ATOM 0 H LEU C 29 76.896 7.256 -1.387 1.00 0.00 H new ATOM 0 HA LEU C 29 74.277 7.184 -0.383 1.00 0.00 H new ATOM 0 HB2 LEU C 29 74.893 9.159 0.759 1.00 0.00 H new ATOM 0 HB3 LEU C 29 76.433 8.363 0.503 1.00 0.00 H new ATOM 0 HG LEU C 29 76.227 9.794 -1.840 1.00 0.00 H new ATOM 0 HD11 LEU C 29 75.435 12.063 -1.232 1.00 0.00 H new ATOM 0 HD12 LEU C 29 74.123 10.869 -1.086 1.00 0.00 H new ATOM 0 HD13 LEU C 29 74.951 11.465 0.372 1.00 0.00 H new ATOM 0 HD21 LEU C 29 77.796 11.389 -0.768 1.00 0.00 H new ATOM 0 HD22 LEU C 29 77.310 10.790 0.836 1.00 0.00 H new ATOM 0 HD23 LEU C 29 78.167 9.714 -0.294 1.00 0.00 H new ATOM 473 N GLY C 30 74.548 8.619 -3.217 1.00 0.00 N ATOM 474 CA GLY C 30 73.828 9.296 -4.292 1.00 0.00 C ATOM 475 C GLY C 30 73.722 8.397 -5.520 1.00 0.00 C ATOM 476 O GLY C 30 73.353 8.845 -6.606 1.00 0.00 O ATOM 0 H GLY C 30 75.425 8.183 -3.502 1.00 0.00 H new ATOM 0 HA2 GLY C 30 72.831 9.572 -3.950 1.00 0.00 H new ATOM 0 HA3 GLY C 30 74.342 10.220 -4.555 1.00 0.00 H new ATOM 480 N ALA C 31 74.054 7.120 -5.336 1.00 0.00 N ATOM 481 CA ALA C 31 73.996 6.160 -6.436 1.00 0.00 C ATOM 482 C ALA C 31 72.611 5.533 -6.531 1.00 0.00 C ATOM 483 O ALA C 31 71.725 5.816 -5.724 1.00 0.00 O ATOM 484 CB ALA C 31 75.031 5.052 -6.236 1.00 0.00 C ATOM 0 H ALA C 31 74.363 6.730 -4.446 1.00 0.00 H new ATOM 0 HA ALA C 31 74.213 6.698 -7.359 1.00 0.00 H new ATOM 0 HB1 ALA C 31 74.973 4.346 -7.065 1.00 0.00 H new ATOM 0 HB2 ALA C 31 76.029 5.489 -6.200 1.00 0.00 H new ATOM 0 HB3 ALA C 31 74.829 4.530 -5.300 1.00 0.00 H new ATOM 490 N GLU C 32 72.438 4.681 -7.535 1.00 0.00 N ATOM 491 CA GLU C 32 71.160 4.012 -7.748 1.00 0.00 C ATOM 492 C GLU C 32 71.094 2.708 -6.957 1.00 0.00 C ATOM 493 O GLU C 32 70.263 2.550 -6.063 1.00 0.00 O ATOM 494 CB GLU C 32 70.970 3.709 -9.234 1.00 0.00 C ATOM 495 CG GLU C 32 69.726 4.435 -9.748 1.00 0.00 C ATOM 496 CD GLU C 32 68.487 3.601 -9.440 1.00 0.00 C ATOM 497 OE1 GLU C 32 68.638 2.553 -8.834 1.00 0.00 O ATOM 498 OE2 GLU C 32 67.406 4.023 -9.814 1.00 0.00 O ATOM 0 H GLU C 32 73.162 4.438 -8.211 1.00 0.00 H new ATOM 0 HA GLU C 32 70.367 4.676 -7.404 1.00 0.00 H new ATOM 0 HB2 GLU C 32 71.848 4.027 -9.796 1.00 0.00 H new ATOM 0 HB3 GLU C 32 70.866 2.635 -9.387 1.00 0.00 H new ATOM 0 HG2 GLU C 32 69.644 5.415 -9.278 1.00 0.00 H new ATOM 0 HG3 GLU C 32 69.807 4.602 -10.822 1.00 0.00 H new ATOM 505 N ASP C 33 71.980 1.774 -7.296 1.00 0.00 N ATOM 506 CA ASP C 33 72.011 0.483 -6.607 1.00 0.00 C ATOM 507 C ASP C 33 73.085 0.484 -5.523 1.00 0.00 C ATOM 508 O ASP C 33 72.788 0.622 -4.336 1.00 0.00 O ATOM 509 CB ASP C 33 72.290 -0.673 -7.582 1.00 0.00 C ATOM 510 CG ASP C 33 72.455 -0.146 -9.006 1.00 0.00 C ATOM 511 OD1 ASP C 33 71.613 0.628 -9.431 1.00 0.00 O ATOM 512 OD2 ASP C 33 73.418 -0.528 -9.650 1.00 0.00 O ATOM 0 H ASP C 33 72.677 1.882 -8.033 1.00 0.00 H new ATOM 0 HA ASP C 33 71.029 0.334 -6.159 1.00 0.00 H new ATOM 0 HB2 ASP C 33 73.192 -1.203 -7.278 1.00 0.00 H new ATOM 0 HB3 ASP C 33 71.471 -1.392 -7.547 1.00 0.00 H new ATOM 517 N GLY C 34 74.337 0.329 -5.944 1.00 0.00 N ATOM 518 CA GLY C 34 75.450 0.313 -4.998 1.00 0.00 C ATOM 519 C GLY C 34 76.781 0.452 -5.727 1.00 0.00 C ATOM 520 O GLY C 34 77.798 -0.098 -5.304 1.00 0.00 O ATOM 0 H GLY C 34 74.605 0.214 -6.921 1.00 0.00 H new ATOM 0 HA2 GLY C 34 75.336 1.126 -4.281 1.00 0.00 H new ATOM 0 HA3 GLY C 34 75.437 -0.617 -4.430 1.00 0.00 H new ATOM 524 N CYS C 35 76.763 1.195 -6.830 1.00 0.00 N ATOM 525 CA CYS C 35 77.976 1.405 -7.615 1.00 0.00 C ATOM 526 C CYS C 35 78.626 2.732 -7.238 1.00 0.00 C ATOM 527 O CYS C 35 77.986 3.783 -7.265 1.00 0.00 O ATOM 528 CB CYS C 35 77.655 1.413 -9.112 1.00 0.00 C ATOM 529 SG CYS C 35 76.340 0.217 -9.458 1.00 0.00 S ATOM 0 H CYS C 35 75.932 1.657 -7.198 1.00 0.00 H new ATOM 0 HA CYS C 35 78.663 0.587 -7.399 1.00 0.00 H new ATOM 0 HB2 CYS C 35 77.344 2.411 -9.422 1.00 0.00 H new ATOM 0 HB3 CYS C 35 78.547 1.164 -9.687 1.00 0.00 H new ATOM 0 HG CYS C 35 75.191 0.730 -9.132 1.00 0.00 H new ATOM 535 N ILE C 36 79.906 2.671 -6.883 1.00 0.00 N ATOM 536 CA ILE C 36 80.637 3.876 -6.499 1.00 0.00 C ATOM 537 C ILE C 36 81.355 4.471 -7.704 1.00 0.00 C ATOM 538 O ILE C 36 81.412 3.865 -8.774 1.00 0.00 O ATOM 539 CB ILE C 36 81.670 3.559 -5.417 1.00 0.00 C ATOM 540 CG1 ILE C 36 81.084 2.551 -4.427 1.00 0.00 C ATOM 541 CG2 ILE C 36 82.041 4.844 -4.674 1.00 0.00 C ATOM 542 CD1 ILE C 36 82.197 2.028 -3.517 1.00 0.00 C ATOM 0 H ILE C 36 80.454 1.811 -6.853 1.00 0.00 H new ATOM 0 HA ILE C 36 79.914 4.594 -6.112 1.00 0.00 H new ATOM 0 HB ILE C 36 82.561 3.135 -5.881 1.00 0.00 H new ATOM 0 HG12 ILE C 36 80.303 3.022 -3.831 1.00 0.00 H new ATOM 0 HG13 ILE C 36 80.620 1.724 -4.965 1.00 0.00 H new ATOM 0 HG21 ILE C 36 82.777 4.619 -3.903 1.00 0.00 H new ATOM 0 HG22 ILE C 36 82.461 5.563 -5.378 1.00 0.00 H new ATOM 0 HG23 ILE C 36 81.149 5.267 -4.212 1.00 0.00 H new ATOM 0 HD11 ILE C 36 81.782 1.309 -2.810 1.00 0.00 H new ATOM 0 HD12 ILE C 36 82.963 1.542 -4.121 1.00 0.00 H new ATOM 0 HD13 ILE C 36 82.641 2.860 -2.970 1.00 0.00 H new ATOM 554 N SER C 37 81.906 5.666 -7.515 1.00 0.00 N ATOM 555 CA SER C 37 82.626 6.342 -8.590 1.00 0.00 C ATOM 556 C SER C 37 83.692 7.271 -8.017 1.00 0.00 C ATOM 557 O SER C 37 83.582 7.745 -6.886 1.00 0.00 O ATOM 558 CB SER C 37 81.663 7.159 -9.452 1.00 0.00 C ATOM 559 OG SER C 37 81.854 6.819 -10.819 1.00 0.00 O ATOM 0 H SER C 37 81.869 6.183 -6.636 1.00 0.00 H new ATOM 0 HA SER C 37 83.102 5.579 -9.205 1.00 0.00 H new ATOM 0 HB2 SER C 37 80.633 6.960 -9.156 1.00 0.00 H new ATOM 0 HB3 SER C 37 81.837 8.225 -9.302 1.00 0.00 H new ATOM 0 HG SER C 37 81.237 7.340 -11.375 1.00 0.00 H new ATOM 565 N THR C 38 84.727 7.519 -8.811 1.00 0.00 N ATOM 566 CA THR C 38 85.819 8.388 -8.380 1.00 0.00 C ATOM 567 C THR C 38 85.277 9.616 -7.655 1.00 0.00 C ATOM 568 O THR C 38 85.828 10.051 -6.644 1.00 0.00 O ATOM 569 CB THR C 38 86.645 8.849 -9.583 1.00 0.00 C ATOM 570 OG1 THR C 38 85.952 9.891 -10.260 1.00 0.00 O ATOM 571 CG2 THR C 38 86.861 7.674 -10.536 1.00 0.00 C ATOM 0 H THR C 38 84.834 7.135 -9.750 1.00 0.00 H new ATOM 0 HA THR C 38 86.450 7.815 -7.701 1.00 0.00 H new ATOM 0 HB THR C 38 87.612 9.218 -9.241 1.00 0.00 H new ATOM 0 HG1 THR C 38 86.480 10.189 -11.030 1.00 0.00 H new ATOM 0 HG21 THR C 38 87.449 8.004 -11.392 1.00 0.00 H new ATOM 0 HG22 THR C 38 87.392 6.877 -10.016 1.00 0.00 H new ATOM 0 HG23 THR C 38 85.896 7.303 -10.880 1.00 0.00 H new ATOM 579 N LYS C 39 84.196 10.172 -8.190 1.00 0.00 N ATOM 580 CA LYS C 39 83.586 11.359 -7.595 1.00 0.00 C ATOM 581 C LYS C 39 82.768 10.991 -6.360 1.00 0.00 C ATOM 582 O LYS C 39 82.851 11.654 -5.325 1.00 0.00 O ATOM 583 CB LYS C 39 82.672 12.051 -8.609 1.00 0.00 C ATOM 584 CG LYS C 39 82.104 13.333 -7.995 1.00 0.00 C ATOM 585 CD LYS C 39 82.409 14.517 -8.915 1.00 0.00 C ATOM 586 CE LYS C 39 81.099 15.132 -9.408 1.00 0.00 C ATOM 587 NZ LYS C 39 80.522 15.993 -8.337 1.00 0.00 N ATOM 0 H LYS C 39 83.726 9.825 -9.026 1.00 0.00 H new ATOM 0 HA LYS C 39 84.390 12.034 -7.302 1.00 0.00 H new ATOM 0 HB2 LYS C 39 83.229 12.286 -9.516 1.00 0.00 H new ATOM 0 HB3 LYS C 39 81.860 11.383 -8.898 1.00 0.00 H new ATOM 0 HG2 LYS C 39 81.027 13.236 -7.854 1.00 0.00 H new ATOM 0 HG3 LYS C 39 82.540 13.502 -7.010 1.00 0.00 H new ATOM 0 HD2 LYS C 39 82.995 15.265 -8.381 1.00 0.00 H new ATOM 0 HD3 LYS C 39 83.010 14.187 -9.763 1.00 0.00 H new ATOM 0 HE2 LYS C 39 81.277 15.722 -10.307 1.00 0.00 H new ATOM 0 HE3 LYS C 39 80.394 14.346 -9.677 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 79.631 16.412 -8.671 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 80.338 15.418 -7.490 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 81.194 16.751 -8.101 1.00 0.00 H new ATOM 601 N GLU C 40 81.971 9.934 -6.480 1.00 0.00 N ATOM 602 CA GLU C 40 81.132 9.494 -5.368 1.00 0.00 C ATOM 603 C GLU C 40 81.966 9.269 -4.108 1.00 0.00 C ATOM 604 O GLU C 40 81.435 9.230 -2.998 1.00 0.00 O ATOM 605 CB GLU C 40 80.401 8.199 -5.726 1.00 0.00 C ATOM 606 CG GLU C 40 78.972 8.523 -6.167 1.00 0.00 C ATOM 607 CD GLU C 40 79.007 9.284 -7.488 1.00 0.00 C ATOM 608 OE1 GLU C 40 79.506 10.397 -7.495 1.00 0.00 O ATOM 609 OE2 GLU C 40 78.536 8.742 -8.473 1.00 0.00 O ATOM 0 H GLU C 40 81.888 9.371 -7.326 1.00 0.00 H new ATOM 0 HA GLU C 40 80.403 10.281 -5.174 1.00 0.00 H new ATOM 0 HB2 GLU C 40 80.930 7.679 -6.525 1.00 0.00 H new ATOM 0 HB3 GLU C 40 80.384 7.529 -4.866 1.00 0.00 H new ATOM 0 HG2 GLU C 40 78.398 7.603 -6.280 1.00 0.00 H new ATOM 0 HG3 GLU C 40 78.471 9.120 -5.405 1.00 0.00 H new ATOM 616 N LEU C 41 83.277 9.125 -4.285 1.00 0.00 N ATOM 617 CA LEU C 41 84.166 8.911 -3.143 1.00 0.00 C ATOM 618 C LEU C 41 84.590 10.247 -2.543 1.00 0.00 C ATOM 619 O LEU C 41 84.501 10.460 -1.334 1.00 0.00 O ATOM 620 CB LEU C 41 85.429 8.147 -3.562 1.00 0.00 C ATOM 621 CG LEU C 41 85.097 6.689 -3.915 1.00 0.00 C ATOM 622 CD1 LEU C 41 86.353 5.836 -3.737 1.00 0.00 C ATOM 623 CD2 LEU C 41 83.998 6.150 -2.993 1.00 0.00 C ATOM 0 H LEU C 41 83.743 9.152 -5.192 1.00 0.00 H new ATOM 0 HA LEU C 41 83.615 8.326 -2.407 1.00 0.00 H new ATOM 0 HB2 LEU C 41 85.887 8.638 -4.421 1.00 0.00 H new ATOM 0 HB3 LEU C 41 86.159 8.172 -2.753 1.00 0.00 H new ATOM 0 HG LEU C 41 84.748 6.646 -4.947 1.00 0.00 H new ATOM 0 HD11 LEU C 41 86.127 4.799 -3.985 1.00 0.00 H new ATOM 0 HD12 LEU C 41 87.139 6.204 -4.396 1.00 0.00 H new ATOM 0 HD13 LEU C 41 86.690 5.896 -2.702 1.00 0.00 H new ATOM 0 HD21 LEU C 41 83.776 5.116 -3.258 1.00 0.00 H new ATOM 0 HD22 LEU C 41 84.337 6.195 -1.958 1.00 0.00 H new ATOM 0 HD23 LEU C 41 83.098 6.755 -3.107 1.00 0.00 H new ATOM 635 N GLY C 42 85.063 11.140 -3.405 1.00 0.00 N ATOM 636 CA GLY C 42 85.515 12.455 -2.962 1.00 0.00 C ATOM 637 C GLY C 42 84.605 13.022 -1.874 1.00 0.00 C ATOM 638 O GLY C 42 85.066 13.699 -0.955 1.00 0.00 O ATOM 0 H GLY C 42 85.144 10.980 -4.409 1.00 0.00 H new ATOM 0 HA2 GLY C 42 86.535 12.382 -2.584 1.00 0.00 H new ATOM 0 HA3 GLY C 42 85.538 13.138 -3.811 1.00 0.00 H new ATOM 642 N LYS C 43 83.307 12.748 -1.991 1.00 0.00 N ATOM 643 CA LYS C 43 82.344 13.251 -1.012 1.00 0.00 C ATOM 644 C LYS C 43 82.445 12.480 0.303 1.00 0.00 C ATOM 645 O LYS C 43 82.345 13.061 1.384 1.00 0.00 O ATOM 646 CB LYS C 43 80.915 13.140 -1.549 1.00 0.00 C ATOM 647 CG LYS C 43 80.581 11.676 -1.836 1.00 0.00 C ATOM 648 CD LYS C 43 79.312 11.602 -2.690 1.00 0.00 C ATOM 649 CE LYS C 43 79.539 12.345 -4.008 1.00 0.00 C ATOM 650 NZ LYS C 43 78.731 13.598 -4.018 1.00 0.00 N ATOM 0 H LYS C 43 82.902 12.189 -2.742 1.00 0.00 H new ATOM 0 HA LYS C 43 82.582 14.299 -0.831 1.00 0.00 H new ATOM 0 HB2 LYS C 43 80.211 13.547 -0.823 1.00 0.00 H new ATOM 0 HB3 LYS C 43 80.812 13.731 -2.459 1.00 0.00 H new ATOM 0 HG2 LYS C 43 81.411 11.197 -2.356 1.00 0.00 H new ATOM 0 HG3 LYS C 43 80.436 11.135 -0.901 1.00 0.00 H new ATOM 0 HD2 LYS C 43 79.054 10.562 -2.887 1.00 0.00 H new ATOM 0 HD3 LYS C 43 78.473 12.043 -2.152 1.00 0.00 H new ATOM 0 HE2 LYS C 43 80.596 12.581 -4.127 1.00 0.00 H new ATOM 0 HE3 LYS C 43 79.257 11.711 -4.848 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 79.110 14.250 -4.734 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 77.742 13.371 -4.246 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 78.776 14.048 -3.081 1.00 0.00 H new ATOM 664 N VAL C 44 82.641 11.167 0.206 1.00 0.00 N ATOM 665 CA VAL C 44 82.749 10.336 1.406 1.00 0.00 C ATOM 666 C VAL C 44 84.121 10.507 2.052 1.00 0.00 C ATOM 667 O VAL C 44 84.229 10.795 3.244 1.00 0.00 O ATOM 668 CB VAL C 44 82.538 8.859 1.063 1.00 0.00 C ATOM 669 CG1 VAL C 44 82.861 7.997 2.286 1.00 0.00 C ATOM 670 CG2 VAL C 44 81.079 8.634 0.656 1.00 0.00 C ATOM 0 H VAL C 44 82.727 10.661 -0.675 1.00 0.00 H new ATOM 0 HA VAL C 44 81.976 10.657 2.104 1.00 0.00 H new ATOM 0 HB VAL C 44 83.195 8.582 0.239 1.00 0.00 H new ATOM 0 HG11 VAL C 44 82.710 6.946 2.040 1.00 0.00 H new ATOM 0 HG12 VAL C 44 83.899 8.156 2.579 1.00 0.00 H new ATOM 0 HG13 VAL C 44 82.204 8.275 3.110 1.00 0.00 H new ATOM 0 HG21 VAL C 44 80.927 7.583 0.411 1.00 0.00 H new ATOM 0 HG22 VAL C 44 80.424 8.913 1.481 1.00 0.00 H new ATOM 0 HG23 VAL C 44 80.846 9.246 -0.215 1.00 0.00 H new ATOM 680 N MET C 45 85.168 10.328 1.252 1.00 0.00 N ATOM 681 CA MET C 45 86.532 10.467 1.758 1.00 0.00 C ATOM 682 C MET C 45 86.643 11.702 2.642 1.00 0.00 C ATOM 683 O MET C 45 87.147 11.642 3.763 1.00 0.00 O ATOM 684 CB MET C 45 87.523 10.600 0.602 1.00 0.00 C ATOM 685 CG MET C 45 87.701 9.242 -0.073 1.00 0.00 C ATOM 686 SD MET C 45 89.189 8.440 0.572 1.00 0.00 S ATOM 687 CE MET C 45 88.387 7.519 1.908 1.00 0.00 C ATOM 0 H MET C 45 85.102 10.089 0.263 1.00 0.00 H new ATOM 0 HA MET C 45 86.768 9.575 2.338 1.00 0.00 H new ATOM 0 HB2 MET C 45 87.161 11.332 -0.120 1.00 0.00 H new ATOM 0 HB3 MET C 45 88.482 10.964 0.971 1.00 0.00 H new ATOM 0 HG2 MET C 45 86.828 8.615 0.111 1.00 0.00 H new ATOM 0 HG3 MET C 45 87.782 9.368 -1.153 1.00 0.00 H new ATOM 0 HE1 MET C 45 88.957 6.615 2.120 1.00 0.00 H new ATOM 0 HE2 MET C 45 88.345 8.139 2.803 1.00 0.00 H new ATOM 0 HE3 MET C 45 87.375 7.248 1.607 1.00 0.00 H new ATOM 697 N ARG C 46 86.166 12.824 2.118 1.00 0.00 N ATOM 698 CA ARG C 46 86.212 14.081 2.855 1.00 0.00 C ATOM 699 C ARG C 46 85.719 13.887 4.287 1.00 0.00 C ATOM 700 O ARG C 46 86.212 14.523 5.219 1.00 0.00 O ATOM 701 CB ARG C 46 85.336 15.126 2.167 1.00 0.00 C ATOM 702 CG ARG C 46 86.062 16.470 2.146 1.00 0.00 C ATOM 703 CD ARG C 46 85.031 17.594 2.212 1.00 0.00 C ATOM 704 NE ARG C 46 85.492 18.668 3.089 1.00 0.00 N ATOM 705 CZ ARG C 46 84.633 19.507 3.663 1.00 0.00 C ATOM 706 NH1 ARG C 46 83.352 19.386 3.444 1.00 0.00 N ATOM 707 NH2 ARG C 46 85.071 20.454 4.446 1.00 0.00 N ATOM 0 H ARG C 46 85.745 12.890 1.191 1.00 0.00 H new ATOM 0 HA ARG C 46 87.247 14.421 2.875 1.00 0.00 H new ATOM 0 HB2 ARG C 46 85.106 14.810 1.150 1.00 0.00 H new ATOM 0 HB3 ARG C 46 84.386 15.222 2.693 1.00 0.00 H new ATOM 0 HG2 ARG C 46 86.749 16.540 2.989 1.00 0.00 H new ATOM 0 HG3 ARG C 46 86.660 16.561 1.239 1.00 0.00 H new ATOM 0 HD2 ARG C 46 84.850 17.987 1.212 1.00 0.00 H new ATOM 0 HD3 ARG C 46 84.082 17.202 2.577 1.00 0.00 H new ATOM 0 HE ARG C 46 86.491 18.777 3.265 1.00 0.00 H new ATOM 0 HH11 ARG C 46 83.007 18.647 2.832 1.00 0.00 H new ATOM 0 HH12 ARG C 46 82.696 20.030 3.885 1.00 0.00 H new ATOM 0 HH21 ARG C 46 86.072 20.551 4.618 1.00 0.00 H new ATOM 0 HH22 ARG C 46 84.413 21.097 4.886 1.00 0.00 H new ATOM 721 N MET C 47 84.736 13.007 4.451 1.00 0.00 N ATOM 722 CA MET C 47 84.178 12.741 5.775 1.00 0.00 C ATOM 723 C MET C 47 85.117 11.856 6.591 1.00 0.00 C ATOM 724 O MET C 47 84.966 11.721 7.806 1.00 0.00 O ATOM 725 CB MET C 47 82.820 12.047 5.653 1.00 0.00 C ATOM 726 CG MET C 47 81.949 12.801 4.646 1.00 0.00 C ATOM 727 SD MET C 47 80.213 12.682 5.142 1.00 0.00 S ATOM 728 CE MET C 47 79.875 11.068 4.397 1.00 0.00 C ATOM 0 H MET C 47 84.312 12.471 3.694 1.00 0.00 H new ATOM 0 HA MET C 47 84.055 13.698 6.282 1.00 0.00 H new ATOM 0 HB2 MET C 47 82.955 11.014 5.331 1.00 0.00 H new ATOM 0 HB3 MET C 47 82.327 12.016 6.625 1.00 0.00 H new ATOM 0 HG2 MET C 47 82.253 13.846 4.597 1.00 0.00 H new ATOM 0 HG3 MET C 47 82.083 12.383 3.648 1.00 0.00 H new ATOM 0 HE1 MET C 47 79.245 10.483 5.067 1.00 0.00 H new ATOM 0 HE2 MET C 47 79.362 11.207 3.445 1.00 0.00 H new ATOM 0 HE3 MET C 47 80.814 10.541 4.229 1.00 0.00 H new ATOM 738 N LEU C 48 86.087 11.252 5.910 1.00 0.00 N ATOM 739 CA LEU C 48 87.045 10.376 6.582 1.00 0.00 C ATOM 740 C LEU C 48 88.310 11.144 6.957 1.00 0.00 C ATOM 741 O LEU C 48 89.326 10.553 7.320 1.00 0.00 O ATOM 742 CB LEU C 48 87.427 9.207 5.674 1.00 0.00 C ATOM 743 CG LEU C 48 86.466 8.042 5.912 1.00 0.00 C ATOM 744 CD1 LEU C 48 85.035 8.488 5.604 1.00 0.00 C ATOM 745 CD2 LEU C 48 86.842 6.877 4.995 1.00 0.00 C ATOM 0 H LEU C 48 86.231 11.350 4.905 1.00 0.00 H new ATOM 0 HA LEU C 48 86.571 9.998 7.488 1.00 0.00 H new ATOM 0 HB2 LEU C 48 87.389 9.516 4.630 1.00 0.00 H new ATOM 0 HB3 LEU C 48 88.451 8.895 5.877 1.00 0.00 H new ATOM 0 HG LEU C 48 86.532 7.725 6.953 1.00 0.00 H new ATOM 0 HD11 LEU C 48 84.350 7.657 5.774 1.00 0.00 H new ATOM 0 HD12 LEU C 48 84.765 9.320 6.255 1.00 0.00 H new ATOM 0 HD13 LEU C 48 84.969 8.806 4.563 1.00 0.00 H new ATOM 0 HD21 LEU C 48 86.158 6.046 5.164 1.00 0.00 H new ATOM 0 HD22 LEU C 48 86.776 7.196 3.955 1.00 0.00 H new ATOM 0 HD23 LEU C 48 87.861 6.558 5.212 1.00 0.00 H new ATOM 757 N GLY C 49 88.236 12.469 6.868 1.00 0.00 N ATOM 758 CA GLY C 49 89.383 13.309 7.203 1.00 0.00 C ATOM 759 C GLY C 49 90.390 13.331 6.058 1.00 0.00 C ATOM 760 O GLY C 49 91.545 13.717 6.235 1.00 0.00 O ATOM 0 H GLY C 49 87.405 12.980 6.571 1.00 0.00 H new ATOM 0 HA2 GLY C 49 89.047 14.323 7.417 1.00 0.00 H new ATOM 0 HA3 GLY C 49 89.862 12.934 8.108 1.00 0.00 H new ATOM 764 N GLN C 50 89.937 12.914 4.881 1.00 0.00 N ATOM 765 CA GLN C 50 90.804 12.890 3.707 1.00 0.00 C ATOM 766 C GLN C 50 90.101 13.534 2.516 1.00 0.00 C ATOM 767 O GLN C 50 88.924 13.278 2.259 1.00 0.00 O ATOM 768 CB GLN C 50 91.180 11.451 3.348 1.00 0.00 C ATOM 769 CG GLN C 50 92.377 11.008 4.194 1.00 0.00 C ATOM 770 CD GLN C 50 92.919 9.690 3.653 1.00 0.00 C ATOM 771 OE1 GLN C 50 92.388 8.622 3.957 1.00 0.00 O ATOM 772 NE2 GLN C 50 93.956 9.700 2.861 1.00 0.00 N ATOM 0 H GLN C 50 88.984 12.591 4.714 1.00 0.00 H new ATOM 0 HA GLN C 50 91.708 13.451 3.943 1.00 0.00 H new ATOM 0 HB2 GLN C 50 90.333 10.788 3.523 1.00 0.00 H new ATOM 0 HB3 GLN C 50 91.425 11.382 2.288 1.00 0.00 H new ATOM 0 HG2 GLN C 50 93.155 11.771 4.171 1.00 0.00 H new ATOM 0 HG3 GLN C 50 92.077 10.891 5.235 1.00 0.00 H new ATOM 0 HE21 GLN C 50 94.396 10.585 2.609 1.00 0.00 H new ATOM 0 HE22 GLN C 50 94.326 8.823 2.494 1.00 0.00 H new ATOM 781 N ASN C 51 90.834 14.378 1.796 1.00 0.00 N ATOM 782 CA ASN C 51 90.270 15.060 0.635 1.00 0.00 C ATOM 783 C ASN C 51 90.990 14.634 -0.641 1.00 0.00 C ATOM 784 O ASN C 51 91.897 15.318 -1.117 1.00 0.00 O ATOM 785 CB ASN C 51 90.394 16.577 0.794 1.00 0.00 C ATOM 786 CG ASN C 51 89.516 17.272 -0.241 1.00 0.00 C ATOM 787 OD1 ASN C 51 88.364 17.607 0.038 1.00 0.00 O ATOM 788 ND2 ASN C 51 89.995 17.510 -1.431 1.00 0.00 N ATOM 0 H ASN C 51 91.809 14.605 1.992 1.00 0.00 H new ATOM 0 HA ASN C 51 89.217 14.786 0.565 1.00 0.00 H new ATOM 0 HB2 ASN C 51 90.093 16.873 1.799 1.00 0.00 H new ATOM 0 HB3 ASN C 51 91.433 16.882 0.669 1.00 0.00 H new ATOM 0 HD21 ASN C 51 89.415 17.974 -2.131 1.00 0.00 H new ATOM 0 HD22 ASN C 51 90.949 17.232 -1.662 1.00 0.00 H new ATOM 795 N PRO C 52 90.585 13.499 -1.203 1.00 0.00 N ATOM 796 CA PRO C 52 91.187 12.967 -2.439 1.00 0.00 C ATOM 797 C PRO C 52 90.642 13.650 -3.692 1.00 0.00 C ATOM 798 O PRO C 52 89.733 14.477 -3.617 1.00 0.00 O ATOM 799 CB PRO C 52 90.775 11.501 -2.392 1.00 0.00 C ATOM 800 CG PRO C 52 89.528 11.416 -1.518 1.00 0.00 C ATOM 801 CD PRO C 52 89.498 12.674 -0.642 1.00 0.00 C ATOM 0 HA PRO C 52 92.264 13.127 -2.490 1.00 0.00 H new ATOM 0 HB2 PRO C 52 90.570 11.126 -3.395 1.00 0.00 H new ATOM 0 HB3 PRO C 52 91.577 10.888 -1.980 1.00 0.00 H new ATOM 0 HG2 PRO C 52 88.631 11.355 -2.134 1.00 0.00 H new ATOM 0 HG3 PRO C 52 89.552 10.518 -0.900 1.00 0.00 H new ATOM 0 HD2 PRO C 52 88.535 13.182 -0.700 1.00 0.00 H new ATOM 0 HD3 PRO C 52 89.672 12.438 0.408 1.00 0.00 H new ATOM 809 N THR C 53 91.209 13.301 -4.844 1.00 0.00 N ATOM 810 CA THR C 53 90.772 13.893 -6.103 1.00 0.00 C ATOM 811 C THR C 53 90.118 12.841 -6.989 1.00 0.00 C ATOM 812 O THR C 53 90.243 11.639 -6.749 1.00 0.00 O ATOM 813 CB THR C 53 91.964 14.497 -6.848 1.00 0.00 C ATOM 814 OG1 THR C 53 93.164 14.164 -6.164 1.00 0.00 O ATOM 815 CG2 THR C 53 91.816 16.018 -6.910 1.00 0.00 C ATOM 0 H THR C 53 91.963 12.620 -4.931 1.00 0.00 H new ATOM 0 HA THR C 53 90.048 14.675 -5.874 1.00 0.00 H new ATOM 0 HB THR C 53 91.998 14.098 -7.862 1.00 0.00 H new ATOM 0 HG1 THR C 53 93.929 14.548 -6.640 1.00 0.00 H new ATOM 0 HG21 THR C 53 92.667 16.445 -7.441 1.00 0.00 H new ATOM 0 HG22 THR C 53 90.895 16.273 -7.435 1.00 0.00 H new ATOM 0 HG23 THR C 53 91.780 16.422 -5.898 1.00 0.00 H new ATOM 823 N PRO C 54 89.425 13.290 -8.032 1.00 0.00 N ATOM 824 CA PRO C 54 88.751 12.387 -8.980 1.00 0.00 C ATOM 825 C PRO C 54 89.736 11.759 -9.959 1.00 0.00 C ATOM 826 O PRO C 54 89.421 10.791 -10.651 1.00 0.00 O ATOM 827 CB PRO C 54 87.787 13.326 -9.694 1.00 0.00 C ATOM 828 CG PRO C 54 88.357 14.732 -9.556 1.00 0.00 C ATOM 829 CD PRO C 54 89.276 14.728 -8.331 1.00 0.00 C ATOM 0 HA PRO C 54 88.263 11.541 -8.496 1.00 0.00 H new ATOM 0 HB2 PRO C 54 87.686 13.051 -10.744 1.00 0.00 H new ATOM 0 HB3 PRO C 54 86.792 13.267 -9.252 1.00 0.00 H new ATOM 0 HG2 PRO C 54 88.911 15.013 -10.452 1.00 0.00 H new ATOM 0 HG3 PRO C 54 87.557 15.462 -9.434 1.00 0.00 H new ATOM 0 HD2 PRO C 54 90.236 15.197 -8.545 1.00 0.00 H new ATOM 0 HD3 PRO C 54 88.836 15.271 -7.494 1.00 0.00 H new ATOM 837 N GLU C 55 90.941 12.322 -9.996 1.00 0.00 N ATOM 838 CA GLU C 55 91.985 11.815 -10.879 1.00 0.00 C ATOM 839 C GLU C 55 92.741 10.683 -10.193 1.00 0.00 C ATOM 840 O GLU C 55 93.197 9.740 -10.839 1.00 0.00 O ATOM 841 CB GLU C 55 92.967 12.931 -11.242 1.00 0.00 C ATOM 842 CG GLU C 55 92.208 14.075 -11.917 1.00 0.00 C ATOM 843 CD GLU C 55 92.232 13.881 -13.429 1.00 0.00 C ATOM 844 OE1 GLU C 55 93.314 13.717 -13.968 1.00 0.00 O ATOM 845 OE2 GLU C 55 91.168 13.898 -14.026 1.00 0.00 O ATOM 0 H GLU C 55 91.217 13.124 -9.429 1.00 0.00 H new ATOM 0 HA GLU C 55 91.516 11.443 -11.790 1.00 0.00 H new ATOM 0 HB2 GLU C 55 93.471 13.293 -10.346 1.00 0.00 H new ATOM 0 HB3 GLU C 55 93.739 12.548 -11.909 1.00 0.00 H new ATOM 0 HG2 GLU C 55 91.179 14.103 -11.560 1.00 0.00 H new ATOM 0 HG3 GLU C 55 92.662 15.031 -11.655 1.00 0.00 H new ATOM 852 N GLU C 56 92.858 10.785 -8.870 1.00 0.00 N ATOM 853 CA GLU C 56 93.551 9.760 -8.097 1.00 0.00 C ATOM 854 C GLU C 56 92.564 8.684 -7.656 1.00 0.00 C ATOM 855 O GLU C 56 92.929 7.525 -7.463 1.00 0.00 O ATOM 856 CB GLU C 56 94.207 10.373 -6.858 1.00 0.00 C ATOM 857 CG GLU C 56 95.609 10.868 -7.217 1.00 0.00 C ATOM 858 CD GLU C 56 96.572 9.686 -7.256 1.00 0.00 C ATOM 859 OE1 GLU C 56 96.309 8.711 -6.572 1.00 0.00 O ATOM 860 OE2 GLU C 56 97.557 9.774 -7.971 1.00 0.00 O ATOM 0 H GLU C 56 92.486 11.558 -8.318 1.00 0.00 H new ATOM 0 HA GLU C 56 94.321 9.318 -8.729 1.00 0.00 H new ATOM 0 HB2 GLU C 56 93.602 11.199 -6.484 1.00 0.00 H new ATOM 0 HB3 GLU C 56 94.264 9.633 -6.060 1.00 0.00 H new ATOM 0 HG2 GLU C 56 95.592 11.369 -8.185 1.00 0.00 H new ATOM 0 HG3 GLU C 56 95.946 11.601 -6.484 1.00 0.00 H new ATOM 867 N LEU C 57 91.306 9.087 -7.502 1.00 0.00 N ATOM 868 CA LEU C 57 90.261 8.157 -7.085 1.00 0.00 C ATOM 869 C LEU C 57 89.976 7.147 -8.193 1.00 0.00 C ATOM 870 O LEU C 57 89.578 6.012 -7.931 1.00 0.00 O ATOM 871 CB LEU C 57 88.973 8.914 -6.754 1.00 0.00 C ATOM 872 CG LEU C 57 88.888 9.154 -5.244 1.00 0.00 C ATOM 873 CD1 LEU C 57 88.045 10.402 -4.970 1.00 0.00 C ATOM 874 CD2 LEU C 57 88.237 7.942 -4.570 1.00 0.00 C ATOM 0 H LEU C 57 90.987 10.043 -7.658 1.00 0.00 H new ATOM 0 HA LEU C 57 90.610 7.632 -6.196 1.00 0.00 H new ATOM 0 HB2 LEU C 57 88.953 9.866 -7.285 1.00 0.00 H new ATOM 0 HB3 LEU C 57 88.108 8.343 -7.090 1.00 0.00 H new ATOM 0 HG LEU C 57 89.891 9.299 -4.844 1.00 0.00 H new ATOM 0 HD11 LEU C 57 87.985 10.572 -3.895 1.00 0.00 H new ATOM 0 HD12 LEU C 57 88.507 11.265 -5.449 1.00 0.00 H new ATOM 0 HD13 LEU C 57 87.042 10.259 -5.371 1.00 0.00 H new ATOM 0 HD21 LEU C 57 88.176 8.112 -3.495 1.00 0.00 H new ATOM 0 HD22 LEU C 57 87.234 7.797 -4.972 1.00 0.00 H new ATOM 0 HD23 LEU C 57 88.837 7.053 -4.763 1.00 0.00 H new ATOM 886 N GLN C 58 90.186 7.574 -9.436 1.00 0.00 N ATOM 887 CA GLN C 58 89.951 6.700 -10.582 1.00 0.00 C ATOM 888 C GLN C 58 90.930 5.531 -10.569 1.00 0.00 C ATOM 889 O GLN C 58 90.729 4.524 -11.248 1.00 0.00 O ATOM 890 CB GLN C 58 90.122 7.475 -11.891 1.00 0.00 C ATOM 891 CG GLN C 58 89.992 6.514 -13.074 1.00 0.00 C ATOM 892 CD GLN C 58 88.613 5.865 -13.053 1.00 0.00 C ATOM 893 OE1 GLN C 58 87.595 6.549 -13.169 1.00 0.00 O ATOM 894 NE2 GLN C 58 88.517 4.572 -12.908 1.00 0.00 N ATOM 0 H GLN C 58 90.515 8.510 -9.674 1.00 0.00 H new ATOM 0 HA GLN C 58 88.931 6.323 -10.513 1.00 0.00 H new ATOM 0 HB2 GLN C 58 89.369 8.260 -11.962 1.00 0.00 H new ATOM 0 HB3 GLN C 58 91.096 7.964 -11.912 1.00 0.00 H new ATOM 0 HG2 GLN C 58 90.138 7.052 -14.011 1.00 0.00 H new ATOM 0 HG3 GLN C 58 90.767 5.749 -13.021 1.00 0.00 H new ATOM 0 HE21 GLN C 58 89.360 4.006 -12.812 1.00 0.00 H new ATOM 0 HE22 GLN C 58 87.599 4.128 -12.891 1.00 0.00 H new ATOM 903 N GLU C 59 91.997 5.679 -9.789 1.00 0.00 N ATOM 904 CA GLU C 59 93.011 4.632 -9.692 1.00 0.00 C ATOM 905 C GLU C 59 92.542 3.511 -8.769 1.00 0.00 C ATOM 906 O GLU C 59 93.114 2.421 -8.754 1.00 0.00 O ATOM 907 CB GLU C 59 94.320 5.207 -9.150 1.00 0.00 C ATOM 908 CG GLU C 59 95.397 4.121 -9.160 1.00 0.00 C ATOM 909 CD GLU C 59 95.495 3.491 -7.775 1.00 0.00 C ATOM 910 OE1 GLU C 59 94.617 3.744 -6.967 1.00 0.00 O ATOM 911 OE2 GLU C 59 96.447 2.763 -7.543 1.00 0.00 O ATOM 0 H GLU C 59 92.182 6.505 -9.220 1.00 0.00 H new ATOM 0 HA GLU C 59 93.174 4.231 -10.692 1.00 0.00 H new ATOM 0 HB2 GLU C 59 94.637 6.054 -9.758 1.00 0.00 H new ATOM 0 HB3 GLU C 59 94.174 5.580 -8.136 1.00 0.00 H new ATOM 0 HG2 GLU C 59 95.154 3.360 -9.901 1.00 0.00 H new ATOM 0 HG3 GLU C 59 96.358 4.549 -9.446 1.00 0.00 H new ATOM 918 N MET C 60 91.495 3.792 -7.997 1.00 0.00 N ATOM 919 CA MET C 60 90.956 2.799 -7.071 1.00 0.00 C ATOM 920 C MET C 60 89.914 1.927 -7.767 1.00 0.00 C ATOM 921 O MET C 60 89.857 0.715 -7.558 1.00 0.00 O ATOM 922 CB MET C 60 90.306 3.484 -5.866 1.00 0.00 C ATOM 923 CG MET C 60 91.377 3.806 -4.821 1.00 0.00 C ATOM 924 SD MET C 60 91.389 5.588 -4.498 1.00 0.00 S ATOM 925 CE MET C 60 90.891 5.507 -2.760 1.00 0.00 C ATOM 0 H MET C 60 91.008 4.688 -7.993 1.00 0.00 H new ATOM 0 HA MET C 60 91.783 2.176 -6.732 1.00 0.00 H new ATOM 0 HB2 MET C 60 89.804 4.399 -6.182 1.00 0.00 H new ATOM 0 HB3 MET C 60 89.544 2.836 -5.433 1.00 0.00 H new ATOM 0 HG2 MET C 60 91.177 3.260 -3.899 1.00 0.00 H new ATOM 0 HG3 MET C 60 92.356 3.483 -5.176 1.00 0.00 H new ATOM 0 HE1 MET C 60 89.957 6.053 -2.623 1.00 0.00 H new ATOM 0 HE2 MET C 60 90.748 4.466 -2.471 1.00 0.00 H new ATOM 0 HE3 MET C 60 91.667 5.954 -2.138 1.00 0.00 H new ATOM 935 N ILE C 61 89.091 2.558 -8.598 1.00 0.00 N ATOM 936 CA ILE C 61 88.051 1.835 -9.326 1.00 0.00 C ATOM 937 C ILE C 61 88.681 0.809 -10.268 1.00 0.00 C ATOM 938 O ILE C 61 88.266 -0.349 -10.315 1.00 0.00 O ATOM 939 CB ILE C 61 87.188 2.821 -10.129 1.00 0.00 C ATOM 940 CG1 ILE C 61 86.149 3.473 -9.206 1.00 0.00 C ATOM 941 CG2 ILE C 61 86.456 2.088 -11.258 1.00 0.00 C ATOM 942 CD1 ILE C 61 86.785 3.823 -7.857 1.00 0.00 C ATOM 0 H ILE C 61 89.122 3.560 -8.784 1.00 0.00 H new ATOM 0 HA ILE C 61 87.420 1.313 -8.607 1.00 0.00 H new ATOM 0 HB ILE C 61 87.839 3.585 -10.554 1.00 0.00 H new ATOM 0 HG12 ILE C 61 85.751 4.374 -9.673 1.00 0.00 H new ATOM 0 HG13 ILE C 61 85.309 2.795 -9.055 1.00 0.00 H new ATOM 0 HG21 ILE C 61 85.848 2.798 -11.819 1.00 0.00 H new ATOM 0 HG22 ILE C 61 87.185 1.628 -11.925 1.00 0.00 H new ATOM 0 HG23 ILE C 61 85.814 1.316 -10.834 1.00 0.00 H new ATOM 0 HD11 ILE C 61 86.038 4.285 -7.211 1.00 0.00 H new ATOM 0 HD12 ILE C 61 87.161 2.915 -7.385 1.00 0.00 H new ATOM 0 HD13 ILE C 61 87.609 4.519 -8.013 1.00 0.00 H new ATOM 954 N ASP C 62 89.687 1.248 -11.020 1.00 0.00 N ATOM 955 CA ASP C 62 90.365 0.360 -11.961 1.00 0.00 C ATOM 956 C ASP C 62 90.812 -0.922 -11.261 1.00 0.00 C ATOM 957 O ASP C 62 91.052 -1.945 -11.902 1.00 0.00 O ATOM 958 CB ASP C 62 91.588 1.052 -12.567 1.00 0.00 C ATOM 959 CG ASP C 62 91.254 1.538 -13.974 1.00 0.00 C ATOM 960 OD1 ASP C 62 90.979 0.702 -14.819 1.00 0.00 O ATOM 961 OD2 ASP C 62 91.278 2.740 -14.186 1.00 0.00 O ATOM 0 H ASP C 62 90.048 2.202 -10.998 1.00 0.00 H new ATOM 0 HA ASP C 62 89.660 0.112 -12.754 1.00 0.00 H new ATOM 0 HB2 ASP C 62 91.890 1.893 -11.943 1.00 0.00 H new ATOM 0 HB3 ASP C 62 92.431 0.361 -12.600 1.00 0.00 H new ATOM 966 N GLU C 63 90.922 -0.852 -9.937 1.00 0.00 N ATOM 967 CA GLU C 63 91.342 -2.013 -9.154 1.00 0.00 C ATOM 968 C GLU C 63 90.153 -2.924 -8.866 1.00 0.00 C ATOM 969 O GLU C 63 90.320 -4.088 -8.502 1.00 0.00 O ATOM 970 CB GLU C 63 91.957 -1.570 -7.824 1.00 0.00 C ATOM 971 CG GLU C 63 92.626 -0.205 -7.994 1.00 0.00 C ATOM 972 CD GLU C 63 93.470 0.106 -6.763 1.00 0.00 C ATOM 973 OE1 GLU C 63 92.904 0.182 -5.685 1.00 0.00 O ATOM 974 OE2 GLU C 63 94.670 0.264 -6.916 1.00 0.00 O ATOM 0 H GLU C 63 90.729 -0.014 -9.388 1.00 0.00 H new ATOM 0 HA GLU C 63 92.085 -2.556 -9.737 1.00 0.00 H new ATOM 0 HB2 GLU C 63 91.185 -1.514 -7.056 1.00 0.00 H new ATOM 0 HB3 GLU C 63 92.689 -2.305 -7.488 1.00 0.00 H new ATOM 0 HG2 GLU C 63 93.252 -0.204 -8.887 1.00 0.00 H new ATOM 0 HG3 GLU C 63 91.870 0.567 -8.134 1.00 0.00 H new ATOM 981 N VAL C 64 88.949 -2.382 -9.029 1.00 0.00 N ATOM 982 CA VAL C 64 87.738 -3.158 -8.778 1.00 0.00 C ATOM 983 C VAL C 64 86.925 -3.318 -10.059 1.00 0.00 C ATOM 984 O VAL C 64 86.026 -4.154 -10.138 1.00 0.00 O ATOM 985 CB VAL C 64 86.872 -2.472 -7.721 1.00 0.00 C ATOM 986 CG1 VAL C 64 87.565 -2.558 -6.361 1.00 0.00 C ATOM 987 CG2 VAL C 64 86.675 -1.002 -8.099 1.00 0.00 C ATOM 0 H VAL C 64 88.786 -1.421 -9.330 1.00 0.00 H new ATOM 0 HA VAL C 64 88.041 -4.141 -8.418 1.00 0.00 H new ATOM 0 HB VAL C 64 85.903 -2.968 -7.668 1.00 0.00 H new ATOM 0 HG11 VAL C 64 86.948 -2.069 -5.607 1.00 0.00 H new ATOM 0 HG12 VAL C 64 87.707 -3.604 -6.091 1.00 0.00 H new ATOM 0 HG13 VAL C 64 88.534 -2.062 -6.414 1.00 0.00 H new ATOM 0 HG21 VAL C 64 86.058 -0.512 -7.346 1.00 0.00 H new ATOM 0 HG22 VAL C 64 87.645 -0.507 -8.152 1.00 0.00 H new ATOM 0 HG23 VAL C 64 86.182 -0.939 -9.069 1.00 0.00 H new ATOM 997 N ASP C 65 87.250 -2.507 -11.061 1.00 0.00 N ATOM 998 CA ASP C 65 86.537 -2.570 -12.335 1.00 0.00 C ATOM 999 C ASP C 65 87.086 -3.701 -13.198 1.00 0.00 C ATOM 1000 O ASP C 65 87.783 -3.467 -14.185 1.00 0.00 O ATOM 1001 CB ASP C 65 86.674 -1.251 -13.096 1.00 0.00 C ATOM 1002 CG ASP C 65 85.321 -0.551 -13.147 1.00 0.00 C ATOM 1003 OD1 ASP C 65 84.447 -0.938 -12.388 1.00 0.00 O ATOM 1004 OD2 ASP C 65 85.177 0.361 -13.945 1.00 0.00 O ATOM 0 H ASP C 65 87.991 -1.808 -11.019 1.00 0.00 H new ATOM 0 HA ASP C 65 85.484 -2.754 -12.120 1.00 0.00 H new ATOM 0 HB2 ASP C 65 87.408 -0.611 -12.607 1.00 0.00 H new ATOM 0 HB3 ASP C 65 87.037 -1.438 -14.107 1.00 0.00 H new ATOM 1009 N GLU C 66 86.757 -4.932 -12.817 1.00 0.00 N ATOM 1010 CA GLU C 66 87.216 -6.100 -13.565 1.00 0.00 C ATOM 1011 C GLU C 66 86.213 -6.455 -14.659 1.00 0.00 C ATOM 1012 O GLU C 66 86.511 -7.234 -15.565 1.00 0.00 O ATOM 1013 CB GLU C 66 87.388 -7.301 -12.633 1.00 0.00 C ATOM 1014 CG GLU C 66 88.865 -7.697 -12.581 1.00 0.00 C ATOM 1015 CD GLU C 66 88.997 -9.207 -12.747 1.00 0.00 C ATOM 1016 OE1 GLU C 66 88.357 -9.744 -13.636 1.00 0.00 O ATOM 1017 OE2 GLU C 66 89.738 -9.805 -11.983 1.00 0.00 O ATOM 0 H GLU C 66 86.180 -5.146 -12.003 1.00 0.00 H new ATOM 0 HA GLU C 66 88.177 -5.856 -14.017 1.00 0.00 H new ATOM 0 HB2 GLU C 66 87.031 -7.053 -11.633 1.00 0.00 H new ATOM 0 HB3 GLU C 66 86.788 -8.139 -12.987 1.00 0.00 H new ATOM 0 HG2 GLU C 66 89.417 -7.185 -13.369 1.00 0.00 H new ATOM 0 HG3 GLU C 66 89.302 -7.386 -11.632 1.00 0.00 H new ATOM 1024 N ASP C 67 85.020 -5.874 -14.564 1.00 0.00 N ATOM 1025 CA ASP C 67 83.974 -6.133 -15.550 1.00 0.00 C ATOM 1026 C ASP C 67 83.854 -4.966 -16.527 1.00 0.00 C ATOM 1027 O ASP C 67 83.160 -5.056 -17.540 1.00 0.00 O ATOM 1028 CB ASP C 67 82.627 -6.343 -14.855 1.00 0.00 C ATOM 1029 CG ASP C 67 82.393 -5.221 -13.849 1.00 0.00 C ATOM 1030 OD1 ASP C 67 83.210 -4.316 -13.798 1.00 0.00 O ATOM 1031 OD2 ASP C 67 81.400 -5.283 -13.143 1.00 0.00 O ATOM 0 H ASP C 67 84.755 -5.227 -13.822 1.00 0.00 H new ATOM 0 HA ASP C 67 84.246 -7.035 -16.098 1.00 0.00 H new ATOM 0 HB2 ASP C 67 81.824 -6.358 -15.592 1.00 0.00 H new ATOM 0 HB3 ASP C 67 82.614 -7.308 -14.349 1.00 0.00 H new ATOM 1036 N GLY C 68 84.537 -3.867 -16.211 1.00 0.00 N ATOM 1037 CA GLY C 68 84.498 -2.686 -17.069 1.00 0.00 C ATOM 1038 C GLY C 68 83.174 -1.948 -16.908 1.00 0.00 C ATOM 1039 O GLY C 68 82.630 -1.399 -17.866 1.00 0.00 O ATOM 0 H GLY C 68 85.117 -3.770 -15.378 1.00 0.00 H new ATOM 0 HA2 GLY C 68 85.324 -2.021 -16.818 1.00 0.00 H new ATOM 0 HA3 GLY C 68 84.631 -2.982 -18.110 1.00 0.00 H new ATOM 1043 N SER C 69 82.662 -1.944 -15.681 1.00 0.00 N ATOM 1044 CA SER C 69 81.397 -1.273 -15.396 1.00 0.00 C ATOM 1045 C SER C 69 81.612 0.230 -15.257 1.00 0.00 C ATOM 1046 O SER C 69 80.726 1.029 -15.561 1.00 0.00 O ATOM 1047 CB SER C 69 80.785 -1.811 -14.103 1.00 0.00 C ATOM 1048 OG SER C 69 81.661 -1.534 -13.018 1.00 0.00 O ATOM 0 H SER C 69 83.098 -2.393 -14.875 1.00 0.00 H new ATOM 0 HA SER C 69 80.718 -1.468 -16.226 1.00 0.00 H new ATOM 0 HB2 SER C 69 79.813 -1.350 -13.928 1.00 0.00 H new ATOM 0 HB3 SER C 69 80.618 -2.885 -14.186 1.00 0.00 H new ATOM 1054 N GLY C 70 82.801 0.607 -14.795 1.00 0.00 N ATOM 1055 CA GLY C 70 83.127 2.020 -14.620 1.00 0.00 C ATOM 1056 C GLY C 70 82.829 2.477 -13.195 1.00 0.00 C ATOM 1057 O GLY C 70 83.136 3.607 -12.815 1.00 0.00 O ATOM 0 H GLY C 70 83.548 -0.038 -14.537 1.00 0.00 H new ATOM 0 HA2 GLY C 70 84.181 2.185 -14.846 1.00 0.00 H new ATOM 0 HA3 GLY C 70 82.552 2.620 -15.326 1.00 0.00 H new ATOM 1061 N THR C 71 82.228 1.587 -12.408 1.00 0.00 N ATOM 1062 CA THR C 71 81.894 1.915 -11.025 1.00 0.00 C ATOM 1063 C THR C 71 82.057 0.693 -10.126 1.00 0.00 C ATOM 1064 O THR C 71 82.004 -0.448 -10.585 1.00 0.00 O ATOM 1065 CB THR C 71 80.451 2.411 -10.925 1.00 0.00 C ATOM 1066 OG1 THR C 71 79.631 1.661 -11.809 1.00 0.00 O ATOM 1067 CG2 THR C 71 80.392 3.890 -11.303 1.00 0.00 C ATOM 0 H THR C 71 81.965 0.645 -12.700 1.00 0.00 H new ATOM 0 HA THR C 71 82.575 2.700 -10.697 1.00 0.00 H new ATOM 0 HB THR C 71 80.093 2.285 -9.903 1.00 0.00 H new ATOM 0 HG1 THR C 71 78.706 1.977 -11.744 1.00 0.00 H new ATOM 0 HG21 THR C 71 79.363 4.243 -11.232 1.00 0.00 H new ATOM 0 HG22 THR C 71 81.021 4.465 -10.623 1.00 0.00 H new ATOM 0 HG23 THR C 71 80.750 4.019 -12.325 1.00 0.00 H new ATOM 1075 N VAL C 72 82.253 0.952 -8.837 1.00 0.00 N ATOM 1076 CA VAL C 72 82.421 -0.126 -7.866 1.00 0.00 C ATOM 1077 C VAL C 72 81.074 -0.502 -7.256 1.00 0.00 C ATOM 1078 O VAL C 72 80.513 0.241 -6.451 1.00 0.00 O ATOM 1079 CB VAL C 72 83.373 0.308 -6.749 1.00 0.00 C ATOM 1080 CG1 VAL C 72 84.002 -0.926 -6.099 1.00 0.00 C ATOM 1081 CG2 VAL C 72 84.474 1.193 -7.338 1.00 0.00 C ATOM 0 H VAL C 72 82.299 1.891 -8.442 1.00 0.00 H new ATOM 0 HA VAL C 72 82.839 -0.989 -8.384 1.00 0.00 H new ATOM 0 HB VAL C 72 82.818 0.867 -5.996 1.00 0.00 H new ATOM 0 HG11 VAL C 72 84.679 -0.613 -5.304 1.00 0.00 H new ATOM 0 HG12 VAL C 72 83.218 -1.556 -5.680 1.00 0.00 H new ATOM 0 HG13 VAL C 72 84.558 -1.489 -6.849 1.00 0.00 H new ATOM 0 HG21 VAL C 72 85.154 1.504 -6.545 1.00 0.00 H new ATOM 0 HG22 VAL C 72 85.027 0.632 -8.091 1.00 0.00 H new ATOM 0 HG23 VAL C 72 84.026 2.074 -7.798 1.00 0.00 H new ATOM 1091 N ASP C 73 80.560 -1.663 -7.652 1.00 0.00 N ATOM 1092 CA ASP C 73 79.274 -2.128 -7.141 1.00 0.00 C ATOM 1093 C ASP C 73 79.387 -2.519 -5.670 1.00 0.00 C ATOM 1094 O ASP C 73 80.437 -2.361 -5.048 1.00 0.00 O ATOM 1095 CB ASP C 73 78.780 -3.338 -7.939 1.00 0.00 C ATOM 1096 CG ASP C 73 79.940 -4.298 -8.184 1.00 0.00 C ATOM 1097 OD1 ASP C 73 80.305 -5.003 -7.258 1.00 0.00 O ATOM 1098 OD2 ASP C 73 80.443 -4.315 -9.295 1.00 0.00 O ATOM 0 H ASP C 73 81.008 -2.293 -8.317 1.00 0.00 H new ATOM 0 HA ASP C 73 78.562 -1.309 -7.245 1.00 0.00 H new ATOM 0 HB2 ASP C 73 77.984 -3.845 -7.394 1.00 0.00 H new ATOM 0 HB3 ASP C 73 78.358 -3.012 -8.889 1.00 0.00 H new ATOM 1103 N PHE C 74 78.285 -3.028 -5.126 1.00 0.00 N ATOM 1104 CA PHE C 74 78.249 -3.442 -3.725 1.00 0.00 C ATOM 1105 C PHE C 74 79.048 -4.729 -3.519 1.00 0.00 C ATOM 1106 O PHE C 74 79.239 -5.183 -2.391 1.00 0.00 O ATOM 1107 CB PHE C 74 76.799 -3.676 -3.289 1.00 0.00 C ATOM 1108 CG PHE C 74 76.758 -4.158 -1.858 1.00 0.00 C ATOM 1109 CD1 PHE C 74 76.834 -5.528 -1.578 1.00 0.00 C ATOM 1110 CD2 PHE C 74 76.636 -3.236 -0.813 1.00 0.00 C ATOM 1111 CE1 PHE C 74 76.787 -5.975 -0.253 1.00 0.00 C ATOM 1112 CE2 PHE C 74 76.590 -3.683 0.513 1.00 0.00 C ATOM 1113 CZ PHE C 74 76.666 -5.052 0.793 1.00 0.00 C ATOM 0 H PHE C 74 77.409 -3.164 -5.630 1.00 0.00 H new ATOM 0 HA PHE C 74 78.694 -2.649 -3.124 1.00 0.00 H new ATOM 0 HB2 PHE C 74 76.228 -2.752 -3.386 1.00 0.00 H new ATOM 0 HB3 PHE C 74 76.329 -4.411 -3.942 1.00 0.00 H new ATOM 0 HD1 PHE C 74 76.929 -6.240 -2.385 1.00 0.00 H new ATOM 0 HD2 PHE C 74 76.577 -2.179 -1.029 1.00 0.00 H new ATOM 0 HE1 PHE C 74 76.844 -7.032 -0.037 1.00 0.00 H new ATOM 0 HE2 PHE C 74 76.496 -2.971 1.320 1.00 0.00 H new ATOM 0 HZ PHE C 74 76.631 -5.397 1.816 1.00 0.00 H new ATOM 1123 N ASP C 75 79.507 -5.317 -4.621 1.00 0.00 N ATOM 1124 CA ASP C 75 80.274 -6.558 -4.548 1.00 0.00 C ATOM 1125 C ASP C 75 81.774 -6.281 -4.446 1.00 0.00 C ATOM 1126 O ASP C 75 82.362 -6.345 -3.367 1.00 0.00 O ATOM 1127 CB ASP C 75 80.014 -7.414 -5.789 1.00 0.00 C ATOM 1128 CG ASP C 75 79.352 -8.724 -5.377 1.00 0.00 C ATOM 1129 OD1 ASP C 75 79.934 -9.431 -4.570 1.00 0.00 O ATOM 1130 OD2 ASP C 75 78.272 -9.001 -5.872 1.00 0.00 O ATOM 0 H ASP C 75 79.364 -4.959 -5.565 1.00 0.00 H new ATOM 0 HA ASP C 75 79.951 -7.089 -3.653 1.00 0.00 H new ATOM 0 HB2 ASP C 75 79.374 -6.875 -6.487 1.00 0.00 H new ATOM 0 HB3 ASP C 75 80.952 -7.616 -6.307 1.00 0.00 H new ATOM 1135 N GLU C 76 82.387 -5.996 -5.592 1.00 0.00 N ATOM 1136 CA GLU C 76 83.826 -5.733 -5.644 1.00 0.00 C ATOM 1137 C GLU C 76 84.285 -4.859 -4.479 1.00 0.00 C ATOM 1138 O GLU C 76 85.422 -4.968 -4.020 1.00 0.00 O ATOM 1139 CB GLU C 76 84.203 -5.040 -6.958 1.00 0.00 C ATOM 1140 CG GLU C 76 83.160 -3.978 -7.313 1.00 0.00 C ATOM 1141 CD GLU C 76 82.996 -3.915 -8.827 1.00 0.00 C ATOM 1142 OE1 GLU C 76 83.294 -4.903 -9.477 1.00 0.00 O ATOM 1143 OE2 GLU C 76 82.578 -2.878 -9.316 1.00 0.00 O ATOM 0 H GLU C 76 81.914 -5.941 -6.494 1.00 0.00 H new ATOM 0 HA GLU C 76 84.325 -6.700 -5.577 1.00 0.00 H new ATOM 0 HB2 GLU C 76 85.186 -4.578 -6.865 1.00 0.00 H new ATOM 0 HB3 GLU C 76 84.271 -5.776 -7.759 1.00 0.00 H new ATOM 0 HG2 GLU C 76 82.206 -4.218 -6.843 1.00 0.00 H new ATOM 0 HG3 GLU C 76 83.469 -3.006 -6.929 1.00 0.00 H new ATOM 1150 N PHE C 77 83.402 -3.987 -4.008 1.00 0.00 N ATOM 1151 CA PHE C 77 83.750 -3.100 -2.899 1.00 0.00 C ATOM 1152 C PHE C 77 84.313 -3.894 -1.722 1.00 0.00 C ATOM 1153 O PHE C 77 85.517 -3.881 -1.464 1.00 0.00 O ATOM 1154 CB PHE C 77 82.521 -2.322 -2.424 1.00 0.00 C ATOM 1155 CG PHE C 77 82.883 -1.521 -1.195 1.00 0.00 C ATOM 1156 CD1 PHE C 77 83.428 -0.239 -1.332 1.00 0.00 C ATOM 1157 CD2 PHE C 77 82.679 -2.063 0.080 1.00 0.00 C ATOM 1158 CE1 PHE C 77 83.769 0.502 -0.194 1.00 0.00 C ATOM 1159 CE2 PHE C 77 83.019 -1.321 1.218 1.00 0.00 C ATOM 1160 CZ PHE C 77 83.564 -0.039 1.081 1.00 0.00 C ATOM 0 H PHE C 77 82.454 -3.873 -4.368 1.00 0.00 H new ATOM 0 HA PHE C 77 84.507 -2.405 -3.262 1.00 0.00 H new ATOM 0 HB2 PHE C 77 82.168 -1.659 -3.214 1.00 0.00 H new ATOM 0 HB3 PHE C 77 81.706 -3.009 -2.197 1.00 0.00 H new ATOM 0 HD1 PHE C 77 83.585 0.179 -2.315 1.00 0.00 H new ATOM 0 HD2 PHE C 77 82.260 -3.053 0.186 1.00 0.00 H new ATOM 0 HE1 PHE C 77 84.190 1.491 -0.300 1.00 0.00 H new ATOM 0 HE2 PHE C 77 82.861 -1.738 2.202 1.00 0.00 H new ATOM 0 HZ PHE C 77 83.826 0.533 1.959 1.00 0.00 H new ATOM 1170 N LEU C 78 83.423 -4.575 -1.008 1.00 0.00 N ATOM 1171 CA LEU C 78 83.825 -5.368 0.153 1.00 0.00 C ATOM 1172 C LEU C 78 85.096 -6.164 -0.133 1.00 0.00 C ATOM 1173 O LEU C 78 85.968 -6.292 0.726 1.00 0.00 O ATOM 1174 CB LEU C 78 82.707 -6.338 0.543 1.00 0.00 C ATOM 1175 CG LEU C 78 81.608 -5.577 1.287 1.00 0.00 C ATOM 1176 CD1 LEU C 78 80.305 -6.376 1.237 1.00 0.00 C ATOM 1177 CD2 LEU C 78 82.026 -5.377 2.746 1.00 0.00 C ATOM 0 H LEU C 78 82.423 -4.595 -1.210 1.00 0.00 H new ATOM 0 HA LEU C 78 84.020 -4.677 0.973 1.00 0.00 H new ATOM 0 HB2 LEU C 78 82.296 -6.813 -0.348 1.00 0.00 H new ATOM 0 HB3 LEU C 78 83.104 -7.133 1.174 1.00 0.00 H new ATOM 0 HG LEU C 78 81.456 -4.607 0.814 1.00 0.00 H new ATOM 0 HD11 LEU C 78 79.524 -5.832 1.768 1.00 0.00 H new ATOM 0 HD12 LEU C 78 80.006 -6.520 0.199 1.00 0.00 H new ATOM 0 HD13 LEU C 78 80.455 -7.347 1.709 1.00 0.00 H new ATOM 0 HD21 LEU C 78 81.244 -4.835 3.278 1.00 0.00 H new ATOM 0 HD22 LEU C 78 82.179 -6.348 3.217 1.00 0.00 H new ATOM 0 HD23 LEU C 78 82.953 -4.806 2.784 1.00 0.00 H new ATOM 1189 N VAL C 79 85.191 -6.706 -1.344 1.00 0.00 N ATOM 1190 CA VAL C 79 86.360 -7.499 -1.722 1.00 0.00 C ATOM 1191 C VAL C 79 87.632 -6.653 -1.673 1.00 0.00 C ATOM 1192 O VAL C 79 88.508 -6.875 -0.838 1.00 0.00 O ATOM 1193 CB VAL C 79 86.192 -8.069 -3.133 1.00 0.00 C ATOM 1194 CG1 VAL C 79 87.477 -8.787 -3.550 1.00 0.00 C ATOM 1195 CG2 VAL C 79 85.028 -9.063 -3.146 1.00 0.00 C ATOM 0 H VAL C 79 84.483 -6.614 -2.073 1.00 0.00 H new ATOM 0 HA VAL C 79 86.447 -8.318 -1.008 1.00 0.00 H new ATOM 0 HB VAL C 79 85.986 -7.257 -3.830 1.00 0.00 H new ATOM 0 HG11 VAL C 79 87.357 -9.193 -4.555 1.00 0.00 H new ATOM 0 HG12 VAL C 79 88.308 -8.081 -3.540 1.00 0.00 H new ATOM 0 HG13 VAL C 79 87.683 -9.599 -2.853 1.00 0.00 H new ATOM 0 HG21 VAL C 79 84.908 -9.469 -4.150 1.00 0.00 H new ATOM 0 HG22 VAL C 79 85.235 -9.875 -2.449 1.00 0.00 H new ATOM 0 HG23 VAL C 79 84.111 -8.554 -2.848 1.00 0.00 H new ATOM 1205 N MET C 80 87.724 -5.687 -2.581 1.00 0.00 N ATOM 1206 CA MET C 80 88.897 -4.813 -2.641 1.00 0.00 C ATOM 1207 C MET C 80 89.421 -4.510 -1.239 1.00 0.00 C ATOM 1208 O MET C 80 90.593 -4.731 -0.937 1.00 0.00 O ATOM 1209 CB MET C 80 88.545 -3.495 -3.336 1.00 0.00 C ATOM 1210 CG MET C 80 89.691 -2.495 -3.159 1.00 0.00 C ATOM 1211 SD MET C 80 89.716 -1.350 -4.561 1.00 0.00 S ATOM 1212 CE MET C 80 89.135 0.114 -3.669 1.00 0.00 C ATOM 0 H MET C 80 87.009 -5.488 -3.281 1.00 0.00 H new ATOM 0 HA MET C 80 89.670 -5.332 -3.208 1.00 0.00 H new ATOM 0 HB2 MET C 80 88.363 -3.669 -4.396 1.00 0.00 H new ATOM 0 HB3 MET C 80 87.625 -3.086 -2.917 1.00 0.00 H new ATOM 0 HG2 MET C 80 89.565 -1.943 -2.227 1.00 0.00 H new ATOM 0 HG3 MET C 80 90.642 -3.024 -3.091 1.00 0.00 H new ATOM 0 HE1 MET C 80 88.536 0.733 -4.337 1.00 0.00 H new ATOM 0 HE2 MET C 80 88.527 -0.195 -2.819 1.00 0.00 H new ATOM 0 HE3 MET C 80 89.991 0.687 -3.314 1.00 0.00 H new ATOM 1222 N MET C 81 88.539 -3.989 -0.393 1.00 0.00 N ATOM 1223 CA MET C 81 88.918 -3.642 0.974 1.00 0.00 C ATOM 1224 C MET C 81 89.411 -4.870 1.736 1.00 0.00 C ATOM 1225 O MET C 81 90.568 -4.938 2.150 1.00 0.00 O ATOM 1226 CB MET C 81 87.721 -3.045 1.718 1.00 0.00 C ATOM 1227 CG MET C 81 87.830 -1.518 1.731 1.00 0.00 C ATOM 1228 SD MET C 81 88.174 -0.915 0.059 1.00 0.00 S ATOM 1229 CE MET C 81 86.588 -1.373 -0.682 1.00 0.00 C ATOM 0 H MET C 81 87.564 -3.798 -0.626 1.00 0.00 H new ATOM 0 HA MET C 81 89.724 -2.911 0.919 1.00 0.00 H new ATOM 0 HB2 MET C 81 86.792 -3.349 1.235 1.00 0.00 H new ATOM 0 HB3 MET C 81 87.689 -3.425 2.739 1.00 0.00 H new ATOM 0 HG2 MET C 81 86.903 -1.081 2.102 1.00 0.00 H new ATOM 0 HG3 MET C 81 88.623 -1.206 2.410 1.00 0.00 H new ATOM 0 HE1 MET C 81 86.744 -2.163 -1.416 1.00 0.00 H new ATOM 0 HE2 MET C 81 85.912 -1.729 0.096 1.00 0.00 H new ATOM 0 HE3 MET C 81 86.151 -0.503 -1.173 1.00 0.00 H new ATOM 1239 N VAL C 82 88.513 -5.831 1.929 1.00 0.00 N ATOM 1240 CA VAL C 82 88.854 -7.050 2.659 1.00 0.00 C ATOM 1241 C VAL C 82 90.102 -7.713 2.077 1.00 0.00 C ATOM 1242 O VAL C 82 90.848 -8.391 2.784 1.00 0.00 O ATOM 1243 CB VAL C 82 87.676 -8.036 2.623 1.00 0.00 C ATOM 1244 CG1 VAL C 82 87.731 -8.900 1.358 1.00 0.00 C ATOM 1245 CG2 VAL C 82 87.736 -8.938 3.856 1.00 0.00 C ATOM 0 H VAL C 82 87.551 -5.792 1.594 1.00 0.00 H new ATOM 0 HA VAL C 82 89.064 -6.774 3.692 1.00 0.00 H new ATOM 0 HB VAL C 82 86.745 -7.470 2.618 1.00 0.00 H new ATOM 0 HG11 VAL C 82 86.888 -9.591 1.352 1.00 0.00 H new ATOM 0 HG12 VAL C 82 87.681 -8.259 0.477 1.00 0.00 H new ATOM 0 HG13 VAL C 82 88.663 -9.465 1.343 1.00 0.00 H new ATOM 0 HG21 VAL C 82 86.902 -9.639 3.835 1.00 0.00 H new ATOM 0 HG22 VAL C 82 88.675 -9.491 3.857 1.00 0.00 H new ATOM 0 HG23 VAL C 82 87.674 -8.327 4.757 1.00 0.00 H new ATOM 1255 N ARG C 83 90.311 -7.521 0.781 1.00 0.00 N ATOM 1256 CA ARG C 83 91.464 -8.116 0.107 1.00 0.00 C ATOM 1257 C ARG C 83 92.769 -7.474 0.573 1.00 0.00 C ATOM 1258 O ARG C 83 93.729 -8.167 0.911 1.00 0.00 O ATOM 1259 CB ARG C 83 91.345 -7.947 -1.409 1.00 0.00 C ATOM 1260 CG ARG C 83 92.476 -8.713 -2.099 1.00 0.00 C ATOM 1261 CD ARG C 83 92.582 -8.269 -3.558 1.00 0.00 C ATOM 1262 NE ARG C 83 93.729 -7.384 -3.747 1.00 0.00 N ATOM 1263 CZ ARG C 83 94.971 -7.820 -3.546 1.00 0.00 C ATOM 1264 NH1 ARG C 83 95.177 -9.054 -3.175 1.00 0.00 N ATOM 1265 NH2 ARG C 83 95.983 -7.013 -3.720 1.00 0.00 N ATOM 0 H ARG C 83 89.705 -6.964 0.178 1.00 0.00 H new ATOM 0 HA ARG C 83 91.477 -9.176 0.361 1.00 0.00 H new ATOM 0 HB2 ARG C 83 90.379 -8.317 -1.752 1.00 0.00 H new ATOM 0 HB3 ARG C 83 91.393 -6.890 -1.673 1.00 0.00 H new ATOM 0 HG2 ARG C 83 93.419 -8.531 -1.584 1.00 0.00 H new ATOM 0 HG3 ARG C 83 92.287 -9.785 -2.048 1.00 0.00 H new ATOM 0 HD2 ARG C 83 92.680 -9.142 -4.203 1.00 0.00 H new ATOM 0 HD3 ARG C 83 91.667 -7.755 -3.854 1.00 0.00 H new ATOM 0 HE ARG C 83 93.576 -6.418 -4.037 1.00 0.00 H new ATOM 0 HH11 ARG C 83 94.387 -9.684 -3.039 1.00 0.00 H new ATOM 0 HH12 ARG C 83 96.128 -9.388 -3.021 1.00 0.00 H new ATOM 0 HH21 ARG C 83 95.822 -6.048 -4.010 1.00 0.00 H new ATOM 0 HH22 ARG C 83 96.934 -7.347 -3.566 1.00 0.00 H new ATOM 1279 N CYS C 84 92.801 -6.145 0.572 1.00 0.00 N ATOM 1280 CA CYS C 84 94.005 -5.420 0.981 1.00 0.00 C ATOM 1281 C CYS C 84 94.096 -5.305 2.501 1.00 0.00 C ATOM 1282 O CYS C 84 95.043 -5.795 3.117 1.00 0.00 O ATOM 1283 CB CYS C 84 94.008 -4.014 0.379 1.00 0.00 C ATOM 1284 SG CYS C 84 93.814 -4.126 -1.417 1.00 0.00 S ATOM 0 H CYS C 84 92.019 -5.552 0.297 1.00 0.00 H new ATOM 0 HA CYS C 84 94.864 -5.984 0.617 1.00 0.00 H new ATOM 0 HB2 CYS C 84 93.199 -3.422 0.807 1.00 0.00 H new ATOM 0 HB3 CYS C 84 94.940 -3.504 0.624 1.00 0.00 H new ATOM 0 HG CYS C 84 92.572 -4.381 -1.704 1.00 0.00 H new ATOM 1290 N MET C 85 93.111 -4.637 3.096 1.00 0.00 N ATOM 1291 CA MET C 85 93.098 -4.446 4.546 1.00 0.00 C ATOM 1292 C MET C 85 93.642 -5.679 5.263 1.00 0.00 C ATOM 1293 O MET C 85 94.250 -5.575 6.329 1.00 0.00 O ATOM 1294 CB MET C 85 91.677 -4.160 5.041 1.00 0.00 C ATOM 1295 CG MET C 85 90.864 -5.457 5.061 1.00 0.00 C ATOM 1296 SD MET C 85 89.246 -5.144 5.810 1.00 0.00 S ATOM 1297 CE MET C 85 88.802 -3.707 4.804 1.00 0.00 C ATOM 0 H MET C 85 92.319 -4.223 2.604 1.00 0.00 H new ATOM 0 HA MET C 85 93.737 -3.592 4.772 1.00 0.00 H new ATOM 0 HB2 MET C 85 91.711 -3.726 6.040 1.00 0.00 H new ATOM 0 HB3 MET C 85 91.196 -3.429 4.392 1.00 0.00 H new ATOM 0 HG2 MET C 85 90.740 -5.836 4.047 1.00 0.00 H new ATOM 0 HG3 MET C 85 91.396 -6.223 5.625 1.00 0.00 H new ATOM 0 HE1 MET C 85 87.741 -3.750 4.556 1.00 0.00 H new ATOM 0 HE2 MET C 85 89.008 -2.794 5.363 1.00 0.00 H new ATOM 0 HE3 MET C 85 89.389 -3.710 3.886 1.00 0.00 H new ATOM 1307 N LYS C 86 93.419 -6.847 4.669 1.00 0.00 N ATOM 1308 CA LYS C 86 93.896 -8.092 5.265 1.00 0.00 C ATOM 1309 C LYS C 86 95.213 -8.522 4.626 1.00 0.00 C ATOM 1310 O LYS C 86 95.237 -9.347 3.713 1.00 0.00 O ATOM 1311 CB LYS C 86 92.863 -9.206 5.083 1.00 0.00 C ATOM 1312 CG LYS C 86 91.840 -9.141 6.219 1.00 0.00 C ATOM 1313 CD LYS C 86 90.697 -10.118 5.937 1.00 0.00 C ATOM 1314 CE LYS C 86 90.898 -11.389 6.763 1.00 0.00 C ATOM 1315 NZ LYS C 86 89.701 -11.615 7.621 1.00 0.00 N ATOM 0 H LYS C 86 92.918 -6.959 3.787 1.00 0.00 H new ATOM 0 HA LYS C 86 94.052 -7.915 6.329 1.00 0.00 H new ATOM 0 HB2 LYS C 86 92.362 -9.099 4.121 1.00 0.00 H new ATOM 0 HB3 LYS C 86 93.357 -10.178 5.079 1.00 0.00 H new ATOM 0 HG2 LYS C 86 92.318 -9.389 7.167 1.00 0.00 H new ATOM 0 HG3 LYS C 86 91.450 -8.127 6.314 1.00 0.00 H new ATOM 0 HD2 LYS C 86 89.741 -9.657 6.185 1.00 0.00 H new ATOM 0 HD3 LYS C 86 90.667 -10.362 4.875 1.00 0.00 H new ATOM 0 HE2 LYS C 86 91.054 -12.243 6.104 1.00 0.00 H new ATOM 0 HE3 LYS C 86 91.791 -11.297 7.382 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 89.835 -12.479 8.184 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 89.572 -10.803 8.258 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 88.858 -11.721 7.021 1.00 0.00 H new ATOM 1329 N ASP C 87 96.308 -7.951 5.119 1.00 0.00 N ATOM 1330 CA ASP C 87 97.632 -8.278 4.594 1.00 0.00 C ATOM 1331 C ASP C 87 97.868 -7.578 3.261 1.00 0.00 C ATOM 1332 O ASP C 87 97.890 -8.212 2.207 1.00 0.00 O ATOM 1333 CB ASP C 87 97.774 -9.788 4.391 1.00 0.00 C ATOM 1334 CG ASP C 87 97.175 -10.522 5.585 1.00 0.00 C ATOM 1335 OD1 ASP C 87 97.324 -10.031 6.692 1.00 0.00 O ATOM 1336 OD2 ASP C 87 96.576 -11.563 5.374 1.00 0.00 O ATOM 0 H ASP C 87 96.307 -7.266 5.874 1.00 0.00 H new ATOM 0 HA ASP C 87 98.370 -7.938 5.320 1.00 0.00 H new ATOM 0 HB2 ASP C 87 97.269 -10.091 3.474 1.00 0.00 H new ATOM 0 HB3 ASP C 87 98.825 -10.053 4.278 1.00 0.00 H new ATOM 1341 N ASP C 88 98.046 -6.261 3.319 1.00 0.00 N ATOM 1342 CA ASP C 88 98.283 -5.487 2.106 1.00 0.00 C ATOM 1343 C ASP C 88 99.366 -6.150 1.263 1.00 0.00 C ATOM 1344 O ASP C 88 100.330 -6.704 1.790 1.00 0.00 O ATOM 1345 CB ASP C 88 98.723 -4.064 2.451 1.00 0.00 C ATOM 1346 CG ASP C 88 99.096 -3.326 1.170 1.00 0.00 C ATOM 1347 OD1 ASP C 88 100.152 -3.614 0.630 1.00 0.00 O ATOM 1348 OD2 ASP C 88 98.321 -2.484 0.748 1.00 0.00 O ATOM 0 H ASP C 88 98.031 -5.714 4.180 1.00 0.00 H new ATOM 0 HA ASP C 88 97.350 -5.448 1.543 1.00 0.00 H new ATOM 0 HB2 ASP C 88 97.920 -3.538 2.966 1.00 0.00 H new ATOM 0 HB3 ASP C 88 99.575 -4.089 3.131 1.00 0.00 H new ATOM 1353 N SER C 89 99.196 -6.091 -0.054 1.00 0.00 N ATOM 1354 CA SER C 89 100.167 -6.692 -0.963 1.00 0.00 C ATOM 1355 C SER C 89 101.523 -6.009 -0.820 1.00 0.00 C ATOM 1356 O SER C 89 101.651 -4.888 -1.283 1.00 0.00 O ATOM 1357 CB SER C 89 99.695 -6.565 -2.411 1.00 0.00 C ATOM 1358 OG SER C 89 100.745 -6.962 -3.283 1.00 0.00 O ATOM 1359 OXT SER C 89 102.414 -6.618 -0.250 1.00 0.00 O ATOM 0 H SER C 89 98.405 -5.639 -0.512 1.00 0.00 H new ATOM 0 HA SER C 89 100.262 -7.747 -0.705 1.00 0.00 H new ATOM 0 HB2 SER C 89 98.815 -7.188 -2.575 1.00 0.00 H new ATOM 0 HB3 SER C 89 99.401 -5.537 -2.621 1.00 0.00 H new ATOM 0 HG SER C 89 100.445 -6.883 -4.213 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 147 94.913 -1.190 3.219 1.00 0.00 N ATOM 1367 CA ARG I 147 94.842 -1.132 4.706 1.00 0.00 C ATOM 1368 C ARG I 147 93.407 -0.841 5.133 1.00 0.00 C ATOM 1369 O ARG I 147 92.669 -1.739 5.538 1.00 0.00 O ATOM 1370 CB ARG I 147 95.761 -0.020 5.216 1.00 0.00 C ATOM 1371 CG ARG I 147 96.851 -0.623 6.103 1.00 0.00 C ATOM 1372 CD ARG I 147 96.216 -1.218 7.359 1.00 0.00 C ATOM 1373 NE ARG I 147 96.686 -0.520 8.552 1.00 0.00 N ATOM 1374 CZ ARG I 147 96.556 -1.064 9.757 1.00 0.00 C ATOM 1375 NH1 ARG I 147 95.994 -2.234 9.886 1.00 0.00 N ATOM 1376 NH2 ARG I 147 96.989 -0.427 10.811 1.00 0.00 N ATOM 0 HA ARG I 147 95.160 -2.087 5.124 1.00 0.00 H new ATOM 0 HB2 ARG I 147 96.212 0.507 4.375 1.00 0.00 H new ATOM 0 HB3 ARG I 147 95.184 0.713 5.779 1.00 0.00 H new ATOM 0 HG2 ARG I 147 97.394 -1.395 5.557 1.00 0.00 H new ATOM 0 HG3 ARG I 147 97.576 0.143 6.377 1.00 0.00 H new ATOM 0 HD2 ARG I 147 95.130 -1.146 7.293 1.00 0.00 H new ATOM 0 HD3 ARG I 147 96.462 -2.278 7.430 1.00 0.00 H new ATOM 0 HE ARG I 147 97.120 0.398 8.459 1.00 0.00 H new ATOM 0 HH11 ARG I 147 95.655 -2.730 9.062 1.00 0.00 H new ATOM 0 HH12 ARG I 147 95.894 -2.652 10.811 1.00 0.00 H new ATOM 0 HH21 ARG I 147 97.427 0.488 10.709 1.00 0.00 H new ATOM 0 HH22 ARG I 147 96.889 -0.845 11.736 1.00 0.00 H new ATOM 1392 N ILE I 148 93.022 0.428 5.037 1.00 0.00 N ATOM 1393 CA ILE I 148 91.672 0.835 5.414 1.00 0.00 C ATOM 1394 C ILE I 148 91.434 0.579 6.898 1.00 0.00 C ATOM 1395 O ILE I 148 91.219 -0.558 7.320 1.00 0.00 O ATOM 1396 CB ILE I 148 90.634 0.060 4.604 1.00 0.00 C ATOM 1397 CG1 ILE I 148 91.015 0.097 3.120 1.00 0.00 C ATOM 1398 CG2 ILE I 148 89.255 0.695 4.799 1.00 0.00 C ATOM 1399 CD1 ILE I 148 90.729 1.487 2.547 1.00 0.00 C ATOM 0 H ILE I 148 93.619 1.186 4.705 1.00 0.00 H new ATOM 0 HA ILE I 148 91.572 1.901 5.207 1.00 0.00 H new ATOM 0 HB ILE I 148 90.604 -0.975 4.944 1.00 0.00 H new ATOM 0 HG12 ILE I 148 92.071 -0.146 3.000 1.00 0.00 H new ATOM 0 HG13 ILE I 148 90.450 -0.656 2.571 1.00 0.00 H new ATOM 0 HG21 ILE I 148 88.515 0.142 4.221 1.00 0.00 H new ATOM 0 HG22 ILE I 148 88.987 0.665 5.855 1.00 0.00 H new ATOM 0 HG23 ILE I 148 89.280 1.731 4.460 1.00 0.00 H new ATOM 0 HD11 ILE I 148 91.001 1.509 1.492 1.00 0.00 H new ATOM 0 HD12 ILE I 148 89.668 1.713 2.653 1.00 0.00 H new ATOM 0 HD13 ILE I 148 91.314 2.231 3.088 1.00 0.00 H new ATOM 1411 N SER I 149 91.474 1.649 7.685 1.00 0.00 N ATOM 1412 CA SER I 149 91.259 1.530 9.123 1.00 0.00 C ATOM 1413 C SER I 149 89.834 1.067 9.408 1.00 0.00 C ATOM 1414 O SER I 149 89.596 0.258 10.305 1.00 0.00 O ATOM 1415 CB SER I 149 91.496 2.874 9.812 1.00 0.00 C ATOM 1416 OG SER I 149 92.378 3.657 9.019 1.00 0.00 O ATOM 0 H SER I 149 91.651 2.598 7.357 1.00 0.00 H new ATOM 0 HA SER I 149 91.965 0.796 9.512 1.00 0.00 H new ATOM 0 HB2 SER I 149 90.550 3.397 9.950 1.00 0.00 H new ATOM 0 HB3 SER I 149 91.921 2.718 10.804 1.00 0.00 H new ATOM 0 HG SER I 149 91.857 4.241 8.429 1.00 0.00 H new ATOM 1422 N ALA I 150 88.890 1.593 8.632 1.00 0.00 N ATOM 1423 CA ALA I 150 87.484 1.233 8.801 1.00 0.00 C ATOM 1424 C ALA I 150 86.839 2.082 9.893 1.00 0.00 C ATOM 1425 O ALA I 150 85.616 2.115 10.029 1.00 0.00 O ATOM 1426 CB ALA I 150 87.347 -0.245 9.168 1.00 0.00 C ATOM 0 H ALA I 150 89.070 2.265 7.886 1.00 0.00 H new ATOM 0 HA ALA I 150 86.977 1.418 7.854 1.00 0.00 H new ATOM 0 HB1 ALA I 150 86.293 -0.493 9.290 1.00 0.00 H new ATOM 0 HB2 ALA I 150 87.775 -0.858 8.375 1.00 0.00 H new ATOM 0 HB3 ALA I 150 87.875 -0.439 10.102 1.00 0.00 H new ATOM 1432 N ASP I 151 87.673 2.773 10.667 1.00 0.00 N ATOM 1433 CA ASP I 151 87.169 3.624 11.740 1.00 0.00 C ATOM 1434 C ASP I 151 86.800 4.997 11.190 1.00 0.00 C ATOM 1435 O ASP I 151 85.770 5.568 11.546 1.00 0.00 O ATOM 1436 CB ASP I 151 88.222 3.791 12.837 1.00 0.00 C ATOM 1437 CG ASP I 151 87.933 2.815 13.972 1.00 0.00 C ATOM 1438 OD1 ASP I 151 86.842 2.269 13.995 1.00 0.00 O ATOM 1439 OD2 ASP I 151 88.808 2.627 14.802 1.00 0.00 O ATOM 0 H ASP I 151 88.689 2.761 10.573 1.00 0.00 H new ATOM 0 HA ASP I 151 86.285 3.147 12.163 1.00 0.00 H new ATOM 0 HB2 ASP I 151 89.217 3.609 12.431 1.00 0.00 H new ATOM 0 HB3 ASP I 151 88.213 4.814 13.212 1.00 0.00 H new ATOM 1444 N ALA I 152 87.654 5.519 10.312 1.00 0.00 N ATOM 1445 CA ALA I 152 87.406 6.827 9.712 1.00 0.00 C ATOM 1446 C ALA I 152 86.013 6.866 9.098 1.00 0.00 C ATOM 1447 O ALA I 152 85.433 7.934 8.901 1.00 0.00 O ATOM 1448 CB ALA I 152 88.439 7.125 8.622 1.00 0.00 C ATOM 0 H ALA I 152 88.513 5.063 10.004 1.00 0.00 H new ATOM 0 HA ALA I 152 87.484 7.580 10.497 1.00 0.00 H new ATOM 0 HB1 ALA I 152 88.237 8.104 8.187 1.00 0.00 H new ATOM 0 HB2 ALA I 152 89.438 7.120 9.057 1.00 0.00 H new ATOM 0 HB3 ALA I 152 88.378 6.363 7.845 1.00 0.00 H new ATOM 1454 N MET I 153 85.485 5.684 8.796 1.00 0.00 N ATOM 1455 CA MET I 153 84.157 5.585 8.201 1.00 0.00 C ATOM 1456 C MET I 153 83.083 5.877 9.242 1.00 0.00 C ATOM 1457 O MET I 153 82.244 6.758 9.058 1.00 0.00 O ATOM 1458 CB MET I 153 83.931 4.181 7.638 1.00 0.00 C ATOM 1459 CG MET I 153 84.970 3.894 6.553 1.00 0.00 C ATOM 1460 SD MET I 153 84.129 3.486 5.003 1.00 0.00 S ATOM 1461 CE MET I 153 83.166 5.011 4.856 1.00 0.00 C ATOM 0 H MET I 153 85.951 4.790 8.951 1.00 0.00 H new ATOM 0 HA MET I 153 84.092 6.318 7.397 1.00 0.00 H new ATOM 0 HB2 MET I 153 84.008 3.441 8.435 1.00 0.00 H new ATOM 0 HB3 MET I 153 82.926 4.101 7.224 1.00 0.00 H new ATOM 0 HG2 MET I 153 85.613 4.762 6.412 1.00 0.00 H new ATOM 0 HG3 MET I 153 85.612 3.068 6.859 1.00 0.00 H new ATOM 0 HE1 MET I 153 82.111 4.793 5.025 1.00 0.00 H new ATOM 0 HE2 MET I 153 83.511 5.732 5.597 1.00 0.00 H new ATOM 0 HE3 MET I 153 83.295 5.428 3.857 1.00 0.00 H new ATOM 1471 N MET I 154 83.120 5.127 10.340 1.00 0.00 N ATOM 1472 CA MET I 154 82.144 5.309 11.410 1.00 0.00 C ATOM 1473 C MET I 154 81.829 6.790 11.600 1.00 0.00 C ATOM 1474 O MET I 154 80.701 7.164 11.924 1.00 0.00 O ATOM 1475 CB MET I 154 82.679 4.738 12.725 1.00 0.00 C ATOM 1476 CG MET I 154 82.128 3.326 12.933 1.00 0.00 C ATOM 1477 SD MET I 154 81.591 3.135 14.651 1.00 0.00 S ATOM 1478 CE MET I 154 80.017 2.311 14.309 1.00 0.00 C ATOM 0 H MET I 154 83.808 4.394 10.512 1.00 0.00 H new ATOM 0 HA MET I 154 81.234 4.779 11.129 1.00 0.00 H new ATOM 0 HB2 MET I 154 83.769 4.715 12.707 1.00 0.00 H new ATOM 0 HB3 MET I 154 82.388 5.379 13.557 1.00 0.00 H new ATOM 0 HG2 MET I 154 81.292 3.147 12.257 1.00 0.00 H new ATOM 0 HG3 MET I 154 82.893 2.587 12.696 1.00 0.00 H new ATOM 0 HE1 MET I 154 79.507 2.096 15.248 1.00 0.00 H new ATOM 0 HE2 MET I 154 79.391 2.961 13.697 1.00 0.00 H new ATOM 0 HE3 MET I 154 80.203 1.379 13.775 1.00 0.00 H new ATOM 1488 N GLN I 155 82.840 7.629 11.394 1.00 0.00 N ATOM 1489 CA GLN I 155 82.663 9.072 11.544 1.00 0.00 C ATOM 1490 C GLN I 155 81.638 9.590 10.539 1.00 0.00 C ATOM 1491 O GLN I 155 80.771 10.396 10.873 1.00 0.00 O ATOM 1492 CB GLN I 155 83.991 9.799 11.320 1.00 0.00 C ATOM 1493 CG GLN I 155 84.326 10.644 12.551 1.00 0.00 C ATOM 1494 CD GLN I 155 84.327 12.121 12.171 1.00 0.00 C ATOM 1495 OE1 GLN I 155 84.615 12.474 11.027 1.00 0.00 O ATOM 1496 NE2 GLN I 155 84.022 13.015 13.071 1.00 0.00 N ATOM 0 H GLN I 155 83.781 7.340 11.126 1.00 0.00 H new ATOM 0 HA GLN I 155 82.309 9.265 12.557 1.00 0.00 H new ATOM 0 HB2 GLN I 155 84.786 9.077 11.135 1.00 0.00 H new ATOM 0 HB3 GLN I 155 83.925 10.434 10.437 1.00 0.00 H new ATOM 0 HG2 GLN I 155 83.596 10.461 13.340 1.00 0.00 H new ATOM 0 HG3 GLN I 155 85.301 10.359 12.946 1.00 0.00 H new ATOM 0 HE21 GLN I 155 83.783 12.724 14.019 1.00 0.00 H new ATOM 0 HE22 GLN I 155 84.022 14.005 12.827 1.00 0.00 H new ATOM 1505 N ALA I 156 81.752 9.115 9.301 1.00 0.00 N ATOM 1506 CA ALA I 156 80.834 9.531 8.242 1.00 0.00 C ATOM 1507 C ALA I 156 79.542 8.721 8.302 1.00 0.00 C ATOM 1508 O ALA I 156 78.542 9.075 7.678 1.00 0.00 O ATOM 1509 CB ALA I 156 81.481 9.337 6.870 1.00 0.00 C ATOM 0 H ALA I 156 82.465 8.447 9.007 1.00 0.00 H new ATOM 0 HA ALA I 156 80.605 10.586 8.391 1.00 0.00 H new ATOM 0 HB1 ALA I 156 80.785 9.651 6.092 1.00 0.00 H new ATOM 0 HB2 ALA I 156 82.389 9.936 6.808 1.00 0.00 H new ATOM 0 HB3 ALA I 156 81.730 8.285 6.731 1.00 0.00 H new ATOM 1515 N LEU I 157 79.574 7.630 9.061 1.00 0.00 N ATOM 1516 CA LEU I 157 78.399 6.776 9.197 1.00 0.00 C ATOM 1517 C LEU I 157 78.207 6.366 10.654 1.00 0.00 C ATOM 1518 O LEU I 157 78.398 5.205 11.017 1.00 0.00 O ATOM 1519 CB LEU I 157 78.547 5.516 8.337 1.00 0.00 C ATOM 1520 CG LEU I 157 80.028 5.149 8.210 1.00 0.00 C ATOM 1521 CD1 LEU I 157 80.177 3.628 8.136 1.00 0.00 C ATOM 1522 CD2 LEU I 157 80.603 5.777 6.937 1.00 0.00 C ATOM 0 H LEU I 157 80.391 7.319 9.586 1.00 0.00 H new ATOM 0 HA LEU I 157 77.530 7.342 8.860 1.00 0.00 H new ATOM 0 HB2 LEU I 157 77.995 4.690 8.786 1.00 0.00 H new ATOM 0 HB3 LEU I 157 78.118 5.686 7.349 1.00 0.00 H new ATOM 0 HG LEU I 157 80.568 5.525 9.079 1.00 0.00 H new ATOM 0 HD11 LEU I 157 81.232 3.370 8.046 1.00 0.00 H new ATOM 0 HD12 LEU I 157 79.770 3.178 9.041 1.00 0.00 H new ATOM 0 HD13 LEU I 157 79.636 3.251 7.268 1.00 0.00 H new ATOM 0 HD21 LEU I 157 81.657 5.516 6.847 1.00 0.00 H new ATOM 0 HD22 LEU I 157 80.061 5.402 6.069 1.00 0.00 H new ATOM 0 HD23 LEU I 157 80.501 6.861 6.988 1.00 0.00 H new ATOM 1534 N LEU I 158 77.830 7.334 11.486 1.00 0.00 N ATOM 1535 CA LEU I 158 77.619 7.063 12.907 1.00 0.00 C ATOM 1536 C LEU I 158 76.129 6.968 13.224 1.00 0.00 C ATOM 1537 O LEU I 158 75.677 7.415 14.278 1.00 0.00 O ATOM 1538 CB LEU I 158 78.236 8.172 13.761 1.00 0.00 C ATOM 1539 CG LEU I 158 77.464 9.474 13.542 1.00 0.00 C ATOM 1540 CD1 LEU I 158 76.982 10.016 14.889 1.00 0.00 C ATOM 1541 CD2 LEU I 158 78.381 10.503 12.878 1.00 0.00 C ATOM 0 H LEU I 158 77.666 8.301 11.207 1.00 0.00 H new ATOM 0 HA LEU I 158 78.099 6.112 13.138 1.00 0.00 H new ATOM 0 HB2 LEU I 158 78.208 7.893 14.814 1.00 0.00 H new ATOM 0 HB3 LEU I 158 79.284 8.309 13.496 1.00 0.00 H new ATOM 0 HG LEU I 158 76.604 9.283 12.900 1.00 0.00 H new ATOM 0 HD11 LEU I 158 76.432 10.944 14.732 1.00 0.00 H new ATOM 0 HD12 LEU I 158 76.329 9.283 15.364 1.00 0.00 H new ATOM 0 HD13 LEU I 158 77.841 10.208 15.532 1.00 0.00 H new ATOM 0 HD21 LEU I 158 77.832 11.432 12.721 1.00 0.00 H new ATOM 0 HD22 LEU I 158 79.240 10.693 13.521 1.00 0.00 H new ATOM 0 HD23 LEU I 158 78.725 10.118 11.918 1.00 0.00 H new ATOM 1553 N GLY I 159 75.373 6.379 12.303 1.00 0.00 N ATOM 1554 CA GLY I 159 73.933 6.228 12.501 1.00 0.00 C ATOM 1555 C GLY I 159 73.194 6.249 11.167 1.00 0.00 C ATOM 1556 O GLY I 159 72.771 7.302 10.691 1.00 0.00 O ATOM 0 H GLY I 159 75.726 6.003 11.423 1.00 0.00 H new ATOM 0 HA2 GLY I 159 73.730 5.291 13.019 1.00 0.00 H new ATOM 0 HA3 GLY I 159 73.563 7.031 13.138 1.00 0.00 H new ATOM 1560 N ALA I 160 73.041 5.069 10.572 1.00 0.00 N ATOM 1561 CA ALA I 160 72.347 4.959 9.293 1.00 0.00 C ATOM 1562 C ALA I 160 70.918 4.471 9.507 1.00 0.00 C ATOM 1563 O ALA I 160 70.646 3.271 9.482 1.00 0.00 O ATOM 1564 CB ALA I 160 73.074 3.982 8.366 1.00 0.00 C ATOM 0 H ALA I 160 73.384 4.186 10.950 1.00 0.00 H new ATOM 0 HA ALA I 160 72.332 5.947 8.833 1.00 0.00 H new ATOM 0 HB1 ALA I 160 72.540 3.914 7.418 1.00 0.00 H new ATOM 0 HB2 ALA I 160 74.089 4.337 8.187 1.00 0.00 H new ATOM 0 HB3 ALA I 160 73.111 2.997 8.832 1.00 0.00 H new ATOM 1570 N ARG I 161 70.010 5.419 9.721 1.00 0.00 N ATOM 1571 CA ARG I 161 68.606 5.082 9.942 1.00 0.00 C ATOM 1572 C ARG I 161 68.439 4.333 11.259 1.00 0.00 C ATOM 1573 O ARG I 161 67.847 3.255 11.308 1.00 0.00 O ATOM 1574 CB ARG I 161 68.076 4.210 8.803 1.00 0.00 C ATOM 1575 CG ARG I 161 68.077 5.012 7.501 1.00 0.00 C ATOM 1576 CD ARG I 161 66.919 4.548 6.618 1.00 0.00 C ATOM 1577 NE ARG I 161 67.052 5.082 5.266 1.00 0.00 N ATOM 1578 CZ ARG I 161 66.856 6.373 5.018 1.00 0.00 C ATOM 1579 NH1 ARG I 161 66.541 7.183 5.990 1.00 0.00 N ATOM 1580 NH2 ARG I 161 66.979 6.828 3.802 1.00 0.00 N ATOM 0 H ARG I 161 70.217 6.417 9.746 1.00 0.00 H new ATOM 0 HA ARG I 161 68.040 6.013 9.978 1.00 0.00 H new ATOM 0 HB2 ARG I 161 68.696 3.320 8.694 1.00 0.00 H new ATOM 0 HB3 ARG I 161 67.066 3.869 9.032 1.00 0.00 H new ATOM 0 HG2 ARG I 161 67.981 6.076 7.716 1.00 0.00 H new ATOM 0 HG3 ARG I 161 69.024 4.877 6.979 1.00 0.00 H new ATOM 0 HD2 ARG I 161 66.896 3.459 6.583 1.00 0.00 H new ATOM 0 HD3 ARG I 161 65.973 4.873 7.051 1.00 0.00 H new ATOM 0 HE ARG I 161 67.299 4.455 4.500 1.00 0.00 H new ATOM 0 HH11 ARG I 161 66.445 6.826 6.941 1.00 0.00 H new ATOM 0 HH12 ARG I 161 66.391 8.174 5.800 1.00 0.00 H new ATOM 0 HH21 ARG I 161 67.225 6.193 3.042 1.00 0.00 H new ATOM 0 HH22 ARG I 161 66.829 7.819 3.610 1.00 0.00 H new ATOM 1594 N ALA I 162 68.968 4.921 12.328 1.00 0.00 N ATOM 1595 CA ALA I 162 68.875 4.305 13.649 1.00 0.00 C ATOM 1596 C ALA I 162 69.306 5.293 14.727 1.00 0.00 C ATOM 1597 O ALA I 162 68.566 5.564 15.674 1.00 0.00 O ATOM 1598 CB ALA I 162 69.765 3.063 13.726 1.00 0.00 C ATOM 0 H ALA I 162 69.461 5.814 12.308 1.00 0.00 H new ATOM 0 HA ALA I 162 67.837 4.016 13.813 1.00 0.00 H new ATOM 0 HB1 ALA I 162 69.683 2.617 14.717 1.00 0.00 H new ATOM 0 HB2 ALA I 162 69.446 2.340 12.975 1.00 0.00 H new ATOM 0 HB3 ALA I 162 70.801 3.346 13.540 1.00 0.00 H new ATOM 1604 N LYS I 163 70.513 5.829 14.572 1.00 0.00 N ATOM 1605 CA LYS I 163 71.038 6.790 15.539 1.00 0.00 C ATOM 1606 C LYS I 163 71.021 6.194 16.942 1.00 0.00 C ATOM 1607 O LYS I 163 71.338 6.915 17.874 1.00 0.00 O ATOM 1608 CB LYS I 163 70.198 8.069 15.530 1.00 0.00 C ATOM 1609 CG LYS I 163 71.008 9.220 16.131 1.00 0.00 C ATOM 1610 CD LYS I 163 70.073 10.386 16.456 1.00 0.00 C ATOM 1611 CE LYS I 163 70.764 11.343 17.429 1.00 0.00 C ATOM 1612 NZ LYS I 163 71.422 12.440 16.664 1.00 0.00 N ATOM 1613 OXT LYS I 163 70.690 5.027 17.064 1.00 0.00 O ATOM 0 H LYS I 163 71.140 5.618 13.796 1.00 0.00 H new ATOM 0 HA LYS I 163 72.064 7.028 15.257 1.00 0.00 H new ATOM 0 HB2 LYS I 163 69.901 8.314 14.510 1.00 0.00 H new ATOM 0 HB3 LYS I 163 69.282 7.918 16.101 1.00 0.00 H new ATOM 0 HG2 LYS I 163 71.519 8.887 17.034 1.00 0.00 H new ATOM 0 HG3 LYS I 163 71.778 9.542 15.430 1.00 0.00 H new ATOM 0 HD2 LYS I 163 69.802 10.914 15.542 1.00 0.00 H new ATOM 0 HD3 LYS I 163 69.148 10.012 16.894 1.00 0.00 H new ATOM 0 HE2 LYS I 163 70.036 11.757 18.127 1.00 0.00 H new ATOM 0 HE3 LYS I 163 71.503 10.805 18.022 1.00 0.00 H new ATOM 0 HZ1 LYS I 163 71.892 13.091 17.325 1.00 0.00 H new ATOM 0 HZ2 LYS I 163 72.128 12.036 16.015 1.00 0.00 H new ATOM 0 HZ3 LYS I 163 70.706 12.959 16.117 1.00 0.00 H new TER 1627 LYS I 163 HETATM 1628 CA CA C 93 82.793 -2.951 -11.417 1.00 0.00 CA HETATM 1629 C1 BEP C 92 92.450 3.267 -0.924 1.00 0.00 C HETATM 1630 C2 BEP C 92 91.493 2.131 -1.285 1.00 0.00 C HETATM 1631 C3 BEP C 92 90.067 2.396 -0.685 1.00 0.00 C HETATM 1632 O1 BEP C 92 93.330 2.837 0.143 1.00 0.00 O HETATM 1633 N2 BEP C 92 92.028 0.829 -0.795 1.00 0.00 N HETATM 1634 N3 BEP C 92 89.387 3.527 -1.377 1.00 0.00 N HETATM 1635 C4 BEP C 92 94.494 3.672 0.359 1.00 0.00 C HETATM 1636 C5 BEP C 92 95.061 3.385 1.750 1.00 0.00 C HETATM 1637 C6 BEP C 92 96.566 3.655 1.754 1.00 0.00 C HETATM 1638 C7 BEP C 92 94.802 1.921 2.110 1.00 0.00 C HETATM 1639 C8 BEP C 92 91.135 -0.360 -0.837 1.00 0.00 C HETATM 1640 C9 BEP C 92 92.044 -1.541 -1.219 1.00 0.00 C HETATM 1641 C10 BEP C 92 93.460 -1.040 -0.896 1.00 0.00 C HETATM 1642 C11 BEP C 92 93.399 0.443 -1.203 1.00 0.00 C HETATM 1643 C12 BEP C 92 89.186 4.795 -0.623 1.00 0.00 C HETATM 1644 C13 BEP C 92 88.501 4.684 0.763 1.00 0.00 C HETATM 1645 C14 BEP C 92 89.248 4.307 1.887 1.00 0.00 C HETATM 1646 C15 BEP C 92 88.627 4.208 3.139 1.00 0.00 C HETATM 1647 C16 BEP C 92 87.260 4.487 3.267 1.00 0.00 C HETATM 1648 C17 BEP C 92 86.514 4.865 2.143 1.00 0.00 C HETATM 1649 C18 BEP C 92 87.134 4.963 0.891 1.00 0.00 C HETATM 1650 C19 BEP C 92 88.341 3.169 -2.361 1.00 0.00 C HETATM 1651 C20 BEP C 92 87.314 2.286 -2.004 1.00 0.00 C HETATM 1652 C21 BEP C 92 86.326 1.949 -2.938 1.00 0.00 C HETATM 1653 C22 BEP C 92 86.365 2.496 -4.227 1.00 0.00 C HETATM 1654 C23 BEP C 92 87.393 3.378 -4.583 1.00 0.00 C HETATM 1655 C24 BEP C 92 88.380 3.715 -3.649 1.00 0.00 C HETATM 0 H241 BEP C 92 89.179 4.403 -3.925 1.00 0.00 H new HETATM 0 H231 BEP C 92 87.425 3.802 -5.587 1.00 0.00 H new HETATM 0 H221 BEP C 92 85.595 2.235 -4.953 1.00 0.00 H new HETATM 0 H211 BEP C 92 85.527 1.261 -2.662 1.00 0.00 H new HETATM 0 H201 BEP C 92 87.284 1.862 -1.000 1.00 0.00 H new HETATM 0 H181 BEP C 92 86.553 5.256 0.016 1.00 0.00 H new HETATM 0 H171 BEP C 92 85.451 5.083 2.243 1.00 0.00 H new HETATM 0 H161 BEP C 92 86.777 4.410 4.241 1.00 0.00 H new HETATM 0 H151 BEP C 92 89.207 3.914 4.013 1.00 0.00 H new HETATM 0 H141 BEP C 92 90.312 4.091 1.787 1.00 0.00 H new HETATM 0 H122 BEP C 92 90.159 5.265 -0.484 1.00 0.00 H new HETATM 0 H121 BEP C 92 88.593 5.468 -1.242 1.00 0.00 H new HETATM 0 H112 BEP C 92 93.573 0.641 -2.261 1.00 0.00 H new HETATM 0 H111 BEP C 92 94.154 0.999 -0.647 1.00 0.00 H new HETATM 0 H102 BEP C 92 93.720 -1.222 0.147 1.00 0.00 H new HETATM 0 H101 BEP C 92 94.211 -1.544 -1.505 1.00 0.00 H new HETATM 0 H92 BEP C 92 91.797 -2.436 -0.648 1.00 0.00 H new HETATM 0 H91 BEP C 92 91.942 -1.798 -2.273 1.00 0.00 H new HETATM 0 H82 BEP C 92 90.658 -0.528 0.129 1.00 0.00 H new HETATM 0 H81 BEP C 92 90.337 -0.226 -1.567 1.00 0.00 H new HETATM 0 H73 BEP C 92 93.729 1.730 2.107 1.00 0.00 H new HETATM 0 H72 BEP C 92 95.287 1.275 1.378 1.00 0.00 H new HETATM 0 H71 BEP C 92 95.205 1.713 3.101 1.00 0.00 H new HETATM 0 H63 BEP C 92 97.053 3.009 1.023 1.00 0.00 H new HETATM 0 H62 BEP C 92 96.749 4.698 1.496 1.00 0.00 H new HETATM 0 H61 BEP C 92 96.970 3.450 2.746 1.00 0.00 H new HETATM 0 H51 BEP C 92 94.577 4.031 2.482 1.00 0.00 H new HETATM 0 H42 BEP C 92 95.247 3.472 -0.403 1.00 0.00 H new HETATM 0 H41 BEP C 92 94.224 4.724 0.272 1.00 0.00 H new HETATM 0 H32 BEP C 92 89.460 1.495 -0.774 1.00 0.00 H new HETATM 0 H31 BEP C 92 90.154 2.618 0.379 1.00 0.00 H new HETATM 0 H21 BEP C 92 91.405 2.087 -2.371 1.00 0.00 H new HETATM 0 H12 BEP C 92 93.034 3.556 -1.798 1.00 0.00 H new HETATM 0 H11 BEP C 92 91.886 4.146 -0.613 1.00 0.00 H new