USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1009 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 144 HIS : no HE2:sc= -3.53! K(o=-6.7!,f=-3.9) USER MOD Set 1.2: A 148 CYS SG : rot 77:sc= -3.22! USER MOD Set 2.1: A 86 ASN : amide:sc= -9! C(o=-10!,f=-6.7!) USER MOD Set 2.2: A 95 THR OG1 : rot 30:sc= -1.29! USER MOD Set 3.1: A 42 HIS : no HD1:sc= -0.237 K(o=-0.24,f=-0.83) USER MOD Set 3.2: A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot 35:sc= -1.43 USER MOD Single : A 35 GLN : amide:sc= -1.53 K(o=-1.5,f=-4.8!) USER MOD Single : A 47 LYS NZ :NH3+ 160:sc= -2.22! (180deg=-3.2!) USER MOD Single : A 49 HIS : no HD1:sc= -4.39! C(o=-4.4!,f=-3.7!) USER MOD Single : A 59 THR OG1 : rot 68:sc= -2! USER MOD Single : A 64 THR OG1 : rot 70:sc= -5.43! USER MOD Single : A 65 GLN : amide:sc= -0.225 K(o=-0.23,f=-2.5!) USER MOD Single : A 74 GLN : amide:sc= -0.739 X(o=-0.74,f=-0.84) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 162:sc=-0.000883 (180deg=-0.302) USER MOD Single : A 98 TYR OH : rot 161:sc= -3.35! USER MOD Single : A 104 LYS NZ :NH3+ 143:sc= 1.3 (180deg=-0.605) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc=-0.00143 USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=-0.056) USER MOD Single : A 116 HIS : no HD1:sc= -1.61 K(o=-1.6,f=-3) USER MOD Single : A 117 GLN : amide:sc= -1.18! K(o=-1.2!,f=0) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot 180:sc= -4.22 USER MOD Single : A 129 GLN : amide:sc= -8.29! C(o=-8.3!,f=-12!) USER MOD Single : A 132 GLN : amide:sc= -31.9! C(o=-32!,f=-25!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl -153:sc= -1.16 (180deg=-3.1) USER MOD Single : A 137 LYS NZ :NH3+ -157:sc= -1.97 (180deg=-2.84!) USER MOD Single : A 141 GLN : amide:sc= -3.74! K(o=-3.7!,f=-1.3) USER MOD Single : A 145 GLN : amide:sc= -0.111 X(o=-0.11,f=-0.11) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 86 N LEU A 8 7.808 -7.988 4.806 1.00 0.00 N ATOM 87 CA LEU A 8 6.568 -8.428 4.117 1.00 0.00 C ATOM 88 C LEU A 8 5.856 -7.215 3.502 1.00 0.00 C ATOM 89 O LEU A 8 5.823 -6.147 4.080 1.00 0.00 O ATOM 90 CB LEU A 8 5.641 -9.092 5.135 1.00 0.00 C ATOM 91 CG LEU A 8 6.464 -9.780 6.233 1.00 0.00 C ATOM 92 CD1 LEU A 8 7.141 -8.732 7.115 1.00 0.00 C ATOM 93 CD2 LEU A 8 5.528 -10.621 7.095 1.00 0.00 C ATOM 0 HA LEU A 8 6.823 -9.134 3.327 1.00 0.00 H new ATOM 0 HB2 LEU A 8 4.982 -8.346 5.578 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.005 -9.823 4.636 1.00 0.00 H new ATOM 0 HG LEU A 8 7.226 -10.408 5.772 1.00 0.00 H new ATOM 0 HD11 LEU A 8 7.722 -9.230 7.891 1.00 0.00 H new ATOM 0 HD12 LEU A 8 7.802 -8.116 6.506 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.382 -8.102 7.579 1.00 0.00 H new ATOM 0 HD21 LEU A 8 6.101 -11.115 7.879 1.00 0.00 H new ATOM 0 HD22 LEU A 8 4.774 -9.977 7.548 1.00 0.00 H new ATOM 0 HD23 LEU A 8 5.039 -11.372 6.475 1.00 0.00 H new ATOM 105 N ARG A 9 5.271 -7.381 2.343 1.00 0.00 N ATOM 106 CA ARG A 9 4.546 -6.244 1.702 1.00 0.00 C ATOM 107 C ARG A 9 3.112 -6.207 2.224 1.00 0.00 C ATOM 108 O ARG A 9 2.438 -7.219 2.290 1.00 0.00 O ATOM 109 CB ARG A 9 4.534 -6.427 0.179 1.00 0.00 C ATOM 110 CG ARG A 9 4.143 -5.106 -0.489 1.00 0.00 C ATOM 111 CD ARG A 9 4.008 -5.314 -2.000 1.00 0.00 C ATOM 112 NE ARG A 9 5.310 -5.777 -2.557 1.00 0.00 N ATOM 113 CZ ARG A 9 5.486 -5.828 -3.849 1.00 0.00 C ATOM 114 NH1 ARG A 9 4.540 -5.435 -4.654 1.00 0.00 N ATOM 115 NH2 ARG A 9 6.614 -6.256 -4.339 1.00 0.00 N ATOM 0 H ARG A 9 5.264 -8.253 1.814 1.00 0.00 H new ATOM 0 HA ARG A 9 5.050 -5.308 1.944 1.00 0.00 H new ATOM 0 HB2 ARG A 9 5.517 -6.746 -0.168 1.00 0.00 H new ATOM 0 HB3 ARG A 9 3.829 -7.210 -0.099 1.00 0.00 H new ATOM 0 HG2 ARG A 9 3.202 -4.743 -0.076 1.00 0.00 H new ATOM 0 HG3 ARG A 9 4.896 -4.346 -0.282 1.00 0.00 H new ATOM 0 HD2 ARG A 9 3.230 -6.048 -2.209 1.00 0.00 H new ATOM 0 HD3 ARG A 9 3.705 -4.383 -2.480 1.00 0.00 H new ATOM 0 HE ARG A 9 6.064 -6.054 -1.928 1.00 0.00 H new ATOM 0 HH11 ARG A 9 3.660 -5.087 -4.275 1.00 0.00 H new ATOM 0 HH12 ARG A 9 4.680 -5.476 -5.664 1.00 0.00 H new ATOM 0 HH21 ARG A 9 7.362 -6.552 -3.713 1.00 0.00 H new ATOM 0 HH22 ARG A 9 6.749 -6.295 -5.349 1.00 0.00 H new ATOM 129 N ALA A 10 2.635 -5.053 2.603 1.00 0.00 N ATOM 130 CA ALA A 10 1.240 -4.966 3.126 1.00 0.00 C ATOM 131 C ALA A 10 0.577 -3.676 2.660 1.00 0.00 C ATOM 132 O ALA A 10 1.228 -2.739 2.238 1.00 0.00 O ATOM 133 CB ALA A 10 1.256 -4.975 4.654 1.00 0.00 C ATOM 0 H ALA A 10 3.146 -4.171 2.574 1.00 0.00 H new ATOM 0 HA ALA A 10 0.681 -5.823 2.750 1.00 0.00 H new ATOM 0 HB1 ALA A 10 0.235 -4.911 5.029 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.715 -5.898 5.008 1.00 0.00 H new ATOM 0 HB3 ALA A 10 1.830 -4.122 5.017 1.00 0.00 H new ATOM 139 N CYS A 11 -0.723 -3.620 2.744 1.00 0.00 N ATOM 140 CA CYS A 11 -1.443 -2.392 2.321 1.00 0.00 C ATOM 141 C CYS A 11 -2.777 -2.296 3.067 1.00 0.00 C ATOM 142 O CYS A 11 -3.616 -3.172 2.978 1.00 0.00 O ATOM 143 CB CYS A 11 -1.710 -2.468 0.815 1.00 0.00 C ATOM 144 SG CYS A 11 -0.404 -1.590 -0.074 1.00 0.00 S ATOM 0 H CYS A 11 -1.317 -4.374 3.088 1.00 0.00 H new ATOM 0 HA CYS A 11 -0.838 -1.514 2.549 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -1.747 -3.509 0.494 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -2.680 -2.029 0.584 1.00 0.00 H new ATOM 0 HG CYS A 11 0.725 -1.744 0.551 1.00 0.00 H new ATOM 150 N GLY A 12 -2.988 -1.225 3.783 1.00 0.00 N ATOM 151 CA GLY A 12 -4.275 -1.052 4.523 1.00 0.00 C ATOM 152 C GLY A 12 -4.938 0.240 4.045 1.00 0.00 C ATOM 153 O GLY A 12 -4.385 0.959 3.236 1.00 0.00 O ATOM 0 H GLY A 12 -2.323 -0.459 3.889 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -4.932 -1.903 4.345 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -4.092 -1.009 5.597 1.00 0.00 H new ATOM 157 N LEU A 13 -6.118 0.547 4.519 1.00 0.00 N ATOM 158 CA LEU A 13 -6.783 1.796 4.051 1.00 0.00 C ATOM 159 C LEU A 13 -7.105 2.728 5.222 1.00 0.00 C ATOM 160 O LEU A 13 -7.917 2.412 6.068 1.00 0.00 O ATOM 161 CB LEU A 13 -8.108 1.443 3.351 1.00 0.00 C ATOM 162 CG LEU A 13 -8.058 1.861 1.879 1.00 0.00 C ATOM 163 CD1 LEU A 13 -9.455 1.788 1.259 1.00 0.00 C ATOM 164 CD2 LEU A 13 -7.539 3.296 1.761 1.00 0.00 C ATOM 0 H LEU A 13 -6.642 -0.004 5.199 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.099 2.298 3.367 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.293 0.371 3.426 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.936 1.945 3.851 1.00 0.00 H new ATOM 0 HG LEU A 13 -7.389 1.181 1.351 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -9.405 2.088 0.212 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.830 0.767 1.326 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.127 2.457 1.796 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -7.506 3.586 0.711 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.204 3.969 2.303 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -6.537 3.357 2.185 1.00 0.00 H new ATOM 176 N ILE A 14 -6.536 3.906 5.235 1.00 0.00 N ATOM 177 CA ILE A 14 -6.895 4.871 6.307 1.00 0.00 C ATOM 178 C ILE A 14 -8.148 5.576 5.811 1.00 0.00 C ATOM 179 O ILE A 14 -8.121 6.349 4.871 1.00 0.00 O ATOM 180 CB ILE A 14 -5.765 5.872 6.555 1.00 0.00 C ATOM 181 CG1 ILE A 14 -4.661 5.184 7.362 1.00 0.00 C ATOM 182 CG2 ILE A 14 -6.301 7.063 7.350 1.00 0.00 C ATOM 183 CD1 ILE A 14 -3.448 6.106 7.475 1.00 0.00 C ATOM 0 H ILE A 14 -5.848 4.235 4.558 1.00 0.00 H new ATOM 0 HA ILE A 14 -7.063 4.367 7.259 1.00 0.00 H new ATOM 0 HB ILE A 14 -5.369 6.222 5.602 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -5.030 4.930 8.356 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -4.375 4.249 6.880 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -5.495 7.775 7.526 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -7.097 7.548 6.786 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -6.693 6.716 8.306 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.666 5.610 8.050 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.073 6.338 6.478 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -3.738 7.029 7.977 1.00 0.00 H new ATOM 195 N ILE A 15 -9.255 5.248 6.395 1.00 0.00 N ATOM 196 CA ILE A 15 -10.550 5.807 5.939 1.00 0.00 C ATOM 197 C ILE A 15 -10.962 6.995 6.789 1.00 0.00 C ATOM 198 O ILE A 15 -10.865 6.976 7.998 1.00 0.00 O ATOM 199 CB ILE A 15 -11.569 4.687 6.069 1.00 0.00 C ATOM 200 CG1 ILE A 15 -11.174 3.556 5.121 1.00 0.00 C ATOM 201 CG2 ILE A 15 -12.976 5.178 5.739 1.00 0.00 C ATOM 202 CD1 ILE A 15 -11.872 2.267 5.545 1.00 0.00 C ATOM 0 H ILE A 15 -9.321 4.605 7.184 1.00 0.00 H new ATOM 0 HA ILE A 15 -10.476 6.164 4.912 1.00 0.00 H new ATOM 0 HB ILE A 15 -11.577 4.331 7.099 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -11.450 3.812 4.098 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -10.093 3.418 5.134 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -13.682 4.354 5.841 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -13.252 5.979 6.425 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -13.000 5.552 4.715 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -11.590 1.461 4.868 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -11.574 2.009 6.561 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -12.952 2.409 5.509 1.00 0.00 H new ATOM 214 N PHE A 16 -11.430 8.031 6.154 1.00 0.00 N ATOM 215 CA PHE A 16 -11.864 9.232 6.901 1.00 0.00 C ATOM 216 C PHE A 16 -13.205 9.713 6.346 1.00 0.00 C ATOM 217 O PHE A 16 -13.317 10.048 5.185 1.00 0.00 O ATOM 218 CB PHE A 16 -10.817 10.332 6.722 1.00 0.00 C ATOM 219 CG PHE A 16 -10.821 10.797 5.285 1.00 0.00 C ATOM 220 CD1 PHE A 16 -10.052 10.123 4.324 1.00 0.00 C ATOM 221 CD2 PHE A 16 -11.600 11.898 4.910 1.00 0.00 C ATOM 222 CE1 PHE A 16 -10.068 10.549 2.990 1.00 0.00 C ATOM 223 CE2 PHE A 16 -11.613 12.326 3.577 1.00 0.00 C ATOM 224 CZ PHE A 16 -10.848 11.651 2.616 1.00 0.00 C ATOM 0 H PHE A 16 -11.530 8.093 5.141 1.00 0.00 H new ATOM 0 HA PHE A 16 -11.972 8.993 7.959 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.034 11.168 7.387 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -9.830 9.957 6.992 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.448 9.276 4.613 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -12.191 12.418 5.649 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.479 10.028 2.250 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -12.213 13.177 3.289 1.00 0.00 H new ATOM 0 HZ PHE A 16 -10.860 11.980 1.587 1.00 0.00 H new ATOM 234 N ARG A 17 -14.218 9.771 7.164 1.00 0.00 N ATOM 235 CA ARG A 17 -15.539 10.246 6.669 1.00 0.00 C ATOM 236 C ARG A 17 -15.579 11.774 6.733 1.00 0.00 C ATOM 237 O ARG A 17 -15.492 12.358 7.795 1.00 0.00 O ATOM 238 CB ARG A 17 -16.656 9.676 7.545 1.00 0.00 C ATOM 239 CG ARG A 17 -18.010 10.156 7.018 1.00 0.00 C ATOM 240 CD ARG A 17 -19.116 9.657 7.941 1.00 0.00 C ATOM 241 NE ARG A 17 -20.432 10.158 7.451 1.00 0.00 N ATOM 242 CZ ARG A 17 -20.760 11.409 7.632 1.00 0.00 C ATOM 243 NH1 ARG A 17 -19.953 12.211 8.271 1.00 0.00 N ATOM 244 NH2 ARG A 17 -21.899 11.860 7.182 1.00 0.00 N ATOM 0 H ARG A 17 -14.189 9.511 8.150 1.00 0.00 H new ATOM 0 HA ARG A 17 -15.681 9.913 5.641 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -16.617 8.587 7.540 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -16.522 9.995 8.578 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -18.028 11.245 6.966 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -18.171 9.786 6.005 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -19.117 8.567 7.970 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -18.939 10.003 8.959 1.00 0.00 H new ATOM 0 HE ARG A 17 -21.075 9.525 6.975 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -19.065 11.861 8.630 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -20.211 13.188 8.412 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -22.536 11.235 6.688 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -22.153 12.838 7.325 1.00 0.00 H new ATOM 258 N ARG A 18 -15.720 12.429 5.611 1.00 0.00 N ATOM 259 CA ARG A 18 -15.779 13.919 5.631 1.00 0.00 C ATOM 260 C ARG A 18 -17.243 14.362 5.689 1.00 0.00 C ATOM 261 O ARG A 18 -18.079 13.857 4.966 1.00 0.00 O ATOM 262 CB ARG A 18 -15.126 14.497 4.370 1.00 0.00 C ATOM 263 CG ARG A 18 -14.973 16.012 4.540 1.00 0.00 C ATOM 264 CD ARG A 18 -14.146 16.581 3.386 1.00 0.00 C ATOM 265 NE ARG A 18 -14.956 16.545 2.135 1.00 0.00 N ATOM 266 CZ ARG A 18 -15.858 17.462 1.913 1.00 0.00 C ATOM 267 NH1 ARG A 18 -16.051 18.414 2.784 1.00 0.00 N ATOM 268 NH2 ARG A 18 -16.574 17.421 0.821 1.00 0.00 N ATOM 0 H ARG A 18 -15.796 12.000 4.689 1.00 0.00 H new ATOM 0 HA ARG A 18 -15.241 14.284 6.506 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.152 14.036 4.205 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -15.736 14.276 3.494 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -15.954 16.486 4.564 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -14.488 16.234 5.491 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -13.845 17.605 3.609 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -13.232 16.001 3.258 1.00 0.00 H new ATOM 0 HE ARG A 18 -14.805 15.803 1.452 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -15.497 18.442 3.640 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -16.756 19.130 2.609 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -16.428 16.673 0.143 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -17.279 18.137 0.646 1.00 0.00 H new ATOM 434 N ILE A 29 -13.882 15.627 10.706 1.00 0.00 N ATOM 435 CA ILE A 29 -13.500 14.372 10.006 1.00 0.00 C ATOM 436 C ILE A 29 -13.296 13.241 11.012 1.00 0.00 C ATOM 437 O ILE A 29 -12.716 13.419 12.065 1.00 0.00 O ATOM 438 CB ILE A 29 -12.222 14.602 9.208 1.00 0.00 C ATOM 439 CG1 ILE A 29 -12.552 15.465 7.993 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.659 13.260 8.743 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.338 16.305 7.612 1.00 0.00 C ATOM 0 HA ILE A 29 -14.303 14.086 9.326 1.00 0.00 H new ATOM 0 HB ILE A 29 -11.481 15.103 9.831 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -12.846 14.833 7.155 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.399 16.114 8.215 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.745 13.427 8.173 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.437 12.638 9.610 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -12.393 12.756 8.114 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.578 16.919 6.744 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.064 16.949 8.448 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -10.502 15.648 7.371 1.00 0.00 H new ATOM 453 N GLU A 30 -13.773 12.075 10.676 1.00 0.00 N ATOM 454 CA GLU A 30 -13.624 10.900 11.577 1.00 0.00 C ATOM 455 C GLU A 30 -12.928 9.783 10.806 1.00 0.00 C ATOM 456 O GLU A 30 -12.893 9.795 9.596 1.00 0.00 O ATOM 457 CB GLU A 30 -15.004 10.416 12.028 1.00 0.00 C ATOM 458 CG GLU A 30 -15.672 11.491 12.886 1.00 0.00 C ATOM 459 CD GLU A 30 -17.033 10.986 13.373 1.00 0.00 C ATOM 460 OE1 GLU A 30 -17.596 11.616 14.254 1.00 0.00 O ATOM 461 OE2 GLU A 30 -17.491 9.982 12.850 1.00 0.00 O ATOM 0 H GLU A 30 -14.266 11.885 9.804 1.00 0.00 H new ATOM 0 HA GLU A 30 -13.038 11.178 12.453 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -15.624 10.193 11.159 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.908 9.491 12.597 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -15.038 11.737 13.738 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -15.798 12.406 12.308 1.00 0.00 H new ATOM 469 N PHE A 31 -12.367 8.824 11.491 1.00 0.00 N ATOM 470 CA PHE A 31 -11.671 7.717 10.775 1.00 0.00 C ATOM 471 C PHE A 31 -12.305 6.370 11.146 1.00 0.00 C ATOM 472 O PHE A 31 -12.798 6.188 12.242 1.00 0.00 O ATOM 473 CB PHE A 31 -10.187 7.721 11.164 1.00 0.00 C ATOM 474 CG PHE A 31 -9.554 9.035 10.747 1.00 0.00 C ATOM 475 CD1 PHE A 31 -9.044 9.188 9.451 1.00 0.00 C ATOM 476 CD2 PHE A 31 -9.482 10.100 11.657 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.463 10.402 9.065 1.00 0.00 C ATOM 478 CE2 PHE A 31 -8.901 11.315 11.266 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.391 11.461 9.971 1.00 0.00 C ATOM 0 H PHE A 31 -12.360 8.759 12.509 1.00 0.00 H new ATOM 0 HA PHE A 31 -11.767 7.863 9.699 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.083 7.581 12.240 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -9.672 6.889 10.683 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -9.099 8.369 8.749 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -9.873 9.985 12.657 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -8.070 10.519 8.066 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -8.847 12.138 11.964 1.00 0.00 H new ATOM 0 HZ PHE A 31 -7.940 12.396 9.672 1.00 0.00 H new ATOM 489 N LEU A 32 -12.282 5.419 10.245 1.00 0.00 N ATOM 490 CA LEU A 32 -12.868 4.080 10.555 1.00 0.00 C ATOM 491 C LEU A 32 -11.855 3.285 11.376 1.00 0.00 C ATOM 492 O LEU A 32 -10.706 3.150 11.000 1.00 0.00 O ATOM 493 CB LEU A 32 -13.176 3.322 9.255 1.00 0.00 C ATOM 494 CG LEU A 32 -13.600 1.884 9.579 1.00 0.00 C ATOM 495 CD1 LEU A 32 -14.849 1.885 10.461 1.00 0.00 C ATOM 496 CD2 LEU A 32 -13.912 1.145 8.281 1.00 0.00 C ATOM 0 H LEU A 32 -11.884 5.512 9.311 1.00 0.00 H new ATOM 0 HA LEU A 32 -13.795 4.208 11.114 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -13.969 3.830 8.707 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.297 3.315 8.610 1.00 0.00 H new ATOM 0 HG LEU A 32 -12.786 1.388 10.109 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.138 0.858 10.683 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.637 2.411 11.392 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.663 2.386 9.938 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.214 0.122 8.508 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.721 1.654 7.758 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.024 1.129 7.649 1.00 0.00 H new ATOM 508 N LEU A 33 -12.264 2.767 12.501 1.00 0.00 N ATOM 509 CA LEU A 33 -11.319 1.987 13.348 1.00 0.00 C ATOM 510 C LEU A 33 -11.960 0.657 13.737 1.00 0.00 C ATOM 511 O LEU A 33 -13.093 0.602 14.165 1.00 0.00 O ATOM 512 CB LEU A 33 -10.984 2.783 14.612 1.00 0.00 C ATOM 513 CG LEU A 33 -9.778 3.690 14.349 1.00 0.00 C ATOM 514 CD1 LEU A 33 -9.685 4.745 15.447 1.00 0.00 C ATOM 515 CD2 LEU A 33 -8.495 2.855 14.353 1.00 0.00 C ATOM 0 H LEU A 33 -13.211 2.850 12.870 1.00 0.00 H new ATOM 0 HA LEU A 33 -10.404 1.798 12.787 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -11.843 3.383 14.914 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -10.766 2.102 15.435 1.00 0.00 H new ATOM 0 HG LEU A 33 -9.899 4.174 13.380 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.827 5.390 15.260 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.595 5.345 15.454 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.566 4.255 16.413 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -7.639 3.503 14.166 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -8.379 2.371 15.323 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -8.553 2.095 13.573 1.00 0.00 H new ATOM 527 N LEU A 34 -11.238 -0.413 13.587 1.00 0.00 N ATOM 528 CA LEU A 34 -11.790 -1.747 13.936 1.00 0.00 C ATOM 529 C LEU A 34 -11.194 -2.207 15.270 1.00 0.00 C ATOM 530 O LEU A 34 -10.037 -1.968 15.557 1.00 0.00 O ATOM 531 CB LEU A 34 -11.429 -2.729 12.826 1.00 0.00 C ATOM 532 CG LEU A 34 -11.886 -2.147 11.486 1.00 0.00 C ATOM 533 CD1 LEU A 34 -11.566 -3.131 10.365 1.00 0.00 C ATOM 534 CD2 LEU A 34 -13.394 -1.900 11.530 1.00 0.00 C ATOM 0 H LEU A 34 -10.281 -0.421 13.235 1.00 0.00 H new ATOM 0 HA LEU A 34 -12.874 -1.697 14.036 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -10.354 -2.906 12.814 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -11.909 -3.692 13.003 1.00 0.00 H new ATOM 0 HG LEU A 34 -11.366 -1.207 11.302 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.892 -2.715 9.412 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -10.491 -3.310 10.334 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -12.086 -4.072 10.547 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -13.723 -1.485 10.577 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -13.912 -2.841 11.714 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.624 -1.197 12.330 1.00 0.00 H new ATOM 546 N GLN A 35 -11.977 -2.847 16.095 1.00 0.00 N ATOM 547 CA GLN A 35 -11.453 -3.300 17.417 1.00 0.00 C ATOM 548 C GLN A 35 -11.102 -4.784 17.362 1.00 0.00 C ATOM 549 O GLN A 35 -11.872 -5.595 16.885 1.00 0.00 O ATOM 550 CB GLN A 35 -12.521 -3.089 18.490 1.00 0.00 C ATOM 551 CG GLN A 35 -11.909 -3.306 19.875 1.00 0.00 C ATOM 552 CD GLN A 35 -12.966 -3.039 20.947 1.00 0.00 C ATOM 553 OE1 GLN A 35 -14.073 -2.646 20.636 1.00 0.00 O ATOM 554 NE2 GLN A 35 -12.670 -3.230 22.203 1.00 0.00 N ATOM 0 H GLN A 35 -12.954 -3.076 15.913 1.00 0.00 H new ATOM 0 HA GLN A 35 -10.560 -2.722 17.656 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -12.930 -2.081 18.416 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -13.348 -3.781 18.335 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -11.536 -4.326 19.963 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -11.057 -2.641 20.016 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -11.741 -3.560 22.463 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -13.368 -3.049 22.925 1.00 0.00 H new ATOM 641 N HIS A 42 -6.534 -3.390 20.688 1.00 0.00 N ATOM 642 CA HIS A 42 -6.033 -2.139 20.053 1.00 0.00 C ATOM 643 C HIS A 42 -6.903 -1.804 18.840 1.00 0.00 C ATOM 644 O HIS A 42 -7.514 -2.668 18.244 1.00 0.00 O ATOM 645 CB HIS A 42 -4.581 -2.339 19.603 1.00 0.00 C ATOM 646 CG HIS A 42 -4.501 -3.486 18.635 1.00 0.00 C ATOM 647 ND1 HIS A 42 -4.564 -4.809 19.049 1.00 0.00 N ATOM 648 CD2 HIS A 42 -4.350 -3.525 17.271 1.00 0.00 C ATOM 649 CE1 HIS A 42 -4.452 -5.582 17.952 1.00 0.00 C ATOM 650 NE2 HIS A 42 -4.321 -4.849 16.845 1.00 0.00 N ATOM 0 HA HIS A 42 -6.079 -1.321 20.772 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.207 -1.429 19.134 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -3.947 -2.536 20.467 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -4.267 -2.661 16.628 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -4.466 -6.662 17.967 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -4.221 -5.188 15.888 1.00 0.00 H new ATOM 659 N TRP A 43 -6.966 -0.550 18.474 1.00 0.00 N ATOM 660 CA TRP A 43 -7.798 -0.154 17.301 1.00 0.00 C ATOM 661 C TRP A 43 -6.886 0.178 16.119 1.00 0.00 C ATOM 662 O TRP A 43 -5.905 0.880 16.262 1.00 0.00 O ATOM 663 CB TRP A 43 -8.622 1.082 17.652 1.00 0.00 C ATOM 664 CG TRP A 43 -9.497 0.802 18.836 1.00 0.00 C ATOM 665 CD1 TRP A 43 -9.074 0.739 20.120 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.934 0.563 18.868 1.00 0.00 C ATOM 667 NE1 TRP A 43 -10.159 0.469 20.937 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.328 0.352 20.213 1.00 0.00 C ATOM 669 CE3 TRP A 43 -11.925 0.504 17.873 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.658 0.096 20.555 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -13.262 0.248 18.213 1.00 0.00 C ATOM 672 CH2 TRP A 43 -13.628 0.043 19.552 1.00 0.00 C ATOM 0 H TRP A 43 -6.477 0.216 18.937 1.00 0.00 H new ATOM 0 HA TRP A 43 -8.462 -0.977 17.038 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -7.960 1.920 17.870 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -9.235 1.374 16.799 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -8.056 0.877 20.453 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -10.101 0.369 21.950 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -11.655 0.657 16.838 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -12.934 -0.060 21.587 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -14.014 0.208 17.439 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -14.659 -0.156 19.806 1.00 0.00 H new ATOM 683 N THR A 44 -7.204 -0.316 14.954 1.00 0.00 N ATOM 684 CA THR A 44 -6.354 -0.023 13.770 1.00 0.00 C ATOM 685 C THR A 44 -7.191 -0.125 12.491 1.00 0.00 C ATOM 686 O THR A 44 -8.176 -0.835 12.438 1.00 0.00 O ATOM 687 CB THR A 44 -5.217 -1.042 13.710 1.00 0.00 C ATOM 688 OG1 THR A 44 -5.642 -2.254 14.323 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.998 -0.491 14.450 1.00 0.00 C ATOM 0 H THR A 44 -8.014 -0.908 14.773 1.00 0.00 H new ATOM 0 HA THR A 44 -5.949 0.985 13.854 1.00 0.00 H new ATOM 0 HB THR A 44 -4.950 -1.233 12.671 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.916 -2.912 14.286 1.00 0.00 H new ATOM 0 HG21 THR A 44 -3.187 -1.218 14.407 1.00 0.00 H new ATOM 0 HG22 THR A 44 -3.677 0.439 13.980 1.00 0.00 H new ATOM 0 HG23 THR A 44 -4.260 -0.300 15.491 1.00 0.00 H new ATOM 697 N PRO A 45 -6.787 0.572 11.466 1.00 0.00 N ATOM 698 CA PRO A 45 -7.493 0.569 10.150 1.00 0.00 C ATOM 699 C PRO A 45 -7.349 -0.782 9.432 1.00 0.00 C ATOM 700 O PRO A 45 -6.406 -1.506 9.665 1.00 0.00 O ATOM 701 CB PRO A 45 -6.796 1.681 9.360 1.00 0.00 C ATOM 702 CG PRO A 45 -5.449 1.834 9.985 1.00 0.00 C ATOM 703 CD PRO A 45 -5.606 1.447 11.454 1.00 0.00 C ATOM 0 HA PRO A 45 -8.566 0.728 10.257 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -6.711 1.419 8.305 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.360 2.612 9.412 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -4.717 1.194 9.491 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -5.091 2.859 9.890 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.722 0.930 11.827 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.752 2.324 12.085 1.00 0.00 H new ATOM 711 N PRO A 46 -8.280 -1.120 8.574 1.00 0.00 N ATOM 712 CA PRO A 46 -8.241 -2.408 7.821 1.00 0.00 C ATOM 713 C PRO A 46 -6.879 -2.673 7.177 1.00 0.00 C ATOM 714 O PRO A 46 -6.487 -2.008 6.241 1.00 0.00 O ATOM 715 CB PRO A 46 -9.300 -2.229 6.733 1.00 0.00 C ATOM 716 CG PRO A 46 -10.254 -1.210 7.261 1.00 0.00 C ATOM 717 CD PRO A 46 -9.467 -0.319 8.228 1.00 0.00 C ATOM 0 HA PRO A 46 -8.421 -3.256 8.481 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -8.849 -1.896 5.799 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -9.809 -3.170 6.523 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -10.676 -0.619 6.448 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -11.088 -1.691 7.772 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -9.188 0.626 7.761 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -10.055 -0.076 9.113 1.00 0.00 H new ATOM 725 N LYS A 47 -6.155 -3.649 7.661 1.00 0.00 N ATOM 726 CA LYS A 47 -4.826 -3.963 7.060 1.00 0.00 C ATOM 727 C LYS A 47 -4.920 -5.287 6.297 1.00 0.00 C ATOM 728 O LYS A 47 -5.630 -6.189 6.696 1.00 0.00 O ATOM 729 CB LYS A 47 -3.767 -4.094 8.154 1.00 0.00 C ATOM 730 CG LYS A 47 -3.678 -2.799 8.960 1.00 0.00 C ATOM 731 CD LYS A 47 -2.419 -2.841 9.825 1.00 0.00 C ATOM 732 CE LYS A 47 -2.482 -1.735 10.879 1.00 0.00 C ATOM 733 NZ LYS A 47 -2.657 -2.344 12.227 1.00 0.00 N ATOM 0 H LYS A 47 -6.427 -4.241 8.446 1.00 0.00 H new ATOM 0 HA LYS A 47 -4.543 -3.156 6.384 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.016 -4.925 8.814 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.799 -4.320 7.708 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -3.647 -1.939 8.290 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.562 -2.683 9.587 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -2.331 -3.814 10.309 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -1.534 -2.713 9.202 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -1.569 -1.140 10.853 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -3.309 -1.059 10.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -2.367 -1.662 12.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -3.656 -2.596 12.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -2.070 -3.200 12.300 1.00 0.00 H new ATOM 747 N GLY A 48 -4.207 -5.415 5.209 1.00 0.00 N ATOM 748 CA GLY A 48 -4.256 -6.684 4.426 1.00 0.00 C ATOM 749 C GLY A 48 -2.893 -6.940 3.772 1.00 0.00 C ATOM 750 O GLY A 48 -1.979 -6.150 3.895 1.00 0.00 O ATOM 0 H GLY A 48 -3.593 -4.695 4.829 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -4.519 -7.516 5.079 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -5.031 -6.622 3.662 1.00 0.00 H new ATOM 754 N HIS A 49 -2.756 -8.035 3.076 1.00 0.00 N ATOM 755 CA HIS A 49 -1.457 -8.335 2.407 1.00 0.00 C ATOM 756 C HIS A 49 -1.659 -8.317 0.892 1.00 0.00 C ATOM 757 O HIS A 49 -2.601 -8.883 0.379 1.00 0.00 O ATOM 758 CB HIS A 49 -0.959 -9.715 2.846 1.00 0.00 C ATOM 759 CG HIS A 49 0.296 -10.057 2.089 1.00 0.00 C ATOM 760 ND1 HIS A 49 0.269 -10.715 0.866 1.00 0.00 N ATOM 761 CD2 HIS A 49 1.621 -9.835 2.368 1.00 0.00 C ATOM 762 CE1 HIS A 49 1.544 -10.863 0.459 1.00 0.00 C ATOM 763 NE2 HIS A 49 2.403 -10.345 1.337 1.00 0.00 N ATOM 0 H HIS A 49 -3.486 -8.735 2.941 1.00 0.00 H new ATOM 0 HA HIS A 49 -0.718 -7.584 2.686 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -0.763 -9.719 3.918 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -1.726 -10.467 2.660 1.00 0.00 H new ATOM 0 HD2 HIS A 49 1.998 -9.341 3.251 1.00 0.00 H new ATOM 0 HE1 HIS A 49 1.835 -11.342 -0.464 1.00 0.00 H new ATOM 0 HE2 HIS A 49 3.420 -10.327 1.267 1.00 0.00 H new ATOM 772 N VAL A 50 -0.786 -7.668 0.170 1.00 0.00 N ATOM 773 CA VAL A 50 -0.947 -7.617 -1.310 1.00 0.00 C ATOM 774 C VAL A 50 -0.503 -8.948 -1.920 1.00 0.00 C ATOM 775 O VAL A 50 0.480 -9.540 -1.519 1.00 0.00 O ATOM 776 CB VAL A 50 -0.127 -6.453 -1.889 1.00 0.00 C ATOM 777 CG1 VAL A 50 0.685 -5.788 -0.782 1.00 0.00 C ATOM 778 CG2 VAL A 50 0.818 -6.964 -2.979 1.00 0.00 C ATOM 0 H VAL A 50 0.027 -7.174 0.539 1.00 0.00 H new ATOM 0 HA VAL A 50 -1.996 -7.452 -1.556 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.812 -5.725 -2.323 1.00 0.00 H new ATOM 0 HG11 VAL A 50 1.264 -4.964 -1.200 1.00 0.00 H new ATOM 0 HG12 VAL A 50 0.011 -5.406 -0.016 1.00 0.00 H new ATOM 0 HG13 VAL A 50 1.362 -6.518 -0.338 1.00 0.00 H new ATOM 0 HG21 VAL A 50 1.394 -6.130 -3.382 1.00 0.00 H new ATOM 0 HG22 VAL A 50 1.498 -7.703 -2.554 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.237 -7.423 -3.779 1.00 0.00 H new ATOM 788 N GLU A 51 -1.241 -9.421 -2.884 1.00 0.00 N ATOM 789 CA GLU A 51 -0.908 -10.714 -3.539 1.00 0.00 C ATOM 790 C GLU A 51 0.247 -10.498 -4.526 1.00 0.00 C ATOM 791 O GLU A 51 0.805 -9.422 -4.608 1.00 0.00 O ATOM 792 CB GLU A 51 -2.165 -11.216 -4.266 1.00 0.00 C ATOM 793 CG GLU A 51 -2.620 -12.562 -3.680 1.00 0.00 C ATOM 794 CD GLU A 51 -3.470 -12.305 -2.438 1.00 0.00 C ATOM 795 OE1 GLU A 51 -4.460 -12.996 -2.267 1.00 0.00 O ATOM 796 OE2 GLU A 51 -3.113 -11.420 -1.678 1.00 0.00 O ATOM 0 H GLU A 51 -2.073 -8.959 -3.251 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.594 -11.456 -2.805 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -2.965 -10.482 -4.172 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.958 -11.327 -5.330 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.194 -13.119 -4.420 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.754 -13.172 -3.423 1.00 0.00 H new ATOM 804 N PRO A 52 0.617 -11.519 -5.253 1.00 0.00 N ATOM 805 CA PRO A 52 1.732 -11.451 -6.232 1.00 0.00 C ATOM 806 C PRO A 52 1.737 -10.128 -7.004 1.00 0.00 C ATOM 807 O PRO A 52 1.992 -9.076 -6.452 1.00 0.00 O ATOM 808 CB PRO A 52 1.459 -12.642 -7.155 1.00 0.00 C ATOM 809 CG PRO A 52 0.739 -13.638 -6.307 1.00 0.00 C ATOM 810 CD PRO A 52 0.001 -12.854 -5.225 1.00 0.00 C ATOM 0 HA PRO A 52 2.713 -11.494 -5.758 1.00 0.00 H new ATOM 0 HB2 PRO A 52 0.855 -12.345 -8.012 1.00 0.00 H new ATOM 0 HB3 PRO A 52 2.387 -13.057 -7.547 1.00 0.00 H new ATOM 0 HG2 PRO A 52 0.039 -14.220 -6.906 1.00 0.00 H new ATOM 0 HG3 PRO A 52 1.440 -14.343 -5.861 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -1.068 -12.802 -5.432 1.00 0.00 H new ATOM 0 HD3 PRO A 52 0.114 -13.323 -4.248 1.00 0.00 H new ATOM 818 N GLY A 53 1.458 -10.168 -8.274 1.00 0.00 N ATOM 819 CA GLY A 53 1.441 -8.914 -9.072 1.00 0.00 C ATOM 820 C GLY A 53 0.221 -8.078 -8.672 1.00 0.00 C ATOM 821 O GLY A 53 -0.168 -7.160 -9.365 1.00 0.00 O ATOM 0 H GLY A 53 1.240 -11.017 -8.795 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.357 -8.348 -8.901 1.00 0.00 H new ATOM 0 HA3 GLY A 53 1.404 -9.147 -10.136 1.00 0.00 H new ATOM 825 N GLU A 54 -0.387 -8.400 -7.560 1.00 0.00 N ATOM 826 CA GLU A 54 -1.589 -7.640 -7.108 1.00 0.00 C ATOM 827 C GLU A 54 -1.221 -6.177 -6.874 1.00 0.00 C ATOM 828 O GLU A 54 -0.096 -5.851 -6.556 1.00 0.00 O ATOM 829 CB GLU A 54 -2.122 -8.251 -5.812 1.00 0.00 C ATOM 830 CG GLU A 54 -3.441 -7.573 -5.442 1.00 0.00 C ATOM 831 CD GLU A 54 -3.973 -8.135 -4.125 1.00 0.00 C ATOM 832 OE1 GLU A 54 -5.164 -8.393 -4.053 1.00 0.00 O ATOM 833 OE2 GLU A 54 -3.186 -8.288 -3.206 1.00 0.00 O ATOM 0 H GLU A 54 -0.101 -9.160 -6.943 1.00 0.00 H new ATOM 0 HA GLU A 54 -2.359 -7.694 -7.878 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -2.273 -9.323 -5.937 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -1.396 -8.122 -5.010 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -3.292 -6.497 -5.353 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.173 -7.729 -6.234 1.00 0.00 H new ATOM 841 N ASP A 55 -2.164 -5.284 -7.037 1.00 0.00 N ATOM 842 CA ASP A 55 -1.860 -3.840 -6.833 1.00 0.00 C ATOM 843 C ASP A 55 -1.661 -3.540 -5.363 1.00 0.00 C ATOM 844 O ASP A 55 -2.092 -4.269 -4.488 1.00 0.00 O ATOM 845 CB ASP A 55 -3.007 -2.967 -7.308 1.00 0.00 C ATOM 846 CG ASP A 55 -2.556 -1.504 -7.295 1.00 0.00 C ATOM 847 OD1 ASP A 55 -2.021 -1.061 -8.295 1.00 0.00 O ATOM 848 OD2 ASP A 55 -2.746 -0.853 -6.278 1.00 0.00 O ATOM 0 H ASP A 55 -3.127 -5.493 -7.301 1.00 0.00 H new ATOM 0 HA ASP A 55 -0.955 -3.626 -7.402 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.311 -3.259 -8.313 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.874 -3.100 -6.661 1.00 0.00 H new ATOM 854 N ASP A 56 -1.032 -2.443 -5.096 1.00 0.00 N ATOM 855 CA ASP A 56 -0.813 -2.034 -3.693 1.00 0.00 C ATOM 856 C ASP A 56 -2.107 -1.439 -3.135 1.00 0.00 C ATOM 857 O ASP A 56 -2.528 -1.754 -2.039 1.00 0.00 O ATOM 858 CB ASP A 56 0.302 -0.999 -3.648 1.00 0.00 C ATOM 859 CG ASP A 56 1.580 -1.622 -4.203 1.00 0.00 C ATOM 860 OD1 ASP A 56 2.459 -0.874 -4.600 1.00 0.00 O ATOM 861 OD2 ASP A 56 1.661 -2.840 -4.226 1.00 0.00 O ATOM 0 H ASP A 56 -0.656 -1.804 -5.797 1.00 0.00 H new ATOM 0 HA ASP A 56 -0.528 -2.896 -3.089 1.00 0.00 H new ATOM 0 HB2 ASP A 56 0.026 -0.122 -4.233 1.00 0.00 H new ATOM 0 HB3 ASP A 56 0.461 -0.661 -2.624 1.00 0.00 H new ATOM 867 N LEU A 57 -2.740 -0.569 -3.881 1.00 0.00 N ATOM 868 CA LEU A 57 -4.002 0.050 -3.387 1.00 0.00 C ATOM 869 C LEU A 57 -5.141 -0.970 -3.445 1.00 0.00 C ATOM 870 O LEU A 57 -5.880 -1.132 -2.495 1.00 0.00 O ATOM 871 CB LEU A 57 -4.354 1.266 -4.246 1.00 0.00 C ATOM 872 CG LEU A 57 -5.675 1.873 -3.763 1.00 0.00 C ATOM 873 CD1 LEU A 57 -5.546 2.290 -2.302 1.00 0.00 C ATOM 874 CD2 LEU A 57 -6.005 3.110 -4.594 1.00 0.00 C ATOM 0 H LEU A 57 -2.437 -0.263 -4.806 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.861 0.369 -2.354 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.558 2.008 -4.186 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.438 0.972 -5.292 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.465 1.130 -3.869 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -6.488 2.721 -1.962 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.306 1.417 -1.694 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.752 3.030 -2.204 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -6.945 3.540 -4.249 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.208 3.845 -4.485 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -6.098 2.829 -5.643 1.00 0.00 H new ATOM 886 N GLU A 58 -5.288 -1.670 -4.539 1.00 0.00 N ATOM 887 CA GLU A 58 -6.381 -2.676 -4.622 1.00 0.00 C ATOM 888 C GLU A 58 -6.279 -3.592 -3.410 1.00 0.00 C ATOM 889 O GLU A 58 -7.271 -3.977 -2.825 1.00 0.00 O ATOM 890 CB GLU A 58 -6.241 -3.508 -5.902 1.00 0.00 C ATOM 891 CG GLU A 58 -6.650 -2.669 -7.122 1.00 0.00 C ATOM 892 CD GLU A 58 -5.506 -1.743 -7.544 1.00 0.00 C ATOM 893 OE1 GLU A 58 -5.119 -1.803 -8.700 1.00 0.00 O ATOM 894 OE2 GLU A 58 -5.044 -0.986 -6.707 1.00 0.00 O ATOM 0 H GLU A 58 -4.703 -1.588 -5.371 1.00 0.00 H new ATOM 0 HA GLU A 58 -7.346 -2.170 -4.640 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -5.212 -3.849 -6.013 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -6.866 -4.399 -5.837 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -6.918 -3.326 -7.949 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -7.535 -2.079 -6.885 1.00 0.00 H new ATOM 902 N THR A 59 -5.085 -3.921 -2.998 1.00 0.00 N ATOM 903 CA THR A 59 -4.952 -4.777 -1.795 1.00 0.00 C ATOM 904 C THR A 59 -5.638 -4.060 -0.641 1.00 0.00 C ATOM 905 O THR A 59 -6.396 -4.642 0.105 1.00 0.00 O ATOM 906 CB THR A 59 -3.475 -4.995 -1.468 1.00 0.00 C ATOM 907 OG1 THR A 59 -2.853 -5.646 -2.564 1.00 0.00 O ATOM 908 CG2 THR A 59 -3.343 -5.852 -0.206 1.00 0.00 C ATOM 0 H THR A 59 -4.210 -3.637 -3.438 1.00 0.00 H new ATOM 0 HA THR A 59 -5.410 -5.751 -1.968 1.00 0.00 H new ATOM 0 HB THR A 59 -2.991 -4.035 -1.290 1.00 0.00 H new ATOM 0 HG1 THR A 59 -2.826 -5.039 -3.333 1.00 0.00 H new ATOM 0 HG21 THR A 59 -2.288 -6.004 0.022 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.826 -5.346 0.630 1.00 0.00 H new ATOM 0 HG23 THR A 59 -3.821 -6.818 -0.370 1.00 0.00 H new ATOM 916 N ALA A 60 -5.402 -2.782 -0.512 1.00 0.00 N ATOM 917 CA ALA A 60 -6.067 -2.021 0.576 1.00 0.00 C ATOM 918 C ALA A 60 -7.572 -2.009 0.304 1.00 0.00 C ATOM 919 O ALA A 60 -8.379 -2.182 1.195 1.00 0.00 O ATOM 920 CB ALA A 60 -5.535 -0.589 0.603 1.00 0.00 C ATOM 0 H ALA A 60 -4.781 -2.238 -1.111 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.864 -2.488 1.540 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -6.025 -0.034 1.403 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.459 -0.604 0.778 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -5.740 -0.106 -0.353 1.00 0.00 H new ATOM 926 N LEU A 61 -7.954 -1.825 -0.931 1.00 0.00 N ATOM 927 CA LEU A 61 -9.400 -1.823 -1.277 1.00 0.00 C ATOM 928 C LEU A 61 -9.994 -3.177 -0.913 1.00 0.00 C ATOM 929 O LEU A 61 -10.986 -3.276 -0.219 1.00 0.00 O ATOM 930 CB LEU A 61 -9.539 -1.627 -2.782 1.00 0.00 C ATOM 931 CG LEU A 61 -8.860 -0.326 -3.189 1.00 0.00 C ATOM 932 CD1 LEU A 61 -8.947 -0.175 -4.707 1.00 0.00 C ATOM 933 CD2 LEU A 61 -9.568 0.843 -2.508 1.00 0.00 C ATOM 0 H LEU A 61 -7.322 -1.675 -1.717 1.00 0.00 H new ATOM 0 HA LEU A 61 -9.913 -1.027 -0.738 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -9.088 -2.466 -3.312 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -10.592 -1.603 -3.061 1.00 0.00 H new ATOM 0 HG LEU A 61 -7.813 -0.337 -2.885 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -8.463 0.754 -5.009 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -8.446 -1.017 -5.186 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -9.993 -0.155 -5.011 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -9.086 1.778 -2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -10.614 0.864 -2.815 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -9.510 0.723 -1.426 1.00 0.00 H new ATOM 945 N ARG A 62 -9.379 -4.222 -1.386 1.00 0.00 N ATOM 946 CA ARG A 62 -9.887 -5.585 -1.087 1.00 0.00 C ATOM 947 C ARG A 62 -9.863 -5.819 0.423 1.00 0.00 C ATOM 948 O ARG A 62 -10.771 -6.396 0.984 1.00 0.00 O ATOM 949 CB ARG A 62 -9.009 -6.626 -1.784 1.00 0.00 C ATOM 950 CG ARG A 62 -9.640 -8.009 -1.626 1.00 0.00 C ATOM 951 CD ARG A 62 -8.721 -9.058 -2.249 1.00 0.00 C ATOM 952 NE ARG A 62 -8.515 -8.732 -3.690 1.00 0.00 N ATOM 953 CZ ARG A 62 -8.081 -9.647 -4.516 1.00 0.00 C ATOM 954 NH1 ARG A 62 -7.829 -10.853 -4.087 1.00 0.00 N ATOM 955 NH2 ARG A 62 -7.901 -9.350 -5.774 1.00 0.00 N ATOM 0 H ARG A 62 -8.543 -4.190 -1.969 1.00 0.00 H new ATOM 0 HA ARG A 62 -10.910 -5.678 -1.451 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.904 -6.381 -2.841 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -8.007 -6.620 -1.354 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.800 -8.230 -0.571 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.617 -8.033 -2.108 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.764 -9.077 -1.727 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -9.160 -10.051 -2.147 1.00 0.00 H new ATOM 0 HE ARG A 62 -8.714 -7.792 -4.032 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -7.971 -11.085 -3.104 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -7.490 -11.564 -4.735 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -8.099 -8.407 -6.109 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -7.562 -10.061 -6.422 1.00 0.00 H new ATOM 969 N ALA A 63 -8.828 -5.374 1.089 1.00 0.00 N ATOM 970 CA ALA A 63 -8.755 -5.573 2.564 1.00 0.00 C ATOM 971 C ALA A 63 -9.761 -4.651 3.258 1.00 0.00 C ATOM 972 O ALA A 63 -10.305 -4.978 4.295 1.00 0.00 O ATOM 973 CB ALA A 63 -7.342 -5.252 3.054 1.00 0.00 C ATOM 0 H ALA A 63 -8.035 -4.884 0.676 1.00 0.00 H new ATOM 0 HA ALA A 63 -8.994 -6.610 2.801 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.289 -5.398 4.133 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.628 -5.913 2.563 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.101 -4.216 2.816 1.00 0.00 H new ATOM 979 N THR A 64 -10.004 -3.498 2.699 1.00 0.00 N ATOM 980 CA THR A 64 -10.966 -2.546 3.325 1.00 0.00 C ATOM 981 C THR A 64 -12.347 -3.189 3.422 1.00 0.00 C ATOM 982 O THR A 64 -13.000 -3.126 4.444 1.00 0.00 O ATOM 983 CB THR A 64 -11.050 -1.290 2.456 1.00 0.00 C ATOM 984 OG1 THR A 64 -9.743 -0.790 2.239 1.00 0.00 O ATOM 985 CG2 THR A 64 -11.893 -0.221 3.153 1.00 0.00 C ATOM 0 H THR A 64 -9.576 -3.172 1.832 1.00 0.00 H new ATOM 0 HA THR A 64 -10.625 -2.287 4.327 1.00 0.00 H new ATOM 0 HB THR A 64 -11.517 -1.543 1.504 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.251 -1.403 1.653 1.00 0.00 H new ATOM 0 HG21 THR A 64 -11.945 0.668 2.525 1.00 0.00 H new ATOM 0 HG22 THR A 64 -12.899 -0.605 3.323 1.00 0.00 H new ATOM 0 HG23 THR A 64 -11.436 0.037 4.109 1.00 0.00 H new ATOM 993 N GLN A 65 -12.812 -3.801 2.369 1.00 0.00 N ATOM 994 CA GLN A 65 -14.157 -4.430 2.420 1.00 0.00 C ATOM 995 C GLN A 65 -14.093 -5.779 3.144 1.00 0.00 C ATOM 996 O GLN A 65 -14.990 -6.136 3.880 1.00 0.00 O ATOM 997 CB GLN A 65 -14.694 -4.612 0.997 1.00 0.00 C ATOM 998 CG GLN A 65 -14.837 -6.100 0.664 1.00 0.00 C ATOM 999 CD GLN A 65 -15.275 -6.240 -0.793 1.00 0.00 C ATOM 1000 OE1 GLN A 65 -14.905 -5.438 -1.628 1.00 0.00 O ATOM 1001 NE2 GLN A 65 -16.048 -7.232 -1.141 1.00 0.00 N ATOM 0 H GLN A 65 -12.320 -3.892 1.480 1.00 0.00 H new ATOM 0 HA GLN A 65 -14.832 -3.779 2.975 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -15.660 -4.117 0.901 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -14.020 -4.137 0.284 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -13.890 -6.615 0.824 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -15.569 -6.566 1.324 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -16.359 -7.906 -0.441 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -16.341 -7.334 -2.113 1.00 0.00 H new ATOM 1010 N GLU A 66 -13.049 -6.532 2.940 1.00 0.00 N ATOM 1011 CA GLU A 66 -12.950 -7.859 3.615 1.00 0.00 C ATOM 1012 C GLU A 66 -12.935 -7.681 5.137 1.00 0.00 C ATOM 1013 O GLU A 66 -13.480 -8.486 5.869 1.00 0.00 O ATOM 1014 CB GLU A 66 -11.660 -8.560 3.180 1.00 0.00 C ATOM 1015 CG GLU A 66 -11.801 -9.058 1.739 1.00 0.00 C ATOM 1016 CD GLU A 66 -12.866 -10.153 1.685 1.00 0.00 C ATOM 1017 OE1 GLU A 66 -13.394 -10.392 0.612 1.00 0.00 O ATOM 1018 OE2 GLU A 66 -13.131 -10.741 2.720 1.00 0.00 O ATOM 0 H GLU A 66 -12.262 -6.289 2.338 1.00 0.00 H new ATOM 0 HA GLU A 66 -13.814 -8.461 3.333 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -10.818 -7.872 3.256 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -11.448 -9.397 3.845 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -12.078 -8.233 1.082 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -10.847 -9.445 1.381 1.00 0.00 H new ATOM 1026 N GLU A 67 -12.307 -6.648 5.625 1.00 0.00 N ATOM 1027 CA GLU A 67 -12.257 -6.449 7.101 1.00 0.00 C ATOM 1028 C GLU A 67 -13.224 -5.342 7.521 1.00 0.00 C ATOM 1029 O GLU A 67 -13.350 -5.030 8.689 1.00 0.00 O ATOM 1030 CB GLU A 67 -10.837 -6.071 7.511 1.00 0.00 C ATOM 1031 CG GLU A 67 -9.884 -7.200 7.118 1.00 0.00 C ATOM 1032 CD GLU A 67 -8.474 -6.875 7.610 1.00 0.00 C ATOM 1033 OE1 GLU A 67 -8.265 -5.758 8.055 1.00 0.00 O ATOM 1034 OE2 GLU A 67 -7.625 -7.747 7.531 1.00 0.00 O ATOM 0 H GLU A 67 -11.829 -5.937 5.071 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.550 -7.376 7.595 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -10.540 -5.142 7.024 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -10.790 -5.897 8.586 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.223 -8.142 7.549 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.882 -7.328 6.035 1.00 0.00 H new ATOM 1042 N ALA A 68 -13.912 -4.744 6.589 1.00 0.00 N ATOM 1043 CA ALA A 68 -14.864 -3.658 6.958 1.00 0.00 C ATOM 1044 C ALA A 68 -16.102 -3.742 6.079 1.00 0.00 C ATOM 1045 O ALA A 68 -17.180 -3.344 6.467 1.00 0.00 O ATOM 1046 CB ALA A 68 -14.200 -2.301 6.751 1.00 0.00 C ATOM 0 H ALA A 68 -13.858 -4.958 5.593 1.00 0.00 H new ATOM 0 HA ALA A 68 -15.147 -3.773 8.004 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -14.898 -1.509 7.022 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -13.311 -2.231 7.378 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -13.915 -2.191 5.705 1.00 0.00 H new ATOM 1052 N GLY A 69 -15.961 -4.244 4.893 1.00 0.00 N ATOM 1053 CA GLY A 69 -17.137 -4.336 3.994 1.00 0.00 C ATOM 1054 C GLY A 69 -17.179 -3.100 3.098 1.00 0.00 C ATOM 1055 O GLY A 69 -18.025 -2.975 2.238 1.00 0.00 O ATOM 0 H GLY A 69 -15.085 -4.595 4.506 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -17.076 -5.239 3.386 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -18.053 -4.407 4.580 1.00 0.00 H new ATOM 1059 N ILE A 70 -16.267 -2.184 3.291 1.00 0.00 N ATOM 1060 CA ILE A 70 -16.264 -0.958 2.450 1.00 0.00 C ATOM 1061 C ILE A 70 -15.165 -1.077 1.388 1.00 0.00 C ATOM 1062 O ILE A 70 -14.007 -1.298 1.689 1.00 0.00 O ATOM 1063 CB ILE A 70 -15.993 0.272 3.322 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -16.862 0.234 4.582 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -16.361 1.520 2.528 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -16.225 1.096 5.678 1.00 0.00 C ATOM 0 H ILE A 70 -15.528 -2.234 3.992 1.00 0.00 H new ATOM 0 HA ILE A 70 -17.236 -0.850 1.968 1.00 0.00 H new ATOM 0 HB ILE A 70 -14.941 0.282 3.607 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -17.864 0.599 4.355 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -16.969 -0.793 4.930 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -16.174 2.406 3.135 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -15.756 1.566 1.622 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -17.416 1.481 2.258 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -16.847 1.066 6.572 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -15.233 0.711 5.913 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -16.142 2.125 5.329 1.00 0.00 H new ATOM 1078 N GLU A 71 -15.524 -0.933 0.146 1.00 0.00 N ATOM 1079 CA GLU A 71 -14.521 -1.034 -0.948 1.00 0.00 C ATOM 1080 C GLU A 71 -14.413 0.316 -1.658 1.00 0.00 C ATOM 1081 O GLU A 71 -15.209 1.208 -1.439 1.00 0.00 O ATOM 1082 CB GLU A 71 -14.972 -2.104 -1.940 1.00 0.00 C ATOM 1083 CG GLU A 71 -16.239 -1.628 -2.650 1.00 0.00 C ATOM 1084 CD GLU A 71 -16.755 -2.736 -3.567 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -17.826 -3.254 -3.292 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -16.071 -3.049 -4.525 1.00 0.00 O ATOM 0 H GLU A 71 -16.479 -0.748 -0.162 1.00 0.00 H new ATOM 0 HA GLU A 71 -13.548 -1.305 -0.538 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -14.184 -2.298 -2.668 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -15.163 -3.042 -1.419 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -17.001 -1.363 -1.918 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -16.028 -0.730 -3.230 1.00 0.00 H new ATOM 1094 N ALA A 72 -13.435 0.474 -2.506 1.00 0.00 N ATOM 1095 CA ALA A 72 -13.270 1.767 -3.231 1.00 0.00 C ATOM 1096 C ALA A 72 -14.591 2.164 -3.865 1.00 0.00 C ATOM 1097 O ALA A 72 -14.933 3.330 -3.940 1.00 0.00 O ATOM 1098 CB ALA A 72 -12.203 1.598 -4.303 1.00 0.00 C ATOM 0 H ALA A 72 -12.740 -0.239 -2.729 1.00 0.00 H new ATOM 0 HA ALA A 72 -12.964 2.550 -2.536 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -12.074 2.538 -4.840 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -11.260 1.315 -3.836 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -12.510 0.820 -5.002 1.00 0.00 H new ATOM 1104 N GLY A 73 -15.356 1.212 -4.301 1.00 0.00 N ATOM 1105 CA GLY A 73 -16.667 1.553 -4.899 1.00 0.00 C ATOM 1106 C GLY A 73 -17.514 2.229 -3.824 1.00 0.00 C ATOM 1107 O GLY A 73 -18.470 2.924 -4.109 1.00 0.00 O ATOM 0 H GLY A 73 -15.132 0.217 -4.270 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -16.535 2.217 -5.754 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -17.163 0.655 -5.267 1.00 0.00 H new ATOM 1111 N GLN A 74 -17.171 2.009 -2.577 1.00 0.00 N ATOM 1112 CA GLN A 74 -17.950 2.611 -1.464 1.00 0.00 C ATOM 1113 C GLN A 74 -17.170 3.762 -0.814 1.00 0.00 C ATOM 1114 O GLN A 74 -17.731 4.545 -0.075 1.00 0.00 O ATOM 1115 CB GLN A 74 -18.261 1.522 -0.434 1.00 0.00 C ATOM 1116 CG GLN A 74 -19.217 2.070 0.626 1.00 0.00 C ATOM 1117 CD GLN A 74 -20.556 2.407 -0.029 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -21.055 1.653 -0.838 1.00 0.00 O ATOM 1119 NE2 GLN A 74 -21.162 3.518 0.287 1.00 0.00 N ATOM 0 H GLN A 74 -16.380 1.434 -2.287 1.00 0.00 H new ATOM 0 HA GLN A 74 -18.881 3.023 -1.854 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -18.707 0.658 -0.928 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -17.339 1.180 0.036 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -19.361 1.335 1.418 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -18.792 2.960 1.091 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -20.743 4.152 0.967 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -22.055 3.753 -0.146 1.00 0.00 H new ATOM 1128 N LEU A 75 -15.896 3.913 -1.095 1.00 0.00 N ATOM 1129 CA LEU A 75 -15.161 5.066 -0.489 1.00 0.00 C ATOM 1130 C LEU A 75 -14.490 5.882 -1.588 1.00 0.00 C ATOM 1131 O LEU A 75 -14.657 5.636 -2.769 1.00 0.00 O ATOM 1132 CB LEU A 75 -14.084 4.643 0.535 1.00 0.00 C ATOM 1133 CG LEU A 75 -13.914 3.124 0.601 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -12.672 2.721 -0.189 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -13.719 2.684 2.058 1.00 0.00 C ATOM 0 H LEU A 75 -15.347 3.304 -1.702 1.00 0.00 H new ATOM 0 HA LEU A 75 -15.907 5.654 0.046 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -13.132 5.102 0.269 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.355 5.020 1.521 1.00 0.00 H new ATOM 0 HG LEU A 75 -14.803 2.650 0.185 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -12.548 1.639 -0.144 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -12.785 3.031 -1.228 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -11.795 3.205 0.240 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -13.599 1.601 2.098 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -12.830 3.163 2.467 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -14.590 2.974 2.645 1.00 0.00 H new ATOM 1147 N THR A 76 -13.735 6.855 -1.189 1.00 0.00 N ATOM 1148 CA THR A 76 -13.025 7.724 -2.158 1.00 0.00 C ATOM 1149 C THR A 76 -11.563 7.786 -1.742 1.00 0.00 C ATOM 1150 O THR A 76 -11.222 8.344 -0.720 1.00 0.00 O ATOM 1151 CB THR A 76 -13.644 9.124 -2.113 1.00 0.00 C ATOM 1152 OG1 THR A 76 -14.986 9.055 -2.572 1.00 0.00 O ATOM 1153 CG2 THR A 76 -12.851 10.093 -2.993 1.00 0.00 C ATOM 0 H THR A 76 -13.575 7.092 -0.210 1.00 0.00 H new ATOM 0 HA THR A 76 -13.108 7.333 -3.172 1.00 0.00 H new ATOM 0 HB THR A 76 -13.619 9.489 -1.086 1.00 0.00 H new ATOM 0 HG1 THR A 76 -15.388 9.948 -2.544 1.00 0.00 H new ATOM 0 HG21 THR A 76 -13.307 11.082 -2.947 1.00 0.00 H new ATOM 0 HG22 THR A 76 -11.823 10.151 -2.636 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.858 9.738 -4.023 1.00 0.00 H new ATOM 1161 N ILE A 77 -10.697 7.215 -2.520 1.00 0.00 N ATOM 1162 CA ILE A 77 -9.260 7.236 -2.158 1.00 0.00 C ATOM 1163 C ILE A 77 -8.683 8.596 -2.544 1.00 0.00 C ATOM 1164 O ILE A 77 -8.927 9.093 -3.626 1.00 0.00 O ATOM 1165 CB ILE A 77 -8.531 6.129 -2.917 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -9.368 4.840 -2.896 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -7.177 5.866 -2.255 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -9.417 4.269 -1.477 1.00 0.00 C ATOM 0 H ILE A 77 -10.921 6.734 -3.391 1.00 0.00 H new ATOM 0 HA ILE A 77 -9.137 7.073 -1.087 1.00 0.00 H new ATOM 0 HB ILE A 77 -8.381 6.442 -3.950 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -10.378 5.047 -3.248 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -8.937 4.106 -3.577 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.655 5.076 -2.795 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -6.579 6.777 -2.276 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -7.331 5.557 -1.221 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -10.012 3.356 -1.473 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -8.405 4.044 -1.140 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -9.869 5.000 -0.806 1.00 0.00 H new ATOM 1180 N ILE A 78 -7.932 9.213 -1.675 1.00 0.00 N ATOM 1181 CA ILE A 78 -7.363 10.547 -2.014 1.00 0.00 C ATOM 1182 C ILE A 78 -5.988 10.380 -2.652 1.00 0.00 C ATOM 1183 O ILE A 78 -5.222 9.503 -2.302 1.00 0.00 O ATOM 1184 CB ILE A 78 -7.263 11.416 -0.756 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -8.281 12.554 -0.857 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -5.857 12.014 -0.628 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -9.689 11.975 -1.004 1.00 0.00 C ATOM 0 H ILE A 78 -7.689 8.855 -0.751 1.00 0.00 H new ATOM 0 HA ILE A 78 -8.024 11.042 -2.726 1.00 0.00 H new ATOM 0 HB ILE A 78 -7.466 10.799 0.119 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -8.227 13.183 0.032 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -8.047 13.189 -1.712 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -5.803 12.628 0.271 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -5.124 11.210 -0.562 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.643 12.630 -1.502 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -10.411 12.788 -1.076 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -9.739 11.365 -1.906 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -9.922 11.359 -0.135 1.00 0.00 H new ATOM 1199 N GLU A 79 -5.686 11.216 -3.601 1.00 0.00 N ATOM 1200 CA GLU A 79 -4.374 11.132 -4.296 1.00 0.00 C ATOM 1201 C GLU A 79 -3.454 12.247 -3.808 1.00 0.00 C ATOM 1202 O GLU A 79 -3.899 13.302 -3.402 1.00 0.00 O ATOM 1203 CB GLU A 79 -4.594 11.276 -5.797 1.00 0.00 C ATOM 1204 CG GLU A 79 -5.439 10.106 -6.303 1.00 0.00 C ATOM 1205 CD GLU A 79 -5.625 10.233 -7.813 1.00 0.00 C ATOM 1206 OE1 GLU A 79 -6.007 9.252 -8.429 1.00 0.00 O ATOM 1207 OE2 GLU A 79 -5.385 11.314 -8.330 1.00 0.00 O ATOM 0 H GLU A 79 -6.299 11.963 -3.929 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.911 10.169 -4.080 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -5.094 12.220 -6.013 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -3.635 11.297 -6.315 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -4.952 9.161 -6.063 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -6.409 10.101 -5.805 1.00 0.00 H new ATOM 1215 N GLY A 80 -2.171 12.024 -3.848 1.00 0.00 N ATOM 1216 CA GLY A 80 -1.218 13.069 -3.388 1.00 0.00 C ATOM 1217 C GLY A 80 -0.700 12.693 -2.003 1.00 0.00 C ATOM 1218 O GLY A 80 0.355 13.130 -1.584 1.00 0.00 O ATOM 0 H GLY A 80 -1.741 11.161 -4.180 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -0.388 13.157 -4.089 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.711 14.040 -3.355 1.00 0.00 H new ATOM 1222 N PHE A 81 -1.430 11.879 -1.288 1.00 0.00 N ATOM 1223 CA PHE A 81 -0.969 11.476 0.072 1.00 0.00 C ATOM 1224 C PHE A 81 -0.543 10.008 0.077 1.00 0.00 C ATOM 1225 O PHE A 81 -1.312 9.128 -0.261 1.00 0.00 O ATOM 1226 CB PHE A 81 -2.099 11.653 1.085 1.00 0.00 C ATOM 1227 CG PHE A 81 -1.616 11.187 2.441 1.00 0.00 C ATOM 1228 CD1 PHE A 81 -1.599 9.819 2.744 1.00 0.00 C ATOM 1229 CD2 PHE A 81 -1.185 12.117 3.393 1.00 0.00 C ATOM 1230 CE1 PHE A 81 -1.149 9.383 3.997 1.00 0.00 C ATOM 1231 CE2 PHE A 81 -0.737 11.682 4.646 1.00 0.00 C ATOM 1232 CZ PHE A 81 -0.720 10.315 4.949 1.00 0.00 C ATOM 0 H PHE A 81 -2.320 11.478 -1.584 1.00 0.00 H new ATOM 0 HA PHE A 81 -0.123 12.107 0.342 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -2.404 12.699 1.132 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -2.974 11.080 0.778 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -1.933 9.100 2.011 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -1.198 13.172 3.161 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -1.133 8.328 4.228 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -0.404 12.401 5.380 1.00 0.00 H new ATOM 0 HZ PHE A 81 -0.376 9.980 5.916 1.00 0.00 H new ATOM 1242 N LYS A 82 0.663 9.732 0.493 1.00 0.00 N ATOM 1243 CA LYS A 82 1.116 8.315 0.555 1.00 0.00 C ATOM 1244 C LYS A 82 2.171 8.162 1.645 1.00 0.00 C ATOM 1245 O LYS A 82 3.119 8.918 1.727 1.00 0.00 O ATOM 1246 CB LYS A 82 1.727 7.877 -0.770 1.00 0.00 C ATOM 1247 CG LYS A 82 1.401 6.398 -0.991 1.00 0.00 C ATOM 1248 CD LYS A 82 2.039 5.909 -2.291 1.00 0.00 C ATOM 1249 CE LYS A 82 3.522 5.613 -2.063 1.00 0.00 C ATOM 1250 NZ LYS A 82 4.328 6.296 -3.111 1.00 0.00 N ATOM 0 H LYS A 82 1.351 10.424 0.791 1.00 0.00 H new ATOM 0 HA LYS A 82 0.247 7.694 0.771 1.00 0.00 H new ATOM 0 HB2 LYS A 82 1.329 8.479 -1.587 1.00 0.00 H new ATOM 0 HB3 LYS A 82 2.806 8.029 -0.758 1.00 0.00 H new ATOM 0 HG2 LYS A 82 1.768 5.807 -0.152 1.00 0.00 H new ATOM 0 HG3 LYS A 82 0.321 6.258 -1.031 1.00 0.00 H new ATOM 0 HD2 LYS A 82 1.530 5.011 -2.641 1.00 0.00 H new ATOM 0 HD3 LYS A 82 1.925 6.664 -3.069 1.00 0.00 H new ATOM 0 HE2 LYS A 82 3.825 5.956 -1.074 1.00 0.00 H new ATOM 0 HE3 LYS A 82 3.699 4.538 -2.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 5.337 6.096 -2.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 4.044 5.948 -4.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 4.167 7.322 -3.059 1.00 0.00 H new ATOM 1264 N ARG A 83 2.016 7.175 2.470 1.00 0.00 N ATOM 1265 CA ARG A 83 3.007 6.939 3.550 1.00 0.00 C ATOM 1266 C ARG A 83 2.873 5.496 4.020 1.00 0.00 C ATOM 1267 O ARG A 83 1.780 4.979 4.132 1.00 0.00 O ATOM 1268 CB ARG A 83 2.728 7.895 4.709 1.00 0.00 C ATOM 1269 CG ARG A 83 3.914 7.889 5.673 1.00 0.00 C ATOM 1270 CD ARG A 83 3.739 9.013 6.693 1.00 0.00 C ATOM 1271 NE ARG A 83 2.702 8.619 7.688 1.00 0.00 N ATOM 1272 CZ ARG A 83 3.053 8.179 8.867 1.00 0.00 C ATOM 1273 NH1 ARG A 83 4.316 8.083 9.184 1.00 0.00 N ATOM 1274 NH2 ARG A 83 2.138 7.824 9.725 1.00 0.00 N ATOM 0 H ARG A 83 1.239 6.514 2.444 1.00 0.00 H new ATOM 0 HA ARG A 83 4.019 7.114 3.184 1.00 0.00 H new ATOM 0 HB2 ARG A 83 2.559 8.903 4.330 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.820 7.594 5.231 1.00 0.00 H new ATOM 0 HG2 ARG A 83 3.979 6.927 6.182 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.846 8.023 5.123 1.00 0.00 H new ATOM 0 HD2 ARG A 83 4.685 9.213 7.196 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.445 9.934 6.189 1.00 0.00 H new ATOM 0 HE ARG A 83 1.714 8.693 7.447 1.00 0.00 H new ATOM 0 HH11 ARG A 83 5.033 8.352 8.510 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.586 7.739 10.106 1.00 0.00 H new ATOM 0 HH21 ARG A 83 1.151 7.890 9.475 1.00 0.00 H new ATOM 0 HH22 ARG A 83 2.409 7.480 10.646 1.00 0.00 H new ATOM 1288 N GLU A 84 3.959 4.835 4.293 1.00 0.00 N ATOM 1289 CA GLU A 84 3.837 3.428 4.745 1.00 0.00 C ATOM 1290 C GLU A 84 4.461 3.249 6.115 1.00 0.00 C ATOM 1291 O GLU A 84 5.549 3.718 6.382 1.00 0.00 O ATOM 1292 CB GLU A 84 4.511 2.470 3.763 1.00 0.00 C ATOM 1293 CG GLU A 84 5.932 2.934 3.428 1.00 0.00 C ATOM 1294 CD GLU A 84 5.896 4.347 2.849 1.00 0.00 C ATOM 1295 OE1 GLU A 84 6.574 5.204 3.387 1.00 0.00 O ATOM 1296 OE2 GLU A 84 5.186 4.547 1.878 1.00 0.00 O ATOM 0 H GLU A 84 4.909 5.200 4.224 1.00 0.00 H new ATOM 0 HA GLU A 84 2.773 3.196 4.795 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.544 1.468 4.192 1.00 0.00 H new ATOM 0 HB3 GLU A 84 3.921 2.406 2.849 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.551 2.915 4.325 1.00 0.00 H new ATOM 0 HG3 GLU A 84 6.388 2.250 2.712 1.00 0.00 H new ATOM 1304 N LEU A 85 3.795 2.552 6.988 1.00 0.00 N ATOM 1305 CA LEU A 85 4.382 2.334 8.327 1.00 0.00 C ATOM 1306 C LEU A 85 5.165 1.026 8.281 1.00 0.00 C ATOM 1307 O LEU A 85 4.615 -0.029 8.032 1.00 0.00 O ATOM 1308 CB LEU A 85 3.281 2.248 9.390 1.00 0.00 C ATOM 1309 CG LEU A 85 2.292 3.406 9.221 1.00 0.00 C ATOM 1310 CD1 LEU A 85 1.534 3.631 10.531 1.00 0.00 C ATOM 1311 CD2 LEU A 85 3.038 4.685 8.844 1.00 0.00 C ATOM 0 H LEU A 85 2.880 2.129 6.832 1.00 0.00 H new ATOM 0 HA LEU A 85 5.035 3.166 8.590 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.756 1.296 9.305 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.723 2.280 10.386 1.00 0.00 H new ATOM 0 HG LEU A 85 1.588 3.154 8.428 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.831 4.455 10.408 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.988 2.725 10.796 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.242 3.873 11.324 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.325 5.501 8.727 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.750 4.936 9.630 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.572 4.532 7.906 1.00 0.00 H new ATOM 1323 N ASN A 86 6.451 1.091 8.494 1.00 0.00 N ATOM 1324 CA ASN A 86 7.274 -0.146 8.433 1.00 0.00 C ATOM 1325 C ASN A 86 7.859 -0.456 9.809 1.00 0.00 C ATOM 1326 O ASN A 86 8.537 0.355 10.409 1.00 0.00 O ATOM 1327 CB ASN A 86 8.415 0.050 7.434 1.00 0.00 C ATOM 1328 CG ASN A 86 7.909 0.839 6.224 1.00 0.00 C ATOM 1329 OD1 ASN A 86 7.705 2.034 6.308 1.00 0.00 O ATOM 1330 ND2 ASN A 86 7.708 0.221 5.094 1.00 0.00 N ATOM 0 H ASN A 86 6.965 1.946 8.707 1.00 0.00 H new ATOM 0 HA ASN A 86 6.643 -0.976 8.116 1.00 0.00 H new ATOM 0 HB2 ASN A 86 9.240 0.582 7.908 1.00 0.00 H new ATOM 0 HB3 ASN A 86 8.802 -0.918 7.114 1.00 0.00 H new ATOM 0 HD21 ASN A 86 7.379 0.740 4.280 1.00 0.00 H new ATOM 0 HD22 ASN A 86 7.879 -0.782 5.024 1.00 0.00 H new ATOM 1337 N TYR A 87 7.625 -1.639 10.295 1.00 0.00 N ATOM 1338 CA TYR A 87 8.182 -2.034 11.612 1.00 0.00 C ATOM 1339 C TYR A 87 8.105 -3.543 11.743 1.00 0.00 C ATOM 1340 O TYR A 87 7.266 -4.189 11.150 1.00 0.00 O ATOM 1341 CB TYR A 87 7.387 -1.391 12.752 1.00 0.00 C ATOM 1342 CG TYR A 87 5.906 -1.615 12.539 1.00 0.00 C ATOM 1343 CD1 TYR A 87 5.319 -2.823 12.934 1.00 0.00 C ATOM 1344 CD2 TYR A 87 5.119 -0.616 11.949 1.00 0.00 C ATOM 1345 CE1 TYR A 87 3.947 -3.033 12.739 1.00 0.00 C ATOM 1346 CE2 TYR A 87 3.746 -0.828 11.753 1.00 0.00 C ATOM 1347 CZ TYR A 87 3.161 -2.037 12.149 1.00 0.00 C ATOM 1348 OH TYR A 87 1.810 -2.245 11.957 1.00 0.00 O ATOM 0 H TYR A 87 7.066 -2.355 9.831 1.00 0.00 H new ATOM 0 HA TYR A 87 9.216 -1.696 11.674 1.00 0.00 H new ATOM 0 HB2 TYR A 87 7.694 -1.818 13.707 1.00 0.00 H new ATOM 0 HB3 TYR A 87 7.599 -0.323 12.797 1.00 0.00 H new ATOM 0 HD1 TYR A 87 5.924 -3.593 13.389 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.570 0.317 11.645 1.00 0.00 H new ATOM 0 HE1 TYR A 87 3.496 -3.965 13.045 1.00 0.00 H new ATOM 0 HE2 TYR A 87 3.140 -0.059 11.297 1.00 0.00 H new ATOM 0 HH TYR A 87 1.414 -1.453 11.537 1.00 0.00 H new ATOM 1444 N PRO A 93 9.573 -7.562 9.483 1.00 0.00 N ATOM 1445 CA PRO A 93 9.267 -6.155 9.109 1.00 0.00 C ATOM 1446 C PRO A 93 8.165 -6.053 8.086 1.00 0.00 C ATOM 1447 O PRO A 93 8.245 -6.611 7.016 1.00 0.00 O ATOM 1448 CB PRO A 93 10.553 -5.639 8.506 1.00 0.00 C ATOM 1449 CG PRO A 93 11.261 -6.848 8.004 1.00 0.00 C ATOM 1450 CD PRO A 93 10.828 -8.019 8.874 1.00 0.00 C ATOM 0 HA PRO A 93 8.925 -5.591 9.977 1.00 0.00 H new ATOM 0 HB2 PRO A 93 10.354 -4.935 7.698 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.152 -5.112 9.248 1.00 0.00 H new ATOM 0 HG2 PRO A 93 11.012 -7.033 6.959 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.341 -6.710 8.055 1.00 0.00 H new ATOM 0 HD2 PRO A 93 10.679 -8.922 8.283 1.00 0.00 H new ATOM 0 HD3 PRO A 93 11.577 -8.253 9.630 1.00 0.00 H new ATOM 1458 N LYS A 94 7.151 -5.333 8.402 1.00 0.00 N ATOM 1459 CA LYS A 94 6.034 -5.190 7.448 1.00 0.00 C ATOM 1460 C LYS A 94 5.917 -3.759 6.962 1.00 0.00 C ATOM 1461 O LYS A 94 5.710 -2.845 7.735 1.00 0.00 O ATOM 1462 CB LYS A 94 4.731 -5.574 8.141 1.00 0.00 C ATOM 1463 CG LYS A 94 4.726 -7.070 8.466 1.00 0.00 C ATOM 1464 CD LYS A 94 3.368 -7.467 9.040 1.00 0.00 C ATOM 1465 CE LYS A 94 2.327 -7.487 7.916 1.00 0.00 C ATOM 1466 NZ LYS A 94 2.066 -8.896 7.509 1.00 0.00 N ATOM 0 H LYS A 94 7.041 -4.832 9.283 1.00 0.00 H new ATOM 0 HA LYS A 94 6.225 -5.841 6.595 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.613 -4.995 9.057 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.884 -5.331 7.499 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.934 -7.648 7.566 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.515 -7.299 9.182 1.00 0.00 H new ATOM 0 HD2 LYS A 94 3.432 -8.449 9.509 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.068 -6.762 9.816 1.00 0.00 H new ATOM 0 HE2 LYS A 94 1.403 -7.017 8.253 1.00 0.00 H new ATOM 0 HE3 LYS A 94 2.685 -6.911 7.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.169 -8.945 6.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.841 -9.231 6.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.005 -9.496 8.356 1.00 0.00 H new ATOM 1480 N THR A 95 5.980 -3.564 5.677 1.00 0.00 N ATOM 1481 CA THR A 95 5.799 -2.198 5.144 1.00 0.00 C ATOM 1482 C THR A 95 4.311 -2.033 4.900 1.00 0.00 C ATOM 1483 O THR A 95 3.709 -2.792 4.168 1.00 0.00 O ATOM 1484 CB THR A 95 6.547 -2.026 3.823 1.00 0.00 C ATOM 1485 OG1 THR A 95 7.936 -1.876 4.078 1.00 0.00 O ATOM 1486 CG2 THR A 95 6.013 -0.784 3.104 1.00 0.00 C ATOM 0 H THR A 95 6.148 -4.289 4.980 1.00 0.00 H new ATOM 0 HA THR A 95 6.187 -1.458 5.844 1.00 0.00 H new ATOM 0 HB THR A 95 6.394 -2.904 3.196 1.00 0.00 H new ATOM 0 HG1 THR A 95 8.173 -2.364 4.894 1.00 0.00 H new ATOM 0 HG21 THR A 95 6.542 -0.654 2.160 1.00 0.00 H new ATOM 0 HG22 THR A 95 4.948 -0.906 2.909 1.00 0.00 H new ATOM 0 HG23 THR A 95 6.169 0.094 3.731 1.00 0.00 H new ATOM 1494 N VAL A 96 3.708 -1.072 5.514 1.00 0.00 N ATOM 1495 CA VAL A 96 2.252 -0.890 5.325 1.00 0.00 C ATOM 1496 C VAL A 96 2.002 0.449 4.638 1.00 0.00 C ATOM 1497 O VAL A 96 2.397 1.480 5.127 1.00 0.00 O ATOM 1498 CB VAL A 96 1.580 -0.926 6.700 1.00 0.00 C ATOM 1499 CG1 VAL A 96 0.066 -0.788 6.541 1.00 0.00 C ATOM 1500 CG2 VAL A 96 1.896 -2.264 7.380 1.00 0.00 C ATOM 0 H VAL A 96 4.156 -0.403 6.139 1.00 0.00 H new ATOM 0 HA VAL A 96 1.839 -1.682 4.701 1.00 0.00 H new ATOM 0 HB VAL A 96 1.955 -0.102 7.307 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.407 -0.814 7.523 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -0.164 0.159 6.053 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -0.313 -1.610 5.934 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.420 -2.295 8.360 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.518 -3.082 6.767 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.975 -2.367 7.497 1.00 0.00 H new ATOM 1510 N ILE A 97 1.343 0.436 3.510 1.00 0.00 N ATOM 1511 CA ILE A 97 1.065 1.714 2.789 1.00 0.00 C ATOM 1512 C ILE A 97 -0.370 2.125 3.073 1.00 0.00 C ATOM 1513 O ILE A 97 -1.288 1.342 2.932 1.00 0.00 O ATOM 1514 CB ILE A 97 1.254 1.502 1.287 1.00 0.00 C ATOM 1515 CG1 ILE A 97 2.683 1.000 1.026 1.00 0.00 C ATOM 1516 CG2 ILE A 97 1.001 2.816 0.540 1.00 0.00 C ATOM 1517 CD1 ILE A 97 3.594 2.154 0.582 1.00 0.00 C ATOM 0 H ILE A 97 0.985 -0.404 3.056 1.00 0.00 H new ATOM 0 HA ILE A 97 1.748 2.494 3.126 1.00 0.00 H new ATOM 0 HB ILE A 97 0.543 0.759 0.926 1.00 0.00 H new ATOM 0 HG12 ILE A 97 3.083 0.542 1.931 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.667 0.227 0.258 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.137 2.658 -0.530 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -0.018 3.152 0.730 1.00 0.00 H new ATOM 0 HG23 ILE A 97 1.704 3.573 0.888 1.00 0.00 H new ATOM 0 HD11 ILE A 97 4.600 1.775 0.403 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.203 2.594 -0.336 1.00 0.00 H new ATOM 0 HD13 ILE A 97 3.626 2.914 1.363 1.00 0.00 H new ATOM 1529 N TYR A 98 -0.571 3.342 3.485 1.00 0.00 N ATOM 1530 CA TYR A 98 -1.951 3.789 3.799 1.00 0.00 C ATOM 1531 C TYR A 98 -2.396 4.920 2.875 1.00 0.00 C ATOM 1532 O TYR A 98 -1.718 5.914 2.706 1.00 0.00 O ATOM 1533 CB TYR A 98 -1.997 4.311 5.233 1.00 0.00 C ATOM 1534 CG TYR A 98 -1.996 3.169 6.223 1.00 0.00 C ATOM 1535 CD1 TYR A 98 -3.046 2.242 6.234 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.952 3.052 7.146 1.00 0.00 C ATOM 1537 CE1 TYR A 98 -3.047 1.199 7.168 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.955 2.009 8.081 1.00 0.00 C ATOM 1539 CZ TYR A 98 -2.002 1.084 8.090 1.00 0.00 C ATOM 1540 OH TYR A 98 -2.007 0.056 9.011 1.00 0.00 O ATOM 0 H TYR A 98 0.157 4.044 3.617 1.00 0.00 H new ATOM 0 HA TYR A 98 -2.615 2.935 3.665 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -1.139 4.957 5.417 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -2.890 4.919 5.374 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -3.854 2.332 5.523 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.142 3.767 7.138 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -3.855 0.483 7.176 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -0.149 1.920 8.794 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.102 -0.070 9.366 1.00 0.00 H new ATOM 1550 N TRP A 99 -3.569 4.788 2.324 1.00 0.00 N ATOM 1551 CA TRP A 99 -4.131 5.861 1.461 1.00 0.00 C ATOM 1552 C TRP A 99 -5.328 6.447 2.201 1.00 0.00 C ATOM 1553 O TRP A 99 -6.054 5.735 2.865 1.00 0.00 O ATOM 1554 CB TRP A 99 -4.593 5.274 0.125 1.00 0.00 C ATOM 1555 CG TRP A 99 -3.434 5.164 -0.805 1.00 0.00 C ATOM 1556 CD1 TRP A 99 -2.950 6.166 -1.570 1.00 0.00 C ATOM 1557 CD2 TRP A 99 -2.608 4.003 -1.076 1.00 0.00 C ATOM 1558 NE1 TRP A 99 -1.876 5.689 -2.300 1.00 0.00 N ATOM 1559 CE2 TRP A 99 -1.627 4.359 -2.029 1.00 0.00 C ATOM 1560 CE3 TRP A 99 -2.622 2.686 -0.591 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 -0.687 3.434 -2.485 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 -1.679 1.754 -1.045 1.00 0.00 C ATOM 1563 CH2 TRP A 99 -0.715 2.127 -1.992 1.00 0.00 C ATOM 0 H TRP A 99 -4.170 3.971 2.437 1.00 0.00 H new ATOM 0 HA TRP A 99 -3.380 6.624 1.257 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -5.039 4.292 0.283 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -5.364 5.907 -0.314 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -3.337 7.173 -1.606 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -1.335 6.251 -2.957 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -3.363 2.389 0.136 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 0.056 3.726 -3.213 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -1.695 0.744 -0.664 1.00 0.00 H new ATOM 0 HH2 TRP A 99 0.007 1.403 -2.341 1.00 0.00 H new ATOM 1574 N LEU A 100 -5.557 7.724 2.113 1.00 0.00 N ATOM 1575 CA LEU A 100 -6.723 8.295 2.839 1.00 0.00 C ATOM 1576 C LEU A 100 -7.989 7.948 2.059 1.00 0.00 C ATOM 1577 O LEU A 100 -8.042 8.089 0.854 1.00 0.00 O ATOM 1578 CB LEU A 100 -6.581 9.813 2.946 1.00 0.00 C ATOM 1579 CG LEU A 100 -5.102 10.199 2.877 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -4.942 11.672 3.256 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -4.294 9.336 3.852 1.00 0.00 C ATOM 0 H LEU A 100 -4.998 8.389 1.579 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.775 7.881 3.846 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.131 10.297 2.139 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -7.015 10.163 3.883 1.00 0.00 H new ATOM 0 HG LEU A 100 -4.737 10.038 1.863 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.889 11.948 3.207 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -5.512 12.290 2.562 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.312 11.829 4.269 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.242 9.615 3.799 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.660 9.493 4.867 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.405 8.285 3.585 1.00 0.00 H new ATOM 1593 N ALA A 101 -9.004 7.480 2.732 1.00 0.00 N ATOM 1594 CA ALA A 101 -10.250 7.104 2.009 1.00 0.00 C ATOM 1595 C ALA A 101 -11.471 7.700 2.708 1.00 0.00 C ATOM 1596 O ALA A 101 -11.464 7.953 3.895 1.00 0.00 O ATOM 1597 CB ALA A 101 -10.379 5.581 1.992 1.00 0.00 C ATOM 0 H ALA A 101 -9.025 7.343 3.743 1.00 0.00 H new ATOM 0 HA ALA A 101 -10.199 7.490 0.991 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.290 5.299 1.464 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -9.517 5.148 1.485 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -10.423 5.208 3.015 1.00 0.00 H new ATOM 1603 N GLU A 102 -12.526 7.919 1.970 1.00 0.00 N ATOM 1604 CA GLU A 102 -13.764 8.489 2.569 1.00 0.00 C ATOM 1605 C GLU A 102 -14.954 7.600 2.203 1.00 0.00 C ATOM 1606 O GLU A 102 -15.263 7.423 1.044 1.00 0.00 O ATOM 1607 CB GLU A 102 -13.983 9.895 2.002 1.00 0.00 C ATOM 1608 CG GLU A 102 -15.190 10.537 2.680 1.00 0.00 C ATOM 1609 CD GLU A 102 -15.494 11.882 2.021 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -14.728 12.287 1.160 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -16.492 12.484 2.383 1.00 0.00 O ATOM 0 H GLU A 102 -12.582 7.725 0.970 1.00 0.00 H new ATOM 0 HA GLU A 102 -13.668 8.538 3.654 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -13.095 10.506 2.163 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -14.143 9.843 0.925 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -16.056 9.879 2.603 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -14.991 10.678 3.742 1.00 0.00 H new ATOM 1619 N VAL A 103 -15.632 7.040 3.173 1.00 0.00 N ATOM 1620 CA VAL A 103 -16.795 6.169 2.843 1.00 0.00 C ATOM 1621 C VAL A 103 -18.004 7.042 2.523 1.00 0.00 C ATOM 1622 O VAL A 103 -18.328 7.977 3.223 1.00 0.00 O ATOM 1623 CB VAL A 103 -17.085 5.211 3.999 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -15.776 4.574 4.436 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -17.687 5.959 5.186 1.00 0.00 C ATOM 0 H VAL A 103 -15.432 7.148 4.167 1.00 0.00 H new ATOM 0 HA VAL A 103 -16.565 5.563 1.967 1.00 0.00 H new ATOM 0 HB VAL A 103 -17.796 4.456 3.664 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -15.963 3.887 5.261 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -15.340 4.027 3.600 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -15.084 5.351 4.761 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -17.885 5.257 5.996 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -16.987 6.721 5.529 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -18.620 6.434 4.882 1.00 0.00 H new ATOM 1635 N LYS A 104 -18.634 6.758 1.425 1.00 0.00 N ATOM 1636 CA LYS A 104 -19.796 7.566 0.964 1.00 0.00 C ATOM 1637 C LYS A 104 -20.920 7.596 1.999 1.00 0.00 C ATOM 1638 O LYS A 104 -21.530 8.620 2.225 1.00 0.00 O ATOM 1639 CB LYS A 104 -20.328 6.922 -0.303 1.00 0.00 C ATOM 1640 CG LYS A 104 -19.195 6.816 -1.318 1.00 0.00 C ATOM 1641 CD LYS A 104 -19.656 5.949 -2.480 1.00 0.00 C ATOM 1642 CE LYS A 104 -18.480 5.692 -3.423 1.00 0.00 C ATOM 1643 NZ LYS A 104 -18.998 5.379 -4.782 1.00 0.00 N ATOM 0 H LYS A 104 -18.389 5.982 0.811 1.00 0.00 H new ATOM 0 HA LYS A 104 -19.465 8.592 0.799 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -20.730 5.933 -0.083 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -21.146 7.515 -0.712 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -18.914 7.807 -1.675 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -18.310 6.383 -0.852 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -20.051 5.004 -2.108 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -20.466 6.443 -3.017 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -17.832 6.567 -3.461 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -17.876 4.864 -3.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -18.370 5.798 -5.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -19.032 4.348 -4.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -19.955 5.772 -4.888 1.00 0.00 H new ATOM 1657 N ASP A 105 -21.232 6.485 2.601 1.00 0.00 N ATOM 1658 CA ASP A 105 -22.359 6.480 3.576 1.00 0.00 C ATOM 1659 C ASP A 105 -21.855 6.653 5.001 1.00 0.00 C ATOM 1660 O ASP A 105 -20.878 6.059 5.411 1.00 0.00 O ATOM 1661 CB ASP A 105 -23.109 5.153 3.487 1.00 0.00 C ATOM 1662 CG ASP A 105 -24.526 5.395 2.963 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -24.979 4.602 2.154 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -25.139 6.365 3.380 1.00 0.00 O ATOM 0 H ASP A 105 -20.763 5.589 2.464 1.00 0.00 H new ATOM 0 HA ASP A 105 -23.019 7.312 3.328 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -22.578 4.468 2.826 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -23.150 4.681 4.469 1.00 0.00 H new ATOM 1670 N TYR A 106 -22.546 7.443 5.768 1.00 0.00 N ATOM 1671 CA TYR A 106 -22.156 7.639 7.187 1.00 0.00 C ATOM 1672 C TYR A 106 -22.415 6.331 7.921 1.00 0.00 C ATOM 1673 O TYR A 106 -21.617 5.872 8.712 1.00 0.00 O ATOM 1674 CB TYR A 106 -23.006 8.758 7.788 1.00 0.00 C ATOM 1675 CG TYR A 106 -22.782 8.853 9.281 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -21.581 8.420 9.864 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -23.788 9.401 10.085 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -21.394 8.535 11.245 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -23.601 9.514 11.464 1.00 0.00 C ATOM 1680 CZ TYR A 106 -22.403 9.082 12.046 1.00 0.00 C ATOM 1681 OH TYR A 106 -22.215 9.200 13.408 1.00 0.00 O ATOM 0 H TYR A 106 -23.370 7.965 5.471 1.00 0.00 H new ATOM 0 HA TYR A 106 -21.105 7.915 7.272 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -22.754 9.707 7.316 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -24.060 8.571 7.584 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -20.802 7.998 9.246 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -24.712 9.737 9.637 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -20.470 8.201 11.694 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -24.381 9.935 12.082 1.00 0.00 H new ATOM 0 HH TYR A 106 -23.012 9.600 13.815 1.00 0.00 H new ATOM 1691 N ASP A 107 -23.529 5.721 7.631 1.00 0.00 N ATOM 1692 CA ASP A 107 -23.865 4.424 8.266 1.00 0.00 C ATOM 1693 C ASP A 107 -23.437 3.310 7.311 1.00 0.00 C ATOM 1694 O ASP A 107 -23.899 2.191 7.397 1.00 0.00 O ATOM 1695 CB ASP A 107 -25.371 4.345 8.523 1.00 0.00 C ATOM 1696 CG ASP A 107 -25.687 3.082 9.328 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -26.855 2.761 9.454 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -24.752 2.457 9.805 1.00 0.00 O ATOM 0 H ASP A 107 -24.226 6.072 6.974 1.00 0.00 H new ATOM 0 HA ASP A 107 -23.349 4.322 9.221 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -25.704 5.229 9.067 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -25.912 4.331 7.577 1.00 0.00 H new ATOM 1704 N VAL A 108 -22.552 3.620 6.396 1.00 0.00 N ATOM 1705 CA VAL A 108 -22.076 2.594 5.427 1.00 0.00 C ATOM 1706 C VAL A 108 -21.928 1.280 6.175 1.00 0.00 C ATOM 1707 O VAL A 108 -21.657 1.259 7.360 1.00 0.00 O ATOM 1708 CB VAL A 108 -20.731 3.042 4.856 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -19.819 3.446 6.007 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -20.074 1.907 4.073 1.00 0.00 C ATOM 0 H VAL A 108 -22.139 4.545 6.281 1.00 0.00 H new ATOM 0 HA VAL A 108 -22.780 2.469 4.604 1.00 0.00 H new ATOM 0 HB VAL A 108 -20.894 3.884 4.183 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -18.855 3.768 5.612 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -20.275 4.265 6.563 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -19.673 2.594 6.671 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -19.118 2.246 3.675 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -19.911 1.056 4.734 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -20.724 1.608 3.251 1.00 0.00 H new ATOM 1720 N GLU A 109 -22.134 0.180 5.517 1.00 0.00 N ATOM 1721 CA GLU A 109 -22.034 -1.105 6.236 1.00 0.00 C ATOM 1722 C GLU A 109 -20.620 -1.328 6.726 1.00 0.00 C ATOM 1723 O GLU A 109 -19.642 -0.994 6.081 1.00 0.00 O ATOM 1724 CB GLU A 109 -22.461 -2.276 5.346 1.00 0.00 C ATOM 1725 CG GLU A 109 -21.246 -3.153 5.018 1.00 0.00 C ATOM 1726 CD GLU A 109 -21.610 -4.143 3.913 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -22.707 -4.043 3.394 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -20.781 -4.981 3.602 1.00 0.00 O ATOM 0 H GLU A 109 -22.364 0.118 4.525 1.00 0.00 H new ATOM 0 HA GLU A 109 -22.709 -1.058 7.091 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -23.223 -2.869 5.852 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -22.908 -1.900 4.426 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -20.410 -2.530 4.700 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -20.922 -3.691 5.909 1.00 0.00 H new ATOM 1736 N ILE A 110 -20.532 -1.914 7.869 1.00 0.00 N ATOM 1737 CA ILE A 110 -19.218 -2.221 8.473 1.00 0.00 C ATOM 1738 C ILE A 110 -19.160 -3.708 8.769 1.00 0.00 C ATOM 1739 O ILE A 110 -19.770 -4.190 9.702 1.00 0.00 O ATOM 1740 CB ILE A 110 -19.044 -1.424 9.766 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -18.869 0.054 9.421 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -17.811 -1.927 10.520 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -17.626 0.231 8.543 1.00 0.00 C ATOM 0 H ILE A 110 -21.335 -2.203 8.428 1.00 0.00 H new ATOM 0 HA ILE A 110 -18.417 -1.948 7.786 1.00 0.00 H new ATOM 0 HB ILE A 110 -19.923 -1.552 10.397 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -19.752 0.423 8.899 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -18.769 0.642 10.333 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -17.690 -1.357 11.441 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -17.937 -2.983 10.761 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -16.926 -1.800 9.896 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -17.501 1.286 8.297 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -16.747 -0.122 9.082 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -17.744 -0.344 7.625 1.00 0.00 H new ATOM 1755 N ARG A 111 -18.426 -4.439 7.989 1.00 0.00 N ATOM 1756 CA ARG A 111 -18.326 -5.895 8.237 1.00 0.00 C ATOM 1757 C ARG A 111 -17.000 -6.184 8.915 1.00 0.00 C ATOM 1758 O ARG A 111 -15.952 -5.764 8.465 1.00 0.00 O ATOM 1759 CB ARG A 111 -18.435 -6.653 6.923 1.00 0.00 C ATOM 1760 CG ARG A 111 -19.719 -7.477 6.951 1.00 0.00 C ATOM 1761 CD ARG A 111 -19.600 -8.573 8.015 1.00 0.00 C ATOM 1762 NE ARG A 111 -20.801 -8.546 8.906 1.00 0.00 N ATOM 1763 CZ ARG A 111 -21.885 -9.193 8.565 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -21.927 -9.844 7.434 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -22.926 -9.190 9.354 1.00 0.00 N ATOM 0 H ARG A 111 -17.892 -4.092 7.192 1.00 0.00 H new ATOM 0 HA ARG A 111 -19.140 -6.221 8.884 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -18.448 -5.958 6.084 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -17.570 -7.302 6.786 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -20.572 -6.834 7.170 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -19.899 -7.923 5.973 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -19.512 -9.549 7.537 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -18.695 -8.424 8.604 1.00 0.00 H new ATOM 0 HE ARG A 111 -20.774 -8.022 9.781 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -21.115 -9.848 6.817 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -22.772 -10.349 7.167 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -22.894 -8.682 10.238 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -23.771 -9.695 9.086 1.00 0.00 H new ATOM 1779 N LEU A 112 -17.043 -6.868 10.016 1.00 0.00 N ATOM 1780 CA LEU A 112 -15.786 -7.156 10.750 1.00 0.00 C ATOM 1781 C LEU A 112 -15.490 -8.654 10.709 1.00 0.00 C ATOM 1782 O LEU A 112 -16.377 -9.476 10.828 1.00 0.00 O ATOM 1783 CB LEU A 112 -15.933 -6.717 12.209 1.00 0.00 C ATOM 1784 CG LEU A 112 -16.557 -5.316 12.297 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -16.387 -4.788 13.722 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -15.871 -4.351 11.320 1.00 0.00 C ATOM 0 H LEU A 112 -17.892 -7.241 10.441 1.00 0.00 H new ATOM 0 HA LEU A 112 -14.968 -6.611 10.279 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -16.555 -7.432 12.748 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -14.957 -6.716 12.693 1.00 0.00 H new ATOM 0 HG LEU A 112 -17.613 -5.384 12.036 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -16.827 -3.793 13.796 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -16.887 -5.459 14.421 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -15.326 -4.735 13.966 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -16.329 -3.365 11.400 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -14.811 -4.279 11.564 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -15.985 -4.722 10.302 1.00 0.00 H new ATOM 1798 N SER A 113 -14.248 -9.015 10.559 1.00 0.00 N ATOM 1799 CA SER A 113 -13.893 -10.460 10.533 1.00 0.00 C ATOM 1800 C SER A 113 -13.717 -10.947 11.974 1.00 0.00 C ATOM 1801 O SER A 113 -13.737 -10.168 12.907 1.00 0.00 O ATOM 1802 CB SER A 113 -12.587 -10.654 9.760 1.00 0.00 C ATOM 1803 OG SER A 113 -12.418 -12.033 9.458 1.00 0.00 O ATOM 0 H SER A 113 -13.463 -8.372 10.453 1.00 0.00 H new ATOM 0 HA SER A 113 -14.683 -11.029 10.043 1.00 0.00 H new ATOM 0 HB2 SER A 113 -12.605 -10.069 8.841 1.00 0.00 H new ATOM 0 HB3 SER A 113 -11.745 -10.294 10.351 1.00 0.00 H new ATOM 0 HG SER A 113 -11.583 -12.159 8.961 1.00 0.00 H new ATOM 1809 N HIS A 114 -13.544 -12.221 12.172 1.00 0.00 N ATOM 1810 CA HIS A 114 -13.366 -12.726 13.559 1.00 0.00 C ATOM 1811 C HIS A 114 -12.243 -11.933 14.237 1.00 0.00 C ATOM 1812 O HIS A 114 -12.276 -11.686 15.426 1.00 0.00 O ATOM 1813 CB HIS A 114 -12.991 -14.207 13.523 1.00 0.00 C ATOM 1814 CG HIS A 114 -12.963 -14.741 14.928 1.00 0.00 C ATOM 1815 ND1 HIS A 114 -14.091 -14.752 15.738 1.00 0.00 N ATOM 1816 CD2 HIS A 114 -11.953 -15.285 15.684 1.00 0.00 C ATOM 1817 CE1 HIS A 114 -13.736 -15.284 16.922 1.00 0.00 C ATOM 1818 NE2 HIS A 114 -12.444 -15.623 16.939 1.00 0.00 N ATOM 0 H HIS A 114 -13.518 -12.931 11.440 1.00 0.00 H new ATOM 0 HA HIS A 114 -14.295 -12.605 14.116 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -13.712 -14.763 12.924 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -12.017 -14.337 13.052 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -10.935 -15.428 15.354 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -14.411 -15.420 17.754 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -11.926 -16.042 17.712 1.00 0.00 H new ATOM 1827 N GLU A 115 -11.246 -11.538 13.486 1.00 0.00 N ATOM 1828 CA GLU A 115 -10.109 -10.767 14.078 1.00 0.00 C ATOM 1829 C GLU A 115 -10.619 -9.451 14.666 1.00 0.00 C ATOM 1830 O GLU A 115 -10.115 -8.968 15.661 1.00 0.00 O ATOM 1831 CB GLU A 115 -9.088 -10.456 12.981 1.00 0.00 C ATOM 1832 CG GLU A 115 -8.558 -11.765 12.404 1.00 0.00 C ATOM 1833 CD GLU A 115 -7.831 -12.547 13.497 1.00 0.00 C ATOM 1834 OE1 GLU A 115 -7.637 -13.736 13.317 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -7.481 -11.945 14.498 1.00 0.00 O ATOM 0 H GLU A 115 -11.170 -11.717 12.485 1.00 0.00 H new ATOM 0 HA GLU A 115 -9.647 -11.361 14.866 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -9.551 -9.859 12.195 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.267 -9.865 13.388 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -9.381 -12.358 12.004 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -7.880 -11.561 11.576 1.00 0.00 H new ATOM 1843 N HIS A 116 -11.608 -8.860 14.057 1.00 0.00 N ATOM 1844 CA HIS A 116 -12.140 -7.575 14.581 1.00 0.00 C ATOM 1845 C HIS A 116 -13.481 -7.834 15.270 1.00 0.00 C ATOM 1846 O HIS A 116 -14.328 -8.542 14.760 1.00 0.00 O ATOM 1847 CB HIS A 116 -12.317 -6.600 13.418 1.00 0.00 C ATOM 1848 CG HIS A 116 -10.967 -6.191 12.893 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -10.118 -5.353 13.603 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -10.300 -6.508 11.736 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -9.000 -5.191 12.869 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -9.062 -5.876 11.726 1.00 0.00 N ATOM 0 H HIS A 116 -12.070 -9.212 13.219 1.00 0.00 H new ATOM 0 HA HIS A 116 -11.448 -7.143 15.304 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -12.901 -7.067 12.625 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -12.872 -5.722 13.748 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -10.679 -7.150 10.954 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -8.159 -4.583 13.168 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -8.350 -5.926 10.997 1.00 0.00 H new ATOM 1861 N GLN A 117 -13.671 -7.283 16.439 1.00 0.00 N ATOM 1862 CA GLN A 117 -14.947 -7.507 17.180 1.00 0.00 C ATOM 1863 C GLN A 117 -15.872 -6.297 17.055 1.00 0.00 C ATOM 1864 O GLN A 117 -17.076 -6.437 16.972 1.00 0.00 O ATOM 1865 CB GLN A 117 -14.633 -7.752 18.662 1.00 0.00 C ATOM 1866 CG GLN A 117 -15.883 -7.487 19.507 1.00 0.00 C ATOM 1867 CD GLN A 117 -15.580 -7.733 20.987 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -16.412 -7.478 21.837 1.00 0.00 O ATOM 1869 NE2 GLN A 117 -14.424 -8.220 21.336 1.00 0.00 N ATOM 0 H GLN A 117 -12.995 -6.685 16.915 1.00 0.00 H new ATOM 0 HA GLN A 117 -15.450 -8.373 16.751 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -14.295 -8.778 18.807 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -13.820 -7.101 18.984 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -16.218 -6.460 19.362 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -16.696 -8.136 19.181 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -13.725 -8.434 20.625 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -14.217 -8.387 22.321 1.00 0.00 H new ATOM 1878 N ALA A 118 -15.336 -5.107 17.063 1.00 0.00 N ATOM 1879 CA ALA A 118 -16.221 -3.913 16.970 1.00 0.00 C ATOM 1880 C ALA A 118 -15.460 -2.730 16.379 1.00 0.00 C ATOM 1881 O ALA A 118 -14.250 -2.671 16.415 1.00 0.00 O ATOM 1882 CB ALA A 118 -16.723 -3.548 18.365 1.00 0.00 C ATOM 0 H ALA A 118 -14.337 -4.912 17.129 1.00 0.00 H new ATOM 0 HA ALA A 118 -17.064 -4.148 16.320 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -17.371 -2.674 18.301 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -17.283 -4.386 18.781 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -15.874 -3.323 19.010 1.00 0.00 H new ATOM 1888 N TYR A 119 -16.175 -1.785 15.834 1.00 0.00 N ATOM 1889 CA TYR A 119 -15.519 -0.595 15.232 1.00 0.00 C ATOM 1890 C TYR A 119 -16.168 0.685 15.768 1.00 0.00 C ATOM 1891 O TYR A 119 -17.292 0.681 16.230 1.00 0.00 O ATOM 1892 CB TYR A 119 -15.692 -0.651 13.716 1.00 0.00 C ATOM 1893 CG TYR A 119 -17.132 -0.392 13.372 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -18.056 -1.443 13.391 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -17.546 0.899 13.035 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -19.395 -1.199 13.074 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -18.885 1.143 12.717 1.00 0.00 C ATOM 1898 CZ TYR A 119 -19.811 0.095 12.738 1.00 0.00 C ATOM 1899 OH TYR A 119 -21.131 0.339 12.430 1.00 0.00 O ATOM 0 H TYR A 119 -17.194 -1.788 15.781 1.00 0.00 H new ATOM 0 HA TYR A 119 -14.460 -0.593 15.490 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -15.052 0.091 13.238 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -15.386 -1.627 13.339 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -17.735 -2.441 13.650 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -16.831 1.709 13.020 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -20.109 -2.009 13.088 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -19.205 2.141 12.455 1.00 0.00 H new ATOM 0 HH TYR A 119 -21.248 1.289 12.222 1.00 0.00 H new ATOM 1909 N ARG A 120 -15.465 1.782 15.696 1.00 0.00 N ATOM 1910 CA ARG A 120 -16.032 3.067 16.186 1.00 0.00 C ATOM 1911 C ARG A 120 -15.659 4.196 15.228 1.00 0.00 C ATOM 1912 O ARG A 120 -14.640 4.157 14.569 1.00 0.00 O ATOM 1913 CB ARG A 120 -15.458 3.403 17.564 1.00 0.00 C ATOM 1914 CG ARG A 120 -15.952 2.393 18.597 1.00 0.00 C ATOM 1915 CD ARG A 120 -15.472 2.822 19.983 1.00 0.00 C ATOM 1916 NE ARG A 120 -15.755 1.742 20.972 1.00 0.00 N ATOM 1917 CZ ARG A 120 -15.908 2.037 22.237 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -15.801 3.276 22.636 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -16.158 1.095 23.105 1.00 0.00 N ATOM 0 H ARG A 120 -14.520 1.842 15.318 1.00 0.00 H new ATOM 0 HA ARG A 120 -17.115 2.964 16.247 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -14.369 3.393 17.525 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.757 4.410 17.856 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -17.040 2.336 18.577 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -15.576 1.398 18.360 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.403 3.034 19.958 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -15.973 3.743 20.283 1.00 0.00 H new ATOM 0 HE ARG A 120 -15.829 0.773 20.662 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -15.598 4.013 21.961 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -15.920 3.506 23.622 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -16.235 0.125 22.798 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -16.277 1.328 24.091 1.00 0.00 H new ATOM 1933 N TRP A 121 -16.466 5.217 15.183 1.00 0.00 N ATOM 1934 CA TRP A 121 -16.156 6.382 14.315 1.00 0.00 C ATOM 1935 C TRP A 121 -15.796 7.547 15.226 1.00 0.00 C ATOM 1936 O TRP A 121 -16.636 8.095 15.909 1.00 0.00 O ATOM 1937 CB TRP A 121 -17.375 6.740 13.462 1.00 0.00 C ATOM 1938 CG TRP A 121 -17.445 5.815 12.292 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -18.175 4.678 12.241 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -16.774 5.928 11.003 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -17.990 4.081 11.006 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -17.136 4.814 10.208 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -15.894 6.877 10.451 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -16.642 4.648 8.914 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -15.394 6.712 9.150 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -15.769 5.601 8.383 1.00 0.00 C ATOM 0 H TRP A 121 -17.333 5.294 15.715 1.00 0.00 H new ATOM 0 HA TRP A 121 -15.330 6.151 13.643 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -18.285 6.663 14.057 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -17.304 7.773 13.120 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -18.801 4.298 13.035 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -18.431 3.207 10.721 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -15.601 7.739 11.033 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -16.932 3.789 8.327 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -14.717 7.445 8.738 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -15.383 5.481 7.381 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.544 7.905 15.274 1.00 0.00 N ATOM 1958 CA LEU A 122 -14.123 9.008 16.181 1.00 0.00 C ATOM 1959 C LEU A 122 -13.311 10.045 15.412 1.00 0.00 C ATOM 1960 O LEU A 122 -12.954 9.855 14.267 1.00 0.00 O ATOM 1961 CB LEU A 122 -13.242 8.448 17.299 1.00 0.00 C ATOM 1962 CG LEU A 122 -13.606 6.984 17.590 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -12.474 6.075 17.110 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -13.811 6.796 19.099 1.00 0.00 C ATOM 0 H LEU A 122 -13.795 7.482 14.725 1.00 0.00 H new ATOM 0 HA LEU A 122 -15.018 9.471 16.596 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -12.193 8.518 17.012 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -13.366 9.046 18.202 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.527 6.727 17.066 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.730 5.036 17.315 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.330 6.208 16.038 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -11.554 6.332 17.634 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -14.069 5.757 19.304 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -12.892 7.052 19.626 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -14.618 7.445 19.440 1.00 0.00 H new ATOM 1976 N GLY A 123 -13.005 11.140 16.050 1.00 0.00 N ATOM 1977 CA GLY A 123 -12.204 12.197 15.383 1.00 0.00 C ATOM 1978 C GLY A 123 -10.721 11.842 15.467 1.00 0.00 C ATOM 1979 O GLY A 123 -10.338 10.815 15.995 1.00 0.00 O ATOM 0 H GLY A 123 -13.278 11.347 17.011 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -12.507 12.294 14.340 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -12.386 13.161 15.859 1.00 0.00 H new ATOM 1983 N LEU A 124 -9.891 12.691 14.939 1.00 0.00 N ATOM 1984 CA LEU A 124 -8.427 12.432 14.961 1.00 0.00 C ATOM 1985 C LEU A 124 -7.933 12.245 16.398 1.00 0.00 C ATOM 1986 O LEU A 124 -7.101 11.404 16.667 1.00 0.00 O ATOM 1987 CB LEU A 124 -7.709 13.628 14.335 1.00 0.00 C ATOM 1988 CG LEU A 124 -6.193 13.429 14.414 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -5.815 12.031 13.920 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -5.509 14.463 13.525 1.00 0.00 C ATOM 0 H LEU A 124 -10.166 13.563 14.488 1.00 0.00 H new ATOM 0 HA LEU A 124 -8.217 11.522 14.400 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -8.015 13.743 13.295 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -7.991 14.544 14.854 1.00 0.00 H new ATOM 0 HG LEU A 124 -5.874 13.544 15.450 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -4.734 11.903 13.982 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -6.305 11.281 14.541 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -6.136 11.912 12.885 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.429 14.328 13.575 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -5.843 14.335 12.495 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -5.766 15.465 13.868 1.00 0.00 H new ATOM 2002 N GLU A 125 -8.424 13.029 17.316 1.00 0.00 N ATOM 2003 CA GLU A 125 -7.966 12.905 18.731 1.00 0.00 C ATOM 2004 C GLU A 125 -8.244 11.497 19.262 1.00 0.00 C ATOM 2005 O GLU A 125 -7.359 10.817 19.740 1.00 0.00 O ATOM 2006 CB GLU A 125 -8.715 13.927 19.594 1.00 0.00 C ATOM 2007 CG GLU A 125 -10.215 13.617 19.587 1.00 0.00 C ATOM 2008 CD GLU A 125 -10.969 14.774 20.243 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -10.312 15.667 20.750 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -12.191 14.742 20.230 1.00 0.00 O ATOM 0 H GLU A 125 -9.124 13.752 17.149 1.00 0.00 H new ATOM 0 HA GLU A 125 -6.893 13.092 18.773 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -8.335 13.902 20.615 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -8.541 14.934 19.214 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -10.564 13.473 18.565 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -10.410 12.689 20.124 1.00 0.00 H new ATOM 2018 N GLU A 126 -9.466 11.059 19.182 1.00 0.00 N ATOM 2019 CA GLU A 126 -9.805 9.699 19.680 1.00 0.00 C ATOM 2020 C GLU A 126 -9.180 8.664 18.765 1.00 0.00 C ATOM 2021 O GLU A 126 -8.522 7.742 19.197 1.00 0.00 O ATOM 2022 CB GLU A 126 -11.315 9.522 19.662 1.00 0.00 C ATOM 2023 CG GLU A 126 -11.895 9.737 21.061 1.00 0.00 C ATOM 2024 CD GLU A 126 -11.247 10.953 21.727 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -11.843 12.015 21.678 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -10.169 10.803 22.281 1.00 0.00 O ATOM 0 H GLU A 126 -10.248 11.585 18.792 1.00 0.00 H new ATOM 0 HA GLU A 126 -9.428 9.576 20.695 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -11.762 10.230 18.964 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -11.566 8.522 19.307 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -12.973 9.882 20.996 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -11.729 8.849 21.671 1.00 0.00 H new ATOM 2034 N ALA A 127 -9.368 8.813 17.494 1.00 0.00 N ATOM 2035 CA ALA A 127 -8.765 7.839 16.566 1.00 0.00 C ATOM 2036 C ALA A 127 -7.298 7.723 16.940 1.00 0.00 C ATOM 2037 O ALA A 127 -6.705 6.667 16.891 1.00 0.00 O ATOM 2038 CB ALA A 127 -8.913 8.352 15.138 1.00 0.00 C ATOM 0 H ALA A 127 -9.909 9.561 17.061 1.00 0.00 H new ATOM 0 HA ALA A 127 -9.251 6.866 16.630 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -8.469 7.636 14.446 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.970 8.475 14.903 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -8.406 9.312 15.042 1.00 0.00 H new ATOM 2044 N CYS A 128 -6.718 8.813 17.352 1.00 0.00 N ATOM 2045 CA CYS A 128 -5.303 8.791 17.773 1.00 0.00 C ATOM 2046 C CYS A 128 -5.219 8.181 19.174 1.00 0.00 C ATOM 2047 O CYS A 128 -4.350 7.388 19.466 1.00 0.00 O ATOM 2048 CB CYS A 128 -4.765 10.223 17.798 1.00 0.00 C ATOM 2049 SG CYS A 128 -4.090 10.647 16.171 1.00 0.00 S ATOM 0 H CYS A 128 -7.173 9.724 17.414 1.00 0.00 H new ATOM 0 HA CYS A 128 -4.710 8.197 17.078 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -5.562 10.917 18.064 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -3.991 10.318 18.560 1.00 0.00 H new ATOM 0 HG CYS A 128 -3.635 11.865 16.194 1.00 0.00 H new ATOM 2055 N GLN A 129 -6.124 8.540 20.046 1.00 0.00 N ATOM 2056 CA GLN A 129 -6.084 7.967 21.420 1.00 0.00 C ATOM 2057 C GLN A 129 -6.193 6.443 21.331 1.00 0.00 C ATOM 2058 O GLN A 129 -5.388 5.719 21.883 1.00 0.00 O ATOM 2059 CB GLN A 129 -7.233 8.557 22.261 1.00 0.00 C ATOM 2060 CG GLN A 129 -8.498 7.698 22.165 1.00 0.00 C ATOM 2061 CD GLN A 129 -8.354 6.497 23.095 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -7.273 6.206 23.564 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -9.405 5.785 23.387 1.00 0.00 N ATOM 0 H GLN A 129 -6.882 9.199 19.867 1.00 0.00 H new ATOM 0 HA GLN A 129 -5.142 8.222 21.906 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.921 8.632 23.303 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.452 9.569 21.920 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.374 8.285 22.441 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.649 7.364 21.139 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.313 6.030 22.992 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -9.320 4.982 24.010 1.00 0.00 H new ATOM 2072 N LEU A 130 -7.168 5.953 20.624 1.00 0.00 N ATOM 2073 CA LEU A 130 -7.321 4.476 20.479 1.00 0.00 C ATOM 2074 C LEU A 130 -6.115 3.906 19.728 1.00 0.00 C ATOM 2075 O LEU A 130 -5.623 2.842 20.045 1.00 0.00 O ATOM 2076 CB LEU A 130 -8.585 4.178 19.676 1.00 0.00 C ATOM 2077 CG LEU A 130 -9.823 4.622 20.454 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -10.832 5.217 19.482 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -10.451 3.413 21.146 1.00 0.00 C ATOM 0 H LEU A 130 -7.870 6.511 20.137 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.388 4.022 21.468 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -8.545 4.694 18.717 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -8.645 3.111 19.461 1.00 0.00 H new ATOM 0 HG LEU A 130 -9.540 5.364 21.200 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -11.719 5.537 20.029 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -10.388 6.075 18.977 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -11.112 4.466 18.743 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -11.334 3.730 21.701 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -10.738 2.674 20.398 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -9.729 2.972 21.833 1.00 0.00 H new ATOM 2091 N ALA A 131 -5.630 4.606 18.734 1.00 0.00 N ATOM 2092 CA ALA A 131 -4.453 4.096 17.974 1.00 0.00 C ATOM 2093 C ALA A 131 -3.202 4.368 18.801 1.00 0.00 C ATOM 2094 O ALA A 131 -2.264 4.998 18.360 1.00 0.00 O ATOM 2095 CB ALA A 131 -4.353 4.810 16.631 1.00 0.00 C ATOM 0 H ALA A 131 -5.997 5.504 18.418 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.558 3.027 17.789 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -3.491 4.432 16.081 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -5.260 4.628 16.054 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.237 5.881 16.796 1.00 0.00 H new ATOM 2101 N GLN A 132 -3.211 3.892 20.008 1.00 0.00 N ATOM 2102 CA GLN A 132 -2.069 4.102 20.936 1.00 0.00 C ATOM 2103 C GLN A 132 -0.750 4.034 20.180 1.00 0.00 C ATOM 2104 O GLN A 132 0.190 4.731 20.503 1.00 0.00 O ATOM 2105 CB GLN A 132 -2.076 3.003 21.995 1.00 0.00 C ATOM 2106 CG GLN A 132 -2.912 1.825 21.496 1.00 0.00 C ATOM 2107 CD GLN A 132 -2.387 1.377 20.131 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -1.422 0.647 20.052 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -2.980 1.794 19.048 1.00 0.00 N ATOM 0 H GLN A 132 -3.981 3.352 20.402 1.00 0.00 H new ATOM 0 HA GLN A 132 -2.171 5.084 21.399 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -1.057 2.678 22.204 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -2.487 3.385 22.929 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -2.861 1.000 22.207 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -3.960 2.114 21.419 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -3.792 2.408 19.115 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -2.632 1.506 18.133 1.00 0.00 H new ATOM 2118 N PHE A 133 -0.656 3.202 19.186 1.00 0.00 N ATOM 2119 CA PHE A 133 0.625 3.119 18.445 1.00 0.00 C ATOM 2120 C PHE A 133 0.894 4.472 17.793 1.00 0.00 C ATOM 2121 O PHE A 133 0.061 5.019 17.099 1.00 0.00 O ATOM 2122 CB PHE A 133 0.535 2.014 17.393 1.00 0.00 C ATOM 2123 CG PHE A 133 0.176 0.721 18.083 1.00 0.00 C ATOM 2124 CD1 PHE A 133 0.929 0.289 19.180 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -0.923 -0.030 17.647 1.00 0.00 C ATOM 2126 CE1 PHE A 133 0.590 -0.896 19.839 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -1.264 -1.216 18.311 1.00 0.00 C ATOM 2128 CZ PHE A 133 -0.509 -1.647 19.406 1.00 0.00 C ATOM 0 H PHE A 133 -1.399 2.585 18.859 1.00 0.00 H new ATOM 0 HA PHE A 133 1.445 2.878 19.121 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -0.217 2.265 16.644 1.00 0.00 H new ATOM 0 HB3 PHE A 133 1.485 1.912 16.869 1.00 0.00 H new ATOM 0 HD1 PHE A 133 1.773 0.872 19.518 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -1.506 0.304 16.801 1.00 0.00 H new ATOM 0 HE1 PHE A 133 1.176 -1.232 20.682 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -2.111 -1.797 17.977 1.00 0.00 H new ATOM 0 HZ PHE A 133 -0.774 -2.560 19.918 1.00 0.00 H new ATOM 2138 N LYS A 134 2.047 5.022 18.040 1.00 0.00 N ATOM 2139 CA LYS A 134 2.399 6.358 17.477 1.00 0.00 C ATOM 2140 C LYS A 134 2.334 6.357 15.948 1.00 0.00 C ATOM 2141 O LYS A 134 1.891 7.311 15.339 1.00 0.00 O ATOM 2142 CB LYS A 134 3.825 6.702 17.904 1.00 0.00 C ATOM 2143 CG LYS A 134 4.233 8.065 17.329 1.00 0.00 C ATOM 2144 CD LYS A 134 5.720 8.042 16.963 1.00 0.00 C ATOM 2145 CE LYS A 134 6.561 7.939 18.236 1.00 0.00 C ATOM 2146 NZ LYS A 134 7.780 8.784 18.093 1.00 0.00 N ATOM 0 H LYS A 134 2.774 4.598 18.617 1.00 0.00 H new ATOM 0 HA LYS A 134 1.684 7.091 17.851 1.00 0.00 H new ATOM 0 HB2 LYS A 134 3.892 6.723 18.992 1.00 0.00 H new ATOM 0 HB3 LYS A 134 4.513 5.931 17.557 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.634 8.293 16.447 1.00 0.00 H new ATOM 0 HG3 LYS A 134 4.039 8.852 18.058 1.00 0.00 H new ATOM 0 HD2 LYS A 134 5.930 7.197 16.307 1.00 0.00 H new ATOM 0 HD3 LYS A 134 5.983 8.946 16.413 1.00 0.00 H new ATOM 0 HE2 LYS A 134 5.978 8.265 19.098 1.00 0.00 H new ATOM 0 HE3 LYS A 134 6.843 6.902 18.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 8.353 8.715 18.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 8.338 8.453 17.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 7.500 9.774 17.941 1.00 0.00 H new ATOM 2160 N GLU A 135 2.800 5.317 15.318 1.00 0.00 N ATOM 2161 CA GLU A 135 2.794 5.291 13.828 1.00 0.00 C ATOM 2162 C GLU A 135 1.397 5.598 13.312 1.00 0.00 C ATOM 2163 O GLU A 135 1.222 6.299 12.336 1.00 0.00 O ATOM 2164 CB GLU A 135 3.194 3.902 13.339 1.00 0.00 C ATOM 2165 CG GLU A 135 4.244 3.319 14.283 1.00 0.00 C ATOM 2166 CD GLU A 135 3.590 2.315 15.237 1.00 0.00 C ATOM 2167 OE1 GLU A 135 2.591 1.726 14.859 1.00 0.00 O ATOM 2168 OE2 GLU A 135 4.103 2.153 16.333 1.00 0.00 O ATOM 0 H GLU A 135 3.184 4.486 15.767 1.00 0.00 H new ATOM 0 HA GLU A 135 3.499 6.037 13.461 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.320 3.251 13.301 1.00 0.00 H new ATOM 0 HB3 GLU A 135 3.591 3.961 12.326 1.00 0.00 H new ATOM 0 HG2 GLU A 135 5.030 2.829 13.708 1.00 0.00 H new ATOM 0 HG3 GLU A 135 4.718 4.119 14.852 1.00 0.00 H new ATOM 2176 N MET A 136 0.401 5.071 13.949 1.00 0.00 N ATOM 2177 CA MET A 136 -0.974 5.326 13.485 1.00 0.00 C ATOM 2178 C MET A 136 -1.383 6.747 13.865 1.00 0.00 C ATOM 2179 O MET A 136 -2.039 7.433 13.107 1.00 0.00 O ATOM 2180 CB MET A 136 -1.907 4.303 14.120 1.00 0.00 C ATOM 2181 CG MET A 136 -1.392 2.895 13.802 1.00 0.00 C ATOM 2182 SD MET A 136 -1.009 2.764 12.037 1.00 0.00 S ATOM 2183 CE MET A 136 -2.598 3.349 11.403 1.00 0.00 C ATOM 0 H MET A 136 0.482 4.474 14.772 1.00 0.00 H new ATOM 0 HA MET A 136 -1.032 5.231 12.401 1.00 0.00 H new ATOM 0 HB2 MET A 136 -1.952 4.453 15.199 1.00 0.00 H new ATOM 0 HB3 MET A 136 -2.920 4.429 13.738 1.00 0.00 H new ATOM 0 HG2 MET A 136 -0.501 2.682 14.393 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.142 2.153 14.076 1.00 0.00 H new ATOM 0 HE1 MET A 136 -2.775 2.922 10.416 1.00 0.00 H new ATOM 0 HE2 MET A 136 -3.395 3.042 12.080 1.00 0.00 H new ATOM 0 HE3 MET A 136 -2.583 4.436 11.331 1.00 0.00 H new ATOM 2193 N LYS A 137 -0.983 7.219 15.015 1.00 0.00 N ATOM 2194 CA LYS A 137 -1.348 8.611 15.384 1.00 0.00 C ATOM 2195 C LYS A 137 -0.853 9.526 14.270 1.00 0.00 C ATOM 2196 O LYS A 137 -1.525 10.454 13.875 1.00 0.00 O ATOM 2197 CB LYS A 137 -0.686 9.013 16.709 1.00 0.00 C ATOM 2198 CG LYS A 137 -1.674 8.825 17.869 1.00 0.00 C ATOM 2199 CD LYS A 137 -1.374 7.521 18.608 1.00 0.00 C ATOM 2200 CE LYS A 137 -0.544 7.826 19.851 1.00 0.00 C ATOM 2201 NZ LYS A 137 0.478 8.857 19.520 1.00 0.00 N ATOM 0 H LYS A 137 -0.429 6.709 15.703 1.00 0.00 H new ATOM 0 HA LYS A 137 -2.428 8.692 15.509 1.00 0.00 H new ATOM 0 HB2 LYS A 137 0.205 8.408 16.878 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -0.361 10.052 16.662 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -1.603 9.667 18.558 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -2.695 8.810 17.488 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -2.304 7.027 18.890 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -0.834 6.835 17.955 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -1.189 8.182 20.655 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -0.059 6.918 20.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 1.267 8.793 20.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 0.834 8.696 18.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 0.049 9.802 19.577 1.00 0.00 H new ATOM 2215 N ALA A 138 0.315 9.253 13.750 1.00 0.00 N ATOM 2216 CA ALA A 138 0.861 10.087 12.644 1.00 0.00 C ATOM 2217 C ALA A 138 0.117 9.769 11.350 1.00 0.00 C ATOM 2218 O ALA A 138 -0.250 10.650 10.600 1.00 0.00 O ATOM 2219 CB ALA A 138 2.343 9.790 12.459 1.00 0.00 C ATOM 0 H ALA A 138 0.916 8.484 14.047 1.00 0.00 H new ATOM 0 HA ALA A 138 0.731 11.140 12.892 1.00 0.00 H new ATOM 0 HB1 ALA A 138 2.738 10.402 11.649 1.00 0.00 H new ATOM 0 HB2 ALA A 138 2.878 10.019 13.381 1.00 0.00 H new ATOM 0 HB3 ALA A 138 2.475 8.736 12.215 1.00 0.00 H new ATOM 2225 N ALA A 139 -0.126 8.515 11.084 1.00 0.00 N ATOM 2226 CA ALA A 139 -0.863 8.166 9.842 1.00 0.00 C ATOM 2227 C ALA A 139 -2.207 8.870 9.907 1.00 0.00 C ATOM 2228 O ALA A 139 -2.642 9.514 8.973 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.084 6.655 9.779 1.00 0.00 C ATOM 0 H ALA A 139 0.151 7.726 11.668 1.00 0.00 H new ATOM 0 HA ALA A 139 -0.301 8.472 8.960 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.625 6.404 8.866 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.120 6.146 9.781 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -1.665 6.336 10.644 1.00 0.00 H new ATOM 2235 N LEU A 140 -2.843 8.772 11.032 1.00 0.00 N ATOM 2236 CA LEU A 140 -4.143 9.454 11.215 1.00 0.00 C ATOM 2237 C LEU A 140 -3.885 10.967 11.232 1.00 0.00 C ATOM 2238 O LEU A 140 -4.705 11.758 10.807 1.00 0.00 O ATOM 2239 CB LEU A 140 -4.744 9.002 12.550 1.00 0.00 C ATOM 2240 CG LEU A 140 -4.865 7.471 12.564 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -4.789 6.960 14.004 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -6.207 7.046 11.963 1.00 0.00 C ATOM 0 H LEU A 140 -2.514 8.243 11.840 1.00 0.00 H new ATOM 0 HA LEU A 140 -4.837 9.210 10.411 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -4.115 9.335 13.376 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -5.725 9.456 12.692 1.00 0.00 H new ATOM 0 HG LEU A 140 -4.049 7.051 11.976 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -4.875 5.873 14.010 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -3.835 7.250 14.443 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -5.603 7.392 14.587 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.284 5.959 11.977 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -7.020 7.475 12.549 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.274 7.401 10.935 1.00 0.00 H new ATOM 2254 N GLN A 141 -2.735 11.364 11.731 1.00 0.00 N ATOM 2255 CA GLN A 141 -2.375 12.816 11.804 1.00 0.00 C ATOM 2256 C GLN A 141 -1.943 13.335 10.432 1.00 0.00 C ATOM 2257 O GLN A 141 -2.436 14.334 9.948 1.00 0.00 O ATOM 2258 CB GLN A 141 -1.198 12.976 12.766 1.00 0.00 C ATOM 2259 CG GLN A 141 -1.687 13.484 14.118 1.00 0.00 C ATOM 2260 CD GLN A 141 -2.037 14.967 14.007 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -2.514 15.559 14.954 1.00 0.00 O ATOM 2262 NE2 GLN A 141 -1.818 15.597 12.885 1.00 0.00 N ATOM 0 H GLN A 141 -2.022 10.732 12.095 1.00 0.00 H new ATOM 0 HA GLN A 141 -3.245 13.379 12.143 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -0.689 12.020 12.891 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -0.471 13.673 12.349 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -2.561 12.916 14.438 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.916 13.337 14.875 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -1.417 15.099 12.090 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -2.048 16.587 12.803 1.00 0.00 H new ATOM 2271 N GLU A 142 -1.008 12.671 9.809 1.00 0.00 N ATOM 2272 CA GLU A 142 -0.533 13.139 8.480 1.00 0.00 C ATOM 2273 C GLU A 142 -1.682 13.068 7.471 1.00 0.00 C ATOM 2274 O GLU A 142 -1.804 13.907 6.601 1.00 0.00 O ATOM 2275 CB GLU A 142 0.621 12.253 8.002 1.00 0.00 C ATOM 2276 CG GLU A 142 1.784 12.326 8.995 1.00 0.00 C ATOM 2277 CD GLU A 142 2.302 13.763 9.070 1.00 0.00 C ATOM 2278 OE1 GLU A 142 2.029 14.518 8.151 1.00 0.00 O ATOM 2279 OE2 GLU A 142 2.964 14.083 10.041 1.00 0.00 O ATOM 0 H GLU A 142 -0.555 11.828 10.163 1.00 0.00 H new ATOM 0 HA GLU A 142 -0.186 14.169 8.565 1.00 0.00 H new ATOM 0 HB2 GLU A 142 0.281 11.222 7.902 1.00 0.00 H new ATOM 0 HB3 GLU A 142 0.954 12.576 7.015 1.00 0.00 H new ATOM 0 HG2 GLU A 142 1.456 11.995 9.980 1.00 0.00 H new ATOM 0 HG3 GLU A 142 2.585 11.655 8.683 1.00 0.00 H new ATOM 2287 N GLY A 143 -2.531 12.081 7.577 1.00 0.00 N ATOM 2288 CA GLY A 143 -3.665 11.987 6.617 1.00 0.00 C ATOM 2289 C GLY A 143 -4.540 13.228 6.768 1.00 0.00 C ATOM 2290 O GLY A 143 -4.861 13.901 5.808 1.00 0.00 O ATOM 0 H GLY A 143 -2.488 11.343 8.280 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.290 11.911 5.596 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.249 11.087 6.810 1.00 0.00 H new ATOM 2294 N HIS A 144 -4.916 13.547 7.974 1.00 0.00 N ATOM 2295 CA HIS A 144 -5.759 14.753 8.193 1.00 0.00 C ATOM 2296 C HIS A 144 -4.984 15.997 7.750 1.00 0.00 C ATOM 2297 O HIS A 144 -5.515 16.881 7.112 1.00 0.00 O ATOM 2298 CB HIS A 144 -6.091 14.876 9.680 1.00 0.00 C ATOM 2299 CG HIS A 144 -7.138 15.936 9.878 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -6.817 17.232 10.256 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -8.505 15.906 9.754 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -7.969 17.921 10.347 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -9.023 17.159 10.054 1.00 0.00 N ATOM 0 H HIS A 144 -4.676 13.025 8.817 1.00 0.00 H new ATOM 0 HA HIS A 144 -6.680 14.665 7.616 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -6.450 13.921 10.063 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -5.193 15.128 10.244 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -5.880 17.595 10.432 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -9.087 15.042 9.468 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -8.032 18.963 10.623 1.00 0.00 H new ATOM 2312 N GLN A 145 -3.727 16.068 8.101 1.00 0.00 N ATOM 2313 CA GLN A 145 -2.901 17.253 7.727 1.00 0.00 C ATOM 2314 C GLN A 145 -2.982 17.510 6.222 1.00 0.00 C ATOM 2315 O GLN A 145 -3.106 18.639 5.783 1.00 0.00 O ATOM 2316 CB GLN A 145 -1.441 16.990 8.104 1.00 0.00 C ATOM 2317 CG GLN A 145 -0.631 18.274 7.920 1.00 0.00 C ATOM 2318 CD GLN A 145 -1.009 19.277 9.013 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -0.715 19.069 10.172 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -1.657 20.367 8.692 1.00 0.00 N ATOM 0 H GLN A 145 -3.234 15.351 8.634 1.00 0.00 H new ATOM 0 HA GLN A 145 -3.281 18.125 8.260 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -1.376 16.651 9.138 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -1.030 16.195 7.481 1.00 0.00 H new ATOM 0 HG2 GLN A 145 0.435 18.054 7.967 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -0.825 18.701 6.936 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -1.906 20.545 7.719 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -1.914 21.039 9.415 1.00 0.00 H new ATOM 2329 N PHE A 146 -2.902 16.485 5.424 1.00 0.00 N ATOM 2330 CA PHE A 146 -2.966 16.684 3.948 1.00 0.00 C ATOM 2331 C PHE A 146 -4.399 16.983 3.495 1.00 0.00 C ATOM 2332 O PHE A 146 -4.640 17.921 2.760 1.00 0.00 O ATOM 2333 CB PHE A 146 -2.469 15.427 3.244 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.581 15.616 1.755 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.778 15.303 1.109 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.493 16.098 1.016 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -3.894 15.466 -0.274 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.607 16.263 -0.369 1.00 0.00 C ATOM 2339 CZ PHE A 146 -2.809 15.947 -1.016 1.00 0.00 C ATOM 0 H PHE A 146 -2.795 15.517 5.728 1.00 0.00 H new ATOM 0 HA PHE A 146 -2.335 17.534 3.689 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -1.434 15.226 3.520 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.056 14.564 3.558 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.617 14.934 1.680 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -0.567 16.342 1.515 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -4.821 15.221 -0.771 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.768 16.634 -0.939 1.00 0.00 H new ATOM 0 HZ PHE A 146 -2.898 16.074 -2.085 1.00 0.00 H new ATOM 2349 N LEU A 147 -5.352 16.184 3.905 1.00 0.00 N ATOM 2350 CA LEU A 147 -6.758 16.430 3.466 1.00 0.00 C ATOM 2351 C LEU A 147 -7.155 17.879 3.759 1.00 0.00 C ATOM 2352 O LEU A 147 -7.896 18.490 3.012 1.00 0.00 O ATOM 2353 CB LEU A 147 -7.703 15.473 4.197 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.367 14.032 3.819 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.343 13.086 4.509 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -7.502 13.845 2.308 1.00 0.00 C ATOM 0 H LEU A 147 -5.219 15.380 4.518 1.00 0.00 H new ATOM 0 HA LEU A 147 -6.830 16.255 2.393 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -7.611 15.608 5.275 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -8.737 15.697 3.935 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.345 13.816 4.130 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -8.104 12.057 4.240 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.264 13.206 5.589 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -9.360 13.317 4.192 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -7.261 12.815 2.046 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -8.525 14.067 2.004 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.817 14.520 1.795 1.00 0.00 H new ATOM 2368 N CYS A 148 -6.658 18.444 4.823 1.00 0.00 N ATOM 2369 CA CYS A 148 -6.991 19.864 5.141 1.00 0.00 C ATOM 2370 C CYS A 148 -6.260 20.766 4.143 1.00 0.00 C ATOM 2371 O CYS A 148 -6.528 21.945 4.037 1.00 0.00 O ATOM 2372 CB CYS A 148 -6.524 20.203 6.558 1.00 0.00 C ATOM 2373 SG CYS A 148 -7.565 19.344 7.766 1.00 0.00 S ATOM 0 H CYS A 148 -6.035 17.985 5.488 1.00 0.00 H new ATOM 0 HA CYS A 148 -8.069 20.015 5.075 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -5.482 19.910 6.688 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -6.575 21.280 6.720 1.00 0.00 H new ATOM 0 HG CYS A 148 -7.219 18.092 7.825 1.00 0.00 H new ATOM 2379 N SER A 149 -5.318 20.211 3.427 1.00 0.00 N ATOM 2380 CA SER A 149 -4.539 21.018 2.447 1.00 0.00 C ATOM 2381 C SER A 149 -5.209 21.003 1.072 1.00 0.00 C ATOM 2382 O SER A 149 -4.785 21.689 0.163 1.00 0.00 O ATOM 2383 CB SER A 149 -3.135 20.431 2.319 1.00 0.00 C ATOM 2384 OG SER A 149 -2.179 21.470 2.489 1.00 0.00 O ATOM 0 H SER A 149 -5.054 19.227 3.481 1.00 0.00 H new ATOM 0 HA SER A 149 -4.493 22.047 2.804 1.00 0.00 H new ATOM 0 HB2 SER A 149 -2.983 19.654 3.068 1.00 0.00 H new ATOM 0 HB3 SER A 149 -3.011 19.962 1.343 1.00 0.00 H new ATOM 0 HG SER A 149 -1.275 21.099 2.410 1.00 0.00 H new ATOM 2390 N ILE A 150 -6.241 20.225 0.898 1.00 0.00 N ATOM 2391 CA ILE A 150 -6.905 20.178 -0.431 1.00 0.00 C ATOM 2392 C ILE A 150 -7.947 21.295 -0.518 1.00 0.00 C ATOM 2393 O ILE A 150 -7.653 22.455 -0.299 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.587 18.813 -0.625 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.825 17.730 0.145 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -7.580 18.456 -2.110 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -7.609 16.418 0.077 1.00 0.00 C ATOM 0 H ILE A 150 -6.650 19.624 1.614 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.159 20.316 -1.214 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.610 18.871 -0.253 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.831 17.596 -0.281 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.689 18.033 1.183 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -8.062 17.489 -2.254 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -8.121 19.218 -2.670 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.551 18.405 -2.467 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -7.071 15.644 0.624 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -8.594 16.559 0.523 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -7.722 16.115 -0.964 1.00 0.00 H new