USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1018 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 78 MET CE :methyl -119:sc= -0.0127 (180deg=0) USER MOD Set 1.2: B 96 ASN : amide:sc= -1.68! C(o=-1.7!,f=-5.7!) USER MOD Set 2.1: A 96 ASN : amide:sc= -1.66! C(o=-1.7!,f=-5.6!) USER MOD Set 2.2: B 78 MET CE :methyl 176:sc=-0.00139 (180deg=0) USER MOD Single : A 46 MET CE :methyl -146:sc= 0 (180deg=-1.21) USER MOD Single : A 57 THR OG1 : rot -56:sc= 1.32 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.0582 K(o=-0.058,f=-1.4!) USER MOD Single : A 71 SER OG : rot -31:sc= 0.186 USER MOD Single : A 74 LYS NZ :NH3+ 147:sc= 0.151 (180deg=-0.247) USER MOD Single : A 75 LYS NZ :NH3+ 171:sc=-0.00675 (180deg=-0.0988) USER MOD Single : A 82 LYS NZ :NH3+ -153:sc= -1.28 (180deg=-2.43!) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ -142:sc= -0.103 (180deg=-1.75!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl -159:sc= 0 (180deg=-0.712) USER MOD Single : B 46 MET CE :methyl -146:sc= 0 (180deg=-1.24) USER MOD Single : B 57 THR OG1 : rot -52:sc= 1.23 USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 67 ASN : amide:sc= -0.0636 K(o=-0.064,f=-1.3!) USER MOD Single : B 71 SER OG : rot -25:sc= 0.177 USER MOD Single : B 74 LYS NZ :NH3+ 149:sc= 0.124 (180deg=-0.318) USER MOD Single : B 75 LYS NZ :NH3+ 170:sc=-0.00948 (180deg=-0.147) USER MOD Single : B 82 LYS NZ :NH3+ -158:sc= -1.29 (180deg=-2.43!) USER MOD Single : B 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 85 LYS NZ :NH3+ -143:sc= -0.0925 (180deg=-1.73!) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 MET CE :methyl -159:sc= 0 (180deg=-0.693) USER MOD ----------------------------------------------------------------- ATOM 100 N GLY A 42 8.423 10.205 5.363 1.00 0.00 N ATOM 101 CA GLY A 42 8.737 9.378 6.510 1.00 0.00 C ATOM 102 C GLY A 42 9.998 8.564 6.304 1.00 0.00 C ATOM 103 O GLY A 42 10.624 8.655 5.249 1.00 0.00 O ATOM 0 HA2 GLY A 42 8.855 10.011 7.390 1.00 0.00 H new ATOM 0 HA3 GLY A 42 7.902 8.706 6.710 1.00 0.00 H new ATOM 107 N PRO A 43 10.394 7.757 7.301 1.00 0.00 N ATOM 108 CA PRO A 43 11.599 6.924 7.219 1.00 0.00 C ATOM 109 C PRO A 43 11.464 5.773 6.219 1.00 0.00 C ATOM 110 O PRO A 43 10.487 5.694 5.477 1.00 0.00 O ATOM 111 CB PRO A 43 11.755 6.382 8.642 1.00 0.00 C ATOM 112 CG PRO A 43 10.380 6.416 9.213 1.00 0.00 C ATOM 113 CD PRO A 43 9.704 7.606 8.595 1.00 0.00 C ATOM 0 HA PRO A 43 12.457 7.496 6.866 1.00 0.00 H new ATOM 0 HB2 PRO A 43 12.157 5.369 8.638 1.00 0.00 H new ATOM 0 HB3 PRO A 43 12.441 6.995 9.226 1.00 0.00 H new ATOM 0 HG2 PRO A 43 9.840 5.498 8.984 1.00 0.00 H new ATOM 0 HG3 PRO A 43 10.411 6.505 10.299 1.00 0.00 H new ATOM 0 HD2 PRO A 43 8.635 7.437 8.463 1.00 0.00 H new ATOM 0 HD3 PRO A 43 9.812 8.496 9.214 1.00 0.00 H new ATOM 121 N ILE A 44 12.456 4.884 6.230 1.00 0.00 N ATOM 122 CA ILE A 44 12.543 3.748 5.301 1.00 0.00 C ATOM 123 C ILE A 44 11.208 3.018 5.098 1.00 0.00 C ATOM 124 O ILE A 44 10.777 2.805 3.963 1.00 0.00 O ATOM 125 CB ILE A 44 13.612 2.742 5.781 1.00 0.00 C ATOM 126 CG1 ILE A 44 13.561 2.604 7.310 1.00 0.00 C ATOM 127 CG2 ILE A 44 14.993 3.184 5.317 1.00 0.00 C ATOM 128 CD1 ILE A 44 14.605 1.672 7.884 1.00 0.00 C ATOM 0 H ILE A 44 13.233 4.929 6.890 1.00 0.00 H new ATOM 0 HA ILE A 44 12.825 4.170 4.336 1.00 0.00 H new ATOM 0 HB ILE A 44 13.404 1.765 5.345 1.00 0.00 H new ATOM 0 HG12 ILE A 44 13.686 3.590 7.757 1.00 0.00 H new ATOM 0 HG13 ILE A 44 12.573 2.246 7.598 1.00 0.00 H new ATOM 0 HG21 ILE A 44 15.739 2.468 5.661 1.00 0.00 H new ATOM 0 HG22 ILE A 44 15.012 3.234 4.228 1.00 0.00 H new ATOM 0 HG23 ILE A 44 15.218 4.168 5.729 1.00 0.00 H new ATOM 0 HD11 ILE A 44 14.500 1.631 8.968 1.00 0.00 H new ATOM 0 HD12 ILE A 44 14.469 0.673 7.469 1.00 0.00 H new ATOM 0 HD13 ILE A 44 15.599 2.039 7.629 1.00 0.00 H new ATOM 140 N ARG A 45 10.555 2.649 6.193 1.00 0.00 N ATOM 141 CA ARG A 45 9.274 1.950 6.120 1.00 0.00 C ATOM 142 C ARG A 45 8.217 2.774 5.388 1.00 0.00 C ATOM 143 O ARG A 45 7.470 2.251 4.559 1.00 0.00 O ATOM 144 CB ARG A 45 8.782 1.577 7.521 1.00 0.00 C ATOM 145 CG ARG A 45 8.996 2.659 8.564 1.00 0.00 C ATOM 146 CD ARG A 45 8.420 2.252 9.907 1.00 0.00 C ATOM 147 NE ARG A 45 8.708 3.236 10.949 1.00 0.00 N ATOM 148 CZ ARG A 45 7.833 3.610 11.882 1.00 0.00 C ATOM 149 NH1 ARG A 45 6.610 3.087 11.902 1.00 0.00 N ATOM 150 NH2 ARG A 45 8.180 4.503 12.799 1.00 0.00 N ATOM 0 H ARG A 45 10.889 2.821 7.141 1.00 0.00 H new ATOM 0 HA ARG A 45 9.435 1.037 5.547 1.00 0.00 H new ATOM 0 HB2 ARG A 45 7.719 1.342 7.470 1.00 0.00 H new ATOM 0 HB3 ARG A 45 9.293 0.670 7.844 1.00 0.00 H new ATOM 0 HG2 ARG A 45 10.062 2.860 8.669 1.00 0.00 H new ATOM 0 HG3 ARG A 45 8.528 3.586 8.231 1.00 0.00 H new ATOM 0 HD2 ARG A 45 7.341 2.127 9.815 1.00 0.00 H new ATOM 0 HD3 ARG A 45 8.830 1.285 10.199 1.00 0.00 H new ATOM 0 HE ARG A 45 9.635 3.662 10.963 1.00 0.00 H new ATOM 0 HH11 ARG A 45 6.339 2.397 11.201 1.00 0.00 H new ATOM 0 HH12 ARG A 45 5.943 3.376 12.618 1.00 0.00 H new ATOM 0 HH21 ARG A 45 9.118 4.905 12.791 1.00 0.00 H new ATOM 0 HH22 ARG A 45 7.509 4.788 13.512 1.00 0.00 H new ATOM 164 N MET A 46 8.163 4.064 5.680 1.00 0.00 N ATOM 165 CA MET A 46 7.216 4.945 5.014 1.00 0.00 C ATOM 166 C MET A 46 7.583 5.132 3.550 1.00 0.00 C ATOM 167 O MET A 46 6.709 5.352 2.724 1.00 0.00 O ATOM 168 CB MET A 46 7.119 6.304 5.709 1.00 0.00 C ATOM 169 CG MET A 46 6.251 6.289 6.956 1.00 0.00 C ATOM 170 SD MET A 46 7.003 5.400 8.330 1.00 0.00 S ATOM 171 CE MET A 46 5.720 5.572 9.566 1.00 0.00 C ATOM 0 H MET A 46 8.759 4.522 6.369 1.00 0.00 H new ATOM 0 HA MET A 46 6.239 4.466 5.073 1.00 0.00 H new ATOM 0 HB2 MET A 46 8.121 6.637 5.978 1.00 0.00 H new ATOM 0 HB3 MET A 46 6.718 7.034 5.006 1.00 0.00 H new ATOM 0 HG2 MET A 46 6.048 7.315 7.263 1.00 0.00 H new ATOM 0 HG3 MET A 46 5.291 5.832 6.717 1.00 0.00 H new ATOM 0 HE1 MET A 46 6.174 5.652 10.553 1.00 0.00 H new ATOM 0 HE2 MET A 46 5.136 6.469 9.361 1.00 0.00 H new ATOM 0 HE3 MET A 46 5.067 4.699 9.537 1.00 0.00 H new ATOM 181 N VAL A 47 8.869 5.021 3.229 1.00 0.00 N ATOM 182 CA VAL A 47 9.319 5.118 1.845 1.00 0.00 C ATOM 183 C VAL A 47 8.676 4.010 1.028 1.00 0.00 C ATOM 184 O VAL A 47 8.206 4.226 -0.088 1.00 0.00 O ATOM 185 CB VAL A 47 10.857 5.010 1.735 1.00 0.00 C ATOM 186 CG1 VAL A 47 11.304 5.010 0.281 1.00 0.00 C ATOM 187 CG2 VAL A 47 11.524 6.143 2.495 1.00 0.00 C ATOM 0 H VAL A 47 9.615 4.864 3.906 1.00 0.00 H new ATOM 0 HA VAL A 47 9.022 6.094 1.462 1.00 0.00 H new ATOM 0 HB VAL A 47 11.161 4.063 2.181 1.00 0.00 H new ATOM 0 HG11 VAL A 47 12.390 4.933 0.234 1.00 0.00 H new ATOM 0 HG12 VAL A 47 10.857 4.161 -0.237 1.00 0.00 H new ATOM 0 HG13 VAL A 47 10.985 5.936 -0.198 1.00 0.00 H new ATOM 0 HG21 VAL A 47 12.607 6.052 2.407 1.00 0.00 H new ATOM 0 HG22 VAL A 47 11.205 7.098 2.078 1.00 0.00 H new ATOM 0 HG23 VAL A 47 11.240 6.093 3.546 1.00 0.00 H new ATOM 197 N LEU A 48 8.635 2.828 1.624 1.00 0.00 N ATOM 198 CA LEU A 48 8.024 1.667 0.999 1.00 0.00 C ATOM 199 C LEU A 48 6.519 1.882 0.827 1.00 0.00 C ATOM 200 O LEU A 48 5.934 1.499 -0.190 1.00 0.00 O ATOM 201 CB LEU A 48 8.289 0.430 1.859 1.00 0.00 C ATOM 202 CG LEU A 48 8.628 -0.846 1.092 1.00 0.00 C ATOM 203 CD1 LEU A 48 9.866 -0.636 0.233 1.00 0.00 C ATOM 204 CD2 LEU A 48 8.847 -1.995 2.063 1.00 0.00 C ATOM 0 H LEU A 48 9.023 2.648 2.550 1.00 0.00 H new ATOM 0 HA LEU A 48 8.462 1.520 0.012 1.00 0.00 H new ATOM 0 HB2 LEU A 48 9.110 0.652 2.540 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.408 0.241 2.473 1.00 0.00 H new ATOM 0 HG LEU A 48 7.792 -1.093 0.437 1.00 0.00 H new ATOM 0 HD11 LEU A 48 10.094 -1.555 -0.307 1.00 0.00 H new ATOM 0 HD12 LEU A 48 9.682 0.168 -0.480 1.00 0.00 H new ATOM 0 HD13 LEU A 48 10.710 -0.370 0.870 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.088 -2.901 1.507 1.00 0.00 H new ATOM 0 HD22 LEU A 48 9.670 -1.752 2.735 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.940 -2.158 2.645 1.00 0.00 H new ATOM 216 N ALA A 49 5.902 2.507 1.825 1.00 0.00 N ATOM 217 CA ALA A 49 4.476 2.816 1.777 1.00 0.00 C ATOM 218 C ALA A 49 4.174 3.876 0.717 1.00 0.00 C ATOM 219 O ALA A 49 3.225 3.739 -0.059 1.00 0.00 O ATOM 220 CB ALA A 49 3.990 3.275 3.143 1.00 0.00 C ATOM 0 H ALA A 49 6.369 2.811 2.680 1.00 0.00 H new ATOM 0 HA ALA A 49 3.942 1.907 1.501 1.00 0.00 H new ATOM 0 HB1 ALA A 49 2.925 3.502 3.093 1.00 0.00 H new ATOM 0 HB2 ALA A 49 4.158 2.484 3.874 1.00 0.00 H new ATOM 0 HB3 ALA A 49 4.538 4.168 3.443 1.00 0.00 H new ATOM 226 N ILE A 50 4.990 4.929 0.685 1.00 0.00 N ATOM 227 CA ILE A 50 4.835 5.996 -0.300 1.00 0.00 C ATOM 228 C ILE A 50 5.065 5.445 -1.704 1.00 0.00 C ATOM 229 O ILE A 50 4.451 5.895 -2.674 1.00 0.00 O ATOM 230 CB ILE A 50 5.815 7.167 -0.041 1.00 0.00 C ATOM 231 CG1 ILE A 50 5.646 7.709 1.383 1.00 0.00 C ATOM 232 CG2 ILE A 50 5.594 8.281 -1.058 1.00 0.00 C ATOM 233 CD1 ILE A 50 6.667 8.761 1.761 1.00 0.00 C ATOM 0 H ILE A 50 5.767 5.065 1.332 1.00 0.00 H new ATOM 0 HA ILE A 50 3.819 6.380 -0.210 1.00 0.00 H new ATOM 0 HB ILE A 50 6.832 6.791 -0.149 1.00 0.00 H new ATOM 0 HG12 ILE A 50 4.647 8.133 1.484 1.00 0.00 H new ATOM 0 HG13 ILE A 50 5.714 6.880 2.088 1.00 0.00 H new ATOM 0 HG21 ILE A 50 6.291 9.096 -0.862 1.00 0.00 H new ATOM 0 HG22 ILE A 50 5.762 7.894 -2.063 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.572 8.650 -0.977 1.00 0.00 H new ATOM 0 HD11 ILE A 50 6.483 9.096 2.782 1.00 0.00 H new ATOM 0 HD12 ILE A 50 7.669 8.337 1.693 1.00 0.00 H new ATOM 0 HD13 ILE A 50 6.585 9.609 1.081 1.00 0.00 H new ATOM 245 N LEU A 51 5.951 4.459 -1.798 1.00 0.00 N ATOM 246 CA LEU A 51 6.212 3.773 -3.052 1.00 0.00 C ATOM 247 C LEU A 51 4.925 3.174 -3.601 1.00 0.00 C ATOM 248 O LEU A 51 4.505 3.509 -4.705 1.00 0.00 O ATOM 249 CB LEU A 51 7.243 2.662 -2.850 1.00 0.00 C ATOM 250 CG LEU A 51 7.583 1.860 -4.105 1.00 0.00 C ATOM 251 CD1 LEU A 51 8.613 2.593 -4.953 1.00 0.00 C ATOM 252 CD2 LEU A 51 8.070 0.472 -3.727 1.00 0.00 C ATOM 0 H LEU A 51 6.503 4.117 -1.012 1.00 0.00 H new ATOM 0 HA LEU A 51 6.605 4.499 -3.763 1.00 0.00 H new ATOM 0 HB2 LEU A 51 8.160 3.104 -2.460 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.871 1.976 -2.089 1.00 0.00 H new ATOM 0 HG LEU A 51 6.679 1.752 -4.704 1.00 0.00 H new ATOM 0 HD11 LEU A 51 8.839 2.003 -5.841 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.214 3.562 -5.253 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.524 2.740 -4.373 1.00 0.00 H new ATOM 0 HD21 LEU A 51 8.309 -0.089 -4.631 1.00 0.00 H new ATOM 0 HD22 LEU A 51 8.962 0.556 -3.106 1.00 0.00 H new ATOM 0 HD23 LEU A 51 7.289 -0.049 -3.173 1.00 0.00 H new ATOM 264 N ALA A 52 4.297 2.301 -2.811 1.00 0.00 N ATOM 265 CA ALA A 52 3.057 1.645 -3.220 1.00 0.00 C ATOM 266 C ALA A 52 1.985 2.669 -3.559 1.00 0.00 C ATOM 267 O ALA A 52 1.224 2.496 -4.514 1.00 0.00 O ATOM 268 CB ALA A 52 2.554 0.719 -2.131 1.00 0.00 C ATOM 0 H ALA A 52 4.628 2.033 -1.884 1.00 0.00 H new ATOM 0 HA ALA A 52 3.273 1.057 -4.112 1.00 0.00 H new ATOM 0 HB1 ALA A 52 1.630 0.242 -2.457 1.00 0.00 H new ATOM 0 HB2 ALA A 52 3.305 -0.045 -1.927 1.00 0.00 H new ATOM 0 HB3 ALA A 52 2.365 1.293 -1.224 1.00 0.00 H new ATOM 274 N PHE A 53 1.935 3.731 -2.766 1.00 0.00 N ATOM 275 CA PHE A 53 1.047 4.849 -3.030 1.00 0.00 C ATOM 276 C PHE A 53 1.254 5.350 -4.455 1.00 0.00 C ATOM 277 O PHE A 53 0.342 5.315 -5.273 1.00 0.00 O ATOM 278 CB PHE A 53 1.316 5.966 -2.014 1.00 0.00 C ATOM 279 CG PHE A 53 0.567 7.247 -2.266 1.00 0.00 C ATOM 280 CD1 PHE A 53 -0.770 7.368 -1.926 1.00 0.00 C ATOM 281 CD2 PHE A 53 1.214 8.339 -2.821 1.00 0.00 C ATOM 282 CE1 PHE A 53 -1.447 8.553 -2.139 1.00 0.00 C ATOM 283 CE2 PHE A 53 0.540 9.525 -3.039 1.00 0.00 C ATOM 284 CZ PHE A 53 -0.792 9.632 -2.697 1.00 0.00 C ATOM 0 H PHE A 53 2.506 3.839 -1.928 1.00 0.00 H new ATOM 0 HA PHE A 53 0.011 4.527 -2.928 1.00 0.00 H new ATOM 0 HB2 PHE A 53 1.059 5.602 -1.019 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.384 6.182 -2.008 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -1.289 6.527 -1.490 1.00 0.00 H new ATOM 0 HD2 PHE A 53 2.258 8.262 -3.086 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -2.489 8.635 -1.869 1.00 0.00 H new ATOM 0 HE2 PHE A 53 1.055 10.367 -3.477 1.00 0.00 H new ATOM 0 HZ PHE A 53 -1.321 10.558 -2.866 1.00 0.00 H new ATOM 294 N LEU A 54 2.475 5.759 -4.759 1.00 0.00 N ATOM 295 CA LEU A 54 2.810 6.305 -6.071 1.00 0.00 C ATOM 296 C LEU A 54 2.741 5.239 -7.169 1.00 0.00 C ATOM 297 O LEU A 54 2.779 5.560 -8.353 1.00 0.00 O ATOM 298 CB LEU A 54 4.206 6.930 -6.036 1.00 0.00 C ATOM 299 CG LEU A 54 4.367 8.108 -5.071 1.00 0.00 C ATOM 300 CD1 LEU A 54 5.821 8.540 -4.989 1.00 0.00 C ATOM 301 CD2 LEU A 54 3.493 9.277 -5.503 1.00 0.00 C ATOM 0 H LEU A 54 3.261 5.724 -4.109 1.00 0.00 H new ATOM 0 HA LEU A 54 2.071 7.071 -6.308 1.00 0.00 H new ATOM 0 HB2 LEU A 54 4.926 6.158 -5.765 1.00 0.00 H new ATOM 0 HB3 LEU A 54 4.462 7.266 -7.041 1.00 0.00 H new ATOM 0 HG LEU A 54 4.047 7.782 -4.081 1.00 0.00 H new ATOM 0 HD11 LEU A 54 5.913 9.378 -4.298 1.00 0.00 H new ATOM 0 HD12 LEU A 54 6.428 7.708 -4.633 1.00 0.00 H new ATOM 0 HD13 LEU A 54 6.166 8.845 -5.977 1.00 0.00 H new ATOM 0 HD21 LEU A 54 3.621 10.104 -4.805 1.00 0.00 H new ATOM 0 HD22 LEU A 54 3.783 9.598 -6.503 1.00 0.00 H new ATOM 0 HD23 LEU A 54 2.448 8.967 -5.510 1.00 0.00 H new ATOM 313 N ARG A 55 2.641 3.977 -6.775 1.00 0.00 N ATOM 314 CA ARG A 55 2.534 2.881 -7.734 1.00 0.00 C ATOM 315 C ARG A 55 1.106 2.709 -8.221 1.00 0.00 C ATOM 316 O ARG A 55 0.871 2.444 -9.401 1.00 0.00 O ATOM 317 CB ARG A 55 3.011 1.570 -7.114 1.00 0.00 C ATOM 318 CG ARG A 55 4.507 1.512 -6.903 1.00 0.00 C ATOM 319 CD ARG A 55 5.245 1.360 -8.221 1.00 0.00 C ATOM 320 NE ARG A 55 4.925 0.092 -8.880 1.00 0.00 N ATOM 321 CZ ARG A 55 5.032 -0.116 -10.191 1.00 0.00 C ATOM 322 NH1 ARG A 55 5.419 0.866 -10.996 1.00 0.00 N ATOM 323 NH2 ARG A 55 4.747 -1.309 -10.698 1.00 0.00 N ATOM 0 H ARG A 55 2.632 3.684 -5.798 1.00 0.00 H new ATOM 0 HA ARG A 55 3.169 3.134 -8.583 1.00 0.00 H new ATOM 0 HB2 ARG A 55 2.511 1.427 -6.156 1.00 0.00 H new ATOM 0 HB3 ARG A 55 2.710 0.743 -7.757 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.841 2.419 -6.400 1.00 0.00 H new ATOM 0 HG3 ARG A 55 4.752 0.676 -6.248 1.00 0.00 H new ATOM 0 HD2 ARG A 55 4.986 2.188 -8.881 1.00 0.00 H new ATOM 0 HD3 ARG A 55 6.319 1.417 -8.045 1.00 0.00 H new ATOM 0 HE ARG A 55 4.600 -0.680 -8.298 1.00 0.00 H new ATOM 0 HH11 ARG A 55 5.636 1.785 -10.611 1.00 0.00 H new ATOM 0 HH12 ARG A 55 5.499 0.701 -11.999 1.00 0.00 H new ATOM 0 HH21 ARG A 55 4.446 -2.066 -10.084 1.00 0.00 H new ATOM 0 HH22 ARG A 55 4.829 -1.469 -11.702 1.00 0.00 H new ATOM 337 N PHE A 56 0.157 2.843 -7.311 1.00 0.00 N ATOM 338 CA PHE A 56 -1.237 2.606 -7.646 1.00 0.00 C ATOM 339 C PHE A 56 -2.028 3.903 -7.754 1.00 0.00 C ATOM 340 O PHE A 56 -3.182 3.894 -8.182 1.00 0.00 O ATOM 341 CB PHE A 56 -1.872 1.655 -6.631 1.00 0.00 C ATOM 342 CG PHE A 56 -1.468 0.224 -6.845 1.00 0.00 C ATOM 343 CD1 PHE A 56 -2.239 -0.613 -7.636 1.00 0.00 C ATOM 344 CD2 PHE A 56 -0.311 -0.279 -6.272 1.00 0.00 C ATOM 345 CE1 PHE A 56 -1.864 -1.925 -7.851 1.00 0.00 C ATOM 346 CE2 PHE A 56 0.067 -1.591 -6.481 1.00 0.00 C ATOM 347 CZ PHE A 56 -0.710 -2.414 -7.273 1.00 0.00 C ATOM 0 H PHE A 56 0.324 3.113 -6.341 1.00 0.00 H new ATOM 0 HA PHE A 56 -1.266 2.137 -8.629 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -1.588 1.962 -5.625 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -2.957 1.735 -6.694 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -3.143 -0.235 -8.090 1.00 0.00 H new ATOM 0 HD2 PHE A 56 0.302 0.362 -5.655 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -2.473 -2.567 -8.470 1.00 0.00 H new ATOM 0 HE2 PHE A 56 0.969 -1.973 -6.026 1.00 0.00 H new ATOM 0 HZ PHE A 56 -0.415 -3.439 -7.440 1.00 0.00 H new ATOM 357 N THR A 57 -1.420 5.016 -7.372 1.00 0.00 N ATOM 358 CA THR A 57 -2.072 6.311 -7.557 1.00 0.00 C ATOM 359 C THR A 57 -1.490 7.046 -8.759 1.00 0.00 C ATOM 360 O THR A 57 -2.194 7.771 -9.459 1.00 0.00 O ATOM 361 CB THR A 57 -1.961 7.220 -6.311 1.00 0.00 C ATOM 362 OG1 THR A 57 -0.595 7.590 -6.083 1.00 0.00 O ATOM 363 CG2 THR A 57 -2.509 6.522 -5.075 1.00 0.00 C ATOM 0 H THR A 57 -0.496 5.054 -6.941 1.00 0.00 H new ATOM 0 HA THR A 57 -3.127 6.095 -7.726 1.00 0.00 H new ATOM 0 HB THR A 57 -2.553 8.116 -6.499 1.00 0.00 H new ATOM 0 HG1 THR A 57 -0.047 6.782 -5.997 1.00 0.00 H new ATOM 0 HG21 THR A 57 -2.419 7.184 -4.213 1.00 0.00 H new ATOM 0 HG22 THR A 57 -3.558 6.273 -5.233 1.00 0.00 H new ATOM 0 HG23 THR A 57 -1.943 5.609 -4.892 1.00 0.00 H new ATOM 371 N ALA A 58 -0.210 6.828 -9.012 1.00 0.00 N ATOM 372 CA ALA A 58 0.501 7.574 -10.035 1.00 0.00 C ATOM 373 C ALA A 58 1.295 6.643 -10.940 1.00 0.00 C ATOM 374 O ALA A 58 1.266 5.421 -10.777 1.00 0.00 O ATOM 375 CB ALA A 58 1.427 8.584 -9.374 1.00 0.00 C ATOM 0 H ALA A 58 0.359 6.138 -8.521 1.00 0.00 H new ATOM 0 HA ALA A 58 -0.227 8.099 -10.654 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.961 9.144 -10.141 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.840 9.271 -8.765 1.00 0.00 H new ATOM 0 HB3 ALA A 58 2.144 8.061 -8.742 1.00 0.00 H new ATOM 381 N ILE A 59 1.991 7.230 -11.902 1.00 0.00 N ATOM 382 CA ILE A 59 2.860 6.481 -12.793 1.00 0.00 C ATOM 383 C ILE A 59 4.300 6.920 -12.575 1.00 0.00 C ATOM 384 O ILE A 59 4.618 8.102 -12.731 1.00 0.00 O ATOM 385 CB ILE A 59 2.479 6.688 -14.277 1.00 0.00 C ATOM 386 CG1 ILE A 59 1.031 6.250 -14.532 1.00 0.00 C ATOM 387 CG2 ILE A 59 3.435 5.928 -15.189 1.00 0.00 C ATOM 388 CD1 ILE A 59 0.775 4.782 -14.265 1.00 0.00 C ATOM 0 H ILE A 59 1.969 8.233 -12.085 1.00 0.00 H new ATOM 0 HA ILE A 59 2.745 5.422 -12.564 1.00 0.00 H new ATOM 0 HB ILE A 59 2.560 7.751 -14.503 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.367 6.844 -13.904 1.00 0.00 H new ATOM 0 HG13 ILE A 59 0.773 6.471 -15.568 1.00 0.00 H new ATOM 0 HG21 ILE A 59 3.149 6.087 -16.229 1.00 0.00 H new ATOM 0 HG22 ILE A 59 4.451 6.289 -15.033 1.00 0.00 H new ATOM 0 HG23 ILE A 59 3.389 4.864 -14.959 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -0.271 4.552 -14.469 1.00 0.00 H new ATOM 0 HD12 ILE A 59 1.412 4.178 -14.912 1.00 0.00 H new ATOM 0 HD13 ILE A 59 1.000 4.557 -13.222 1.00 0.00 H new ATOM 400 N LYS A 60 5.148 5.964 -12.199 1.00 0.00 N ATOM 401 CA LYS A 60 6.555 6.218 -11.895 1.00 0.00 C ATOM 402 C LYS A 60 6.699 7.076 -10.637 1.00 0.00 C ATOM 403 O LYS A 60 6.478 8.288 -10.667 1.00 0.00 O ATOM 404 CB LYS A 60 7.270 6.885 -13.073 1.00 0.00 C ATOM 405 CG LYS A 60 8.753 7.117 -12.829 1.00 0.00 C ATOM 406 CD LYS A 60 9.412 7.794 -14.016 1.00 0.00 C ATOM 407 CE LYS A 60 10.896 8.022 -13.779 1.00 0.00 C ATOM 408 NZ LYS A 60 11.552 8.664 -14.947 1.00 0.00 N ATOM 0 H LYS A 60 4.877 4.986 -12.096 1.00 0.00 H new ATOM 0 HA LYS A 60 7.026 5.252 -11.713 1.00 0.00 H new ATOM 0 HB2 LYS A 60 7.149 6.264 -13.960 1.00 0.00 H new ATOM 0 HB3 LYS A 60 6.791 7.841 -13.285 1.00 0.00 H new ATOM 0 HG2 LYS A 60 8.885 7.732 -11.939 1.00 0.00 H new ATOM 0 HG3 LYS A 60 9.244 6.164 -12.633 1.00 0.00 H new ATOM 0 HD2 LYS A 60 9.275 7.181 -14.907 1.00 0.00 H new ATOM 0 HD3 LYS A 60 8.923 8.749 -14.208 1.00 0.00 H new ATOM 0 HE2 LYS A 60 11.031 8.649 -12.897 1.00 0.00 H new ATOM 0 HE3 LYS A 60 11.381 7.068 -13.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 12.563 8.802 -14.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 11.446 8.055 -15.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 11.107 9.586 -15.132 1.00 0.00 H new ATOM 422 N PRO A 61 7.065 6.447 -9.511 1.00 0.00 N ATOM 423 CA PRO A 61 7.280 7.149 -8.242 1.00 0.00 C ATOM 424 C PRO A 61 8.406 8.177 -8.338 1.00 0.00 C ATOM 425 O PRO A 61 9.327 8.034 -9.147 1.00 0.00 O ATOM 426 CB PRO A 61 7.663 6.029 -7.265 1.00 0.00 C ATOM 427 CG PRO A 61 7.189 4.770 -7.906 1.00 0.00 C ATOM 428 CD PRO A 61 7.295 5.000 -9.384 1.00 0.00 C ATOM 0 HA PRO A 61 6.398 7.711 -7.936 1.00 0.00 H new ATOM 0 HB2 PRO A 61 8.740 6.004 -7.098 1.00 0.00 H new ATOM 0 HB3 PRO A 61 7.193 6.177 -6.293 1.00 0.00 H new ATOM 0 HG2 PRO A 61 7.798 3.921 -7.598 1.00 0.00 H new ATOM 0 HG3 PRO A 61 6.162 4.547 -7.618 1.00 0.00 H new ATOM 0 HD2 PRO A 61 8.273 4.712 -9.768 1.00 0.00 H new ATOM 0 HD3 PRO A 61 6.553 4.423 -9.936 1.00 0.00 H new ATOM 436 N SER A 62 8.314 9.217 -7.515 1.00 0.00 N ATOM 437 CA SER A 62 9.323 10.265 -7.473 1.00 0.00 C ATOM 438 C SER A 62 10.689 9.678 -7.130 1.00 0.00 C ATOM 439 O SER A 62 10.811 8.810 -6.258 1.00 0.00 O ATOM 440 CB SER A 62 8.923 11.333 -6.449 1.00 0.00 C ATOM 441 OG SER A 62 9.842 12.414 -6.437 1.00 0.00 O ATOM 0 H SER A 62 7.542 9.355 -6.863 1.00 0.00 H new ATOM 0 HA SER A 62 9.390 10.730 -8.457 1.00 0.00 H new ATOM 0 HB2 SER A 62 7.925 11.705 -6.681 1.00 0.00 H new ATOM 0 HB3 SER A 62 8.873 10.886 -5.456 1.00 0.00 H new ATOM 0 HG SER A 62 9.557 13.078 -5.775 1.00 0.00 H new ATOM 447 N LEU A 63 11.711 10.169 -7.828 1.00 0.00 N ATOM 448 CA LEU A 63 13.056 9.612 -7.745 1.00 0.00 C ATOM 449 C LEU A 63 13.628 9.697 -6.337 1.00 0.00 C ATOM 450 O LEU A 63 14.512 8.926 -5.987 1.00 0.00 O ATOM 451 CB LEU A 63 13.991 10.314 -8.732 1.00 0.00 C ATOM 452 CG LEU A 63 13.603 10.175 -10.207 1.00 0.00 C ATOM 453 CD1 LEU A 63 14.624 10.870 -11.092 1.00 0.00 C ATOM 454 CD2 LEU A 63 13.472 8.709 -10.594 1.00 0.00 C ATOM 0 H LEU A 63 11.629 10.962 -8.465 1.00 0.00 H new ATOM 0 HA LEU A 63 12.980 8.557 -8.007 1.00 0.00 H new ATOM 0 HB2 LEU A 63 14.029 11.374 -8.481 1.00 0.00 H new ATOM 0 HB3 LEU A 63 14.998 9.918 -8.599 1.00 0.00 H new ATOM 0 HG LEU A 63 12.635 10.654 -10.353 1.00 0.00 H new ATOM 0 HD11 LEU A 63 14.333 10.762 -12.137 1.00 0.00 H new ATOM 0 HD12 LEU A 63 14.668 11.928 -10.835 1.00 0.00 H new ATOM 0 HD13 LEU A 63 15.605 10.419 -10.940 1.00 0.00 H new ATOM 0 HD21 LEU A 63 13.196 8.634 -11.646 1.00 0.00 H new ATOM 0 HD22 LEU A 63 14.424 8.203 -10.432 1.00 0.00 H new ATOM 0 HD23 LEU A 63 12.702 8.239 -9.982 1.00 0.00 H new ATOM 466 N GLY A 64 13.127 10.626 -5.532 1.00 0.00 N ATOM 467 CA GLY A 64 13.564 10.711 -4.150 1.00 0.00 C ATOM 468 C GLY A 64 13.235 9.448 -3.382 1.00 0.00 C ATOM 469 O GLY A 64 14.065 8.932 -2.623 1.00 0.00 O ATOM 0 H GLY A 64 12.431 11.318 -5.808 1.00 0.00 H new ATOM 0 HA2 GLY A 64 14.639 10.887 -4.118 1.00 0.00 H new ATOM 0 HA3 GLY A 64 13.087 11.565 -3.669 1.00 0.00 H new ATOM 473 N LEU A 65 12.028 8.937 -3.592 1.00 0.00 N ATOM 474 CA LEU A 65 11.613 7.684 -2.982 1.00 0.00 C ATOM 475 C LEU A 65 12.400 6.534 -3.588 1.00 0.00 C ATOM 476 O LEU A 65 12.806 5.620 -2.888 1.00 0.00 O ATOM 477 CB LEU A 65 10.108 7.436 -3.170 1.00 0.00 C ATOM 478 CG LEU A 65 9.161 8.347 -2.375 1.00 0.00 C ATOM 479 CD1 LEU A 65 9.533 8.371 -0.900 1.00 0.00 C ATOM 480 CD2 LEU A 65 9.141 9.754 -2.950 1.00 0.00 C ATOM 0 H LEU A 65 11.319 9.374 -4.182 1.00 0.00 H new ATOM 0 HA LEU A 65 11.813 7.748 -1.912 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.874 7.542 -4.229 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.896 6.402 -2.898 1.00 0.00 H new ATOM 0 HG LEU A 65 8.156 7.934 -2.462 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.846 9.024 -0.362 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.469 7.362 -0.492 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.551 8.744 -0.788 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.462 10.376 -2.367 1.00 0.00 H new ATOM 0 HD22 LEU A 65 10.145 10.177 -2.911 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.802 9.719 -3.985 1.00 0.00 H new ATOM 492 N ILE A 66 12.631 6.611 -4.895 1.00 0.00 N ATOM 493 CA ILE A 66 13.382 5.584 -5.616 1.00 0.00 C ATOM 494 C ILE A 66 14.834 5.519 -5.134 1.00 0.00 C ATOM 495 O ILE A 66 15.432 4.444 -5.053 1.00 0.00 O ATOM 496 CB ILE A 66 13.358 5.851 -7.139 1.00 0.00 C ATOM 497 CG1 ILE A 66 11.915 5.899 -7.649 1.00 0.00 C ATOM 498 CG2 ILE A 66 14.154 4.793 -7.894 1.00 0.00 C ATOM 499 CD1 ILE A 66 11.159 4.595 -7.482 1.00 0.00 C ATOM 0 H ILE A 66 12.307 7.380 -5.482 1.00 0.00 H new ATOM 0 HA ILE A 66 12.900 4.628 -5.413 1.00 0.00 H new ATOM 0 HB ILE A 66 13.826 6.818 -7.320 1.00 0.00 H new ATOM 0 HG12 ILE A 66 11.380 6.688 -7.121 1.00 0.00 H new ATOM 0 HG13 ILE A 66 11.922 6.170 -8.705 1.00 0.00 H new ATOM 0 HG21 ILE A 66 14.120 5.006 -8.963 1.00 0.00 H new ATOM 0 HG22 ILE A 66 15.190 4.806 -7.554 1.00 0.00 H new ATOM 0 HG23 ILE A 66 13.722 3.810 -7.706 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.146 4.710 -7.867 1.00 0.00 H new ATOM 0 HD12 ILE A 66 11.669 3.805 -8.034 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.118 4.331 -6.425 1.00 0.00 H new ATOM 511 N ASN A 67 15.393 6.674 -4.810 1.00 0.00 N ATOM 512 CA ASN A 67 16.768 6.755 -4.330 1.00 0.00 C ATOM 513 C ASN A 67 16.897 6.186 -2.922 1.00 0.00 C ATOM 514 O ASN A 67 17.872 5.499 -2.608 1.00 0.00 O ATOM 515 CB ASN A 67 17.267 8.204 -4.367 1.00 0.00 C ATOM 516 CG ASN A 67 17.605 8.668 -5.773 1.00 0.00 C ATOM 517 OD1 ASN A 67 17.983 7.868 -6.629 1.00 0.00 O ATOM 518 ND2 ASN A 67 17.477 9.962 -6.021 1.00 0.00 N ATOM 0 H ASN A 67 14.915 7.573 -4.870 1.00 0.00 H new ATOM 0 HA ASN A 67 17.388 6.154 -4.995 1.00 0.00 H new ATOM 0 HB2 ASN A 67 16.504 8.858 -3.946 1.00 0.00 H new ATOM 0 HB3 ASN A 67 18.150 8.297 -3.735 1.00 0.00 H new ATOM 0 HD21 ASN A 67 17.695 10.328 -6.948 1.00 0.00 H new ATOM 0 HD22 ASN A 67 17.161 10.593 -5.285 1.00 0.00 H new ATOM 525 N ARG A 68 15.902 6.445 -2.083 1.00 0.00 N ATOM 526 CA ARG A 68 15.925 5.957 -0.706 1.00 0.00 C ATOM 527 C ARG A 68 15.320 4.554 -0.634 1.00 0.00 C ATOM 528 O ARG A 68 15.392 3.874 0.388 1.00 0.00 O ATOM 529 CB ARG A 68 15.165 6.923 0.207 1.00 0.00 C ATOM 530 CG ARG A 68 15.390 6.673 1.688 1.00 0.00 C ATOM 531 CD ARG A 68 14.725 7.742 2.536 1.00 0.00 C ATOM 532 NE ARG A 68 14.980 7.549 3.963 1.00 0.00 N ATOM 533 CZ ARG A 68 14.335 8.199 4.927 1.00 0.00 C ATOM 534 NH1 ARG A 68 13.391 9.076 4.618 1.00 0.00 N ATOM 535 NH2 ARG A 68 14.633 7.975 6.200 1.00 0.00 N ATOM 0 H ARG A 68 15.073 6.987 -2.328 1.00 0.00 H new ATOM 0 HA ARG A 68 16.959 5.903 -0.365 1.00 0.00 H new ATOM 0 HB2 ARG A 68 15.466 7.944 -0.029 1.00 0.00 H new ATOM 0 HB3 ARG A 68 14.099 6.847 -0.007 1.00 0.00 H new ATOM 0 HG2 ARG A 68 14.994 5.694 1.958 1.00 0.00 H new ATOM 0 HG3 ARG A 68 16.460 6.653 1.897 1.00 0.00 H new ATOM 0 HD2 ARG A 68 15.089 8.724 2.233 1.00 0.00 H new ATOM 0 HD3 ARG A 68 13.650 7.731 2.355 1.00 0.00 H new ATOM 0 HE ARG A 68 15.696 6.875 4.235 1.00 0.00 H new ATOM 0 HH11 ARG A 68 13.159 9.252 3.641 1.00 0.00 H new ATOM 0 HH12 ARG A 68 12.896 9.575 5.358 1.00 0.00 H new ATOM 0 HH21 ARG A 68 15.360 7.302 6.443 1.00 0.00 H new ATOM 0 HH22 ARG A 68 14.135 8.476 6.936 1.00 0.00 H new ATOM 549 N TRP A 69 14.749 4.135 -1.751 1.00 0.00 N ATOM 550 CA TRP A 69 14.111 2.830 -1.892 1.00 0.00 C ATOM 551 C TRP A 69 15.092 1.706 -1.566 1.00 0.00 C ATOM 552 O TRP A 69 14.755 0.750 -0.873 1.00 0.00 O ATOM 553 CB TRP A 69 13.604 2.712 -3.332 1.00 0.00 C ATOM 554 CG TRP A 69 12.736 1.530 -3.625 1.00 0.00 C ATOM 555 CD1 TRP A 69 11.735 1.022 -2.855 1.00 0.00 C ATOM 556 CD2 TRP A 69 12.771 0.736 -4.812 1.00 0.00 C ATOM 557 NE1 TRP A 69 11.151 -0.048 -3.489 1.00 0.00 N ATOM 558 CE2 TRP A 69 11.772 -0.243 -4.694 1.00 0.00 C ATOM 559 CE3 TRP A 69 13.557 0.759 -5.960 1.00 0.00 C ATOM 560 CZ2 TRP A 69 11.539 -1.188 -5.687 1.00 0.00 C ATOM 561 CZ3 TRP A 69 13.327 -0.177 -6.946 1.00 0.00 C ATOM 562 CH2 TRP A 69 12.323 -1.139 -6.804 1.00 0.00 C ATOM 0 H TRP A 69 14.713 4.698 -2.601 1.00 0.00 H new ATOM 0 HA TRP A 69 13.280 2.740 -1.192 1.00 0.00 H new ATOM 0 HB2 TRP A 69 13.047 3.617 -3.576 1.00 0.00 H new ATOM 0 HB3 TRP A 69 14.466 2.679 -3.998 1.00 0.00 H new ATOM 0 HD1 TRP A 69 11.443 1.404 -1.888 1.00 0.00 H new ATOM 0 HE1 TRP A 69 10.380 -0.606 -3.122 1.00 0.00 H new ATOM 0 HE3 TRP A 69 14.335 1.499 -6.077 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 10.766 -1.934 -5.579 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 13.931 -0.167 -7.841 1.00 0.00 H new ATOM 0 HH2 TRP A 69 12.164 -1.858 -7.594 1.00 0.00 H new ATOM 573 N GLY A 70 16.323 1.851 -2.037 1.00 0.00 N ATOM 574 CA GLY A 70 17.328 0.831 -1.806 1.00 0.00 C ATOM 575 C GLY A 70 17.970 0.944 -0.437 1.00 0.00 C ATOM 576 O GLY A 70 18.821 0.132 -0.076 1.00 0.00 O ATOM 0 H GLY A 70 16.644 2.656 -2.575 1.00 0.00 H new ATOM 0 HA2 GLY A 70 16.871 -0.153 -1.909 1.00 0.00 H new ATOM 0 HA3 GLY A 70 18.100 0.906 -2.572 1.00 0.00 H new ATOM 580 N SER A 71 17.558 1.947 0.329 1.00 0.00 N ATOM 581 CA SER A 71 18.109 2.167 1.657 1.00 0.00 C ATOM 582 C SER A 71 17.319 1.382 2.692 1.00 0.00 C ATOM 583 O SER A 71 17.754 1.232 3.838 1.00 0.00 O ATOM 584 CB SER A 71 18.108 3.663 1.995 1.00 0.00 C ATOM 585 OG SER A 71 18.758 3.922 3.229 1.00 0.00 O ATOM 0 H SER A 71 16.844 2.620 0.052 1.00 0.00 H new ATOM 0 HA SER A 71 19.140 1.814 1.671 1.00 0.00 H new ATOM 0 HB2 SER A 71 18.605 4.216 1.198 1.00 0.00 H new ATOM 0 HB3 SER A 71 17.081 4.025 2.042 1.00 0.00 H new ATOM 0 HG SER A 71 18.635 3.158 3.830 1.00 0.00 H new ATOM 591 N VAL A 72 16.161 0.879 2.285 1.00 0.00 N ATOM 592 CA VAL A 72 15.372 0.013 3.140 1.00 0.00 C ATOM 593 C VAL A 72 16.168 -1.260 3.420 1.00 0.00 C ATOM 594 O VAL A 72 16.888 -1.756 2.545 1.00 0.00 O ATOM 595 CB VAL A 72 14.009 -0.333 2.496 1.00 0.00 C ATOM 596 CG1 VAL A 72 13.132 -1.114 3.462 1.00 0.00 C ATOM 597 CG2 VAL A 72 13.298 0.933 2.038 1.00 0.00 C ATOM 0 H VAL A 72 15.751 1.058 1.368 1.00 0.00 H new ATOM 0 HA VAL A 72 15.163 0.535 4.074 1.00 0.00 H new ATOM 0 HB VAL A 72 14.197 -0.961 1.625 1.00 0.00 H new ATOM 0 HG11 VAL A 72 12.180 -1.344 2.984 1.00 0.00 H new ATOM 0 HG12 VAL A 72 13.633 -2.042 3.739 1.00 0.00 H new ATOM 0 HG13 VAL A 72 12.954 -0.517 4.356 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.341 0.670 1.587 1.00 0.00 H new ATOM 0 HG22 VAL A 72 13.129 1.585 2.895 1.00 0.00 H new ATOM 0 HG23 VAL A 72 13.915 1.451 1.304 1.00 0.00 H new ATOM 607 N GLY A 73 16.045 -1.779 4.632 1.00 0.00 N ATOM 608 CA GLY A 73 16.901 -2.858 5.084 1.00 0.00 C ATOM 609 C GLY A 73 16.605 -4.206 4.451 1.00 0.00 C ATOM 610 O GLY A 73 17.054 -5.216 4.974 1.00 0.00 O ATOM 0 H GLY A 73 15.359 -1.468 5.319 1.00 0.00 H new ATOM 0 HA2 GLY A 73 17.938 -2.593 4.876 1.00 0.00 H new ATOM 0 HA3 GLY A 73 16.806 -2.951 6.166 1.00 0.00 H new ATOM 614 N LYS A 74 15.875 -4.198 3.318 1.00 0.00 N ATOM 615 CA LYS A 74 15.501 -5.403 2.534 1.00 0.00 C ATOM 616 C LYS A 74 14.859 -6.516 3.376 1.00 0.00 C ATOM 617 O LYS A 74 13.688 -6.832 3.181 1.00 0.00 O ATOM 618 CB LYS A 74 16.667 -5.920 1.663 1.00 0.00 C ATOM 619 CG LYS A 74 18.041 -5.918 2.319 1.00 0.00 C ATOM 620 CD LYS A 74 19.158 -5.888 1.283 1.00 0.00 C ATOM 621 CE LYS A 74 19.155 -4.587 0.481 1.00 0.00 C ATOM 622 NZ LYS A 74 19.299 -3.386 1.351 1.00 0.00 N ATOM 0 H LYS A 74 15.518 -3.335 2.909 1.00 0.00 H new ATOM 0 HA LYS A 74 14.717 -5.073 1.852 1.00 0.00 H new ATOM 0 HB2 LYS A 74 16.437 -6.938 1.350 1.00 0.00 H new ATOM 0 HB3 LYS A 74 16.717 -5.312 0.759 1.00 0.00 H new ATOM 0 HG2 LYS A 74 18.130 -5.053 2.976 1.00 0.00 H new ATOM 0 HG3 LYS A 74 18.148 -6.805 2.944 1.00 0.00 H new ATOM 0 HD2 LYS A 74 20.120 -6.005 1.782 1.00 0.00 H new ATOM 0 HD3 LYS A 74 19.047 -6.733 0.604 1.00 0.00 H new ATOM 0 HE2 LYS A 74 19.969 -4.608 -0.244 1.00 0.00 H new ATOM 0 HE3 LYS A 74 18.226 -4.514 -0.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 19.829 -2.650 0.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 18.357 -3.024 1.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 19.812 -3.645 2.218 1.00 0.00 H new ATOM 636 N LYS A 75 15.610 -7.106 4.290 1.00 0.00 N ATOM 637 CA LYS A 75 15.051 -8.012 5.283 1.00 0.00 C ATOM 638 C LYS A 75 13.931 -7.295 6.029 1.00 0.00 C ATOM 639 O LYS A 75 12.817 -7.805 6.174 1.00 0.00 O ATOM 640 CB LYS A 75 16.154 -8.434 6.256 1.00 0.00 C ATOM 641 CG LYS A 75 15.728 -9.521 7.223 1.00 0.00 C ATOM 642 CD LYS A 75 14.988 -8.966 8.426 1.00 0.00 C ATOM 643 CE LYS A 75 14.469 -10.079 9.322 1.00 0.00 C ATOM 644 NZ LYS A 75 15.571 -10.910 9.874 1.00 0.00 N ATOM 0 H LYS A 75 16.618 -6.973 4.366 1.00 0.00 H new ATOM 0 HA LYS A 75 14.647 -8.902 4.800 1.00 0.00 H new ATOM 0 HB2 LYS A 75 17.015 -8.783 5.686 1.00 0.00 H new ATOM 0 HB3 LYS A 75 16.480 -7.562 6.823 1.00 0.00 H new ATOM 0 HG2 LYS A 75 15.089 -10.235 6.704 1.00 0.00 H new ATOM 0 HG3 LYS A 75 16.608 -10.068 7.561 1.00 0.00 H new ATOM 0 HD2 LYS A 75 15.653 -8.318 8.997 1.00 0.00 H new ATOM 0 HD3 LYS A 75 14.154 -8.350 8.089 1.00 0.00 H new ATOM 0 HE2 LYS A 75 13.896 -9.647 10.142 1.00 0.00 H new ATOM 0 HE3 LYS A 75 13.787 -10.712 8.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 15.191 -11.557 10.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 16.006 -11.463 9.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 16.288 -10.293 10.306 1.00 0.00 H new ATOM 658 N GLU A 76 14.269 -6.111 6.510 1.00 0.00 N ATOM 659 CA GLU A 76 13.301 -5.190 7.100 1.00 0.00 C ATOM 660 C GLU A 76 12.077 -5.040 6.197 1.00 0.00 C ATOM 661 O GLU A 76 10.938 -5.123 6.657 1.00 0.00 O ATOM 662 CB GLU A 76 13.951 -3.819 7.301 1.00 0.00 C ATOM 663 CG GLU A 76 13.023 -2.783 7.912 1.00 0.00 C ATOM 664 CD GLU A 76 13.274 -1.393 7.377 1.00 0.00 C ATOM 665 OE1 GLU A 76 14.281 -1.198 6.658 1.00 0.00 O ATOM 666 OE2 GLU A 76 12.469 -0.491 7.687 1.00 0.00 O ATOM 0 H GLU A 76 15.225 -5.756 6.504 1.00 0.00 H new ATOM 0 HA GLU A 76 12.982 -5.594 8.061 1.00 0.00 H new ATOM 0 HB2 GLU A 76 14.825 -3.933 7.942 1.00 0.00 H new ATOM 0 HB3 GLU A 76 14.307 -3.452 6.338 1.00 0.00 H new ATOM 0 HG2 GLU A 76 11.989 -3.064 7.713 1.00 0.00 H new ATOM 0 HG3 GLU A 76 13.150 -2.780 8.995 1.00 0.00 H new ATOM 673 N ALA A 77 12.329 -4.832 4.907 1.00 0.00 N ATOM 674 CA ALA A 77 11.263 -4.653 3.930 1.00 0.00 C ATOM 675 C ALA A 77 10.377 -5.890 3.849 1.00 0.00 C ATOM 676 O ALA A 77 9.171 -5.778 3.658 1.00 0.00 O ATOM 677 CB ALA A 77 11.843 -4.326 2.563 1.00 0.00 C ATOM 0 H ALA A 77 13.269 -4.783 4.514 1.00 0.00 H new ATOM 0 HA ALA A 77 10.645 -3.817 4.257 1.00 0.00 H new ATOM 0 HB1 ALA A 77 11.033 -4.196 1.846 1.00 0.00 H new ATOM 0 HB2 ALA A 77 12.424 -3.406 2.625 1.00 0.00 H new ATOM 0 HB3 ALA A 77 12.488 -5.142 2.237 1.00 0.00 H new ATOM 683 N MET A 78 10.980 -7.066 4.000 1.00 0.00 N ATOM 684 CA MET A 78 10.229 -8.319 4.010 1.00 0.00 C ATOM 685 C MET A 78 9.190 -8.288 5.118 1.00 0.00 C ATOM 686 O MET A 78 8.032 -8.658 4.911 1.00 0.00 O ATOM 687 CB MET A 78 11.160 -9.518 4.218 1.00 0.00 C ATOM 688 CG MET A 78 12.210 -9.679 3.135 1.00 0.00 C ATOM 689 SD MET A 78 13.346 -11.036 3.477 1.00 0.00 S ATOM 690 CE MET A 78 14.431 -10.922 2.059 1.00 0.00 C ATOM 0 H MET A 78 11.987 -7.178 4.117 1.00 0.00 H new ATOM 0 HA MET A 78 9.736 -8.427 3.044 1.00 0.00 H new ATOM 0 HB2 MET A 78 11.659 -9.414 5.181 1.00 0.00 H new ATOM 0 HB3 MET A 78 10.560 -10.427 4.266 1.00 0.00 H new ATOM 0 HG2 MET A 78 11.718 -9.853 2.178 1.00 0.00 H new ATOM 0 HG3 MET A 78 12.774 -8.751 3.039 1.00 0.00 H new ATOM 0 HE1 MET A 78 14.380 -11.848 1.486 1.00 0.00 H new ATOM 0 HE2 MET A 78 14.120 -10.088 1.429 1.00 0.00 H new ATOM 0 HE3 MET A 78 15.455 -10.760 2.396 1.00 0.00 H new ATOM 700 N GLU A 79 9.616 -7.827 6.288 1.00 0.00 N ATOM 701 CA GLU A 79 8.729 -7.695 7.435 1.00 0.00 C ATOM 702 C GLU A 79 7.636 -6.665 7.168 1.00 0.00 C ATOM 703 O GLU A 79 6.466 -6.895 7.478 1.00 0.00 O ATOM 704 CB GLU A 79 9.526 -7.301 8.670 1.00 0.00 C ATOM 705 CG GLU A 79 10.469 -8.392 9.138 1.00 0.00 C ATOM 706 CD GLU A 79 9.738 -9.655 9.539 1.00 0.00 C ATOM 707 OE1 GLU A 79 9.223 -9.708 10.677 1.00 0.00 O ATOM 708 OE2 GLU A 79 9.675 -10.601 8.729 1.00 0.00 O ATOM 0 H GLU A 79 10.577 -7.537 6.467 1.00 0.00 H new ATOM 0 HA GLU A 79 8.253 -8.660 7.608 1.00 0.00 H new ATOM 0 HB2 GLU A 79 10.100 -6.400 8.453 1.00 0.00 H new ATOM 0 HB3 GLU A 79 8.837 -7.053 9.477 1.00 0.00 H new ATOM 0 HG2 GLU A 79 11.177 -8.623 8.342 1.00 0.00 H new ATOM 0 HG3 GLU A 79 11.050 -8.027 9.985 1.00 0.00 H new ATOM 715 N ILE A 80 8.031 -5.535 6.587 1.00 0.00 N ATOM 716 CA ILE A 80 7.094 -4.465 6.255 1.00 0.00 C ATOM 717 C ILE A 80 6.058 -4.945 5.245 1.00 0.00 C ATOM 718 O ILE A 80 4.857 -4.813 5.466 1.00 0.00 O ATOM 719 CB ILE A 80 7.826 -3.234 5.675 1.00 0.00 C ATOM 720 CG1 ILE A 80 8.878 -2.726 6.661 1.00 0.00 C ATOM 721 CG2 ILE A 80 6.832 -2.127 5.340 1.00 0.00 C ATOM 722 CD1 ILE A 80 9.738 -1.613 6.107 1.00 0.00 C ATOM 0 H ILE A 80 8.999 -5.336 6.335 1.00 0.00 H new ATOM 0 HA ILE A 80 6.596 -4.178 7.181 1.00 0.00 H new ATOM 0 HB ILE A 80 8.328 -3.534 4.755 1.00 0.00 H new ATOM 0 HG12 ILE A 80 8.378 -2.373 7.563 1.00 0.00 H new ATOM 0 HG13 ILE A 80 9.519 -3.557 6.956 1.00 0.00 H new ATOM 0 HG21 ILE A 80 7.367 -1.269 4.933 1.00 0.00 H new ATOM 0 HG22 ILE A 80 6.116 -2.491 4.603 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.302 -1.828 6.244 1.00 0.00 H new ATOM 0 HD11 ILE A 80 10.461 -1.303 6.861 1.00 0.00 H new ATOM 0 HD12 ILE A 80 10.266 -1.967 5.222 1.00 0.00 H new ATOM 0 HD13 ILE A 80 9.108 -0.765 5.838 1.00 0.00 H new ATOM 734 N ILE A 81 6.537 -5.517 4.145 1.00 0.00 N ATOM 735 CA ILE A 81 5.666 -6.014 3.085 1.00 0.00 C ATOM 736 C ILE A 81 4.742 -7.109 3.612 1.00 0.00 C ATOM 737 O ILE A 81 3.586 -7.210 3.201 1.00 0.00 O ATOM 738 CB ILE A 81 6.491 -6.549 1.888 1.00 0.00 C ATOM 739 CG1 ILE A 81 7.290 -5.415 1.236 1.00 0.00 C ATOM 740 CG2 ILE A 81 5.596 -7.225 0.861 1.00 0.00 C ATOM 741 CD1 ILE A 81 6.433 -4.289 0.693 1.00 0.00 C ATOM 0 H ILE A 81 7.532 -5.649 3.964 1.00 0.00 H new ATOM 0 HA ILE A 81 5.059 -5.178 2.739 1.00 0.00 H new ATOM 0 HB ILE A 81 7.189 -7.294 2.270 1.00 0.00 H new ATOM 0 HG12 ILE A 81 7.986 -5.007 1.969 1.00 0.00 H new ATOM 0 HG13 ILE A 81 7.888 -5.827 0.423 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.204 -7.590 0.033 1.00 0.00 H new ATOM 0 HG22 ILE A 81 5.076 -8.062 1.326 1.00 0.00 H new ATOM 0 HG23 ILE A 81 4.866 -6.508 0.486 1.00 0.00 H new ATOM 0 HD11 ILE A 81 7.073 -3.527 0.248 1.00 0.00 H new ATOM 0 HD12 ILE A 81 5.755 -4.681 -0.065 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.854 -3.848 1.505 1.00 0.00 H new ATOM 753 N LYS A 82 5.252 -7.912 4.538 1.00 0.00 N ATOM 754 CA LYS A 82 4.454 -8.957 5.164 1.00 0.00 C ATOM 755 C LYS A 82 3.262 -8.343 5.891 1.00 0.00 C ATOM 756 O LYS A 82 2.118 -8.737 5.668 1.00 0.00 O ATOM 757 CB LYS A 82 5.309 -9.765 6.146 1.00 0.00 C ATOM 758 CG LYS A 82 4.563 -10.912 6.813 1.00 0.00 C ATOM 759 CD LYS A 82 4.192 -12.015 5.826 1.00 0.00 C ATOM 760 CE LYS A 82 5.331 -13.007 5.613 1.00 0.00 C ATOM 761 NZ LYS A 82 6.522 -12.393 4.970 1.00 0.00 N ATOM 0 H LYS A 82 6.214 -7.859 4.871 1.00 0.00 H new ATOM 0 HA LYS A 82 4.087 -9.627 4.387 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.173 -10.166 5.616 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.690 -9.095 6.917 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.181 -11.331 7.607 1.00 0.00 H new ATOM 0 HG3 LYS A 82 3.657 -10.529 7.283 1.00 0.00 H new ATOM 0 HD2 LYS A 82 3.314 -12.547 6.192 1.00 0.00 H new ATOM 0 HD3 LYS A 82 3.919 -11.568 4.870 1.00 0.00 H new ATOM 0 HE2 LYS A 82 5.622 -13.430 6.574 1.00 0.00 H new ATOM 0 HE3 LYS A 82 4.976 -13.832 4.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 7.048 -13.121 4.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 6.216 -11.647 4.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 7.137 -11.980 5.700 1.00 0.00 H new ATOM 775 N LYS A 83 3.540 -7.362 6.742 1.00 0.00 N ATOM 776 CA LYS A 83 2.497 -6.668 7.488 1.00 0.00 C ATOM 777 C LYS A 83 1.588 -5.887 6.547 1.00 0.00 C ATOM 778 O LYS A 83 0.388 -5.758 6.792 1.00 0.00 O ATOM 779 CB LYS A 83 3.120 -5.717 8.509 1.00 0.00 C ATOM 780 CG LYS A 83 3.901 -6.423 9.604 1.00 0.00 C ATOM 781 CD LYS A 83 4.612 -5.433 10.515 1.00 0.00 C ATOM 782 CE LYS A 83 3.640 -4.449 11.148 1.00 0.00 C ATOM 783 NZ LYS A 83 4.323 -3.511 12.076 1.00 0.00 N ATOM 0 H LYS A 83 4.485 -7.028 6.933 1.00 0.00 H new ATOM 0 HA LYS A 83 1.900 -7.415 8.011 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.783 -5.025 7.990 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.330 -5.120 8.965 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.223 -7.040 10.195 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.633 -7.094 9.154 1.00 0.00 H new ATOM 0 HD2 LYS A 83 5.142 -5.975 11.298 1.00 0.00 H new ATOM 0 HD3 LYS A 83 5.362 -4.886 9.943 1.00 0.00 H new ATOM 0 HE2 LYS A 83 3.137 -3.882 10.365 1.00 0.00 H new ATOM 0 HE3 LYS A 83 2.870 -4.998 11.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 3.625 -2.858 12.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.782 -4.049 12.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 5.041 -2.968 11.555 1.00 0.00 H new ATOM 797 N PHE A 84 2.176 -5.367 5.478 1.00 0.00 N ATOM 798 CA PHE A 84 1.437 -4.609 4.480 1.00 0.00 C ATOM 799 C PHE A 84 0.355 -5.484 3.855 1.00 0.00 C ATOM 800 O PHE A 84 -0.818 -5.115 3.829 1.00 0.00 O ATOM 801 CB PHE A 84 2.395 -4.100 3.400 1.00 0.00 C ATOM 802 CG PHE A 84 2.010 -2.769 2.816 1.00 0.00 C ATOM 803 CD1 PHE A 84 0.912 -2.648 1.982 1.00 0.00 C ATOM 804 CD2 PHE A 84 2.759 -1.638 3.101 1.00 0.00 C ATOM 805 CE1 PHE A 84 0.566 -1.424 1.443 1.00 0.00 C ATOM 806 CE2 PHE A 84 2.418 -0.411 2.565 1.00 0.00 C ATOM 807 CZ PHE A 84 1.320 -0.304 1.735 1.00 0.00 C ATOM 0 H PHE A 84 3.172 -5.458 5.280 1.00 0.00 H new ATOM 0 HA PHE A 84 0.961 -3.755 4.961 1.00 0.00 H new ATOM 0 HB2 PHE A 84 3.396 -4.023 3.824 1.00 0.00 H new ATOM 0 HB3 PHE A 84 2.445 -4.836 2.598 1.00 0.00 H new ATOM 0 HD1 PHE A 84 0.319 -3.520 1.750 1.00 0.00 H new ATOM 0 HD2 PHE A 84 3.619 -1.717 3.749 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -0.293 -1.343 0.794 1.00 0.00 H new ATOM 0 HE2 PHE A 84 3.009 0.463 2.795 1.00 0.00 H new ATOM 0 HZ PHE A 84 1.051 0.654 1.315 1.00 0.00 H new ATOM 817 N LYS A 85 0.758 -6.657 3.378 1.00 0.00 N ATOM 818 CA LYS A 85 -0.174 -7.600 2.769 1.00 0.00 C ATOM 819 C LYS A 85 -1.207 -8.086 3.784 1.00 0.00 C ATOM 820 O LYS A 85 -2.369 -8.313 3.437 1.00 0.00 O ATOM 821 CB LYS A 85 0.578 -8.794 2.178 1.00 0.00 C ATOM 822 CG LYS A 85 1.538 -8.420 1.059 1.00 0.00 C ATOM 823 CD LYS A 85 2.180 -9.653 0.446 1.00 0.00 C ATOM 824 CE LYS A 85 3.125 -9.288 -0.687 1.00 0.00 C ATOM 825 NZ LYS A 85 3.770 -10.489 -1.274 1.00 0.00 N ATOM 0 H LYS A 85 1.726 -6.978 3.401 1.00 0.00 H new ATOM 0 HA LYS A 85 -0.697 -7.079 1.967 1.00 0.00 H new ATOM 0 HB2 LYS A 85 1.136 -9.290 2.972 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -0.145 -9.516 1.798 1.00 0.00 H new ATOM 0 HG2 LYS A 85 1.003 -7.865 0.288 1.00 0.00 H new ATOM 0 HG3 LYS A 85 2.313 -7.759 1.448 1.00 0.00 H new ATOM 0 HD2 LYS A 85 2.727 -10.199 1.215 1.00 0.00 H new ATOM 0 HD3 LYS A 85 1.403 -10.320 0.072 1.00 0.00 H new ATOM 0 HE2 LYS A 85 2.574 -8.755 -1.462 1.00 0.00 H new ATOM 0 HE3 LYS A 85 3.892 -8.608 -0.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 4.758 -10.270 -1.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 3.746 -11.268 -0.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 3.259 -10.772 -2.134 1.00 0.00 H new ATOM 839 N LYS A 86 -0.781 -8.240 5.035 1.00 0.00 N ATOM 840 CA LYS A 86 -1.680 -8.665 6.104 1.00 0.00 C ATOM 841 C LYS A 86 -2.765 -7.622 6.349 1.00 0.00 C ATOM 842 O LYS A 86 -3.945 -7.959 6.477 1.00 0.00 O ATOM 843 CB LYS A 86 -0.911 -8.916 7.405 1.00 0.00 C ATOM 844 CG LYS A 86 -0.075 -10.185 7.401 1.00 0.00 C ATOM 845 CD LYS A 86 0.611 -10.394 8.743 1.00 0.00 C ATOM 846 CE LYS A 86 1.371 -11.708 8.790 1.00 0.00 C ATOM 847 NZ LYS A 86 2.030 -11.923 10.106 1.00 0.00 N ATOM 0 H LYS A 86 0.181 -8.077 5.333 1.00 0.00 H new ATOM 0 HA LYS A 86 -2.147 -9.597 5.785 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -0.258 -8.065 7.597 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -1.622 -8.965 8.230 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -0.710 -11.042 7.177 1.00 0.00 H new ATOM 0 HG3 LYS A 86 0.674 -10.128 6.611 1.00 0.00 H new ATOM 0 HD2 LYS A 86 1.299 -9.570 8.932 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -0.134 -10.376 9.539 1.00 0.00 H new ATOM 0 HE2 LYS A 86 0.685 -12.531 8.589 1.00 0.00 H new ATOM 0 HE3 LYS A 86 2.123 -11.720 8.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 2.538 -12.831 10.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 2.704 -11.152 10.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 1.310 -11.937 10.856 1.00 0.00 H new ATOM 861 N ASP A 87 -2.364 -6.358 6.405 1.00 0.00 N ATOM 862 CA ASP A 87 -3.302 -5.272 6.672 1.00 0.00 C ATOM 863 C ASP A 87 -4.265 -5.118 5.502 1.00 0.00 C ATOM 864 O ASP A 87 -5.460 -4.889 5.692 1.00 0.00 O ATOM 865 CB ASP A 87 -2.550 -3.959 6.924 1.00 0.00 C ATOM 866 CG ASP A 87 -3.373 -2.949 7.705 1.00 0.00 C ATOM 867 OD1 ASP A 87 -3.821 -1.943 7.122 1.00 0.00 O ATOM 868 OD2 ASP A 87 -3.559 -3.151 8.929 1.00 0.00 O ATOM 0 H ASP A 87 -1.398 -6.059 6.270 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.872 -5.515 7.569 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -1.631 -4.171 7.470 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -2.260 -3.523 5.968 1.00 0.00 H new ATOM 873 N LEU A 88 -3.735 -5.281 4.292 1.00 0.00 N ATOM 874 CA LEU A 88 -4.545 -5.236 3.079 1.00 0.00 C ATOM 875 C LEU A 88 -5.609 -6.327 3.100 1.00 0.00 C ATOM 876 O LEU A 88 -6.750 -6.104 2.698 1.00 0.00 O ATOM 877 CB LEU A 88 -3.669 -5.412 1.835 1.00 0.00 C ATOM 878 CG LEU A 88 -2.656 -4.298 1.571 1.00 0.00 C ATOM 879 CD1 LEU A 88 -1.830 -4.620 0.335 1.00 0.00 C ATOM 880 CD2 LEU A 88 -3.358 -2.957 1.412 1.00 0.00 C ATOM 0 H LEU A 88 -2.742 -5.446 4.126 1.00 0.00 H new ATOM 0 HA LEU A 88 -5.030 -4.261 3.042 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -3.129 -6.355 1.925 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -4.320 -5.499 0.965 1.00 0.00 H new ATOM 0 HG LEU A 88 -1.987 -4.230 2.429 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.112 -3.819 0.158 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.296 -5.558 0.488 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -2.489 -4.714 -0.528 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.618 -2.179 1.225 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -4.052 -3.007 0.573 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.907 -2.724 2.324 1.00 0.00 H new ATOM 892 N ALA A 89 -5.222 -7.506 3.577 1.00 0.00 N ATOM 893 CA ALA A 89 -6.127 -8.643 3.649 1.00 0.00 C ATOM 894 C ALA A 89 -7.302 -8.345 4.569 1.00 0.00 C ATOM 895 O ALA A 89 -8.456 -8.590 4.219 1.00 0.00 O ATOM 896 CB ALA A 89 -5.380 -9.878 4.128 1.00 0.00 C ATOM 0 H ALA A 89 -4.281 -7.697 3.921 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.519 -8.833 2.650 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -6.067 -10.722 4.178 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -4.573 -10.108 3.432 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -4.963 -9.690 5.118 1.00 0.00 H new ATOM 902 N ALA A 90 -6.999 -7.802 5.741 1.00 0.00 N ATOM 903 CA ALA A 90 -8.025 -7.465 6.716 1.00 0.00 C ATOM 904 C ALA A 90 -8.961 -6.394 6.169 1.00 0.00 C ATOM 905 O ALA A 90 -10.183 -6.529 6.238 1.00 0.00 O ATOM 906 CB ALA A 90 -7.385 -7.000 8.015 1.00 0.00 C ATOM 0 H ALA A 90 -6.048 -7.585 6.039 1.00 0.00 H new ATOM 0 HA ALA A 90 -8.614 -8.360 6.917 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -8.164 -6.751 8.736 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -6.759 -7.796 8.418 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -6.773 -6.119 7.824 1.00 0.00 H new ATOM 912 N MET A 91 -8.375 -5.344 5.604 1.00 0.00 N ATOM 913 CA MET A 91 -9.142 -4.237 5.044 1.00 0.00 C ATOM 914 C MET A 91 -10.045 -4.707 3.908 1.00 0.00 C ATOM 915 O MET A 91 -11.181 -4.252 3.785 1.00 0.00 O ATOM 916 CB MET A 91 -8.197 -3.133 4.563 1.00 0.00 C ATOM 917 CG MET A 91 -7.900 -2.081 5.624 1.00 0.00 C ATOM 918 SD MET A 91 -7.554 -2.784 7.249 1.00 0.00 S ATOM 919 CE MET A 91 -7.584 -1.305 8.256 1.00 0.00 C ATOM 0 H MET A 91 -7.364 -5.236 5.521 1.00 0.00 H new ATOM 0 HA MET A 91 -9.783 -3.835 5.829 1.00 0.00 H new ATOM 0 HB2 MET A 91 -7.260 -3.584 4.238 1.00 0.00 H new ATOM 0 HB3 MET A 91 -8.635 -2.645 3.692 1.00 0.00 H new ATOM 0 HG2 MET A 91 -7.046 -1.484 5.305 1.00 0.00 H new ATOM 0 HG3 MET A 91 -8.751 -1.404 5.702 1.00 0.00 H new ATOM 0 HE1 MET A 91 -7.039 -1.485 9.183 1.00 0.00 H new ATOM 0 HE2 MET A 91 -7.115 -0.485 7.712 1.00 0.00 H new ATOM 0 HE3 MET A 91 -8.617 -1.043 8.487 1.00 0.00 H new ATOM 929 N LEU A 92 -9.538 -5.629 3.097 1.00 0.00 N ATOM 930 CA LEU A 92 -10.313 -6.213 2.006 1.00 0.00 C ATOM 931 C LEU A 92 -11.574 -6.891 2.536 1.00 0.00 C ATOM 932 O LEU A 92 -12.673 -6.697 2.008 1.00 0.00 O ATOM 933 CB LEU A 92 -9.457 -7.229 1.242 1.00 0.00 C ATOM 934 CG LEU A 92 -10.192 -8.034 0.169 1.00 0.00 C ATOM 935 CD1 LEU A 92 -10.782 -7.112 -0.884 1.00 0.00 C ATOM 936 CD2 LEU A 92 -9.252 -9.045 -0.468 1.00 0.00 C ATOM 0 H LEU A 92 -8.587 -5.991 3.175 1.00 0.00 H new ATOM 0 HA LEU A 92 -10.612 -5.411 1.330 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.629 -6.699 0.771 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -9.023 -7.925 1.960 1.00 0.00 H new ATOM 0 HG LEU A 92 -11.012 -8.574 0.643 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -11.300 -7.705 -1.638 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.487 -6.427 -0.414 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -9.983 -6.542 -1.358 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.788 -9.611 -1.230 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -8.413 -8.523 -0.928 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -8.880 -9.727 0.296 1.00 0.00 H new ATOM 948 N ARG A 93 -11.403 -7.676 3.591 1.00 0.00 N ATOM 949 CA ARG A 93 -12.512 -8.395 4.205 1.00 0.00 C ATOM 950 C ARG A 93 -13.563 -7.419 4.726 1.00 0.00 C ATOM 951 O ARG A 93 -14.766 -7.684 4.653 1.00 0.00 O ATOM 952 CB ARG A 93 -11.999 -9.278 5.344 1.00 0.00 C ATOM 953 CG ARG A 93 -10.948 -10.283 4.901 1.00 0.00 C ATOM 954 CD ARG A 93 -10.327 -11.002 6.086 1.00 0.00 C ATOM 955 NE ARG A 93 -9.181 -11.823 5.694 1.00 0.00 N ATOM 956 CZ ARG A 93 -8.225 -12.219 6.538 1.00 0.00 C ATOM 957 NH1 ARG A 93 -8.289 -11.887 7.824 1.00 0.00 N ATOM 958 NH2 ARG A 93 -7.206 -12.950 6.095 1.00 0.00 N ATOM 0 H ARG A 93 -10.501 -7.832 4.042 1.00 0.00 H new ATOM 0 HA ARG A 93 -12.976 -9.028 3.448 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -11.579 -8.644 6.125 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -12.839 -9.813 5.786 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -11.401 -11.012 4.229 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -10.169 -9.771 4.337 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -10.010 -10.269 6.828 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -11.078 -11.633 6.561 1.00 0.00 H new ATOM 0 HE ARG A 93 -9.108 -12.110 4.718 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -9.070 -11.328 8.168 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -7.557 -12.191 8.466 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -7.154 -13.209 5.110 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -6.476 -13.252 6.741 1.00 0.00 H new ATOM 972 N ILE A 94 -13.104 -6.282 5.234 1.00 0.00 N ATOM 973 CA ILE A 94 -14.005 -5.263 5.745 1.00 0.00 C ATOM 974 C ILE A 94 -14.794 -4.615 4.608 1.00 0.00 C ATOM 975 O ILE A 94 -15.972 -4.305 4.769 1.00 0.00 O ATOM 976 CB ILE A 94 -13.251 -4.177 6.539 1.00 0.00 C ATOM 977 CG1 ILE A 94 -12.411 -4.818 7.646 1.00 0.00 C ATOM 978 CG2 ILE A 94 -14.239 -3.182 7.133 1.00 0.00 C ATOM 979 CD1 ILE A 94 -11.529 -3.837 8.387 1.00 0.00 C ATOM 0 H ILE A 94 -12.114 -6.045 5.302 1.00 0.00 H new ATOM 0 HA ILE A 94 -14.697 -5.762 6.423 1.00 0.00 H new ATOM 0 HB ILE A 94 -12.584 -3.645 5.861 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -13.077 -5.305 8.359 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -11.786 -5.597 7.210 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -13.696 -2.420 7.692 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -14.806 -2.709 6.331 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -14.923 -3.704 7.802 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -10.964 -4.364 9.156 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -10.838 -3.368 7.687 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -12.149 -3.071 8.853 1.00 0.00 H new ATOM 991 N ILE A 95 -14.149 -4.424 3.455 1.00 0.00 N ATOM 992 CA ILE A 95 -14.835 -3.879 2.283 1.00 0.00 C ATOM 993 C ILE A 95 -16.030 -4.753 1.927 1.00 0.00 C ATOM 994 O ILE A 95 -17.129 -4.259 1.670 1.00 0.00 O ATOM 995 CB ILE A 95 -13.919 -3.792 1.044 1.00 0.00 C ATOM 996 CG1 ILE A 95 -12.660 -3.002 1.362 1.00 0.00 C ATOM 997 CG2 ILE A 95 -14.665 -3.115 -0.097 1.00 0.00 C ATOM 998 CD1 ILE A 95 -12.939 -1.541 1.594 1.00 0.00 C ATOM 0 H ILE A 95 -13.162 -4.636 3.309 1.00 0.00 H new ATOM 0 HA ILE A 95 -15.150 -2.870 2.550 1.00 0.00 H new ATOM 0 HB ILE A 95 -13.635 -4.803 0.752 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.185 -3.423 2.248 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.952 -3.107 0.540 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -14.016 -3.055 -0.971 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -15.554 -3.694 -0.345 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -14.959 -2.110 0.206 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -12.006 -1.023 1.817 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -13.388 -1.110 0.699 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -13.625 -1.430 2.434 1.00 0.00 H new ATOM 1010 N ASN A 96 -15.797 -6.061 1.927 1.00 0.00 N ATOM 1011 CA ASN A 96 -16.845 -7.040 1.646 1.00 0.00 C ATOM 1012 C ASN A 96 -17.968 -6.923 2.663 1.00 0.00 C ATOM 1013 O ASN A 96 -19.143 -7.020 2.319 1.00 0.00 O ATOM 1014 CB ASN A 96 -16.277 -8.463 1.682 1.00 0.00 C ATOM 1015 CG ASN A 96 -15.177 -8.693 0.666 1.00 0.00 C ATOM 1016 OD1 ASN A 96 -15.184 -8.120 -0.422 1.00 0.00 O ATOM 1017 ND2 ASN A 96 -14.224 -9.540 1.016 1.00 0.00 N ATOM 0 H ASN A 96 -14.884 -6.472 2.120 1.00 0.00 H new ATOM 0 HA ASN A 96 -17.237 -6.836 0.650 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -15.889 -8.667 2.680 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -17.083 -9.174 1.502 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -13.457 -9.739 0.373 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -14.256 -9.995 1.929 1.00 0.00 H new ATOM 1024 N ALA A 97 -17.596 -6.686 3.911 1.00 0.00 N ATOM 1025 CA ALA A 97 -18.561 -6.573 4.994 1.00 0.00 C ATOM 1026 C ALA A 97 -19.312 -5.245 4.946 1.00 0.00 C ATOM 1027 O ALA A 97 -20.197 -4.996 5.767 1.00 0.00 O ATOM 1028 CB ALA A 97 -17.861 -6.731 6.332 1.00 0.00 C ATOM 0 H ALA A 97 -16.625 -6.567 4.201 1.00 0.00 H new ATOM 0 HA ALA A 97 -19.294 -7.371 4.872 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -18.591 -6.645 7.137 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -17.383 -7.709 6.379 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -17.106 -5.952 6.442 1.00 0.00 H new ATOM 1034 N ARG A 98 -18.958 -4.387 3.996 1.00 0.00 N ATOM 1035 CA ARG A 98 -19.609 -3.091 3.873 1.00 0.00 C ATOM 1036 C ARG A 98 -20.673 -3.093 2.781 1.00 0.00 C ATOM 1037 O ARG A 98 -21.184 -2.038 2.409 1.00 0.00 O ATOM 1038 CB ARG A 98 -18.592 -1.979 3.610 1.00 0.00 C ATOM 1039 CG ARG A 98 -17.630 -1.752 4.763 1.00 0.00 C ATOM 1040 CD ARG A 98 -16.899 -0.430 4.625 1.00 0.00 C ATOM 1041 NE ARG A 98 -17.819 0.706 4.699 1.00 0.00 N ATOM 1042 CZ ARG A 98 -17.433 1.977 4.779 1.00 0.00 C ATOM 1043 NH1 ARG A 98 -16.144 2.283 4.759 1.00 0.00 N ATOM 1044 NH2 ARG A 98 -18.342 2.939 4.863 1.00 0.00 N ATOM 0 H ARG A 98 -18.229 -4.565 3.305 1.00 0.00 H new ATOM 0 HA ARG A 98 -20.100 -2.896 4.826 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -18.021 -2.224 2.714 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -19.125 -1.051 3.404 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -18.179 -1.769 5.705 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -16.907 -2.567 4.801 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -16.150 -0.344 5.412 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -16.366 -0.406 3.674 1.00 0.00 H new ATOM 0 HE ARG A 98 -18.820 0.511 4.689 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -15.445 1.544 4.682 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -15.850 3.258 4.820 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -19.335 2.704 4.866 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -18.049 3.914 4.924 1.00 0.00 H new ATOM 1288 N GLY B 42 -7.985 10.165 -6.133 1.00 0.00 N ATOM 1289 CA GLY B 42 -8.311 9.315 -7.259 1.00 0.00 C ATOM 1290 C GLY B 42 -9.585 8.529 -7.035 1.00 0.00 C ATOM 1291 O GLY B 42 -10.216 8.666 -5.987 1.00 0.00 O ATOM 0 HA2 GLY B 42 -8.417 9.927 -8.155 1.00 0.00 H new ATOM 0 HA3 GLY B 42 -7.488 8.624 -7.440 1.00 0.00 H new ATOM 1295 N PRO B 43 -9.988 7.697 -8.009 1.00 0.00 N ATOM 1296 CA PRO B 43 -11.204 6.880 -7.908 1.00 0.00 C ATOM 1297 C PRO B 43 -11.084 5.753 -6.880 1.00 0.00 C ATOM 1298 O PRO B 43 -10.106 5.678 -6.139 1.00 0.00 O ATOM 1299 CB PRO B 43 -11.364 6.303 -9.318 1.00 0.00 C ATOM 1300 CG PRO B 43 -9.989 6.305 -9.888 1.00 0.00 C ATOM 1301 CD PRO B 43 -9.299 7.503 -9.298 1.00 0.00 C ATOM 0 HA PRO B 43 -12.056 7.471 -7.571 1.00 0.00 H new ATOM 0 HB2 PRO B 43 -11.778 5.295 -9.288 1.00 0.00 H new ATOM 0 HB3 PRO B 43 -12.042 6.909 -9.919 1.00 0.00 H new ATOM 0 HG2 PRO B 43 -9.460 5.386 -9.635 1.00 0.00 H new ATOM 0 HG3 PRO B 43 -10.017 6.367 -10.976 1.00 0.00 H new ATOM 0 HD2 PRO B 43 -8.233 7.324 -9.160 1.00 0.00 H new ATOM 0 HD3 PRO B 43 -9.395 8.378 -9.940 1.00 0.00 H new ATOM 1309 N ILE B 44 -12.088 4.876 -6.870 1.00 0.00 N ATOM 1310 CA ILE B 44 -12.190 3.765 -5.913 1.00 0.00 C ATOM 1311 C ILE B 44 -10.865 3.025 -5.691 1.00 0.00 C ATOM 1312 O ILE B 44 -10.436 2.839 -4.550 1.00 0.00 O ATOM 1313 CB ILE B 44 -13.273 2.761 -6.369 1.00 0.00 C ATOM 1314 CG1 ILE B 44 -13.225 2.581 -7.895 1.00 0.00 C ATOM 1315 CG2 ILE B 44 -14.648 3.233 -5.918 1.00 0.00 C ATOM 1316 CD1 ILE B 44 -14.284 1.650 -8.447 1.00 0.00 C ATOM 0 H ILE B 44 -12.863 4.914 -7.532 1.00 0.00 H new ATOM 0 HA ILE B 44 -12.467 4.213 -4.959 1.00 0.00 H new ATOM 0 HB ILE B 44 -13.076 1.793 -5.908 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -13.334 3.557 -8.368 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -12.242 2.200 -8.173 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -15.403 2.518 -6.245 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -14.668 3.310 -4.831 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -14.859 4.209 -6.355 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -14.178 1.580 -9.530 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -14.164 0.660 -8.006 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -15.273 2.039 -8.203 1.00 0.00 H new ATOM 1328 N ARG B 45 -10.218 2.615 -6.775 1.00 0.00 N ATOM 1329 CA ARG B 45 -8.945 1.904 -6.684 1.00 0.00 C ATOM 1330 C ARG B 45 -7.878 2.734 -5.973 1.00 0.00 C ATOM 1331 O ARG B 45 -7.134 2.222 -5.132 1.00 0.00 O ATOM 1332 CB ARG B 45 -8.457 1.489 -8.075 1.00 0.00 C ATOM 1333 CG ARG B 45 -8.659 2.547 -9.145 1.00 0.00 C ATOM 1334 CD ARG B 45 -8.083 2.100 -10.478 1.00 0.00 C ATOM 1335 NE ARG B 45 -8.351 3.064 -11.542 1.00 0.00 N ATOM 1336 CZ ARG B 45 -7.470 3.404 -12.483 1.00 0.00 C ATOM 1337 NH1 ARG B 45 -6.256 2.861 -12.496 1.00 0.00 N ATOM 1338 NH2 ARG B 45 -7.810 4.287 -13.412 1.00 0.00 N ATOM 0 H ARG B 45 -10.552 2.762 -7.728 1.00 0.00 H new ATOM 0 HA ARG B 45 -9.117 1.008 -6.088 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -7.397 1.244 -8.018 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -8.979 0.580 -8.375 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -9.723 2.755 -9.257 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -8.183 3.477 -8.834 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -7.007 1.960 -10.379 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -8.507 1.133 -10.750 1.00 0.00 H new ATOM 0 HE ARG B 45 -9.270 3.505 -11.567 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -5.994 2.180 -11.783 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -5.587 3.126 -13.219 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -8.742 4.702 -13.404 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -7.140 4.551 -14.134 1.00 0.00 H new ATOM 1352 N MET B 46 -7.806 4.015 -6.298 1.00 0.00 N ATOM 1353 CA MET B 46 -6.847 4.898 -5.654 1.00 0.00 C ATOM 1354 C MET B 46 -7.211 5.125 -4.196 1.00 0.00 C ATOM 1355 O MET B 46 -6.333 5.350 -3.375 1.00 0.00 O ATOM 1356 CB MET B 46 -6.732 6.239 -6.381 1.00 0.00 C ATOM 1357 CG MET B 46 -5.863 6.182 -7.626 1.00 0.00 C ATOM 1358 SD MET B 46 -6.627 5.270 -8.978 1.00 0.00 S ATOM 1359 CE MET B 46 -5.342 5.391 -10.218 1.00 0.00 C ATOM 0 H MET B 46 -8.396 4.464 -6.999 1.00 0.00 H new ATOM 0 HA MET B 46 -5.876 4.405 -5.703 1.00 0.00 H new ATOM 0 HB2 MET B 46 -7.730 6.579 -6.659 1.00 0.00 H new ATOM 0 HB3 MET B 46 -6.322 6.981 -5.695 1.00 0.00 H new ATOM 0 HG2 MET B 46 -5.646 7.197 -7.957 1.00 0.00 H new ATOM 0 HG3 MET B 46 -4.909 5.718 -7.375 1.00 0.00 H new ATOM 0 HE1 MET B 46 -5.796 5.453 -11.207 1.00 0.00 H new ATOM 0 HE2 MET B 46 -4.744 6.284 -10.036 1.00 0.00 H new ATOM 0 HE3 MET B 46 -4.703 4.510 -10.167 1.00 0.00 H new ATOM 1369 N VAL B 47 -8.499 5.041 -3.872 1.00 0.00 N ATOM 1370 CA VAL B 47 -8.947 5.179 -2.491 1.00 0.00 C ATOM 1371 C VAL B 47 -8.319 4.084 -1.646 1.00 0.00 C ATOM 1372 O VAL B 47 -7.846 4.322 -0.535 1.00 0.00 O ATOM 1373 CB VAL B 47 -10.486 5.094 -2.379 1.00 0.00 C ATOM 1374 CG1 VAL B 47 -10.935 5.137 -0.925 1.00 0.00 C ATOM 1375 CG2 VAL B 47 -11.139 6.215 -3.168 1.00 0.00 C ATOM 0 H VAL B 47 -9.248 4.879 -4.545 1.00 0.00 H new ATOM 0 HA VAL B 47 -8.637 6.160 -2.132 1.00 0.00 H new ATOM 0 HB VAL B 47 -10.801 4.139 -2.801 1.00 0.00 H new ATOM 0 HG11 VAL B 47 -12.022 5.075 -0.878 1.00 0.00 H new ATOM 0 HG12 VAL B 47 -10.500 4.296 -0.385 1.00 0.00 H new ATOM 0 HG13 VAL B 47 -10.604 6.070 -0.470 1.00 0.00 H new ATOM 0 HG21 VAL B 47 -12.223 6.140 -3.078 1.00 0.00 H new ATOM 0 HG22 VAL B 47 -10.808 7.177 -2.776 1.00 0.00 H new ATOM 0 HG23 VAL B 47 -10.856 6.134 -4.217 1.00 0.00 H new ATOM 1385 N LEU B 48 -8.293 2.886 -2.211 1.00 0.00 N ATOM 1386 CA LEU B 48 -7.698 1.734 -1.557 1.00 0.00 C ATOM 1387 C LEU B 48 -6.191 1.934 -1.389 1.00 0.00 C ATOM 1388 O LEU B 48 -5.611 1.569 -0.363 1.00 0.00 O ATOM 1389 CB LEU B 48 -7.979 0.480 -2.387 1.00 0.00 C ATOM 1390 CG LEU B 48 -8.335 -0.772 -1.588 1.00 0.00 C ATOM 1391 CD1 LEU B 48 -9.571 -0.524 -0.734 1.00 0.00 C ATOM 1392 CD2 LEU B 48 -8.568 -1.942 -2.529 1.00 0.00 C ATOM 0 H LEU B 48 -8.683 2.687 -3.132 1.00 0.00 H new ATOM 0 HA LEU B 48 -8.138 1.617 -0.566 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -8.797 0.696 -3.074 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -7.101 0.264 -2.995 1.00 0.00 H new ATOM 0 HG LEU B 48 -7.503 -1.014 -0.927 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -9.811 -1.426 -0.171 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -9.376 0.295 -0.042 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -10.411 -0.263 -1.377 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -8.821 -2.830 -1.950 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -9.388 -1.706 -3.208 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -7.663 -2.131 -3.106 1.00 0.00 H new ATOM 1404 N ALA B 49 -5.566 2.525 -2.404 1.00 0.00 N ATOM 1405 CA ALA B 49 -4.136 2.816 -2.362 1.00 0.00 C ATOM 1406 C ALA B 49 -3.821 3.898 -1.329 1.00 0.00 C ATOM 1407 O ALA B 49 -2.875 3.768 -0.549 1.00 0.00 O ATOM 1408 CB ALA B 49 -3.642 3.235 -3.738 1.00 0.00 C ATOM 0 H ALA B 49 -6.028 2.812 -3.267 1.00 0.00 H new ATOM 0 HA ALA B 49 -3.615 1.906 -2.063 1.00 0.00 H new ATOM 0 HB1 ALA B 49 -2.574 3.449 -3.692 1.00 0.00 H new ATOM 0 HB2 ALA B 49 -3.820 2.429 -4.450 1.00 0.00 H new ATOM 0 HB3 ALA B 49 -4.177 4.128 -4.060 1.00 0.00 H new ATOM 1414 N ILE B 50 -4.621 4.962 -1.325 1.00 0.00 N ATOM 1415 CA ILE B 50 -4.453 6.050 -0.366 1.00 0.00 C ATOM 1416 C ILE B 50 -4.691 5.536 1.051 1.00 0.00 C ATOM 1417 O ILE B 50 -4.070 6.001 2.009 1.00 0.00 O ATOM 1418 CB ILE B 50 -5.417 7.229 -0.655 1.00 0.00 C ATOM 1419 CG1 ILE B 50 -5.241 7.733 -2.091 1.00 0.00 C ATOM 1420 CG2 ILE B 50 -5.181 8.366 0.333 1.00 0.00 C ATOM 1421 CD1 ILE B 50 -6.250 8.788 -2.496 1.00 0.00 C ATOM 0 H ILE B 50 -5.394 5.093 -1.977 1.00 0.00 H new ATOM 0 HA ILE B 50 -3.432 6.418 -0.464 1.00 0.00 H new ATOM 0 HB ILE B 50 -6.439 6.869 -0.537 1.00 0.00 H new ATOM 0 HG12 ILE B 50 -4.237 8.142 -2.202 1.00 0.00 H new ATOM 0 HG13 ILE B 50 -5.318 6.888 -2.775 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -5.866 9.185 0.115 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -5.354 8.008 1.348 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -4.154 8.719 0.243 1.00 0.00 H new ATOM 0 HD11 ILE B 50 -6.062 9.096 -3.525 1.00 0.00 H new ATOM 0 HD12 ILE B 50 -7.257 8.377 -2.418 1.00 0.00 H new ATOM 0 HD13 ILE B 50 -6.158 9.651 -1.837 1.00 0.00 H new ATOM 1433 N LEU B 51 -5.590 4.566 1.169 1.00 0.00 N ATOM 1434 CA LEU B 51 -5.859 3.917 2.440 1.00 0.00 C ATOM 1435 C LEU B 51 -4.580 3.315 3.005 1.00 0.00 C ATOM 1436 O LEU B 51 -4.158 3.670 4.102 1.00 0.00 O ATOM 1437 CB LEU B 51 -6.905 2.817 2.266 1.00 0.00 C ATOM 1438 CG LEU B 51 -7.254 2.051 3.540 1.00 0.00 C ATOM 1439 CD1 LEU B 51 -8.273 2.817 4.370 1.00 0.00 C ATOM 1440 CD2 LEU B 51 -7.758 0.661 3.198 1.00 0.00 C ATOM 0 H LEU B 51 -6.147 4.212 0.392 1.00 0.00 H new ATOM 0 HA LEU B 51 -6.241 4.667 3.133 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -7.816 3.263 1.867 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -6.544 2.108 1.521 1.00 0.00 H new ATOM 0 HG LEU B 51 -6.350 1.947 4.141 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -8.506 2.252 5.272 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -7.861 3.788 4.646 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -9.183 2.961 3.787 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -8.003 0.127 4.116 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -8.649 0.740 2.575 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -6.984 0.116 2.657 1.00 0.00 H new ATOM 1452 N ALA B 52 -3.963 2.415 2.238 1.00 0.00 N ATOM 1453 CA ALA B 52 -2.730 1.755 2.663 1.00 0.00 C ATOM 1454 C ALA B 52 -1.646 2.774 2.976 1.00 0.00 C ATOM 1455 O ALA B 52 -0.885 2.616 3.933 1.00 0.00 O ATOM 1456 CB ALA B 52 -2.240 0.794 1.598 1.00 0.00 C ATOM 0 H ALA B 52 -4.298 2.127 1.319 1.00 0.00 H new ATOM 0 HA ALA B 52 -2.952 1.193 3.570 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -1.321 0.314 1.936 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -3.000 0.034 1.416 1.00 0.00 H new ATOM 0 HB3 ALA B 52 -2.046 1.341 0.676 1.00 0.00 H new ATOM 1462 N PHE B 53 -1.582 3.815 2.156 1.00 0.00 N ATOM 1463 CA PHE B 53 -0.680 4.928 2.393 1.00 0.00 C ATOM 1464 C PHE B 53 -0.880 5.467 3.805 1.00 0.00 C ATOM 1465 O PHE B 53 0.032 5.441 4.623 1.00 0.00 O ATOM 1466 CB PHE B 53 -0.935 6.023 1.350 1.00 0.00 C ATOM 1467 CG PHE B 53 -0.171 7.300 1.570 1.00 0.00 C ATOM 1468 CD1 PHE B 53 1.168 7.393 1.229 1.00 0.00 C ATOM 1469 CD2 PHE B 53 -0.802 8.417 2.097 1.00 0.00 C ATOM 1470 CE1 PHE B 53 1.863 8.574 1.412 1.00 0.00 C ATOM 1471 CE2 PHE B 53 -0.111 9.597 2.285 1.00 0.00 C ATOM 1472 CZ PHE B 53 1.223 9.676 1.942 1.00 0.00 C ATOM 0 H PHE B 53 -2.151 3.909 1.314 1.00 0.00 H new ATOM 0 HA PHE B 53 0.352 4.590 2.300 1.00 0.00 H new ATOM 0 HB2 PHE B 53 -0.683 5.631 0.365 1.00 0.00 H new ATOM 0 HB3 PHE B 53 -2.001 6.252 1.339 1.00 0.00 H new ATOM 0 HD1 PHE B 53 1.675 6.534 0.816 1.00 0.00 H new ATOM 0 HD2 PHE B 53 -1.847 8.363 2.364 1.00 0.00 H new ATOM 0 HE1 PHE B 53 2.907 8.634 1.140 1.00 0.00 H new ATOM 0 HE2 PHE B 53 -0.614 10.458 2.700 1.00 0.00 H new ATOM 0 HZ PHE B 53 1.765 10.598 2.088 1.00 0.00 H new ATOM 1482 N LEU B 54 -2.097 5.898 4.098 1.00 0.00 N ATOM 1483 CA LEU B 54 -2.425 6.481 5.396 1.00 0.00 C ATOM 1484 C LEU B 54 -2.372 5.443 6.521 1.00 0.00 C ATOM 1485 O LEU B 54 -2.415 5.796 7.695 1.00 0.00 O ATOM 1486 CB LEU B 54 -3.813 7.124 5.343 1.00 0.00 C ATOM 1487 CG LEU B 54 -3.958 8.281 4.349 1.00 0.00 C ATOM 1488 CD1 LEU B 54 -5.408 8.729 4.256 1.00 0.00 C ATOM 1489 CD2 LEU B 54 -3.067 9.447 4.752 1.00 0.00 C ATOM 0 H LEU B 54 -2.883 5.855 3.449 1.00 0.00 H new ATOM 0 HA LEU B 54 -1.675 7.241 5.615 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -4.543 6.355 5.090 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -4.066 7.488 6.339 1.00 0.00 H new ATOM 0 HG LEU B 54 -3.643 7.929 3.367 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -5.490 9.551 3.545 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -6.025 7.896 3.920 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -5.750 9.061 5.236 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -3.184 10.259 4.034 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -3.352 9.796 5.745 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -2.027 9.122 4.766 1.00 0.00 H new ATOM 1501 N ARG B 55 -2.284 4.169 6.162 1.00 0.00 N ATOM 1502 CA ARG B 55 -2.189 3.098 7.150 1.00 0.00 C ATOM 1503 C ARG B 55 -0.762 2.921 7.639 1.00 0.00 C ATOM 1504 O ARG B 55 -0.525 2.692 8.823 1.00 0.00 O ATOM 1505 CB ARG B 55 -2.686 1.777 6.562 1.00 0.00 C ATOM 1506 CG ARG B 55 -4.183 1.736 6.350 1.00 0.00 C ATOM 1507 CD ARG B 55 -4.923 1.626 7.670 1.00 0.00 C ATOM 1508 NE ARG B 55 -4.623 0.371 8.361 1.00 0.00 N ATOM 1509 CZ ARG B 55 -4.732 0.196 9.677 1.00 0.00 C ATOM 1510 NH1 ARG B 55 -5.105 1.203 10.457 1.00 0.00 N ATOM 1511 NH2 ARG B 55 -4.468 -0.989 10.211 1.00 0.00 N ATOM 0 H ARG B 55 -2.276 3.850 5.193 1.00 0.00 H new ATOM 0 HA ARG B 55 -2.817 3.380 7.995 1.00 0.00 H new ATOM 0 HB2 ARG B 55 -2.187 1.602 5.609 1.00 0.00 H new ATOM 0 HB3 ARG B 55 -2.399 0.962 7.226 1.00 0.00 H new ATOM 0 HG2 ARG B 55 -4.503 2.636 5.825 1.00 0.00 H new ATOM 0 HG3 ARG B 55 -4.440 0.888 5.715 1.00 0.00 H new ATOM 0 HD2 ARG B 55 -4.652 2.466 8.309 1.00 0.00 H new ATOM 0 HD3 ARG B 55 -5.996 1.695 7.491 1.00 0.00 H new ATOM 0 HE ARG B 55 -4.310 -0.420 7.799 1.00 0.00 H new ATOM 0 HH11 ARG B 55 -5.309 2.115 10.049 1.00 0.00 H new ATOM 0 HH12 ARG B 55 -5.187 1.065 11.464 1.00 0.00 H new ATOM 0 HH21 ARG B 55 -4.182 -1.765 9.614 1.00 0.00 H new ATOM 0 HH22 ARG B 55 -4.551 -1.124 11.219 1.00 0.00 H new ATOM 1525 N PHE B 56 0.188 3.017 6.725 1.00 0.00 N ATOM 1526 CA PHE B 56 1.578 2.770 7.068 1.00 0.00 C ATOM 1527 C PHE B 56 2.385 4.059 7.148 1.00 0.00 C ATOM 1528 O PHE B 56 3.537 4.046 7.586 1.00 0.00 O ATOM 1529 CB PHE B 56 2.198 1.787 6.076 1.00 0.00 C ATOM 1530 CG PHE B 56 1.774 0.368 6.328 1.00 0.00 C ATOM 1531 CD1 PHE B 56 2.535 -0.459 7.139 1.00 0.00 C ATOM 1532 CD2 PHE B 56 0.610 -0.135 5.768 1.00 0.00 C ATOM 1533 CE1 PHE B 56 2.143 -1.760 7.388 1.00 0.00 C ATOM 1534 CE2 PHE B 56 0.215 -1.436 6.011 1.00 0.00 C ATOM 1535 CZ PHE B 56 0.982 -2.248 6.823 1.00 0.00 C ATOM 0 H PHE B 56 0.025 3.262 5.748 1.00 0.00 H new ATOM 0 HA PHE B 56 1.603 2.324 8.062 1.00 0.00 H new ATOM 0 HB2 PHE B 56 1.915 2.072 5.063 1.00 0.00 H new ATOM 0 HB3 PHE B 56 3.284 1.854 6.135 1.00 0.00 H new ATOM 0 HD1 PHE B 56 3.445 -0.082 7.581 1.00 0.00 H new ATOM 0 HD2 PHE B 56 0.005 0.497 5.135 1.00 0.00 H new ATOM 0 HE1 PHE B 56 2.744 -2.394 8.023 1.00 0.00 H new ATOM 0 HE2 PHE B 56 -0.692 -1.818 5.567 1.00 0.00 H new ATOM 0 HZ PHE B 56 0.673 -3.265 7.016 1.00 0.00 H new ATOM 1545 N THR B 57 1.792 5.169 6.732 1.00 0.00 N ATOM 1546 CA THR B 57 2.458 6.460 6.883 1.00 0.00 C ATOM 1547 C THR B 57 1.886 7.234 8.064 1.00 0.00 C ATOM 1548 O THR B 57 2.600 7.968 8.742 1.00 0.00 O ATOM 1549 CB THR B 57 2.358 7.339 5.616 1.00 0.00 C ATOM 1550 OG1 THR B 57 0.997 7.722 5.380 1.00 0.00 O ATOM 1551 CG2 THR B 57 2.896 6.604 4.397 1.00 0.00 C ATOM 0 H THR B 57 0.871 5.206 6.296 1.00 0.00 H new ATOM 0 HA THR B 57 3.510 6.234 7.057 1.00 0.00 H new ATOM 0 HB THR B 57 2.962 8.231 5.782 1.00 0.00 H new ATOM 0 HG1 THR B 57 0.429 6.924 5.376 1.00 0.00 H new ATOM 0 HG21 THR B 57 2.814 7.245 3.520 1.00 0.00 H new ATOM 0 HG22 THR B 57 3.942 6.345 4.560 1.00 0.00 H new ATOM 0 HG23 THR B 57 2.318 5.694 4.237 1.00 0.00 H new ATOM 1559 N ALA B 58 0.604 7.041 8.324 1.00 0.00 N ATOM 1560 CA ALA B 58 -0.094 7.823 9.330 1.00 0.00 C ATOM 1561 C ALA B 58 -0.899 6.927 10.259 1.00 0.00 C ATOM 1562 O ALA B 58 -0.878 5.704 10.132 1.00 0.00 O ATOM 1563 CB ALA B 58 -1.009 8.832 8.649 1.00 0.00 C ATOM 0 H ALA B 58 0.024 6.348 7.851 1.00 0.00 H new ATOM 0 HA ALA B 58 0.645 8.352 9.932 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -1.532 9.418 9.405 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -0.415 9.497 8.022 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -1.736 8.305 8.032 1.00 0.00 H new ATOM 1569 N ILE B 59 -1.591 7.546 11.202 1.00 0.00 N ATOM 1570 CA ILE B 59 -2.469 6.828 12.110 1.00 0.00 C ATOM 1571 C ILE B 59 -3.905 7.275 11.881 1.00 0.00 C ATOM 1572 O ILE B 59 -4.210 8.463 12.010 1.00 0.00 O ATOM 1573 CB ILE B 59 -2.084 7.068 13.589 1.00 0.00 C ATOM 1574 CG1 ILE B 59 -0.642 6.618 13.858 1.00 0.00 C ATOM 1575 CG2 ILE B 59 -3.050 6.345 14.520 1.00 0.00 C ATOM 1576 CD1 ILE B 59 -0.405 5.138 13.629 1.00 0.00 C ATOM 0 H ILE B 59 -1.560 8.553 11.359 1.00 0.00 H new ATOM 0 HA ILE B 59 -2.366 5.762 11.906 1.00 0.00 H new ATOM 0 HB ILE B 59 -2.150 8.138 13.786 1.00 0.00 H new ATOM 0 HG12 ILE B 59 0.031 7.187 13.216 1.00 0.00 H new ATOM 0 HG13 ILE B 59 -0.382 6.862 14.888 1.00 0.00 H new ATOM 0 HG21 ILE B 59 -2.762 6.526 15.555 1.00 0.00 H new ATOM 0 HG22 ILE B 59 -4.061 6.716 14.354 1.00 0.00 H new ATOM 0 HG23 ILE B 59 -3.019 5.275 14.317 1.00 0.00 H new ATOM 0 HD11 ILE B 59 0.637 4.899 13.840 1.00 0.00 H new ATOM 0 HD12 ILE B 59 -1.051 4.560 14.290 1.00 0.00 H new ATOM 0 HD13 ILE B 59 -0.631 4.889 12.592 1.00 0.00 H new ATOM 1588 N LYS B 60 -4.766 6.320 11.533 1.00 0.00 N ATOM 1589 CA LYS B 60 -6.169 6.588 11.219 1.00 0.00 C ATOM 1590 C LYS B 60 -6.298 7.415 9.939 1.00 0.00 C ATOM 1591 O LYS B 60 -6.055 8.622 9.934 1.00 0.00 O ATOM 1592 CB LYS B 60 -6.876 7.297 12.381 1.00 0.00 C ATOM 1593 CG LYS B 60 -8.356 7.540 12.133 1.00 0.00 C ATOM 1594 CD LYS B 60 -9.006 8.254 13.305 1.00 0.00 C ATOM 1595 CE LYS B 60 -10.486 8.495 13.058 1.00 0.00 C ATOM 1596 NZ LYS B 60 -11.136 9.164 14.214 1.00 0.00 N ATOM 0 H LYS B 60 -4.510 5.335 11.461 1.00 0.00 H new ATOM 0 HA LYS B 60 -6.655 5.625 11.060 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -6.761 6.699 13.285 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -6.385 8.252 12.566 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -8.482 8.135 11.228 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -8.858 6.588 11.961 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -8.879 7.660 14.210 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -8.505 9.207 13.476 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -10.610 9.109 12.166 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -10.982 7.544 12.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -12.145 9.311 14.008 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -11.039 8.567 15.060 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -10.680 10.083 14.385 1.00 0.00 H new ATOM 1610 N PRO B 61 -6.677 6.763 8.830 1.00 0.00 N ATOM 1611 CA PRO B 61 -6.883 7.436 7.543 1.00 0.00 C ATOM 1612 C PRO B 61 -7.997 8.478 7.612 1.00 0.00 C ATOM 1613 O PRO B 61 -8.917 8.367 8.426 1.00 0.00 O ATOM 1614 CB PRO B 61 -7.280 6.297 6.595 1.00 0.00 C ATOM 1615 CG PRO B 61 -6.826 5.048 7.269 1.00 0.00 C ATOM 1616 CD PRO B 61 -6.929 5.317 8.741 1.00 0.00 C ATOM 0 HA PRO B 61 -5.994 7.980 7.224 1.00 0.00 H new ATOM 0 HB2 PRO B 61 -8.357 6.283 6.426 1.00 0.00 H new ATOM 0 HB3 PRO B 61 -6.806 6.413 5.621 1.00 0.00 H new ATOM 0 HG2 PRO B 61 -7.448 4.200 6.982 1.00 0.00 H new ATOM 0 HG3 PRO B 61 -5.802 4.802 6.987 1.00 0.00 H new ATOM 0 HD2 PRO B 61 -7.912 5.054 9.132 1.00 0.00 H new ATOM 0 HD3 PRO B 61 -6.196 4.744 9.309 1.00 0.00 H new ATOM 1624 N SER B 62 -7.891 9.500 6.769 1.00 0.00 N ATOM 1625 CA SER B 62 -8.889 10.557 6.704 1.00 0.00 C ATOM 1626 C SER B 62 -10.260 9.977 6.372 1.00 0.00 C ATOM 1627 O SER B 62 -10.389 9.090 5.524 1.00 0.00 O ATOM 1628 CB SER B 62 -8.479 11.598 5.659 1.00 0.00 C ATOM 1629 OG SER B 62 -9.385 12.688 5.630 1.00 0.00 O ATOM 0 H SER B 62 -7.116 9.617 6.117 1.00 0.00 H new ATOM 0 HA SER B 62 -8.951 11.043 7.678 1.00 0.00 H new ATOM 0 HB2 SER B 62 -7.476 11.963 5.881 1.00 0.00 H new ATOM 0 HB3 SER B 62 -8.438 11.131 4.675 1.00 0.00 H new ATOM 0 HG SER B 62 -9.095 13.336 4.954 1.00 0.00 H new ATOM 1635 N LEU B 63 -11.279 10.503 7.049 1.00 0.00 N ATOM 1636 CA LEU B 63 -12.629 9.958 6.982 1.00 0.00 C ATOM 1637 C LEU B 63 -13.202 10.017 5.574 1.00 0.00 C ATOM 1638 O LEU B 63 -14.098 9.251 5.244 1.00 0.00 O ATOM 1639 CB LEU B 63 -13.554 10.695 7.952 1.00 0.00 C ATOM 1640 CG LEU B 63 -13.165 10.588 9.430 1.00 0.00 C ATOM 1641 CD1 LEU B 63 -14.173 11.322 10.298 1.00 0.00 C ATOM 1642 CD2 LEU B 63 -13.057 9.130 9.854 1.00 0.00 C ATOM 0 H LEU B 63 -11.190 11.317 7.657 1.00 0.00 H new ATOM 0 HA LEU B 63 -12.564 8.909 7.270 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -13.580 11.749 7.675 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -14.566 10.308 7.830 1.00 0.00 H new ATOM 0 HG LEU B 63 -12.189 11.055 9.562 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -13.882 11.236 11.345 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -14.200 12.374 10.014 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -15.161 10.883 10.159 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -12.780 9.077 10.907 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -14.017 8.636 9.706 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -12.296 8.632 9.253 1.00 0.00 H new ATOM 1654 N GLY B 64 -12.690 10.919 4.746 1.00 0.00 N ATOM 1655 CA GLY B 64 -13.126 10.976 3.361 1.00 0.00 C ATOM 1656 C GLY B 64 -12.812 9.690 2.623 1.00 0.00 C ATOM 1657 O GLY B 64 -13.648 9.164 1.879 1.00 0.00 O ATOM 0 H GLY B 64 -11.985 11.609 5.005 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -14.199 11.164 3.324 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -12.638 11.812 2.860 1.00 0.00 H new ATOM 1661 N LEU B 65 -11.610 9.169 2.849 1.00 0.00 N ATOM 1662 CA LEU B 65 -11.211 7.897 2.271 1.00 0.00 C ATOM 1663 C LEU B 65 -12.011 6.773 2.906 1.00 0.00 C ATOM 1664 O LEU B 65 -12.426 5.845 2.230 1.00 0.00 O ATOM 1665 CB LEU B 65 -9.708 7.637 2.464 1.00 0.00 C ATOM 1666 CG LEU B 65 -8.750 8.517 1.646 1.00 0.00 C ATOM 1667 CD1 LEU B 65 -9.122 8.504 0.171 1.00 0.00 C ATOM 1668 CD2 LEU B 65 -8.712 9.940 2.181 1.00 0.00 C ATOM 0 H LEU B 65 -10.897 9.611 3.429 1.00 0.00 H new ATOM 0 HA LEU B 65 -11.411 7.935 1.200 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -9.472 7.766 3.520 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -9.508 6.594 2.218 1.00 0.00 H new ATOM 0 HG LEU B 65 -7.750 8.096 1.747 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -8.428 9.135 -0.385 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -9.069 7.484 -0.209 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -10.136 8.884 0.048 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -8.025 10.536 1.580 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -9.710 10.375 2.130 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -8.373 9.930 3.217 1.00 0.00 H new ATOM 1680 N ILE B 66 -12.239 6.884 4.210 1.00 0.00 N ATOM 1681 CA ILE B 66 -13.003 5.886 4.956 1.00 0.00 C ATOM 1682 C ILE B 66 -14.455 5.827 4.473 1.00 0.00 C ATOM 1683 O ILE B 66 -15.064 4.757 4.415 1.00 0.00 O ATOM 1684 CB ILE B 66 -12.977 6.191 6.471 1.00 0.00 C ATOM 1685 CG1 ILE B 66 -11.533 6.235 6.979 1.00 0.00 C ATOM 1686 CG2 ILE B 66 -13.786 5.162 7.248 1.00 0.00 C ATOM 1687 CD1 ILE B 66 -10.793 4.918 6.847 1.00 0.00 C ATOM 0 H ILE B 66 -11.903 7.662 4.778 1.00 0.00 H new ATOM 0 HA ILE B 66 -12.533 4.919 4.779 1.00 0.00 H new ATOM 0 HB ILE B 66 -13.433 7.168 6.631 1.00 0.00 H new ATOM 0 HG12 ILE B 66 -10.988 7.003 6.429 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -11.536 6.535 8.027 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -13.751 5.399 8.311 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -14.821 5.179 6.906 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -13.366 4.170 7.084 1.00 0.00 H new ATOM 0 HD11 ILE B 66 -9.778 5.031 7.228 1.00 0.00 H new ATOM 0 HD12 ILE B 66 -11.312 4.150 7.420 1.00 0.00 H new ATOM 0 HD13 ILE B 66 -10.756 4.625 5.798 1.00 0.00 H new ATOM 1699 N ASN B 67 -15.001 6.980 4.121 1.00 0.00 N ATOM 1700 CA ASN B 67 -16.374 7.067 3.639 1.00 0.00 C ATOM 1701 C ASN B 67 -16.510 6.465 2.245 1.00 0.00 C ATOM 1702 O ASN B 67 -17.493 5.785 1.946 1.00 0.00 O ATOM 1703 CB ASN B 67 -16.854 8.523 3.641 1.00 0.00 C ATOM 1704 CG ASN B 67 -17.185 9.024 5.035 1.00 0.00 C ATOM 1705 OD1 ASN B 67 -17.574 8.250 5.914 1.00 0.00 O ATOM 1706 ND2 ASN B 67 -17.047 10.325 5.248 1.00 0.00 N ATOM 0 H ASN B 67 -14.513 7.875 4.160 1.00 0.00 H new ATOM 0 HA ASN B 67 -17.003 6.490 4.317 1.00 0.00 H new ATOM 0 HB2 ASN B 67 -16.082 9.157 3.204 1.00 0.00 H new ATOM 0 HB3 ASN B 67 -17.736 8.612 3.007 1.00 0.00 H new ATOM 0 HD21 ASN B 67 -17.265 10.718 6.164 1.00 0.00 H new ATOM 0 HD22 ASN B 67 -16.723 10.933 4.496 1.00 0.00 H new ATOM 1713 N ARG B 68 -15.511 6.691 1.400 1.00 0.00 N ATOM 1714 CA ARG B 68 -15.540 6.170 0.035 1.00 0.00 C ATOM 1715 C ARG B 68 -14.954 4.758 -0.001 1.00 0.00 C ATOM 1716 O ARG B 68 -15.033 4.055 -1.008 1.00 0.00 O ATOM 1717 CB ARG B 68 -14.766 7.102 -0.900 1.00 0.00 C ATOM 1718 CG ARG B 68 -14.994 6.820 -2.376 1.00 0.00 C ATOM 1719 CD ARG B 68 -14.314 7.859 -3.250 1.00 0.00 C ATOM 1720 NE ARG B 68 -14.571 7.634 -4.671 1.00 0.00 N ATOM 1721 CZ ARG B 68 -13.923 8.256 -5.653 1.00 0.00 C ATOM 1722 NH1 ARG B 68 -12.962 9.125 -5.372 1.00 0.00 N ATOM 1723 NH2 ARG B 68 -14.231 8.001 -6.917 1.00 0.00 N ATOM 0 H ARG B 68 -14.675 7.228 1.632 1.00 0.00 H new ATOM 0 HA ARG B 68 -16.574 6.122 -0.306 1.00 0.00 H new ATOM 0 HB2 ARG B 68 -15.052 8.132 -0.688 1.00 0.00 H new ATOM 0 HB3 ARG B 68 -13.701 7.016 -0.684 1.00 0.00 H new ATOM 0 HG2 ARG B 68 -14.612 5.829 -2.622 1.00 0.00 H new ATOM 0 HG3 ARG B 68 -16.064 6.810 -2.585 1.00 0.00 H new ATOM 0 HD2 ARG B 68 -14.665 8.853 -2.971 1.00 0.00 H new ATOM 0 HD3 ARG B 68 -13.239 7.838 -3.068 1.00 0.00 H new ATOM 0 HE ARG B 68 -15.292 6.959 -4.926 1.00 0.00 H new ATOM 0 HH11 ARG B 68 -12.717 9.319 -4.401 1.00 0.00 H new ATOM 0 HH12 ARG B 68 -12.467 9.600 -6.127 1.00 0.00 H new ATOM 0 HH21 ARG B 68 -14.965 7.328 -7.137 1.00 0.00 H new ATOM 0 HH22 ARG B 68 -13.734 8.478 -7.669 1.00 0.00 H new ATOM 1737 N TRP B 69 -14.390 4.358 1.128 1.00 0.00 N ATOM 1738 CA TRP B 69 -13.768 3.050 1.302 1.00 0.00 C ATOM 1739 C TRP B 69 -14.763 1.931 1.005 1.00 0.00 C ATOM 1740 O TRP B 69 -14.437 0.952 0.339 1.00 0.00 O ATOM 1741 CB TRP B 69 -13.263 2.960 2.744 1.00 0.00 C ATOM 1742 CG TRP B 69 -12.410 1.775 3.067 1.00 0.00 C ATOM 1743 CD1 TRP B 69 -11.415 1.236 2.310 1.00 0.00 C ATOM 1744 CD2 TRP B 69 -12.456 1.011 4.273 1.00 0.00 C ATOM 1745 NE1 TRP B 69 -10.846 0.174 2.972 1.00 0.00 N ATOM 1746 CE2 TRP B 69 -11.470 0.018 4.181 1.00 0.00 C ATOM 1747 CE3 TRP B 69 -13.242 1.074 5.419 1.00 0.00 C ATOM 1748 CZ2 TRP B 69 -11.249 -0.906 5.198 1.00 0.00 C ATOM 1749 CZ3 TRP B 69 -13.025 0.160 6.428 1.00 0.00 C ATOM 1750 CH2 TRP B 69 -12.033 -0.819 6.312 1.00 0.00 C ATOM 0 H TRP B 69 -14.350 4.941 1.964 1.00 0.00 H new ATOM 0 HA TRP B 69 -12.938 2.934 0.605 1.00 0.00 H new ATOM 0 HB2 TRP B 69 -12.695 3.863 2.966 1.00 0.00 H new ATOM 0 HB3 TRP B 69 -14.126 2.954 3.410 1.00 0.00 H new ATOM 0 HD1 TRP B 69 -11.117 1.590 1.334 1.00 0.00 H new ATOM 0 HE1 TRP B 69 -10.083 -0.404 2.620 1.00 0.00 H new ATOM 0 HE3 TRP B 69 -14.010 1.827 5.517 1.00 0.00 H new ATOM 0 HZ2 TRP B 69 -10.485 -1.664 5.109 1.00 0.00 H new ATOM 0 HZ3 TRP B 69 -13.630 0.201 7.322 1.00 0.00 H new ATOM 0 HH2 TRP B 69 -11.884 -1.520 7.120 1.00 0.00 H new ATOM 1761 N GLY B 70 -15.991 2.104 1.470 1.00 0.00 N ATOM 1762 CA GLY B 70 -17.009 1.092 1.265 1.00 0.00 C ATOM 1763 C GLY B 70 -17.651 1.181 -0.105 1.00 0.00 C ATOM 1764 O GLY B 70 -18.512 0.373 -0.446 1.00 0.00 O ATOM 0 H GLY B 70 -16.302 2.927 1.986 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -16.565 0.104 1.391 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -17.778 1.195 2.030 1.00 0.00 H new ATOM 1768 N SER B 71 -17.226 2.158 -0.897 1.00 0.00 N ATOM 1769 CA SER B 71 -17.772 2.348 -2.231 1.00 0.00 C ATOM 1770 C SER B 71 -16.986 1.532 -3.245 1.00 0.00 C ATOM 1771 O SER B 71 -17.417 1.362 -4.387 1.00 0.00 O ATOM 1772 CB SER B 71 -17.761 3.832 -2.608 1.00 0.00 C ATOM 1773 OG SER B 71 -18.423 4.058 -3.843 1.00 0.00 O ATOM 0 H SER B 71 -16.504 2.830 -0.636 1.00 0.00 H new ATOM 0 HA SER B 71 -18.805 2.001 -2.236 1.00 0.00 H new ATOM 0 HB2 SER B 71 -18.245 4.412 -1.822 1.00 0.00 H new ATOM 0 HB3 SER B 71 -16.732 4.184 -2.676 1.00 0.00 H new ATOM 0 HG SER B 71 -18.399 3.240 -4.381 1.00 0.00 H new ATOM 1779 N VAL B 72 -15.838 1.021 -2.823 1.00 0.00 N ATOM 1780 CA VAL B 72 -15.061 0.125 -3.659 1.00 0.00 C ATOM 1781 C VAL B 72 -15.875 -1.142 -3.911 1.00 0.00 C ATOM 1782 O VAL B 72 -16.606 -1.604 -3.027 1.00 0.00 O ATOM 1783 CB VAL B 72 -13.705 -0.225 -3.005 1.00 0.00 C ATOM 1784 CG1 VAL B 72 -12.838 -1.040 -3.951 1.00 0.00 C ATOM 1785 CG2 VAL B 72 -12.978 1.043 -2.577 1.00 0.00 C ATOM 0 H VAL B 72 -15.427 1.212 -1.909 1.00 0.00 H new ATOM 0 HA VAL B 72 -14.844 0.622 -4.604 1.00 0.00 H new ATOM 0 HB VAL B 72 -13.902 -0.830 -2.120 1.00 0.00 H new ATOM 0 HG11 VAL B 72 -11.890 -1.273 -3.466 1.00 0.00 H new ATOM 0 HG12 VAL B 72 -13.351 -1.967 -4.208 1.00 0.00 H new ATOM 0 HG13 VAL B 72 -12.650 -0.466 -4.858 1.00 0.00 H new ATOM 0 HG21 VAL B 72 -12.025 0.779 -2.118 1.00 0.00 H new ATOM 0 HG22 VAL B 72 -12.799 1.672 -3.449 1.00 0.00 H new ATOM 0 HG23 VAL B 72 -13.589 1.587 -1.857 1.00 0.00 H new ATOM 1795 N GLY B 73 -15.758 -1.694 -5.109 1.00 0.00 N ATOM 1796 CA GLY B 73 -16.631 -2.773 -5.532 1.00 0.00 C ATOM 1797 C GLY B 73 -16.352 -4.107 -4.865 1.00 0.00 C ATOM 1798 O GLY B 73 -16.817 -5.124 -5.364 1.00 0.00 O ATOM 0 H GLY B 73 -15.067 -1.411 -5.804 1.00 0.00 H new ATOM 0 HA2 GLY B 73 -17.664 -2.489 -5.329 1.00 0.00 H new ATOM 0 HA3 GLY B 73 -16.540 -2.895 -6.611 1.00 0.00 H new ATOM 1802 N LYS B 74 -15.622 -4.082 -3.732 1.00 0.00 N ATOM 1803 CA LYS B 74 -15.264 -5.271 -2.917 1.00 0.00 C ATOM 1804 C LYS B 74 -14.639 -6.414 -3.731 1.00 0.00 C ATOM 1805 O LYS B 74 -13.473 -6.741 -3.527 1.00 0.00 O ATOM 1806 CB LYS B 74 -16.437 -5.752 -2.032 1.00 0.00 C ATOM 1807 CG LYS B 74 -17.809 -5.746 -2.686 1.00 0.00 C ATOM 1808 CD LYS B 74 -18.926 -5.683 -1.653 1.00 0.00 C ATOM 1809 CE LYS B 74 -18.910 -4.364 -0.883 1.00 0.00 C ATOM 1810 NZ LYS B 74 -19.048 -3.187 -1.783 1.00 0.00 N ATOM 0 H LYS B 74 -15.253 -3.214 -3.344 1.00 0.00 H new ATOM 0 HA LYS B 74 -14.476 -4.933 -2.244 1.00 0.00 H new ATOM 0 HB2 LYS B 74 -16.221 -6.766 -1.696 1.00 0.00 H new ATOM 0 HB3 LYS B 74 -16.477 -5.123 -1.143 1.00 0.00 H new ATOM 0 HG2 LYS B 74 -17.887 -4.892 -3.359 1.00 0.00 H new ATOM 0 HG3 LYS B 74 -17.926 -6.643 -3.294 1.00 0.00 H new ATOM 0 HD2 LYS B 74 -19.889 -5.802 -2.150 1.00 0.00 H new ATOM 0 HD3 LYS B 74 -18.823 -6.513 -0.954 1.00 0.00 H new ATOM 0 HE2 LYS B 74 -19.721 -4.360 -0.155 1.00 0.00 H new ATOM 0 HE3 LYS B 74 -17.979 -4.284 -0.322 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 -19.541 -2.422 -1.280 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 -18.105 -2.859 -2.073 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 -19.595 -3.456 -2.626 1.00 0.00 H new ATOM 1824 N LYS B 75 -15.396 -7.020 -4.628 1.00 0.00 N ATOM 1825 CA LYS B 75 -14.847 -7.957 -5.599 1.00 0.00 C ATOM 1826 C LYS B 75 -13.719 -7.275 -6.363 1.00 0.00 C ATOM 1827 O LYS B 75 -12.613 -7.805 -6.495 1.00 0.00 O ATOM 1828 CB LYS B 75 -15.953 -8.391 -6.563 1.00 0.00 C ATOM 1829 CG LYS B 75 -15.539 -9.504 -7.503 1.00 0.00 C ATOM 1830 CD LYS B 75 -14.796 -8.984 -8.720 1.00 0.00 C ATOM 1831 CE LYS B 75 -14.297 -10.123 -9.592 1.00 0.00 C ATOM 1832 NZ LYS B 75 -15.414 -10.948 -10.124 1.00 0.00 N ATOM 0 H LYS B 75 -16.403 -6.880 -4.706 1.00 0.00 H new ATOM 0 HA LYS B 75 -14.455 -8.838 -5.091 1.00 0.00 H new ATOM 0 HB2 LYS B 75 -16.818 -8.718 -5.986 1.00 0.00 H new ATOM 0 HB3 LYS B 75 -16.269 -7.529 -7.151 1.00 0.00 H new ATOM 0 HG2 LYS B 75 -14.905 -10.211 -6.968 1.00 0.00 H new ATOM 0 HG3 LYS B 75 -16.424 -10.051 -7.827 1.00 0.00 H new ATOM 0 HD2 LYS B 75 -15.454 -8.339 -9.302 1.00 0.00 H new ATOM 0 HD3 LYS B 75 -13.953 -8.372 -8.400 1.00 0.00 H new ATOM 0 HE2 LYS B 75 -13.719 -9.717 -10.422 1.00 0.00 H new ATOM 0 HE3 LYS B 75 -13.624 -10.755 -9.013 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 -15.049 -11.604 -10.843 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 -15.845 -11.490 -9.348 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 -16.130 -10.328 -10.553 1.00 0.00 H new ATOM 1846 N GLU B 76 -14.041 -6.100 -6.878 1.00 0.00 N ATOM 1847 CA GLU B 76 -13.060 -5.206 -7.487 1.00 0.00 C ATOM 1848 C GLU B 76 -11.835 -5.051 -6.587 1.00 0.00 C ATOM 1849 O GLU B 76 -10.697 -5.164 -7.042 1.00 0.00 O ATOM 1850 CB GLU B 76 -13.689 -3.833 -7.720 1.00 0.00 C ATOM 1851 CG GLU B 76 -12.746 -2.824 -8.355 1.00 0.00 C ATOM 1852 CD GLU B 76 -12.979 -1.422 -7.850 1.00 0.00 C ATOM 1853 OE1 GLU B 76 -13.984 -1.203 -7.138 1.00 0.00 O ATOM 1854 OE2 GLU B 76 -12.167 -0.535 -8.178 1.00 0.00 O ATOM 0 H GLU B 76 -14.993 -5.734 -6.887 1.00 0.00 H new ATOM 0 HA GLU B 76 -12.746 -5.638 -8.437 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -14.565 -3.949 -8.358 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -14.040 -3.438 -6.766 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -11.716 -3.115 -8.150 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -12.873 -2.843 -9.437 1.00 0.00 H new ATOM 1861 N ALA B 77 -12.085 -4.805 -5.303 1.00 0.00 N ATOM 1862 CA ALA B 77 -11.017 -4.616 -4.328 1.00 0.00 C ATOM 1863 C ALA B 77 -10.148 -5.862 -4.216 1.00 0.00 C ATOM 1864 O ALA B 77 -8.941 -5.761 -4.028 1.00 0.00 O ATOM 1865 CB ALA B 77 -11.592 -4.248 -2.969 1.00 0.00 C ATOM 0 H ALA B 77 -13.025 -4.732 -4.913 1.00 0.00 H new ATOM 0 HA ALA B 77 -10.389 -3.795 -4.675 1.00 0.00 H new ATOM 0 HB1 ALA B 77 -10.780 -4.111 -2.255 1.00 0.00 H new ATOM 0 HB2 ALA B 77 -12.161 -3.322 -3.053 1.00 0.00 H new ATOM 0 HB3 ALA B 77 -12.248 -5.047 -2.623 1.00 0.00 H new ATOM 1871 N MET B 78 -10.766 -7.033 -4.339 1.00 0.00 N ATOM 1872 CA MET B 78 -10.031 -8.294 -4.317 1.00 0.00 C ATOM 1873 C MET B 78 -8.991 -8.305 -5.425 1.00 0.00 C ATOM 1874 O MET B 78 -7.840 -8.688 -5.209 1.00 0.00 O ATOM 1875 CB MET B 78 -10.975 -9.485 -4.496 1.00 0.00 C ATOM 1876 CG MET B 78 -12.027 -9.608 -3.411 1.00 0.00 C ATOM 1877 SD MET B 78 -13.174 -10.964 -3.713 1.00 0.00 S ATOM 1878 CE MET B 78 -14.258 -10.798 -2.301 1.00 0.00 C ATOM 0 H MET B 78 -11.774 -7.135 -4.455 1.00 0.00 H new ATOM 0 HA MET B 78 -9.540 -8.382 -3.348 1.00 0.00 H new ATOM 0 HB2 MET B 78 -11.473 -9.399 -5.462 1.00 0.00 H new ATOM 0 HB3 MET B 78 -10.386 -10.402 -4.522 1.00 0.00 H new ATOM 0 HG2 MET B 78 -11.537 -9.759 -2.449 1.00 0.00 H new ATOM 0 HG3 MET B 78 -12.584 -8.674 -3.342 1.00 0.00 H new ATOM 0 HE1 MET B 78 -15.069 -11.523 -2.377 1.00 0.00 H new ATOM 0 HE2 MET B 78 -13.694 -10.979 -1.386 1.00 0.00 H new ATOM 0 HE3 MET B 78 -14.673 -9.790 -2.278 1.00 0.00 H new ATOM 1888 N GLU B 79 -9.410 -7.871 -6.607 1.00 0.00 N ATOM 1889 CA GLU B 79 -8.518 -7.778 -7.756 1.00 0.00 C ATOM 1890 C GLU B 79 -7.413 -6.752 -7.511 1.00 0.00 C ATOM 1891 O GLU B 79 -6.242 -6.999 -7.808 1.00 0.00 O ATOM 1892 CB GLU B 79 -9.309 -7.406 -9.003 1.00 0.00 C ATOM 1893 CG GLU B 79 -10.268 -8.494 -9.446 1.00 0.00 C ATOM 1894 CD GLU B 79 -9.559 -9.786 -9.794 1.00 0.00 C ATOM 1895 OE1 GLU B 79 -8.979 -9.874 -10.897 1.00 0.00 O ATOM 1896 OE2 GLU B 79 -9.579 -10.720 -8.971 1.00 0.00 O ATOM 0 H GLU B 79 -10.368 -7.576 -6.796 1.00 0.00 H new ATOM 0 HA GLU B 79 -8.052 -8.752 -7.904 1.00 0.00 H new ATOM 0 HB2 GLU B 79 -9.870 -6.492 -8.811 1.00 0.00 H new ATOM 0 HB3 GLU B 79 -8.615 -7.189 -9.815 1.00 0.00 H new ATOM 0 HG2 GLU B 79 -10.990 -8.682 -8.652 1.00 0.00 H new ATOM 0 HG3 GLU B 79 -10.830 -8.147 -10.313 1.00 0.00 H new ATOM 1903 N ILE B 80 -7.795 -5.603 -6.963 1.00 0.00 N ATOM 1904 CA ILE B 80 -6.846 -4.537 -6.656 1.00 0.00 C ATOM 1905 C ILE B 80 -5.815 -5.005 -5.633 1.00 0.00 C ATOM 1906 O ILE B 80 -4.612 -4.890 -5.856 1.00 0.00 O ATOM 1907 CB ILE B 80 -7.563 -3.284 -6.109 1.00 0.00 C ATOM 1908 CG1 ILE B 80 -8.606 -2.788 -7.111 1.00 0.00 C ATOM 1909 CG2 ILE B 80 -6.556 -2.182 -5.801 1.00 0.00 C ATOM 1910 CD1 ILE B 80 -9.453 -1.651 -6.585 1.00 0.00 C ATOM 0 H ILE B 80 -8.762 -5.385 -6.721 1.00 0.00 H new ATOM 0 HA ILE B 80 -6.344 -4.279 -7.588 1.00 0.00 H new ATOM 0 HB ILE B 80 -8.071 -3.554 -5.183 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -8.100 -2.463 -8.020 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -9.256 -3.618 -7.387 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -7.080 -1.307 -5.417 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -5.846 -2.537 -5.054 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -6.021 -1.913 -6.712 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -10.171 -1.349 -7.347 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -9.987 -1.978 -5.693 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -8.812 -0.805 -6.335 1.00 0.00 H new ATOM 1922 N ILE B 81 -6.302 -5.544 -4.521 1.00 0.00 N ATOM 1923 CA ILE B 81 -5.438 -6.025 -3.448 1.00 0.00 C ATOM 1924 C ILE B 81 -4.528 -7.146 -3.946 1.00 0.00 C ATOM 1925 O ILE B 81 -3.373 -7.253 -3.529 1.00 0.00 O ATOM 1926 CB ILE B 81 -6.270 -6.519 -2.238 1.00 0.00 C ATOM 1927 CG1 ILE B 81 -7.054 -5.358 -1.615 1.00 0.00 C ATOM 1928 CG2 ILE B 81 -5.383 -7.181 -1.193 1.00 0.00 C ATOM 1929 CD1 ILE B 81 -6.181 -4.230 -1.101 1.00 0.00 C ATOM 0 H ILE B 81 -7.299 -5.660 -4.338 1.00 0.00 H new ATOM 0 HA ILE B 81 -4.820 -5.188 -3.123 1.00 0.00 H new ATOM 0 HB ILE B 81 -6.978 -7.265 -2.601 1.00 0.00 H new ATOM 0 HG12 ILE B 81 -7.745 -4.959 -2.358 1.00 0.00 H new ATOM 0 HG13 ILE B 81 -7.657 -5.741 -0.792 1.00 0.00 H new ATOM 0 HG21 ILE B 81 -5.995 -7.517 -0.356 1.00 0.00 H new ATOM 0 HG22 ILE B 81 -4.874 -8.037 -1.637 1.00 0.00 H new ATOM 0 HG23 ILE B 81 -4.644 -6.464 -0.836 1.00 0.00 H new ATOM 0 HD11 ILE B 81 -6.810 -3.448 -0.676 1.00 0.00 H new ATOM 0 HD12 ILE B 81 -5.508 -4.612 -0.333 1.00 0.00 H new ATOM 0 HD13 ILE B 81 -5.597 -3.818 -1.924 1.00 0.00 H new ATOM 1941 N LYS B 82 -5.047 -7.963 -4.853 1.00 0.00 N ATOM 1942 CA LYS B 82 -4.264 -9.036 -5.450 1.00 0.00 C ATOM 1943 C LYS B 82 -3.063 -8.458 -6.193 1.00 0.00 C ATOM 1944 O LYS B 82 -1.924 -8.861 -5.962 1.00 0.00 O ATOM 1945 CB LYS B 82 -5.129 -9.858 -6.410 1.00 0.00 C ATOM 1946 CG LYS B 82 -4.397 -11.031 -7.045 1.00 0.00 C ATOM 1947 CD LYS B 82 -4.042 -12.112 -6.031 1.00 0.00 C ATOM 1948 CE LYS B 82 -5.193 -13.084 -5.796 1.00 0.00 C ATOM 1949 NZ LYS B 82 -6.379 -12.443 -5.168 1.00 0.00 N ATOM 0 H LYS B 82 -6.007 -7.903 -5.191 1.00 0.00 H new ATOM 0 HA LYS B 82 -3.907 -9.690 -4.654 1.00 0.00 H new ATOM 0 HB2 LYS B 82 -5.998 -10.234 -5.870 1.00 0.00 H new ATOM 0 HB3 LYS B 82 -5.502 -9.204 -7.199 1.00 0.00 H new ATOM 0 HG2 LYS B 82 -5.019 -11.462 -7.829 1.00 0.00 H new ATOM 0 HG3 LYS B 82 -3.486 -10.671 -7.523 1.00 0.00 H new ATOM 0 HD2 LYS B 82 -3.169 -12.663 -6.381 1.00 0.00 H new ATOM 0 HD3 LYS B 82 -3.765 -11.644 -5.086 1.00 0.00 H new ATOM 0 HE2 LYS B 82 -5.488 -13.526 -6.748 1.00 0.00 H new ATOM 0 HE3 LYS B 82 -4.848 -13.899 -5.160 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 -6.959 -13.169 -4.700 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 -6.064 -11.744 -4.465 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 -6.945 -11.967 -5.900 1.00 0.00 H new ATOM 1963 N LYS B 83 -3.330 -7.496 -7.069 1.00 0.00 N ATOM 1964 CA LYS B 83 -2.278 -6.833 -7.832 1.00 0.00 C ATOM 1965 C LYS B 83 -1.360 -6.042 -6.909 1.00 0.00 C ATOM 1966 O LYS B 83 -0.157 -5.943 -7.149 1.00 0.00 O ATOM 1967 CB LYS B 83 -2.889 -5.899 -8.876 1.00 0.00 C ATOM 1968 CG LYS B 83 -3.681 -6.621 -9.953 1.00 0.00 C ATOM 1969 CD LYS B 83 -4.379 -5.645 -10.888 1.00 0.00 C ATOM 1970 CE LYS B 83 -3.393 -4.696 -11.551 1.00 0.00 C ATOM 1971 NZ LYS B 83 -4.060 -3.786 -12.518 1.00 0.00 N ATOM 0 H LYS B 83 -4.271 -7.156 -7.269 1.00 0.00 H new ATOM 0 HA LYS B 83 -1.690 -7.599 -8.337 1.00 0.00 H new ATOM 0 HB2 LYS B 83 -3.542 -5.185 -8.374 1.00 0.00 H new ATOM 0 HB3 LYS B 83 -2.092 -5.324 -9.347 1.00 0.00 H new ATOM 0 HG2 LYS B 83 -3.013 -7.261 -10.529 1.00 0.00 H new ATOM 0 HG3 LYS B 83 -4.421 -7.271 -9.486 1.00 0.00 H new ATOM 0 HD2 LYS B 83 -4.921 -6.200 -11.654 1.00 0.00 H new ATOM 0 HD3 LYS B 83 -5.117 -5.070 -10.329 1.00 0.00 H new ATOM 0 HE2 LYS B 83 -2.888 -4.105 -10.786 1.00 0.00 H new ATOM 0 HE3 LYS B 83 -2.625 -5.273 -12.067 1.00 0.00 H new ATOM 0 HZ1 LYS B 83 -3.352 -3.156 -12.947 1.00 0.00 H new ATOM 0 HZ2 LYS B 83 -4.520 -4.348 -13.263 1.00 0.00 H new ATOM 0 HZ3 LYS B 83 -4.775 -3.216 -12.022 1.00 0.00 H new ATOM 1985 N PHE B 84 -1.941 -5.485 -5.855 1.00 0.00 N ATOM 1986 CA PHE B 84 -1.193 -4.711 -4.876 1.00 0.00 C ATOM 1987 C PHE B 84 -0.121 -5.583 -4.230 1.00 0.00 C ATOM 1988 O PHE B 84 1.057 -5.229 -4.213 1.00 0.00 O ATOM 1989 CB PHE B 84 -2.144 -4.162 -3.809 1.00 0.00 C ATOM 1990 CG PHE B 84 -1.743 -2.823 -3.259 1.00 0.00 C ATOM 1991 CD1 PHE B 84 -0.642 -2.695 -2.430 1.00 0.00 C ATOM 1992 CD2 PHE B 84 -2.477 -1.690 -3.571 1.00 0.00 C ATOM 1993 CE1 PHE B 84 -0.280 -1.463 -1.921 1.00 0.00 C ATOM 1994 CE2 PHE B 84 -2.120 -0.455 -3.066 1.00 0.00 C ATOM 1995 CZ PHE B 84 -1.020 -0.341 -2.240 1.00 0.00 C ATOM 0 H PHE B 84 -2.939 -5.557 -5.656 1.00 0.00 H new ATOM 0 HA PHE B 84 -0.707 -3.874 -5.378 1.00 0.00 H new ATOM 0 HB2 PHE B 84 -3.144 -4.083 -4.235 1.00 0.00 H new ATOM 0 HB3 PHE B 84 -2.203 -4.877 -2.988 1.00 0.00 H new ATOM 0 HD1 PHE B 84 -0.059 -3.569 -2.178 1.00 0.00 H new ATOM 0 HD2 PHE B 84 -3.339 -1.774 -4.217 1.00 0.00 H new ATOM 0 HE1 PHE B 84 0.581 -1.377 -1.274 1.00 0.00 H new ATOM 0 HE2 PHE B 84 -2.701 0.420 -3.317 1.00 0.00 H new ATOM 0 HZ PHE B 84 -0.738 0.623 -1.844 1.00 0.00 H new ATOM 2005 N LYS B 85 -0.539 -6.738 -3.724 1.00 0.00 N ATOM 2006 CA LYS B 85 0.380 -7.676 -3.091 1.00 0.00 C ATOM 2007 C LYS B 85 1.407 -8.202 -4.092 1.00 0.00 C ATOM 2008 O LYS B 85 2.565 -8.437 -3.738 1.00 0.00 O ATOM 2009 CB LYS B 85 -0.387 -8.843 -2.468 1.00 0.00 C ATOM 2010 CG LYS B 85 -1.343 -8.429 -1.360 1.00 0.00 C ATOM 2011 CD LYS B 85 -1.999 -9.639 -0.717 1.00 0.00 C ATOM 2012 CE LYS B 85 -2.942 -9.239 0.405 1.00 0.00 C ATOM 2013 NZ LYS B 85 -3.601 -10.421 1.018 1.00 0.00 N ATOM 0 H LYS B 85 -1.511 -7.047 -3.740 1.00 0.00 H new ATOM 0 HA LYS B 85 0.911 -7.140 -2.304 1.00 0.00 H new ATOM 0 HB2 LYS B 85 -0.950 -9.353 -3.249 1.00 0.00 H new ATOM 0 HB3 LYS B 85 0.327 -9.563 -2.068 1.00 0.00 H new ATOM 0 HG2 LYS B 85 -0.802 -7.861 -0.603 1.00 0.00 H new ATOM 0 HG3 LYS B 85 -2.110 -7.769 -1.766 1.00 0.00 H new ATOM 0 HD2 LYS B 85 -2.550 -10.198 -1.473 1.00 0.00 H new ATOM 0 HD3 LYS B 85 -1.230 -10.305 -0.326 1.00 0.00 H new ATOM 0 HE2 LYS B 85 -2.388 -8.695 1.169 1.00 0.00 H new ATOM 0 HE3 LYS B 85 -3.701 -8.560 0.017 1.00 0.00 H new ATOM 0 HZ1 LYS B 85 -4.582 -10.181 1.267 1.00 0.00 H new ATOM 0 HZ2 LYS B 85 -3.599 -11.210 0.340 1.00 0.00 H new ATOM 0 HZ3 LYS B 85 -3.084 -10.700 1.876 1.00 0.00 H new ATOM 2027 N LYS B 86 0.979 -8.384 -5.339 1.00 0.00 N ATOM 2028 CA LYS B 86 1.872 -8.847 -6.397 1.00 0.00 C ATOM 2029 C LYS B 86 2.971 -7.826 -6.670 1.00 0.00 C ATOM 2030 O LYS B 86 4.145 -8.184 -6.797 1.00 0.00 O ATOM 2031 CB LYS B 86 1.098 -9.120 -7.691 1.00 0.00 C ATOM 2032 CG LYS B 86 0.244 -10.376 -7.654 1.00 0.00 C ATOM 2033 CD LYS B 86 -0.442 -10.611 -8.991 1.00 0.00 C ATOM 2034 CE LYS B 86 -1.217 -11.918 -9.004 1.00 0.00 C ATOM 2035 NZ LYS B 86 -1.874 -12.159 -10.316 1.00 0.00 N ATOM 0 H LYS B 86 0.019 -8.218 -5.641 1.00 0.00 H new ATOM 0 HA LYS B 86 2.327 -9.776 -6.054 1.00 0.00 H new ATOM 0 HB2 LYS B 86 0.457 -8.265 -7.905 1.00 0.00 H new ATOM 0 HB3 LYS B 86 1.807 -9.201 -8.515 1.00 0.00 H new ATOM 0 HG2 LYS B 86 0.866 -11.236 -7.405 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -0.506 -10.287 -6.868 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -1.120 -9.784 -9.202 1.00 0.00 H new ATOM 0 HD3 LYS B 86 0.304 -10.623 -9.786 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -0.541 -12.743 -8.779 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -1.972 -11.901 -8.218 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -2.392 -13.060 -10.284 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -2.538 -11.385 -10.519 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -1.152 -12.201 -11.063 1.00 0.00 H new ATOM 2049 N ASP B 87 2.588 -6.558 -6.757 1.00 0.00 N ATOM 2050 CA ASP B 87 3.540 -5.491 -7.047 1.00 0.00 C ATOM 2051 C ASP B 87 4.504 -5.319 -5.880 1.00 0.00 C ATOM 2052 O ASP B 87 5.703 -5.112 -6.073 1.00 0.00 O ATOM 2053 CB ASP B 87 2.807 -4.176 -7.335 1.00 0.00 C ATOM 2054 CG ASP B 87 3.649 -3.200 -8.138 1.00 0.00 C ATOM 2055 OD1 ASP B 87 4.080 -2.169 -7.584 1.00 0.00 O ATOM 2056 OD2 ASP B 87 3.870 -3.456 -9.346 1.00 0.00 O ATOM 0 H ASP B 87 1.626 -6.243 -6.631 1.00 0.00 H new ATOM 0 HA ASP B 87 4.109 -5.765 -7.935 1.00 0.00 H new ATOM 0 HB2 ASP B 87 1.887 -4.389 -7.879 1.00 0.00 H new ATOM 0 HB3 ASP B 87 2.519 -3.711 -6.392 1.00 0.00 H new ATOM 2061 N LEU B 88 3.971 -5.443 -4.667 1.00 0.00 N ATOM 2062 CA LEU B 88 4.782 -5.380 -3.455 1.00 0.00 C ATOM 2063 C LEU B 88 5.830 -6.486 -3.450 1.00 0.00 C ATOM 2064 O LEU B 88 6.975 -6.271 -3.055 1.00 0.00 O ATOM 2065 CB LEU B 88 3.903 -5.514 -2.209 1.00 0.00 C ATOM 2066 CG LEU B 88 2.903 -4.380 -1.975 1.00 0.00 C ATOM 2067 CD1 LEU B 88 2.073 -4.661 -0.732 1.00 0.00 C ATOM 2068 CD2 LEU B 88 3.623 -3.045 -1.848 1.00 0.00 C ATOM 0 H LEU B 88 2.976 -5.588 -4.498 1.00 0.00 H new ATOM 0 HA LEU B 88 5.282 -4.411 -3.440 1.00 0.00 H new ATOM 0 HB2 LEU B 88 3.351 -6.452 -2.276 1.00 0.00 H new ATOM 0 HB3 LEU B 88 4.552 -5.587 -1.336 1.00 0.00 H new ATOM 0 HG LEU B 88 2.235 -4.324 -2.835 1.00 0.00 H new ATOM 0 HD11 LEU B 88 1.365 -3.847 -0.576 1.00 0.00 H new ATOM 0 HD12 LEU B 88 1.528 -5.596 -0.862 1.00 0.00 H new ATOM 0 HD13 LEU B 88 2.730 -4.741 0.134 1.00 0.00 H new ATOM 0 HD21 LEU B 88 2.893 -2.252 -1.682 1.00 0.00 H new ATOM 0 HD22 LEU B 88 4.315 -3.083 -1.007 1.00 0.00 H new ATOM 0 HD23 LEU B 88 4.177 -2.842 -2.764 1.00 0.00 H new ATOM 2080 N ALA B 89 5.425 -7.670 -3.898 1.00 0.00 N ATOM 2081 CA ALA B 89 6.316 -8.821 -3.944 1.00 0.00 C ATOM 2082 C ALA B 89 7.494 -8.559 -4.872 1.00 0.00 C ATOM 2083 O ALA B 89 8.645 -8.809 -4.518 1.00 0.00 O ATOM 2084 CB ALA B 89 5.554 -10.058 -4.393 1.00 0.00 C ATOM 0 H ALA B 89 4.481 -7.857 -4.236 1.00 0.00 H new ATOM 0 HA ALA B 89 6.706 -8.992 -2.941 1.00 0.00 H new ATOM 0 HB1 ALA B 89 6.231 -10.912 -4.423 1.00 0.00 H new ATOM 0 HB2 ALA B 89 4.745 -10.261 -3.692 1.00 0.00 H new ATOM 0 HB3 ALA B 89 5.139 -9.889 -5.387 1.00 0.00 H new ATOM 2090 N ALA B 90 7.197 -8.039 -6.056 1.00 0.00 N ATOM 2091 CA ALA B 90 8.227 -7.739 -7.039 1.00 0.00 C ATOM 2092 C ALA B 90 9.179 -6.668 -6.519 1.00 0.00 C ATOM 2093 O ALA B 90 10.400 -6.819 -6.594 1.00 0.00 O ATOM 2094 CB ALA B 90 7.591 -7.297 -8.348 1.00 0.00 C ATOM 0 H ALA B 90 6.249 -7.816 -6.358 1.00 0.00 H new ATOM 0 HA ALA B 90 8.805 -8.646 -7.219 1.00 0.00 H new ATOM 0 HB1 ALA B 90 8.372 -7.075 -9.075 1.00 0.00 H new ATOM 0 HB2 ALA B 90 6.954 -8.095 -8.731 1.00 0.00 H new ATOM 0 HB3 ALA B 90 6.990 -6.404 -8.177 1.00 0.00 H new ATOM 2100 N MET B 91 8.610 -5.599 -5.976 1.00 0.00 N ATOM 2101 CA MET B 91 9.391 -4.488 -5.444 1.00 0.00 C ATOM 2102 C MET B 91 10.289 -4.942 -4.298 1.00 0.00 C ATOM 2103 O MET B 91 11.432 -4.501 -4.189 1.00 0.00 O ATOM 2104 CB MET B 91 8.461 -3.361 -4.988 1.00 0.00 C ATOM 2105 CG MET B 91 8.179 -2.329 -6.072 1.00 0.00 C ATOM 2106 SD MET B 91 7.834 -3.066 -7.679 1.00 0.00 S ATOM 2107 CE MET B 91 7.874 -1.612 -8.724 1.00 0.00 C ATOM 0 H MET B 91 7.601 -5.477 -5.892 1.00 0.00 H new ATOM 0 HA MET B 91 10.035 -4.113 -6.239 1.00 0.00 H new ATOM 0 HB2 MET B 91 7.517 -3.792 -4.654 1.00 0.00 H new ATOM 0 HB3 MET B 91 8.905 -2.860 -4.128 1.00 0.00 H new ATOM 0 HG2 MET B 91 7.329 -1.717 -5.770 1.00 0.00 H new ATOM 0 HG3 MET B 91 9.036 -1.662 -6.162 1.00 0.00 H new ATOM 0 HE1 MET B 91 7.330 -1.812 -9.647 1.00 0.00 H new ATOM 0 HE2 MET B 91 7.408 -0.776 -8.202 1.00 0.00 H new ATOM 0 HE3 MET B 91 8.908 -1.361 -8.959 1.00 0.00 H new ATOM 2117 N LEU B 92 9.769 -5.835 -3.463 1.00 0.00 N ATOM 2118 CA LEU B 92 10.536 -6.402 -2.357 1.00 0.00 C ATOM 2119 C LEU B 92 11.787 -7.109 -2.870 1.00 0.00 C ATOM 2120 O LEU B 92 12.889 -6.913 -2.350 1.00 0.00 O ATOM 2121 CB LEU B 92 9.667 -7.388 -1.569 1.00 0.00 C ATOM 2122 CG LEU B 92 10.391 -8.176 -0.475 1.00 0.00 C ATOM 2123 CD1 LEU B 92 10.993 -7.236 0.556 1.00 0.00 C ATOM 2124 CD2 LEU B 92 9.438 -9.156 0.189 1.00 0.00 C ATOM 0 H LEU B 92 8.813 -6.184 -3.531 1.00 0.00 H new ATOM 0 HA LEU B 92 10.844 -5.588 -1.701 1.00 0.00 H new ATOM 0 HB2 LEU B 92 8.846 -6.836 -1.112 1.00 0.00 H new ATOM 0 HB3 LEU B 92 9.225 -8.096 -2.270 1.00 0.00 H new ATOM 0 HG LEU B 92 11.202 -8.739 -0.937 1.00 0.00 H new ATOM 0 HD11 LEU B 92 11.503 -7.817 1.324 1.00 0.00 H new ATOM 0 HD12 LEU B 92 11.707 -6.572 0.070 1.00 0.00 H new ATOM 0 HD13 LEU B 92 10.201 -6.644 1.015 1.00 0.00 H new ATOM 0 HD21 LEU B 92 9.967 -9.709 0.965 1.00 0.00 H new ATOM 0 HD22 LEU B 92 8.607 -8.610 0.635 1.00 0.00 H new ATOM 0 HD23 LEU B 92 9.055 -9.853 -0.556 1.00 0.00 H new ATOM 2136 N ARG B 93 11.606 -7.921 -3.903 1.00 0.00 N ATOM 2137 CA ARG B 93 12.706 -8.669 -4.499 1.00 0.00 C ATOM 2138 C ARG B 93 13.769 -7.721 -5.044 1.00 0.00 C ATOM 2139 O ARG B 93 14.967 -8.000 -4.967 1.00 0.00 O ATOM 2140 CB ARG B 93 12.180 -9.571 -5.615 1.00 0.00 C ATOM 2141 CG ARG B 93 11.117 -10.551 -5.146 1.00 0.00 C ATOM 2142 CD ARG B 93 10.487 -11.290 -6.313 1.00 0.00 C ATOM 2143 NE ARG B 93 9.328 -12.081 -5.902 1.00 0.00 N ATOM 2144 CZ ARG B 93 8.371 -12.491 -6.734 1.00 0.00 C ATOM 2145 NH1 ARG B 93 8.442 -12.198 -8.027 1.00 0.00 N ATOM 2146 NH2 ARG B 93 7.347 -13.199 -6.273 1.00 0.00 N ATOM 0 H ARG B 93 10.702 -8.079 -4.348 1.00 0.00 H new ATOM 0 HA ARG B 93 13.163 -9.288 -3.727 1.00 0.00 H new ATOM 0 HB2 ARG B 93 11.766 -8.950 -6.410 1.00 0.00 H new ATOM 0 HB3 ARG B 93 13.012 -10.127 -6.046 1.00 0.00 H new ATOM 0 HG2 ARG B 93 11.561 -11.269 -4.457 1.00 0.00 H new ATOM 0 HG3 ARG B 93 10.345 -10.015 -4.594 1.00 0.00 H new ATOM 0 HD2 ARG B 93 10.184 -10.572 -7.075 1.00 0.00 H new ATOM 0 HD3 ARG B 93 11.229 -11.945 -6.770 1.00 0.00 H new ATOM 0 HE ARG B 93 9.247 -12.335 -4.917 1.00 0.00 H new ATOM 0 HH11 ARG B 93 9.230 -11.658 -8.385 1.00 0.00 H new ATOM 0 HH12 ARG B 93 7.709 -12.513 -8.662 1.00 0.00 H new ATOM 0 HH21 ARG B 93 7.292 -13.430 -5.281 1.00 0.00 H new ATOM 0 HH22 ARG B 93 6.615 -13.512 -6.911 1.00 0.00 H new ATOM 2160 N ILE B 94 13.325 -6.590 -5.581 1.00 0.00 N ATOM 2161 CA ILE B 94 14.240 -5.596 -6.118 1.00 0.00 C ATOM 2162 C ILE B 94 15.038 -4.931 -4.997 1.00 0.00 C ATOM 2163 O ILE B 94 16.220 -4.642 -5.166 1.00 0.00 O ATOM 2164 CB ILE B 94 13.502 -4.518 -6.938 1.00 0.00 C ATOM 2165 CG1 ILE B 94 12.652 -5.174 -8.028 1.00 0.00 C ATOM 2166 CG2 ILE B 94 14.503 -3.554 -7.558 1.00 0.00 C ATOM 2167 CD1 ILE B 94 11.783 -4.202 -8.795 1.00 0.00 C ATOM 0 H ILE B 94 12.339 -6.341 -5.655 1.00 0.00 H new ATOM 0 HA ILE B 94 14.924 -6.122 -6.785 1.00 0.00 H new ATOM 0 HB ILE B 94 12.845 -3.959 -6.272 1.00 0.00 H new ATOM 0 HG12 ILE B 94 13.310 -5.688 -8.728 1.00 0.00 H new ATOM 0 HG13 ILE B 94 12.016 -5.933 -7.572 1.00 0.00 H new ATOM 0 HG21 ILE B 94 13.971 -2.798 -8.134 1.00 0.00 H new ATOM 0 HG22 ILE B 94 15.079 -3.070 -6.769 1.00 0.00 H new ATOM 0 HG23 ILE B 94 15.178 -4.103 -8.215 1.00 0.00 H new ATOM 0 HD11 ILE B 94 11.211 -4.742 -9.549 1.00 0.00 H new ATOM 0 HD12 ILE B 94 11.098 -3.705 -8.107 1.00 0.00 H new ATOM 0 HD13 ILE B 94 12.412 -3.457 -9.282 1.00 0.00 H new ATOM 2179 N ILE B 95 14.397 -4.705 -3.848 1.00 0.00 N ATOM 2180 CA ILE B 95 15.088 -4.138 -2.690 1.00 0.00 C ATOM 2181 C ILE B 95 16.271 -5.019 -2.312 1.00 0.00 C ATOM 2182 O ILE B 95 17.375 -4.533 -2.060 1.00 0.00 O ATOM 2183 CB ILE B 95 14.172 -4.006 -1.455 1.00 0.00 C ATOM 2184 CG1 ILE B 95 12.924 -3.208 -1.793 1.00 0.00 C ATOM 2185 CG2 ILE B 95 14.927 -3.309 -0.333 1.00 0.00 C ATOM 2186 CD1 ILE B 95 13.222 -1.758 -2.064 1.00 0.00 C ATOM 0 H ILE B 95 13.408 -4.904 -3.696 1.00 0.00 H new ATOM 0 HA ILE B 95 15.416 -3.140 -2.981 1.00 0.00 H new ATOM 0 HB ILE B 95 13.873 -5.005 -1.138 1.00 0.00 H new ATOM 0 HG12 ILE B 95 12.442 -3.646 -2.667 1.00 0.00 H new ATOM 0 HG13 ILE B 95 12.215 -3.282 -0.968 1.00 0.00 H new ATOM 0 HG21 ILE B 95 14.279 -3.216 0.539 1.00 0.00 H new ATOM 0 HG22 ILE B 95 15.808 -3.894 -0.070 1.00 0.00 H new ATOM 0 HG23 ILE B 95 15.235 -2.317 -0.663 1.00 0.00 H new ATOM 0 HD11 ILE B 95 12.296 -1.234 -2.300 1.00 0.00 H new ATOM 0 HD12 ILE B 95 13.678 -1.309 -1.181 1.00 0.00 H new ATOM 0 HD13 ILE B 95 13.909 -1.679 -2.907 1.00 0.00 H new ATOM 2198 N ASN B 96 16.021 -6.324 -2.284 1.00 0.00 N ATOM 2199 CA ASN B 96 17.056 -7.309 -1.977 1.00 0.00 C ATOM 2200 C ASN B 96 18.179 -7.235 -2.995 1.00 0.00 C ATOM 2201 O ASN B 96 19.353 -7.348 -2.650 1.00 0.00 O ATOM 2202 CB ASN B 96 16.470 -8.724 -1.974 1.00 0.00 C ATOM 2203 CG ASN B 96 15.361 -8.908 -0.956 1.00 0.00 C ATOM 2204 OD1 ASN B 96 15.365 -8.295 0.109 1.00 0.00 O ATOM 2205 ND2 ASN B 96 14.401 -9.758 -1.282 1.00 0.00 N ATOM 0 H ASN B 96 15.103 -6.728 -2.472 1.00 0.00 H new ATOM 0 HA ASN B 96 17.451 -7.082 -0.987 1.00 0.00 H new ATOM 0 HB2 ASN B 96 16.084 -8.953 -2.967 1.00 0.00 H new ATOM 0 HB3 ASN B 96 17.266 -9.440 -1.768 1.00 0.00 H new ATOM 0 HD21 ASN B 96 13.627 -9.924 -0.639 1.00 0.00 H new ATOM 0 HD22 ASN B 96 14.435 -10.247 -2.176 1.00 0.00 H new ATOM 2212 N ALA B 97 17.810 -7.021 -4.248 1.00 0.00 N ATOM 2213 CA ALA B 97 18.776 -6.949 -5.333 1.00 0.00 C ATOM 2214 C ALA B 97 19.549 -5.631 -5.313 1.00 0.00 C ATOM 2215 O ALA B 97 20.454 -5.425 -6.119 1.00 0.00 O ATOM 2216 CB ALA B 97 18.073 -7.130 -6.668 1.00 0.00 C ATOM 0 H ALA B 97 16.841 -6.893 -4.540 1.00 0.00 H new ATOM 0 HA ALA B 97 19.497 -7.755 -5.194 1.00 0.00 H new ATOM 0 HB1 ALA B 97 18.804 -7.075 -7.475 1.00 0.00 H new ATOM 0 HB2 ALA B 97 17.580 -8.102 -6.691 1.00 0.00 H new ATOM 0 HB3 ALA B 97 17.330 -6.343 -6.797 1.00 0.00 H new ATOM 2222 N ARG B 98 19.200 -4.742 -4.389 1.00 0.00 N ATOM 2223 CA ARG B 98 19.871 -3.453 -4.297 1.00 0.00 C ATOM 2224 C ARG B 98 20.929 -3.444 -3.201 1.00 0.00 C ATOM 2225 O ARG B 98 21.439 -2.386 -2.838 1.00 0.00 O ATOM 2226 CB ARG B 98 18.870 -2.320 -4.063 1.00 0.00 C ATOM 2227 CG ARG B 98 17.911 -2.110 -5.222 1.00 0.00 C ATOM 2228 CD ARG B 98 17.200 -0.773 -5.121 1.00 0.00 C ATOM 2229 NE ARG B 98 18.135 0.349 -5.226 1.00 0.00 N ATOM 2230 CZ ARG B 98 17.764 1.624 -5.330 1.00 0.00 C ATOM 2231 NH1 ARG B 98 16.476 1.945 -5.317 1.00 0.00 N ATOM 2232 NH2 ARG B 98 18.683 2.574 -5.440 1.00 0.00 N ATOM 0 H ARG B 98 18.463 -4.889 -3.699 1.00 0.00 H new ATOM 0 HA ARG B 98 20.368 -3.289 -5.253 1.00 0.00 H new ATOM 0 HB2 ARG B 98 18.296 -2.533 -3.161 1.00 0.00 H new ATOM 0 HB3 ARG B 98 19.417 -1.395 -3.882 1.00 0.00 H new ATOM 0 HG2 ARG B 98 18.459 -2.162 -6.163 1.00 0.00 H new ATOM 0 HG3 ARG B 98 17.175 -2.914 -5.237 1.00 0.00 H new ATOM 0 HD2 ARG B 98 16.452 -0.698 -5.911 1.00 0.00 H new ATOM 0 HD3 ARG B 98 16.668 -0.715 -4.172 1.00 0.00 H new ATOM 0 HE ARG B 98 19.134 0.141 -5.219 1.00 0.00 H new ATOM 0 HH11 ARG B 98 15.769 1.215 -5.227 1.00 0.00 H new ATOM 0 HH12 ARG B 98 16.193 2.922 -5.397 1.00 0.00 H new ATOM 0 HH21 ARG B 98 19.673 2.328 -5.445 1.00 0.00 H new ATOM 0 HH22 ARG B 98 18.400 3.551 -5.520 1.00 0.00 H new