USER MOD reduce.3.24.130724 H: found=0, std=0, add=676, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 674 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 41 MET CE :methyl -134:sc= -0.137 (180deg=-0.894) USER MOD Set 1.2: A 116 CYS SG : rot 77:sc= 0.889 USER MOD Set 2.1: A 79 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 83 ASN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 33 SER OG : rot 180:sc= -0.935 USER MOD Single : A 37 LYS NZ :NH3+ -175:sc= -3.25! (180deg=-3.48!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 HIS : no HE2:sc= 1.02 K(o=1,f=-4.5!) USER MOD Single : A 48 LYS NZ :NH3+ -163:sc= 0.579! (180deg=-0.913!) USER MOD Single : A 49 HIS : no HE2:sc= -1.83! C(o=-1.8!,f=-2.7!) USER MOD Single : A 57 SER OG : rot -25:sc= 0.102 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot -48:sc= -6.16! USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0.42) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl -154:sc= -0.127 (180deg=-0.999) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN :FLIP amide:sc= -3.94 F(o=-5.5!,f=-3.9) USER MOD Single : A 98 HIS : no HE2:sc= 0.463! C(o=0.46!,f=-9.3!) USER MOD Single : A 105 THR OG1 : rot -32:sc= 0.0386 USER MOD Single : A 106 THR OG1 : rot -90:sc= -5.56! USER MOD Single : A 114 GLN : amide:sc= -0.236 X(o=-0.24,f=-0.33) USER MOD Single : A 120 LYS NZ :NH3+ -165:sc= 0.804 (180deg=0.358) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 128 GLN : amide:sc= -0.0452 K(o=-0.045,f=-2.6!) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 133 N SER A 33 0.261 -12.804 8.846 1.00 0.00 N ATOM 134 CA SER A 33 -0.355 -12.328 10.074 1.00 0.00 C ATOM 135 C SER A 33 -1.637 -13.096 10.361 1.00 0.00 C ATOM 136 O SER A 33 -1.715 -13.844 11.336 1.00 0.00 O ATOM 137 CB SER A 33 -0.666 -10.830 9.955 1.00 0.00 C ATOM 138 OG SER A 33 -0.525 -10.219 11.231 1.00 0.00 O ATOM 0 HA SER A 33 0.342 -12.490 10.896 1.00 0.00 H new ATOM 0 HB2 SER A 33 0.009 -10.362 9.238 1.00 0.00 H new ATOM 0 HB3 SER A 33 -1.679 -10.686 9.580 1.00 0.00 H new ATOM 0 HG SER A 33 -0.721 -9.262 11.159 1.00 0.00 H new ATOM 144 N LEU A 34 -2.650 -12.887 9.526 1.00 0.00 N ATOM 145 CA LEU A 34 -3.937 -13.549 9.722 1.00 0.00 C ATOM 146 C LEU A 34 -3.735 -14.975 10.206 1.00 0.00 C ATOM 147 O LEU A 34 -4.459 -15.450 11.081 1.00 0.00 O ATOM 148 CB LEU A 34 -4.721 -13.554 8.409 1.00 0.00 C ATOM 149 CG LEU A 34 -6.062 -14.263 8.614 1.00 0.00 C ATOM 150 CD1 LEU A 34 -6.854 -13.558 9.719 1.00 0.00 C ATOM 151 CD2 LEU A 34 -6.862 -14.227 7.311 1.00 0.00 C ATOM 0 H LEU A 34 -2.607 -12.271 8.714 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.499 -13.001 10.478 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.887 -12.532 8.069 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.146 -14.059 7.633 1.00 0.00 H new ATOM 0 HG LEU A 34 -5.883 -15.299 8.903 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -7.808 -14.065 9.863 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -6.285 -13.585 10.648 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -7.033 -12.521 9.433 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.817 -14.732 7.456 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.039 -13.191 7.021 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.300 -14.732 6.525 1.00 0.00 H new ATOM 163 N GLU A 35 -2.752 -15.655 9.632 1.00 0.00 N ATOM 164 CA GLU A 35 -2.470 -17.033 10.012 1.00 0.00 C ATOM 165 C GLU A 35 -1.970 -17.097 11.454 1.00 0.00 C ATOM 166 O GLU A 35 -2.395 -17.953 12.230 1.00 0.00 O ATOM 167 CB GLU A 35 -1.413 -17.623 9.078 1.00 0.00 C ATOM 168 CG GLU A 35 -1.408 -19.143 9.209 1.00 0.00 C ATOM 169 CD GLU A 35 -0.310 -19.742 8.334 1.00 0.00 C ATOM 170 OE1 GLU A 35 -0.331 -20.945 8.130 1.00 0.00 O ATOM 171 OE2 GLU A 35 0.535 -18.988 7.883 1.00 0.00 O ATOM 0 H GLU A 35 -2.141 -15.279 8.907 1.00 0.00 H new ATOM 0 HA GLU A 35 -3.391 -17.611 9.931 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -1.623 -17.337 8.047 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -0.430 -17.223 9.326 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -1.249 -19.425 10.250 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -2.378 -19.544 8.915 1.00 0.00 H new ATOM 178 N GLU A 36 -1.068 -16.186 11.805 1.00 0.00 N ATOM 179 CA GLU A 36 -0.520 -16.148 13.158 1.00 0.00 C ATOM 180 C GLU A 36 -1.608 -15.812 14.169 1.00 0.00 C ATOM 181 O GLU A 36 -1.675 -16.408 15.245 1.00 0.00 O ATOM 182 CB GLU A 36 0.594 -15.103 13.241 1.00 0.00 C ATOM 183 CG GLU A 36 1.781 -15.549 12.385 1.00 0.00 C ATOM 184 CD GLU A 36 2.381 -16.830 12.953 1.00 0.00 C ATOM 185 OE1 GLU A 36 2.158 -17.097 14.122 1.00 0.00 O ATOM 186 OE2 GLU A 36 3.058 -17.524 12.211 1.00 0.00 O ATOM 0 H GLU A 36 -0.703 -15.469 11.178 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.115 -17.132 13.392 1.00 0.00 H new ATOM 0 HB2 GLU A 36 0.226 -14.137 12.896 1.00 0.00 H new ATOM 0 HB3 GLU A 36 0.908 -14.973 14.277 1.00 0.00 H new ATOM 0 HG2 GLU A 36 1.457 -15.714 11.357 1.00 0.00 H new ATOM 0 HG3 GLU A 36 2.537 -14.764 12.359 1.00 0.00 H new ATOM 193 N LYS A 37 -2.466 -14.859 13.819 1.00 0.00 N ATOM 194 CA LYS A 37 -3.549 -14.459 14.712 1.00 0.00 C ATOM 195 C LYS A 37 -4.410 -15.658 15.082 1.00 0.00 C ATOM 196 O LYS A 37 -4.719 -15.870 16.255 1.00 0.00 O ATOM 197 CB LYS A 37 -4.418 -13.398 14.025 1.00 0.00 C ATOM 198 CG LYS A 37 -3.845 -12.006 14.294 1.00 0.00 C ATOM 199 CD LYS A 37 -4.342 -11.035 13.219 1.00 0.00 C ATOM 200 CE LYS A 37 -3.424 -11.123 12.005 1.00 0.00 C ATOM 201 NZ LYS A 37 -4.181 -10.733 10.776 1.00 0.00 N ATOM 0 H LYS A 37 -2.434 -14.354 12.933 1.00 0.00 H new ATOM 0 HA LYS A 37 -3.114 -14.046 15.622 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -4.456 -13.585 12.952 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.442 -13.458 14.395 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -4.150 -11.660 15.282 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -2.756 -12.042 14.291 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -5.365 -11.280 12.935 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -4.354 -10.017 13.608 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -2.564 -10.467 12.138 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.038 -12.137 11.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -3.580 -10.874 9.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -5.035 -11.321 10.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -4.455 -9.732 10.840 1.00 0.00 H new ATOM 215 N ILE A 38 -4.795 -16.440 14.082 1.00 0.00 N ATOM 216 CA ILE A 38 -5.618 -17.619 14.322 1.00 0.00 C ATOM 217 C ILE A 38 -4.866 -18.632 15.178 1.00 0.00 C ATOM 218 O ILE A 38 -5.424 -19.208 16.110 1.00 0.00 O ATOM 219 CB ILE A 38 -6.008 -18.260 12.989 1.00 0.00 C ATOM 220 CG1 ILE A 38 -6.934 -17.315 12.222 1.00 0.00 C ATOM 221 CG2 ILE A 38 -6.740 -19.578 13.253 1.00 0.00 C ATOM 222 CD1 ILE A 38 -7.109 -17.824 10.789 1.00 0.00 C ATOM 0 H ILE A 38 -4.553 -16.282 13.104 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.518 -17.311 14.854 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.110 -18.451 12.401 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.902 -17.255 12.719 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.517 -16.308 12.213 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.019 -20.036 12.304 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.086 -20.254 13.804 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.638 -19.384 13.840 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.769 -17.151 10.242 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.138 -17.861 10.295 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.545 -18.823 10.808 1.00 0.00 H new ATOM 234 N LYS A 39 -3.595 -18.844 14.855 1.00 0.00 N ATOM 235 CA LYS A 39 -2.776 -19.795 15.600 1.00 0.00 C ATOM 236 C LYS A 39 -2.665 -19.369 17.059 1.00 0.00 C ATOM 237 O LYS A 39 -2.705 -20.205 17.963 1.00 0.00 O ATOM 238 CB LYS A 39 -1.379 -19.872 14.981 1.00 0.00 C ATOM 239 CG LYS A 39 -1.467 -20.547 13.611 1.00 0.00 C ATOM 240 CD LYS A 39 -0.129 -20.400 12.876 1.00 0.00 C ATOM 241 CE LYS A 39 0.853 -21.463 13.350 1.00 0.00 C ATOM 242 NZ LYS A 39 1.949 -21.610 12.357 1.00 0.00 N ATOM 0 H LYS A 39 -3.112 -18.375 14.089 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.249 -20.776 15.553 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -0.959 -18.872 14.879 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -0.711 -20.434 15.633 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.714 -21.602 13.730 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -2.267 -20.097 13.024 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -0.285 -20.492 11.801 1.00 0.00 H new ATOM 0 HD3 LYS A 39 0.285 -19.407 13.054 1.00 0.00 H new ATOM 0 HE2 LYS A 39 1.264 -21.186 14.321 1.00 0.00 H new ATOM 0 HE3 LYS A 39 0.338 -22.415 13.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 2.618 -22.336 12.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 1.550 -21.894 11.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 2.447 -20.703 12.253 1.00 0.00 H new ATOM 256 N LEU A 40 -2.525 -18.066 17.283 1.00 0.00 N ATOM 257 CA LEU A 40 -2.412 -17.547 18.641 1.00 0.00 C ATOM 258 C LEU A 40 -3.722 -17.732 19.403 1.00 0.00 C ATOM 259 O LEU A 40 -3.730 -18.218 20.535 1.00 0.00 O ATOM 260 CB LEU A 40 -2.050 -16.060 18.600 1.00 0.00 C ATOM 261 CG LEU A 40 -1.961 -15.514 20.027 1.00 0.00 C ATOM 262 CD1 LEU A 40 -0.926 -16.317 20.819 1.00 0.00 C ATOM 263 CD2 LEU A 40 -1.541 -14.044 19.984 1.00 0.00 C ATOM 0 H LEU A 40 -2.487 -17.357 16.550 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.628 -18.102 19.156 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.099 -15.921 18.087 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.801 -15.508 18.035 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.934 -15.601 20.510 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.863 -15.928 21.835 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.224 -17.365 20.850 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.048 -16.231 20.337 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.477 -13.654 21.000 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.568 -13.958 19.500 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.278 -13.471 19.421 1.00 0.00 H new ATOM 275 N MET A 41 -4.824 -17.339 18.775 1.00 0.00 N ATOM 276 CA MET A 41 -6.137 -17.462 19.398 1.00 0.00 C ATOM 277 C MET A 41 -6.510 -18.928 19.564 1.00 0.00 C ATOM 278 O MET A 41 -7.230 -19.297 20.493 1.00 0.00 O ATOM 279 CB MET A 41 -7.188 -16.750 18.548 1.00 0.00 C ATOM 280 CG MET A 41 -6.904 -15.246 18.530 1.00 0.00 C ATOM 281 SD MET A 41 -7.048 -14.578 20.206 1.00 0.00 S ATOM 282 CE MET A 41 -8.848 -14.704 20.347 1.00 0.00 C ATOM 0 H MET A 41 -4.835 -16.934 17.839 1.00 0.00 H new ATOM 0 HA MET A 41 -6.100 -16.997 20.383 1.00 0.00 H new ATOM 0 HB2 MET A 41 -7.176 -17.144 17.532 1.00 0.00 H new ATOM 0 HB3 MET A 41 -8.183 -16.937 18.951 1.00 0.00 H new ATOM 0 HG2 MET A 41 -5.904 -15.060 18.139 1.00 0.00 H new ATOM 0 HG3 MET A 41 -7.606 -14.742 17.866 1.00 0.00 H new ATOM 0 HE1 MET A 41 -9.247 -13.776 20.757 1.00 0.00 H new ATOM 0 HE2 MET A 41 -9.279 -14.880 19.361 1.00 0.00 H new ATOM 0 HE3 MET A 41 -9.104 -15.532 21.008 1.00 0.00 H new ATOM 292 N ARG A 42 -6.021 -19.762 18.655 1.00 0.00 N ATOM 293 CA ARG A 42 -6.313 -21.187 18.710 1.00 0.00 C ATOM 294 C ARG A 42 -5.709 -21.813 19.958 1.00 0.00 C ATOM 295 O ARG A 42 -6.101 -22.908 20.366 1.00 0.00 O ATOM 296 CB ARG A 42 -5.761 -21.891 17.461 1.00 0.00 C ATOM 297 CG ARG A 42 -6.829 -21.929 16.362 1.00 0.00 C ATOM 298 CD ARG A 42 -6.534 -23.081 15.410 1.00 0.00 C ATOM 299 NE ARG A 42 -5.221 -22.915 14.793 1.00 0.00 N ATOM 300 CZ ARG A 42 -5.092 -22.601 13.509 1.00 0.00 C ATOM 301 NH1 ARG A 42 -3.904 -22.459 12.986 1.00 0.00 N ATOM 302 NH2 ARG A 42 -6.154 -22.435 12.768 1.00 0.00 N ATOM 0 H ARG A 42 -5.425 -19.479 17.877 1.00 0.00 H new ATOM 0 HA ARG A 42 -7.395 -21.311 18.744 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -4.876 -21.367 17.100 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -5.451 -22.905 17.713 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -7.818 -22.052 16.804 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.839 -20.985 15.817 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -6.570 -24.026 15.952 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -7.302 -23.127 14.637 1.00 0.00 H new ATOM 0 HE ARG A 42 -4.384 -23.043 15.361 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -3.074 -22.589 13.564 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -3.806 -22.218 12.000 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.083 -22.546 13.175 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -6.055 -22.194 11.782 1.00 0.00 H new ATOM 316 N LEU A 43 -4.758 -21.114 20.560 1.00 0.00 N ATOM 317 CA LEU A 43 -4.109 -21.606 21.767 1.00 0.00 C ATOM 318 C LEU A 43 -4.779 -21.036 23.011 1.00 0.00 C ATOM 319 O LEU A 43 -4.912 -21.722 24.026 1.00 0.00 O ATOM 320 CB LEU A 43 -2.626 -21.230 21.757 1.00 0.00 C ATOM 321 CG LEU A 43 -1.835 -22.277 20.969 1.00 0.00 C ATOM 322 CD1 LEU A 43 -0.376 -21.833 20.859 1.00 0.00 C ATOM 323 CD2 LEU A 43 -1.903 -23.632 21.693 1.00 0.00 C ATOM 0 H LEU A 43 -4.420 -20.208 20.235 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.204 -22.692 21.789 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.493 -20.246 21.308 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.249 -21.168 22.778 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.264 -22.379 19.972 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.189 -22.577 20.298 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.325 -20.874 20.343 1.00 0.00 H new ATOM 0 HD13 LEU A 43 0.049 -21.731 21.857 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.339 -24.375 21.129 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.476 -23.533 22.691 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.942 -23.950 21.773 1.00 0.00 H new ATOM 335 N VAL A 44 -5.185 -19.775 22.929 1.00 0.00 N ATOM 336 CA VAL A 44 -5.831 -19.120 24.059 1.00 0.00 C ATOM 337 C VAL A 44 -7.144 -19.819 24.399 1.00 0.00 C ATOM 338 O VAL A 44 -7.430 -20.088 25.565 1.00 0.00 O ATOM 339 CB VAL A 44 -6.100 -17.651 23.725 1.00 0.00 C ATOM 340 CG1 VAL A 44 -6.730 -16.948 24.935 1.00 0.00 C ATOM 341 CG2 VAL A 44 -4.781 -16.960 23.364 1.00 0.00 C ATOM 0 H VAL A 44 -5.080 -19.190 22.100 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.167 -19.179 24.922 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.786 -17.595 22.880 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -6.919 -15.903 24.691 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -7.670 -17.437 25.191 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -6.049 -17.005 25.784 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.972 -15.914 23.126 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.095 -17.021 24.209 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.336 -17.453 22.500 1.00 0.00 H new ATOM 351 N VAL A 45 -7.939 -20.103 23.375 1.00 0.00 N ATOM 352 CA VAL A 45 -9.221 -20.766 23.575 1.00 0.00 C ATOM 353 C VAL A 45 -9.012 -22.173 24.121 1.00 0.00 C ATOM 354 O VAL A 45 -9.741 -22.624 25.003 1.00 0.00 O ATOM 355 CB VAL A 45 -9.992 -20.830 22.258 1.00 0.00 C ATOM 356 CG1 VAL A 45 -11.217 -21.728 22.425 1.00 0.00 C ATOM 357 CG2 VAL A 45 -10.447 -19.420 21.868 1.00 0.00 C ATOM 0 H VAL A 45 -7.720 -19.886 22.403 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.799 -20.190 24.298 1.00 0.00 H new ATOM 0 HB VAL A 45 -9.347 -21.237 21.479 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -11.766 -21.773 21.485 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -10.897 -22.731 22.706 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -11.863 -21.321 23.203 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -10.998 -19.462 20.928 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -11.092 -19.017 22.649 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.575 -18.776 21.749 1.00 0.00 H new ATOM 367 N ARG A 46 -8.016 -22.866 23.582 1.00 0.00 N ATOM 368 CA ARG A 46 -7.723 -24.227 24.013 1.00 0.00 C ATOM 369 C ARG A 46 -7.234 -24.234 25.458 1.00 0.00 C ATOM 370 O ARG A 46 -7.174 -25.283 26.098 1.00 0.00 O ATOM 371 CB ARG A 46 -6.655 -24.846 23.108 1.00 0.00 C ATOM 372 CG ARG A 46 -6.683 -26.370 23.250 1.00 0.00 C ATOM 373 CD ARG A 46 -7.700 -26.957 22.269 1.00 0.00 C ATOM 374 NE ARG A 46 -7.785 -28.403 22.435 1.00 0.00 N ATOM 375 CZ ARG A 46 -8.515 -29.148 21.611 1.00 0.00 C ATOM 376 NH1 ARG A 46 -8.575 -30.440 21.780 1.00 0.00 N ATOM 377 NH2 ARG A 46 -9.171 -28.586 20.634 1.00 0.00 N ATOM 0 H ARG A 46 -7.401 -22.510 22.850 1.00 0.00 H new ATOM 0 HA ARG A 46 -8.638 -24.815 23.946 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -6.835 -24.564 22.071 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -5.670 -24.464 23.376 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -5.693 -26.782 23.054 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -6.946 -26.646 24.271 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.678 -26.507 22.436 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -7.409 -26.718 21.246 1.00 0.00 H new ATOM 0 HE ARG A 46 -7.275 -28.851 23.197 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -8.062 -30.879 22.545 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -9.135 -31.012 21.148 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -9.124 -27.576 20.503 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -9.731 -29.157 20.001 1.00 0.00 H new ATOM 391 N HIS A 47 -6.882 -23.057 25.964 1.00 0.00 N ATOM 392 CA HIS A 47 -6.397 -22.939 27.337 1.00 0.00 C ATOM 393 C HIS A 47 -7.159 -21.847 28.082 1.00 0.00 C ATOM 394 O HIS A 47 -6.623 -21.213 28.990 1.00 0.00 O ATOM 395 CB HIS A 47 -4.903 -22.614 27.335 1.00 0.00 C ATOM 396 CG HIS A 47 -4.144 -23.747 26.701 1.00 0.00 C ATOM 397 ND1 HIS A 47 -3.791 -23.740 25.360 1.00 0.00 N ATOM 398 CD2 HIS A 47 -3.664 -24.929 27.209 1.00 0.00 C ATOM 399 CE1 HIS A 47 -3.128 -24.884 25.110 1.00 0.00 C ATOM 400 NE2 HIS A 47 -3.023 -25.646 26.202 1.00 0.00 N ATOM 0 H HIS A 47 -6.922 -22.177 25.450 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.560 -23.889 27.845 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -4.722 -21.689 26.787 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -4.553 -22.454 28.355 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -3.996 -23.002 24.686 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.768 -25.253 28.234 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.729 -25.153 24.143 1.00 0.00 H new ATOM 407 N LYS A 48 -8.411 -21.633 27.693 1.00 0.00 N ATOM 408 CA LYS A 48 -9.236 -20.614 28.333 1.00 0.00 C ATOM 409 C LYS A 48 -9.619 -21.043 29.746 1.00 0.00 C ATOM 410 O LYS A 48 -9.825 -20.207 30.624 1.00 0.00 O ATOM 411 CB LYS A 48 -10.501 -20.374 27.508 1.00 0.00 C ATOM 412 CG LYS A 48 -11.333 -21.656 27.460 1.00 0.00 C ATOM 413 CD LYS A 48 -12.554 -21.440 26.565 1.00 0.00 C ATOM 414 CE LYS A 48 -13.379 -22.727 26.506 1.00 0.00 C ATOM 415 NZ LYS A 48 -14.568 -22.516 25.632 1.00 0.00 N ATOM 0 H LYS A 48 -8.874 -22.147 26.944 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.660 -19.690 28.391 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.086 -19.565 27.947 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.235 -20.063 26.498 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -10.730 -22.479 27.077 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.650 -21.934 28.465 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.162 -20.623 26.953 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.237 -21.153 25.563 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -12.770 -23.544 26.119 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -13.697 -23.014 27.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.268 -23.264 25.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.991 -21.589 25.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -14.276 -22.548 24.634 1.00 0.00 H new ATOM 429 N HIS A 49 -9.715 -22.353 29.954 1.00 0.00 N ATOM 430 CA HIS A 49 -10.075 -22.883 31.264 1.00 0.00 C ATOM 431 C HIS A 49 -8.965 -22.620 32.275 1.00 0.00 C ATOM 432 O HIS A 49 -9.232 -22.277 33.427 1.00 0.00 O ATOM 433 CB HIS A 49 -10.331 -24.389 31.164 1.00 0.00 C ATOM 434 CG HIS A 49 -11.574 -24.637 30.347 1.00 0.00 C ATOM 435 ND1 HIS A 49 -11.814 -25.847 29.717 1.00 0.00 N ATOM 436 CD2 HIS A 49 -12.650 -23.839 30.048 1.00 0.00 C ATOM 437 CE1 HIS A 49 -12.992 -25.744 29.076 1.00 0.00 C ATOM 438 NE2 HIS A 49 -13.544 -24.540 29.245 1.00 0.00 N ATOM 0 H HIS A 49 -9.550 -23.061 29.239 1.00 0.00 H new ATOM 0 HA HIS A 49 -10.982 -22.380 31.601 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -9.476 -24.884 30.703 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -10.447 -24.815 32.160 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -11.208 -26.667 29.736 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -12.782 -22.821 30.385 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -13.437 -26.538 28.495 1.00 0.00 H new ATOM 445 N GLU A 50 -7.722 -22.788 31.838 1.00 0.00 N ATOM 446 CA GLU A 50 -6.580 -22.572 32.717 1.00 0.00 C ATOM 447 C GLU A 50 -6.599 -21.160 33.290 1.00 0.00 C ATOM 448 O GLU A 50 -6.651 -20.179 32.547 1.00 0.00 O ATOM 449 CB GLU A 50 -5.277 -22.796 31.947 1.00 0.00 C ATOM 450 CG GLU A 50 -5.132 -24.281 31.605 1.00 0.00 C ATOM 451 CD GLU A 50 -3.864 -24.506 30.789 1.00 0.00 C ATOM 452 OE1 GLU A 50 -3.194 -23.532 30.491 1.00 0.00 O ATOM 453 OE2 GLU A 50 -3.581 -25.651 30.476 1.00 0.00 O ATOM 0 H GLU A 50 -7.481 -23.071 30.888 1.00 0.00 H new ATOM 0 HA GLU A 50 -6.643 -23.284 33.540 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.275 -22.200 31.034 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.428 -22.465 32.545 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -5.095 -24.872 32.520 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -6.002 -24.620 31.042 1.00 0.00 H new ATOM 567 N SER A 57 -0.755 -13.135 35.312 1.00 0.00 N ATOM 568 CA SER A 57 0.133 -13.246 34.161 1.00 0.00 C ATOM 569 C SER A 57 0.458 -14.708 33.873 1.00 0.00 C ATOM 570 O SER A 57 0.718 -15.085 32.730 1.00 0.00 O ATOM 571 CB SER A 57 1.424 -12.476 34.424 1.00 0.00 C ATOM 572 OG SER A 57 2.061 -13.001 35.581 1.00 0.00 O ATOM 0 HA SER A 57 -0.372 -12.822 33.293 1.00 0.00 H new ATOM 0 HB2 SER A 57 2.088 -12.554 33.563 1.00 0.00 H new ATOM 0 HB3 SER A 57 1.206 -11.417 34.564 1.00 0.00 H new ATOM 0 HG SER A 57 1.393 -13.428 36.157 1.00 0.00 H new ATOM 578 N GLU A 58 0.447 -15.524 34.921 1.00 0.00 N ATOM 579 CA GLU A 58 0.742 -16.943 34.774 1.00 0.00 C ATOM 580 C GLU A 58 0.054 -17.506 33.537 1.00 0.00 C ATOM 581 O GLU A 58 0.506 -18.491 32.962 1.00 0.00 O ATOM 582 CB GLU A 58 0.269 -17.703 36.015 1.00 0.00 C ATOM 583 CG GLU A 58 0.705 -19.165 35.918 1.00 0.00 C ATOM 584 CD GLU A 58 0.358 -19.899 37.208 1.00 0.00 C ATOM 585 OE1 GLU A 58 -0.344 -19.323 38.022 1.00 0.00 O ATOM 586 OE2 GLU A 58 0.799 -21.025 37.363 1.00 0.00 O ATOM 0 H GLU A 58 0.238 -15.229 35.875 1.00 0.00 H new ATOM 0 HA GLU A 58 1.820 -17.064 34.662 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.686 -17.248 36.913 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.816 -17.641 36.100 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.212 -19.645 35.073 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.778 -19.222 35.735 1.00 0.00 H new ATOM 593 N PHE A 59 -1.040 -16.873 33.132 1.00 0.00 N ATOM 594 CA PHE A 59 -1.781 -17.323 31.959 1.00 0.00 C ATOM 595 C PHE A 59 -1.094 -16.859 30.679 1.00 0.00 C ATOM 596 O PHE A 59 -0.581 -17.670 29.908 1.00 0.00 O ATOM 597 CB PHE A 59 -3.209 -16.775 32.003 1.00 0.00 C ATOM 598 CG PHE A 59 -3.913 -17.102 30.709 1.00 0.00 C ATOM 599 CD1 PHE A 59 -4.079 -18.437 30.321 1.00 0.00 C ATOM 600 CD2 PHE A 59 -4.404 -16.072 29.898 1.00 0.00 C ATOM 601 CE1 PHE A 59 -4.734 -18.742 29.122 1.00 0.00 C ATOM 602 CE2 PHE A 59 -5.059 -16.376 28.698 1.00 0.00 C ATOM 603 CZ PHE A 59 -5.224 -17.712 28.310 1.00 0.00 C ATOM 0 H PHE A 59 -1.432 -16.052 33.594 1.00 0.00 H new ATOM 0 HA PHE A 59 -1.809 -18.413 31.966 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -3.751 -17.209 32.844 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.191 -15.696 32.157 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.701 -19.232 30.947 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -4.278 -15.042 30.198 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.861 -19.772 28.823 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.437 -15.581 28.072 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.729 -17.947 27.385 1.00 0.00 H new ATOM 613 N TYR A 60 -1.092 -15.550 30.457 1.00 0.00 N ATOM 614 CA TYR A 60 -0.473 -14.988 29.266 1.00 0.00 C ATOM 615 C TYR A 60 0.994 -15.406 29.179 1.00 0.00 C ATOM 616 O TYR A 60 1.552 -15.532 28.089 1.00 0.00 O ATOM 617 CB TYR A 60 -0.571 -13.466 29.304 1.00 0.00 C ATOM 618 CG TYR A 60 -2.008 -13.048 29.469 1.00 0.00 C ATOM 619 CD1 TYR A 60 -2.493 -12.714 30.738 1.00 0.00 C ATOM 620 CD2 TYR A 60 -2.859 -13.000 28.358 1.00 0.00 C ATOM 621 CE1 TYR A 60 -3.830 -12.330 30.897 1.00 0.00 C ATOM 622 CE2 TYR A 60 -4.196 -12.617 28.517 1.00 0.00 C ATOM 623 CZ TYR A 60 -4.682 -12.282 29.787 1.00 0.00 C ATOM 624 OH TYR A 60 -5.997 -11.903 29.943 1.00 0.00 O ATOM 0 H TYR A 60 -1.510 -14.862 31.083 1.00 0.00 H new ATOM 0 HA TYR A 60 -0.998 -15.365 28.388 1.00 0.00 H new ATOM 0 HB2 TYR A 60 0.027 -13.075 30.127 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -0.164 -13.044 28.385 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -1.836 -12.752 31.595 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -2.484 -13.258 27.379 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -4.204 -12.071 31.876 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -4.853 -12.580 27.660 1.00 0.00 H new ATOM 0 HH TYR A 60 -6.448 -11.922 29.073 1.00 0.00 H new ATOM 634 N ALA A 61 1.612 -15.619 30.337 1.00 0.00 N ATOM 635 CA ALA A 61 3.012 -16.027 30.383 1.00 0.00 C ATOM 636 C ALA A 61 3.178 -17.443 29.839 1.00 0.00 C ATOM 637 O ALA A 61 4.272 -17.839 29.434 1.00 0.00 O ATOM 638 CB ALA A 61 3.527 -15.968 31.822 1.00 0.00 C ATOM 0 H ALA A 61 1.169 -15.517 31.250 1.00 0.00 H new ATOM 0 HA ALA A 61 3.589 -15.342 29.762 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.573 -16.274 31.847 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.438 -14.949 32.199 1.00 0.00 H new ATOM 0 HB3 ALA A 61 2.938 -16.639 32.447 1.00 0.00 H new ATOM 644 N LYS A 62 2.087 -18.199 29.829 1.00 0.00 N ATOM 645 CA LYS A 62 2.123 -19.567 29.328 1.00 0.00 C ATOM 646 C LYS A 62 1.776 -19.608 27.847 1.00 0.00 C ATOM 647 O LYS A 62 2.318 -20.419 27.096 1.00 0.00 O ATOM 648 CB LYS A 62 1.142 -20.443 30.113 1.00 0.00 C ATOM 649 CG LYS A 62 1.798 -20.925 31.411 1.00 0.00 C ATOM 650 CD LYS A 62 0.968 -22.060 32.011 1.00 0.00 C ATOM 651 CE LYS A 62 -0.381 -21.521 32.482 1.00 0.00 C ATOM 652 NZ LYS A 62 -1.081 -22.564 33.282 1.00 0.00 N ATOM 0 H LYS A 62 1.173 -17.891 30.160 1.00 0.00 H new ATOM 0 HA LYS A 62 3.134 -19.952 29.460 1.00 0.00 H new ATOM 0 HB2 LYS A 62 0.238 -19.878 30.340 1.00 0.00 H new ATOM 0 HB3 LYS A 62 0.840 -21.298 29.508 1.00 0.00 H new ATOM 0 HG2 LYS A 62 2.813 -21.268 31.212 1.00 0.00 H new ATOM 0 HG3 LYS A 62 1.874 -20.101 32.121 1.00 0.00 H new ATOM 0 HD2 LYS A 62 0.818 -22.844 31.269 1.00 0.00 H new ATOM 0 HD3 LYS A 62 1.502 -22.511 32.848 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -0.236 -20.623 33.083 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -0.990 -21.236 31.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -2.000 -22.197 33.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -1.232 -23.409 32.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -0.501 -22.815 34.108 1.00 0.00 H new ATOM 666 N ILE A 63 0.863 -18.736 27.434 1.00 0.00 N ATOM 667 CA ILE A 63 0.447 -18.693 26.037 1.00 0.00 C ATOM 668 C ILE A 63 1.621 -18.322 25.139 1.00 0.00 C ATOM 669 O ILE A 63 1.861 -18.970 24.120 1.00 0.00 O ATOM 670 CB ILE A 63 -0.670 -17.660 25.863 1.00 0.00 C ATOM 671 CG1 ILE A 63 -1.901 -18.100 26.661 1.00 0.00 C ATOM 672 CG2 ILE A 63 -1.038 -17.547 24.382 1.00 0.00 C ATOM 673 CD1 ILE A 63 -2.365 -19.483 26.191 1.00 0.00 C ATOM 0 H ILE A 63 0.401 -18.057 28.039 1.00 0.00 H new ATOM 0 HA ILE A 63 0.084 -19.681 25.753 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.327 -16.691 26.226 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.664 -18.129 27.724 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -2.705 -17.375 26.534 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.833 -16.811 24.260 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.163 -17.234 23.813 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.380 -18.515 24.017 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.241 -19.787 26.764 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.621 -19.441 25.132 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -1.564 -20.206 26.342 1.00 0.00 H new ATOM 685 N ALA A 64 2.352 -17.286 25.526 1.00 0.00 N ATOM 686 CA ALA A 64 3.505 -16.847 24.746 1.00 0.00 C ATOM 687 C ALA A 64 4.608 -17.896 24.781 1.00 0.00 C ATOM 688 O ALA A 64 5.534 -17.863 23.972 1.00 0.00 O ATOM 689 CB ALA A 64 4.034 -15.521 25.301 1.00 0.00 C ATOM 0 H ALA A 64 2.171 -16.737 26.367 1.00 0.00 H new ATOM 0 HA ALA A 64 3.190 -16.708 23.712 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.894 -15.199 24.715 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.252 -14.764 25.243 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.333 -15.655 26.341 1.00 0.00 H new ATOM 695 N ARG A 65 4.507 -18.820 25.730 1.00 0.00 N ATOM 696 CA ARG A 65 5.506 -19.872 25.864 1.00 0.00 C ATOM 697 C ARG A 65 5.219 -21.011 24.891 1.00 0.00 C ATOM 698 O ARG A 65 6.119 -21.503 24.212 1.00 0.00 O ATOM 699 CB ARG A 65 5.512 -20.407 27.296 1.00 0.00 C ATOM 700 CG ARG A 65 6.622 -21.450 27.447 1.00 0.00 C ATOM 701 CD ARG A 65 6.613 -22.003 28.872 1.00 0.00 C ATOM 702 NE ARG A 65 7.009 -20.966 29.819 1.00 0.00 N ATOM 703 CZ ARG A 65 7.057 -21.210 31.124 1.00 0.00 C ATOM 704 NH1 ARG A 65 7.414 -20.266 31.951 1.00 0.00 N ATOM 705 NH2 ARG A 65 6.745 -22.393 31.580 1.00 0.00 N ATOM 0 H ARG A 65 3.750 -18.862 26.412 1.00 0.00 H new ATOM 0 HA ARG A 65 6.484 -19.451 25.631 1.00 0.00 H new ATOM 0 HB2 ARG A 65 5.668 -19.590 28.000 1.00 0.00 H new ATOM 0 HB3 ARG A 65 4.546 -20.852 27.533 1.00 0.00 H new ATOM 0 HG2 ARG A 65 6.475 -22.259 26.731 1.00 0.00 H new ATOM 0 HG3 ARG A 65 7.590 -21.001 27.226 1.00 0.00 H new ATOM 0 HD2 ARG A 65 5.618 -22.371 29.120 1.00 0.00 H new ATOM 0 HD3 ARG A 65 7.294 -22.851 28.945 1.00 0.00 H new ATOM 0 HE ARG A 65 7.253 -20.038 29.473 1.00 0.00 H new ATOM 0 HH11 ARG A 65 7.656 -19.341 31.595 1.00 0.00 H new ATOM 0 HH12 ARG A 65 7.451 -20.453 32.953 1.00 0.00 H new ATOM 0 HH21 ARG A 65 6.464 -23.131 30.934 1.00 0.00 H new ATOM 0 HH22 ARG A 65 6.782 -22.579 32.582 1.00 0.00 H new ATOM 719 N ILE A 66 3.958 -21.423 24.829 1.00 0.00 N ATOM 720 CA ILE A 66 3.558 -22.504 23.938 1.00 0.00 C ATOM 721 C ILE A 66 3.324 -21.974 22.527 1.00 0.00 C ATOM 722 O ILE A 66 3.325 -22.732 21.564 1.00 0.00 O ATOM 723 CB ILE A 66 2.284 -23.170 24.458 1.00 0.00 C ATOM 724 CG1 ILE A 66 2.580 -23.860 25.792 1.00 0.00 C ATOM 725 CG2 ILE A 66 1.800 -24.209 23.444 1.00 0.00 C ATOM 726 CD1 ILE A 66 1.265 -24.294 26.444 1.00 0.00 C ATOM 0 H ILE A 66 3.199 -21.027 25.383 1.00 0.00 H new ATOM 0 HA ILE A 66 4.361 -23.241 23.908 1.00 0.00 H new ATOM 0 HB ILE A 66 1.511 -22.415 24.601 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.222 -24.726 25.631 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.120 -23.182 26.453 1.00 0.00 H new ATOM 0 HG21 ILE A 66 0.892 -24.684 23.815 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.591 -23.719 22.493 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.572 -24.965 23.301 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.475 -24.785 27.394 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.639 -23.419 26.619 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.743 -24.987 25.784 1.00 0.00 H new ATOM 738 N GLY A 67 3.118 -20.668 22.416 1.00 0.00 N ATOM 739 CA GLY A 67 2.878 -20.049 21.117 1.00 0.00 C ATOM 740 C GLY A 67 4.183 -19.890 20.344 1.00 0.00 C ATOM 741 O GLY A 67 4.183 -19.665 19.141 1.00 0.00 O ATOM 0 H GLY A 67 3.112 -20.020 23.203 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.181 -20.659 20.542 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.410 -19.074 21.254 1.00 0.00 H new ATOM 745 N TYR A 68 5.301 -20.003 21.046 1.00 0.00 N ATOM 746 CA TYR A 68 6.610 -19.872 20.411 1.00 0.00 C ATOM 747 C TYR A 68 7.359 -21.198 20.452 1.00 0.00 C ATOM 748 O TYR A 68 8.431 -21.331 19.862 1.00 0.00 O ATOM 749 CB TYR A 68 7.428 -18.795 21.121 1.00 0.00 C ATOM 750 CG TYR A 68 8.883 -18.921 20.734 1.00 0.00 C ATOM 751 CD1 TYR A 68 9.311 -18.512 19.465 1.00 0.00 C ATOM 752 CD2 TYR A 68 9.803 -19.454 21.645 1.00 0.00 C ATOM 753 CE1 TYR A 68 10.658 -18.636 19.108 1.00 0.00 C ATOM 754 CE2 TYR A 68 11.150 -19.578 21.287 1.00 0.00 C ATOM 755 CZ TYR A 68 11.579 -19.169 20.019 1.00 0.00 C ATOM 756 OH TYR A 68 12.906 -19.291 19.666 1.00 0.00 O ATOM 0 H TYR A 68 5.332 -20.184 22.049 1.00 0.00 H new ATOM 0 HA TYR A 68 6.463 -19.585 19.370 1.00 0.00 H new ATOM 0 HB2 TYR A 68 7.055 -17.806 20.853 1.00 0.00 H new ATOM 0 HB3 TYR A 68 7.319 -18.895 22.201 1.00 0.00 H new ATOM 0 HD1 TYR A 68 8.602 -18.101 18.762 1.00 0.00 H new ATOM 0 HD2 TYR A 68 9.473 -19.769 22.624 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.988 -18.321 18.129 1.00 0.00 H new ATOM 0 HE2 TYR A 68 11.859 -19.990 21.990 1.00 0.00 H new ATOM 0 HH TYR A 68 13.409 -19.678 20.413 1.00 0.00 H new ATOM 766 N GLU A 69 6.796 -22.170 21.157 1.00 0.00 N ATOM 767 CA GLU A 69 7.426 -23.482 21.273 1.00 0.00 C ATOM 768 C GLU A 69 6.636 -24.524 20.492 1.00 0.00 C ATOM 769 O GLU A 69 6.962 -25.710 20.520 1.00 0.00 O ATOM 770 CB GLU A 69 7.508 -23.893 22.743 1.00 0.00 C ATOM 771 CG GLU A 69 8.499 -22.983 23.474 1.00 0.00 C ATOM 772 CD GLU A 69 8.521 -23.325 24.961 1.00 0.00 C ATOM 773 OE1 GLU A 69 7.807 -24.235 25.350 1.00 0.00 O ATOM 774 OE2 GLU A 69 9.251 -22.672 25.687 1.00 0.00 O ATOM 0 H GLU A 69 5.910 -22.078 21.655 1.00 0.00 H new ATOM 0 HA GLU A 69 8.432 -23.421 20.858 1.00 0.00 H new ATOM 0 HB2 GLU A 69 6.524 -23.823 23.206 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.825 -24.933 22.824 1.00 0.00 H new ATOM 0 HG2 GLU A 69 9.496 -23.102 23.050 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.217 -21.939 23.336 1.00 0.00 H new ATOM 781 N ASP A 70 5.597 -24.074 19.796 1.00 0.00 N ATOM 782 CA ASP A 70 4.765 -24.979 19.009 1.00 0.00 C ATOM 783 C ASP A 70 4.312 -24.304 17.720 1.00 0.00 C ATOM 784 O ASP A 70 4.378 -24.895 16.642 1.00 0.00 O ATOM 785 CB ASP A 70 3.542 -25.409 19.823 1.00 0.00 C ATOM 786 CG ASP A 70 3.956 -26.395 20.910 1.00 0.00 C ATOM 787 OD1 ASP A 70 5.044 -26.937 20.804 1.00 0.00 O ATOM 788 OD2 ASP A 70 3.180 -26.594 21.830 1.00 0.00 O ATOM 0 H ASP A 70 5.312 -23.095 19.760 1.00 0.00 H new ATOM 0 HA ASP A 70 5.357 -25.859 18.756 1.00 0.00 H new ATOM 0 HB2 ASP A 70 3.070 -24.536 20.274 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.802 -25.868 19.167 1.00 0.00 H new ATOM 793 N GLU A 71 3.845 -23.065 17.838 1.00 0.00 N ATOM 794 CA GLU A 71 3.376 -22.323 16.672 1.00 0.00 C ATOM 795 C GLU A 71 4.543 -21.626 15.980 1.00 0.00 C ATOM 796 O GLU A 71 4.460 -21.280 14.801 1.00 0.00 O ATOM 797 CB GLU A 71 2.342 -21.285 17.105 1.00 0.00 C ATOM 798 CG GLU A 71 1.188 -21.977 17.829 1.00 0.00 C ATOM 799 CD GLU A 71 0.423 -22.889 16.876 1.00 0.00 C ATOM 800 OE1 GLU A 71 0.703 -22.831 15.690 1.00 0.00 O ATOM 801 OE2 GLU A 71 -0.427 -23.631 17.340 1.00 0.00 O ATOM 0 H GLU A 71 3.781 -22.557 18.720 1.00 0.00 H new ATOM 0 HA GLU A 71 2.920 -23.023 15.972 1.00 0.00 H new ATOM 0 HB2 GLU A 71 2.805 -20.548 17.761 1.00 0.00 H new ATOM 0 HB3 GLU A 71 1.967 -20.746 16.235 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.574 -22.559 18.666 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.513 -21.229 18.245 1.00 0.00 H new ATOM 808 N GLY A 72 5.628 -21.421 16.719 1.00 0.00 N ATOM 809 CA GLY A 72 6.804 -20.761 16.165 1.00 0.00 C ATOM 810 C GLY A 72 6.711 -19.249 16.341 1.00 0.00 C ATOM 811 O GLY A 72 7.726 -18.554 16.379 1.00 0.00 O ATOM 0 H GLY A 72 5.717 -21.700 17.696 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.702 -21.134 16.658 1.00 0.00 H new ATOM 0 HA3 GLY A 72 6.897 -21.003 15.106 1.00 0.00 H new ATOM 893 N GLU A 78 5.662 -11.266 28.325 1.00 0.00 N ATOM 894 CA GLU A 78 4.438 -11.307 29.123 1.00 0.00 C ATOM 895 C GLU A 78 3.508 -10.173 28.708 1.00 0.00 C ATOM 896 O GLU A 78 2.354 -10.393 28.331 1.00 0.00 O ATOM 897 CB GLU A 78 4.786 -11.147 30.606 1.00 0.00 C ATOM 898 CG GLU A 78 3.502 -11.097 31.434 1.00 0.00 C ATOM 899 CD GLU A 78 3.844 -10.898 32.904 1.00 0.00 C ATOM 900 OE1 GLU A 78 2.979 -10.436 33.628 1.00 0.00 O ATOM 901 OE2 GLU A 78 4.957 -11.216 33.288 1.00 0.00 O ATOM 0 HA GLU A 78 3.942 -12.264 28.959 1.00 0.00 H new ATOM 0 HB2 GLU A 78 5.410 -11.978 30.935 1.00 0.00 H new ATOM 0 HB3 GLU A 78 5.364 -10.235 30.758 1.00 0.00 H new ATOM 0 HG2 GLU A 78 2.865 -10.284 31.086 1.00 0.00 H new ATOM 0 HG3 GLU A 78 2.938 -12.021 31.304 1.00 0.00 H new ATOM 908 N SER A 79 4.050 -8.964 28.784 1.00 0.00 N ATOM 909 CA SER A 79 3.319 -7.754 28.433 1.00 0.00 C ATOM 910 C SER A 79 2.771 -7.838 27.013 1.00 0.00 C ATOM 911 O SER A 79 1.583 -7.607 26.783 1.00 0.00 O ATOM 912 CB SER A 79 4.272 -6.556 28.531 1.00 0.00 C ATOM 913 OG SER A 79 3.570 -5.364 28.208 1.00 0.00 O ATOM 0 H SER A 79 5.008 -8.795 29.091 1.00 0.00 H new ATOM 0 HA SER A 79 2.481 -7.639 29.121 1.00 0.00 H new ATOM 0 HB2 SER A 79 4.684 -6.487 29.538 1.00 0.00 H new ATOM 0 HB3 SER A 79 5.113 -6.691 27.851 1.00 0.00 H new ATOM 0 HG SER A 79 4.179 -4.598 28.272 1.00 0.00 H new ATOM 919 N ALA A 80 3.636 -8.173 26.063 1.00 0.00 N ATOM 920 CA ALA A 80 3.215 -8.286 24.670 1.00 0.00 C ATOM 921 C ALA A 80 2.076 -9.295 24.538 1.00 0.00 C ATOM 922 O ALA A 80 1.255 -9.202 23.627 1.00 0.00 O ATOM 923 CB ALA A 80 4.403 -8.722 23.802 1.00 0.00 C ATOM 0 H ALA A 80 4.623 -8.370 26.228 1.00 0.00 H new ATOM 0 HA ALA A 80 2.860 -7.313 24.331 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.084 -8.805 22.763 1.00 0.00 H new ATOM 0 HB2 ALA A 80 5.200 -7.983 23.879 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.770 -9.689 24.147 1.00 0.00 H new ATOM 929 N CYS A 81 2.041 -10.262 25.447 1.00 0.00 N ATOM 930 CA CYS A 81 1.005 -11.285 25.416 1.00 0.00 C ATOM 931 C CYS A 81 -0.335 -10.698 25.845 1.00 0.00 C ATOM 932 O CYS A 81 -1.375 -11.342 25.719 1.00 0.00 O ATOM 933 CB CYS A 81 1.387 -12.427 26.347 1.00 0.00 C ATOM 934 SG CYS A 81 3.135 -12.806 26.142 1.00 0.00 S ATOM 0 H CYS A 81 2.713 -10.359 26.209 1.00 0.00 H new ATOM 0 HA CYS A 81 0.912 -11.661 24.397 1.00 0.00 H new ATOM 0 HB2 CYS A 81 1.182 -12.152 27.382 1.00 0.00 H new ATOM 0 HB3 CYS A 81 0.784 -13.308 26.126 1.00 0.00 H new ATOM 0 HG CYS A 81 3.411 -12.909 24.876 1.00 0.00 H new ATOM 940 N ARG A 82 -0.300 -9.471 26.359 1.00 0.00 N ATOM 941 CA ARG A 82 -1.516 -8.806 26.808 1.00 0.00 C ATOM 942 C ARG A 82 -1.925 -7.727 25.823 1.00 0.00 C ATOM 943 O ARG A 82 -3.086 -7.358 25.771 1.00 0.00 O ATOM 944 CB ARG A 82 -1.297 -8.180 28.185 1.00 0.00 C ATOM 945 CG ARG A 82 -1.053 -9.287 29.212 1.00 0.00 C ATOM 946 CD ARG A 82 -0.738 -8.660 30.571 1.00 0.00 C ATOM 947 NE ARG A 82 -1.896 -7.928 31.071 1.00 0.00 N ATOM 948 CZ ARG A 82 -1.825 -7.211 32.188 1.00 0.00 C ATOM 949 NH1 ARG A 82 -2.874 -6.563 32.614 1.00 0.00 N ATOM 950 NH2 ARG A 82 -0.707 -7.153 32.857 1.00 0.00 N ATOM 0 H ARG A 82 0.552 -8.922 26.474 1.00 0.00 H new ATOM 0 HA ARG A 82 -2.310 -9.550 26.871 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -0.445 -7.501 28.157 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.167 -7.589 28.471 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -1.932 -9.926 29.289 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -0.226 -9.920 28.891 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -0.456 -9.437 31.281 1.00 0.00 H new ATOM 0 HD3 ARG A 82 0.115 -7.987 30.480 1.00 0.00 H new ATOM 0 HE ARG A 82 -2.775 -7.967 30.555 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -3.748 -6.607 32.090 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -2.820 -6.013 33.471 1.00 0.00 H new ATOM 0 HH21 ARG A 82 0.114 -7.658 32.523 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -0.653 -6.603 33.714 1.00 0.00 H new ATOM 964 N ASN A 83 -0.963 -7.228 25.052 1.00 0.00 N ATOM 965 CA ASN A 83 -1.238 -6.187 24.065 1.00 0.00 C ATOM 966 C ASN A 83 -1.707 -6.803 22.750 1.00 0.00 C ATOM 967 O ASN A 83 -2.683 -6.350 22.153 1.00 0.00 O ATOM 968 CB ASN A 83 0.021 -5.354 23.823 1.00 0.00 C ATOM 969 CG ASN A 83 0.471 -4.705 25.130 1.00 0.00 C ATOM 970 OD1 ASN A 83 -0.355 -4.215 25.899 1.00 0.00 O ATOM 971 ND2 ASN A 83 1.742 -4.670 25.426 1.00 0.00 N ATOM 0 H ASN A 83 0.012 -7.526 25.091 1.00 0.00 H new ATOM 0 HA ASN A 83 -2.029 -5.545 24.452 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.816 -5.986 23.428 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -0.178 -4.587 23.075 1.00 0.00 H new ATOM 0 HD21 ASN A 83 2.051 -4.236 26.296 1.00 0.00 H new ATOM 0 HD22 ASN A 83 2.426 -5.077 24.788 1.00 0.00 H new ATOM 978 N GLN A 84 -0.996 -7.834 22.300 1.00 0.00 N ATOM 979 CA GLN A 84 -1.342 -8.500 21.048 1.00 0.00 C ATOM 980 C GLN A 84 -2.771 -9.029 21.099 1.00 0.00 C ATOM 981 O GLN A 84 -3.621 -8.620 20.309 1.00 0.00 O ATOM 982 CB GLN A 84 -0.380 -9.662 20.801 1.00 0.00 C ATOM 983 CG GLN A 84 1.022 -9.116 20.551 1.00 0.00 C ATOM 984 CD GLN A 84 2.029 -10.265 20.484 1.00 0.00 C ATOM 985 OE1 GLN A 84 2.305 -10.904 21.499 1.00 0.00 O ATOM 986 NE2 GLN A 84 2.594 -10.567 19.347 1.00 0.00 N ATOM 0 H GLN A 84 -0.184 -8.223 22.779 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.263 -7.776 20.237 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -0.373 -10.332 21.661 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.712 -10.247 19.944 1.00 0.00 H new ATOM 0 HG2 GLN A 84 1.040 -8.552 19.619 1.00 0.00 H new ATOM 0 HG3 GLN A 84 1.299 -8.425 21.347 1.00 0.00 H new ATOM 0 HE21 GLN A 84 2.364 -10.037 18.507 1.00 0.00 H new ATOM 0 HE22 GLN A 84 3.265 -11.333 19.299 1.00 0.00 H new ATOM 995 N ILE A 85 -3.030 -9.932 22.037 1.00 0.00 N ATOM 996 CA ILE A 85 -4.360 -10.510 22.183 1.00 0.00 C ATOM 997 C ILE A 85 -5.397 -9.411 22.362 1.00 0.00 C ATOM 998 O ILE A 85 -6.496 -9.491 21.818 1.00 0.00 O ATOM 999 CB ILE A 85 -4.395 -11.449 23.389 1.00 0.00 C ATOM 1000 CG1 ILE A 85 -3.536 -12.682 23.100 1.00 0.00 C ATOM 1001 CG2 ILE A 85 -5.836 -11.885 23.656 1.00 0.00 C ATOM 1002 CD1 ILE A 85 -3.347 -13.487 24.386 1.00 0.00 C ATOM 0 H ILE A 85 -2.341 -10.278 22.704 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.593 -11.075 21.280 1.00 0.00 H new ATOM 0 HB ILE A 85 -4.005 -10.930 24.264 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -4.013 -13.300 22.339 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -2.567 -12.378 22.703 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -5.860 -12.554 24.516 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -6.449 -11.008 23.862 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -6.227 -12.404 22.781 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -2.735 -14.365 24.179 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -2.852 -12.867 25.134 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -4.319 -13.803 24.763 1.00 0.00 H new ATOM 1014 N ILE A 86 -5.046 -8.385 23.124 1.00 0.00 N ATOM 1015 CA ILE A 86 -5.966 -7.280 23.354 1.00 0.00 C ATOM 1016 C ILE A 86 -6.285 -6.569 22.041 1.00 0.00 C ATOM 1017 O ILE A 86 -7.428 -6.222 21.778 1.00 0.00 O ATOM 1018 CB ILE A 86 -5.345 -6.275 24.348 1.00 0.00 C ATOM 1019 CG1 ILE A 86 -5.935 -6.494 25.750 1.00 0.00 C ATOM 1020 CG2 ILE A 86 -5.616 -4.831 23.901 1.00 0.00 C ATOM 1021 CD1 ILE A 86 -5.565 -5.313 26.659 1.00 0.00 C ATOM 0 H ILE A 86 -4.142 -8.294 23.588 1.00 0.00 H new ATOM 0 HA ILE A 86 -6.889 -7.680 23.773 1.00 0.00 H new ATOM 0 HB ILE A 86 -4.268 -6.439 24.373 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -7.019 -6.591 25.688 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -5.555 -7.424 26.173 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.170 -4.139 24.615 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -5.179 -4.667 22.916 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.692 -4.660 23.854 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.985 -5.472 27.652 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -4.480 -5.236 26.732 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.966 -4.391 26.239 1.00 0.00 H new ATOM 1033 N SER A 87 -5.258 -6.317 21.245 1.00 0.00 N ATOM 1034 CA SER A 87 -5.448 -5.612 19.982 1.00 0.00 C ATOM 1035 C SER A 87 -6.429 -6.372 19.101 1.00 0.00 C ATOM 1036 O SER A 87 -7.327 -5.779 18.502 1.00 0.00 O ATOM 1037 CB SER A 87 -4.110 -5.479 19.260 1.00 0.00 C ATOM 1038 OG SER A 87 -4.324 -4.828 18.014 1.00 0.00 O ATOM 0 H SER A 87 -4.294 -6.585 21.445 1.00 0.00 H new ATOM 0 HA SER A 87 -5.849 -4.620 20.188 1.00 0.00 H new ATOM 0 HB2 SER A 87 -3.408 -4.908 19.868 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.668 -6.462 19.101 1.00 0.00 H new ATOM 0 HG SER A 87 -3.470 -4.736 17.542 1.00 0.00 H new ATOM 1044 N ILE A 88 -6.255 -7.690 19.034 1.00 0.00 N ATOM 1045 CA ILE A 88 -7.137 -8.529 18.231 1.00 0.00 C ATOM 1046 C ILE A 88 -8.596 -8.341 18.669 1.00 0.00 C ATOM 1047 O ILE A 88 -9.522 -8.517 17.898 1.00 0.00 O ATOM 1048 CB ILE A 88 -6.758 -9.995 18.386 1.00 0.00 C ATOM 1049 CG1 ILE A 88 -5.302 -10.192 17.964 1.00 0.00 C ATOM 1050 CG2 ILE A 88 -7.667 -10.853 17.504 1.00 0.00 C ATOM 1051 CD1 ILE A 88 -4.858 -11.612 18.317 1.00 0.00 C ATOM 0 H ILE A 88 -5.516 -8.196 19.523 1.00 0.00 H new ATOM 0 HA ILE A 88 -7.029 -8.234 17.187 1.00 0.00 H new ATOM 0 HB ILE A 88 -6.877 -10.293 19.428 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -5.196 -10.022 16.893 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -4.665 -9.464 18.467 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -7.396 -11.903 17.615 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -8.705 -10.712 17.806 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -7.549 -10.556 16.462 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -3.820 -11.754 18.017 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -4.949 -11.765 19.392 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -5.489 -12.331 17.794 1.00 0.00 H new ATOM 1063 N MET A 89 -8.800 -7.997 19.919 1.00 0.00 N ATOM 1064 CA MET A 89 -10.160 -7.787 20.416 1.00 0.00 C ATOM 1065 C MET A 89 -10.765 -6.518 19.813 1.00 0.00 C ATOM 1066 O MET A 89 -11.865 -6.545 19.257 1.00 0.00 O ATOM 1067 CB MET A 89 -10.135 -7.660 21.937 1.00 0.00 C ATOM 1068 CG MET A 89 -9.690 -8.986 22.551 1.00 0.00 C ATOM 1069 SD MET A 89 -10.910 -10.265 22.171 1.00 0.00 S ATOM 1070 CE MET A 89 -12.217 -9.661 23.267 1.00 0.00 C ATOM 0 H MET A 89 -8.062 -7.856 20.609 1.00 0.00 H new ATOM 0 HA MET A 89 -10.771 -8.641 20.124 1.00 0.00 H new ATOM 0 HB2 MET A 89 -9.454 -6.862 22.235 1.00 0.00 H new ATOM 0 HB3 MET A 89 -11.124 -7.390 22.306 1.00 0.00 H new ATOM 0 HG2 MET A 89 -8.714 -9.271 22.159 1.00 0.00 H new ATOM 0 HG3 MET A 89 -9.581 -8.881 23.630 1.00 0.00 H new ATOM 0 HE1 MET A 89 -12.862 -10.491 23.556 1.00 0.00 H new ATOM 0 HE2 MET A 89 -11.770 -9.221 24.158 1.00 0.00 H new ATOM 0 HE3 MET A 89 -12.808 -8.907 22.747 1.00 0.00 H new ATOM 1080 N ARG A 90 -10.039 -5.408 19.924 1.00 0.00 N ATOM 1081 CA ARG A 90 -10.519 -4.137 19.391 1.00 0.00 C ATOM 1082 C ARG A 90 -11.001 -4.310 17.956 1.00 0.00 C ATOM 1083 O ARG A 90 -12.035 -3.768 17.571 1.00 0.00 O ATOM 1084 CB ARG A 90 -9.395 -3.099 19.432 1.00 0.00 C ATOM 1085 CG ARG A 90 -9.933 -1.744 18.968 1.00 0.00 C ATOM 1086 CD ARG A 90 -8.820 -0.698 19.046 1.00 0.00 C ATOM 1087 NE ARG A 90 -7.753 -1.024 18.105 1.00 0.00 N ATOM 1088 CZ ARG A 90 -7.805 -0.618 16.840 1.00 0.00 C ATOM 1089 NH1 ARG A 90 -6.839 -0.921 16.017 1.00 0.00 N ATOM 1090 NH2 ARG A 90 -8.823 0.084 16.422 1.00 0.00 N ATOM 0 H ARG A 90 -9.125 -5.363 20.374 1.00 0.00 H new ATOM 0 HA ARG A 90 -11.353 -3.795 20.005 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.998 -3.017 20.444 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.571 -3.414 18.791 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.305 -1.819 17.946 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.774 -1.442 19.592 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -9.223 0.290 18.822 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.421 -0.657 20.059 1.00 0.00 H new ATOM 0 HE ARG A 90 -6.954 -1.572 18.423 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -6.044 -1.470 16.344 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -6.879 -0.609 15.047 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -9.578 0.321 17.066 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -8.863 0.396 15.452 1.00 0.00 H new ATOM 1104 N VAL A 91 -10.250 -5.073 17.170 1.00 0.00 N ATOM 1105 CA VAL A 91 -10.621 -5.318 15.778 1.00 0.00 C ATOM 1106 C VAL A 91 -11.872 -6.185 15.694 1.00 0.00 C ATOM 1107 O VAL A 91 -12.735 -5.963 14.845 1.00 0.00 O ATOM 1108 CB VAL A 91 -9.464 -5.996 15.032 1.00 0.00 C ATOM 1109 CG1 VAL A 91 -8.283 -5.017 14.922 1.00 0.00 C ATOM 1110 CG2 VAL A 91 -9.027 -7.217 15.814 1.00 0.00 C ATOM 0 H VAL A 91 -9.388 -5.530 17.468 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.834 -4.357 15.309 1.00 0.00 H new ATOM 0 HB VAL A 91 -9.789 -6.288 14.033 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.460 -5.497 14.392 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.597 -4.128 14.375 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -7.953 -4.731 15.921 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -8.205 -7.707 15.293 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -8.698 -6.914 16.808 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -9.864 -7.910 15.905 1.00 0.00 H new ATOM 1120 N TYR A 92 -11.960 -7.172 16.577 1.00 0.00 N ATOM 1121 CA TYR A 92 -13.104 -8.069 16.596 1.00 0.00 C ATOM 1122 C TYR A 92 -14.374 -7.301 16.919 1.00 0.00 C ATOM 1123 O TYR A 92 -15.411 -7.536 16.316 1.00 0.00 O ATOM 1124 CB TYR A 92 -12.890 -9.177 17.627 1.00 0.00 C ATOM 1125 CG TYR A 92 -14.142 -10.014 17.736 1.00 0.00 C ATOM 1126 CD1 TYR A 92 -14.456 -10.943 16.737 1.00 0.00 C ATOM 1127 CD2 TYR A 92 -14.990 -9.859 18.839 1.00 0.00 C ATOM 1128 CE1 TYR A 92 -15.617 -11.717 16.840 1.00 0.00 C ATOM 1129 CE2 TYR A 92 -16.153 -10.634 18.942 1.00 0.00 C ATOM 1130 CZ TYR A 92 -16.466 -11.563 17.943 1.00 0.00 C ATOM 1131 OH TYR A 92 -17.611 -12.326 18.045 1.00 0.00 O ATOM 0 H TYR A 92 -11.254 -7.370 17.286 1.00 0.00 H new ATOM 0 HA TYR A 92 -13.207 -8.518 15.608 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -12.046 -9.802 17.334 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -12.644 -8.743 18.596 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -13.802 -11.062 15.886 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -14.748 -9.143 19.610 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -15.858 -12.433 16.069 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -16.808 -10.514 19.792 1.00 0.00 H new ATOM 0 HH TYR A 92 -18.086 -12.095 18.871 1.00 0.00 H new ATOM 1141 N GLU A 93 -14.282 -6.384 17.875 1.00 0.00 N ATOM 1142 CA GLU A 93 -15.436 -5.586 18.274 1.00 0.00 C ATOM 1143 C GLU A 93 -15.768 -4.545 17.208 1.00 0.00 C ATOM 1144 O GLU A 93 -16.936 -4.248 16.959 1.00 0.00 O ATOM 1145 CB GLU A 93 -15.153 -4.886 19.604 1.00 0.00 C ATOM 1146 CG GLU A 93 -14.994 -5.936 20.708 1.00 0.00 C ATOM 1147 CD GLU A 93 -16.304 -6.692 20.901 1.00 0.00 C ATOM 1148 OE1 GLU A 93 -17.329 -6.182 20.478 1.00 0.00 O ATOM 1149 OE2 GLU A 93 -16.264 -7.772 21.470 1.00 0.00 O ATOM 0 H GLU A 93 -13.425 -6.175 18.386 1.00 0.00 H new ATOM 0 HA GLU A 93 -16.290 -6.253 18.389 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -14.247 -4.285 19.526 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -15.968 -4.205 19.850 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.198 -6.633 20.447 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.702 -5.454 21.641 1.00 0.00 H new ATOM 1156 N GLN A 94 -14.730 -3.994 16.584 1.00 0.00 N ATOM 1157 CA GLN A 94 -14.923 -2.986 15.548 1.00 0.00 C ATOM 1158 C GLN A 94 -15.632 -3.585 14.338 1.00 0.00 C ATOM 1159 O GLN A 94 -16.660 -3.075 13.895 1.00 0.00 O ATOM 1160 CB GLN A 94 -13.572 -2.414 15.117 1.00 0.00 C ATOM 1161 CG GLN A 94 -13.113 -1.363 16.130 1.00 0.00 C ATOM 1162 CD GLN A 94 -11.715 -0.870 15.773 1.00 0.00 C ATOM 1163 OE1 GLN A 94 -11.389 0.370 16.015 1.00 0.00 O flip ATOM 1164 NE2 GLN A 94 -10.898 -1.634 15.259 1.00 0.00 N flip ATOM 0 H GLN A 94 -13.756 -4.226 16.776 1.00 0.00 H new ATOM 0 HA GLN A 94 -15.542 -2.188 15.958 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -12.833 -3.213 15.046 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -13.654 -1.967 14.126 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -13.811 -0.526 16.140 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -13.112 -1.789 17.133 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -11.154 -2.603 15.070 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -9.965 -1.298 15.022 1.00 0.00 H new ATOM 1173 N ARG A 95 -15.078 -4.671 13.811 1.00 0.00 N ATOM 1174 CA ARG A 95 -15.667 -5.332 12.652 1.00 0.00 C ATOM 1175 C ARG A 95 -16.969 -6.025 13.035 1.00 0.00 C ATOM 1176 O ARG A 95 -17.720 -6.479 12.170 1.00 0.00 O ATOM 1177 CB ARG A 95 -14.687 -6.359 12.083 1.00 0.00 C ATOM 1178 CG ARG A 95 -13.466 -5.639 11.507 1.00 0.00 C ATOM 1179 CD ARG A 95 -12.468 -6.669 10.977 1.00 0.00 C ATOM 1180 NE ARG A 95 -11.886 -7.423 12.082 1.00 0.00 N ATOM 1181 CZ ARG A 95 -11.001 -8.390 11.863 1.00 0.00 C ATOM 1182 NH1 ARG A 95 -10.495 -9.051 12.867 1.00 0.00 N ATOM 1183 NH2 ARG A 95 -10.638 -8.678 10.643 1.00 0.00 N ATOM 0 H ARG A 95 -14.228 -5.110 14.165 1.00 0.00 H new ATOM 0 HA ARG A 95 -15.880 -4.577 11.896 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -14.377 -7.053 12.864 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -15.173 -6.950 11.307 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -13.772 -4.967 10.705 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -12.997 -5.025 12.276 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -12.968 -7.349 10.287 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -11.680 -6.167 10.415 1.00 0.00 H new ATOM 0 HE ARG A 95 -12.163 -7.204 13.039 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -10.778 -8.826 13.821 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -9.816 -9.793 12.699 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -11.033 -8.161 9.858 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -9.959 -9.420 10.475 1.00 0.00 H new ATOM 1197 N LEU A 96 -17.234 -6.098 14.334 1.00 0.00 N ATOM 1198 CA LEU A 96 -18.456 -6.725 14.824 1.00 0.00 C ATOM 1199 C LEU A 96 -19.638 -5.769 14.717 1.00 0.00 C ATOM 1200 O LEU A 96 -20.766 -6.187 14.456 1.00 0.00 O ATOM 1201 CB LEU A 96 -18.278 -7.169 16.276 1.00 0.00 C ATOM 1202 CG LEU A 96 -19.596 -7.710 16.820 1.00 0.00 C ATOM 1203 CD1 LEU A 96 -20.094 -8.840 15.916 1.00 0.00 C ATOM 1204 CD2 LEU A 96 -19.379 -8.249 18.234 1.00 0.00 C ATOM 0 H LEU A 96 -16.623 -5.733 15.064 1.00 0.00 H new ATOM 0 HA LEU A 96 -18.660 -7.599 14.205 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -17.507 -7.937 16.338 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -17.942 -6.329 16.883 1.00 0.00 H new ATOM 0 HG LEU A 96 -20.336 -6.910 16.844 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -21.036 -9.228 16.304 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -20.247 -8.458 14.907 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -19.354 -9.640 15.893 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -20.320 -8.636 18.624 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -18.640 -9.050 18.209 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -19.022 -7.446 18.879 1.00 0.00 H new ATOM 1216 N ALA A 97 -19.374 -4.486 14.941 1.00 0.00 N ATOM 1217 CA ALA A 97 -20.426 -3.479 14.883 1.00 0.00 C ATOM 1218 C ALA A 97 -20.666 -3.042 13.443 1.00 0.00 C ATOM 1219 O ALA A 97 -21.770 -2.634 13.083 1.00 0.00 O ATOM 1220 CB ALA A 97 -20.034 -2.264 15.726 1.00 0.00 C ATOM 0 H ALA A 97 -18.448 -4.121 15.163 1.00 0.00 H new ATOM 0 HA ALA A 97 -21.343 -3.915 15.279 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -20.826 -1.516 15.677 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -19.889 -2.571 16.762 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -19.108 -1.837 15.341 1.00 0.00 H new ATOM 1226 N HIS A 98 -19.624 -3.131 12.622 1.00 0.00 N ATOM 1227 CA HIS A 98 -19.734 -2.738 11.222 1.00 0.00 C ATOM 1228 C HIS A 98 -20.610 -3.722 10.455 1.00 0.00 C ATOM 1229 O HIS A 98 -20.351 -4.925 10.448 1.00 0.00 O ATOM 1230 CB HIS A 98 -18.344 -2.686 10.584 1.00 0.00 C ATOM 1231 CG HIS A 98 -17.622 -1.455 11.055 1.00 0.00 C ATOM 1232 ND1 HIS A 98 -17.006 -1.386 12.294 1.00 0.00 N ATOM 1233 CD2 HIS A 98 -17.408 -0.234 10.462 1.00 0.00 C ATOM 1234 CE1 HIS A 98 -16.456 -0.163 12.408 1.00 0.00 C ATOM 1235 NE2 HIS A 98 -16.671 0.579 11.319 1.00 0.00 N ATOM 0 H HIS A 98 -18.702 -3.469 12.899 1.00 0.00 H new ATOM 0 HA HIS A 98 -20.193 -1.750 11.177 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -17.776 -3.578 10.850 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -18.431 -2.676 9.498 1.00 0.00 H new ATOM 0 HD1 HIS A 98 -16.975 -2.128 12.993 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -17.758 0.051 9.481 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -15.908 0.177 13.274 1.00 0.00 H new ATOM 1343 N THR A 105 -17.358 -12.853 2.474 1.00 0.00 N ATOM 1344 CA THR A 105 -17.092 -13.765 3.581 1.00 0.00 C ATOM 1345 C THR A 105 -15.909 -14.672 3.257 1.00 0.00 C ATOM 1346 O THR A 105 -15.572 -14.875 2.090 1.00 0.00 O ATOM 1347 CB THR A 105 -18.330 -14.620 3.863 1.00 0.00 C ATOM 1348 OG1 THR A 105 -18.590 -15.455 2.743 1.00 0.00 O ATOM 1349 CG2 THR A 105 -19.534 -13.711 4.115 1.00 0.00 C ATOM 0 HA THR A 105 -16.850 -13.173 4.464 1.00 0.00 H new ATOM 0 HB THR A 105 -18.154 -15.237 4.744 1.00 0.00 H new ATOM 0 HG1 THR A 105 -18.322 -14.993 1.921 1.00 0.00 H new ATOM 0 HG21 THR A 105 -20.415 -14.321 4.316 1.00 0.00 H new ATOM 0 HG22 THR A 105 -19.333 -13.071 4.974 1.00 0.00 H new ATOM 0 HG23 THR A 105 -19.714 -13.093 3.235 1.00 0.00 H new ATOM 1357 N THR A 106 -15.284 -15.215 4.297 1.00 0.00 N ATOM 1358 CA THR A 106 -14.143 -16.102 4.110 1.00 0.00 C ATOM 1359 C THR A 106 -14.035 -17.090 5.272 1.00 0.00 C ATOM 1360 O THR A 106 -14.567 -16.853 6.356 1.00 0.00 O ATOM 1361 CB THR A 106 -12.850 -15.275 4.002 1.00 0.00 C ATOM 1362 OG1 THR A 106 -13.055 -14.004 4.597 1.00 0.00 O ATOM 1363 CG2 THR A 106 -12.473 -15.094 2.531 1.00 0.00 C ATOM 0 H THR A 106 -15.546 -15.058 5.270 1.00 0.00 H new ATOM 0 HA THR A 106 -14.287 -16.665 3.188 1.00 0.00 H new ATOM 0 HB THR A 106 -12.043 -15.796 4.518 1.00 0.00 H new ATOM 0 HG1 THR A 106 -13.383 -13.375 3.921 1.00 0.00 H new ATOM 0 HG21 THR A 106 -11.557 -14.508 2.460 1.00 0.00 H new ATOM 0 HG22 THR A 106 -12.316 -16.070 2.073 1.00 0.00 H new ATOM 0 HG23 THR A 106 -13.278 -14.575 2.010 1.00 0.00 H new ATOM 1371 N PRO A 107 -13.359 -18.190 5.058 1.00 0.00 N ATOM 1372 CA PRO A 107 -13.179 -19.237 6.104 1.00 0.00 C ATOM 1373 C PRO A 107 -12.202 -18.803 7.196 1.00 0.00 C ATOM 1374 O PRO A 107 -12.398 -19.107 8.374 1.00 0.00 O ATOM 1375 CB PRO A 107 -12.630 -20.435 5.325 1.00 0.00 C ATOM 1376 CG PRO A 107 -11.974 -19.859 4.113 1.00 0.00 C ATOM 1377 CD PRO A 107 -12.697 -18.554 3.796 1.00 0.00 C ATOM 0 HA PRO A 107 -14.109 -19.453 6.630 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -11.917 -21.000 5.926 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -13.429 -21.123 5.049 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -10.915 -19.679 4.296 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -12.039 -20.551 3.273 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -11.999 -17.780 3.475 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -13.420 -18.685 2.991 1.00 0.00 H new ATOM 1385 N GLU A 108 -11.150 -18.095 6.797 1.00 0.00 N ATOM 1386 CA GLU A 108 -10.151 -17.631 7.752 1.00 0.00 C ATOM 1387 C GLU A 108 -10.743 -16.578 8.680 1.00 0.00 C ATOM 1388 O GLU A 108 -10.610 -16.666 9.901 1.00 0.00 O ATOM 1389 CB GLU A 108 -8.952 -17.039 7.007 1.00 0.00 C ATOM 1390 CG GLU A 108 -8.239 -18.141 6.217 1.00 0.00 C ATOM 1391 CD GLU A 108 -8.882 -18.300 4.844 1.00 0.00 C ATOM 1392 OE1 GLU A 108 -9.883 -17.645 4.602 1.00 0.00 O ATOM 1393 OE2 GLU A 108 -8.365 -19.073 4.055 1.00 0.00 O ATOM 0 H GLU A 108 -10.968 -17.832 5.828 1.00 0.00 H new ATOM 0 HA GLU A 108 -9.825 -18.483 8.349 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -9.285 -16.251 6.331 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -8.261 -16.581 7.715 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -7.183 -17.895 6.106 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -8.291 -19.083 6.763 1.00 0.00 H new ATOM 1400 N GLU A 109 -11.401 -15.584 8.095 1.00 0.00 N ATOM 1401 CA GLU A 109 -12.012 -14.520 8.881 1.00 0.00 C ATOM 1402 C GLU A 109 -13.106 -15.086 9.780 1.00 0.00 C ATOM 1403 O GLU A 109 -13.332 -14.594 10.886 1.00 0.00 O ATOM 1404 CB GLU A 109 -12.602 -13.453 7.952 1.00 0.00 C ATOM 1405 CG GLU A 109 -13.860 -13.994 7.269 1.00 0.00 C ATOM 1406 CD GLU A 109 -14.485 -12.911 6.403 1.00 0.00 C ATOM 1407 OE1 GLU A 109 -13.747 -12.171 5.776 1.00 0.00 O ATOM 1408 OE2 GLU A 109 -15.704 -12.841 6.376 1.00 0.00 O ATOM 0 H GLU A 109 -11.524 -15.493 7.087 1.00 0.00 H new ATOM 0 HA GLU A 109 -11.244 -14.064 9.506 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.844 -12.556 8.522 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -11.866 -13.165 7.202 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -13.608 -14.861 6.658 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -14.576 -14.330 8.019 1.00 0.00 H new ATOM 1415 N ASP A 110 -13.799 -16.108 9.285 1.00 0.00 N ATOM 1416 CA ASP A 110 -14.878 -16.724 10.046 1.00 0.00 C ATOM 1417 C ASP A 110 -14.330 -17.413 11.289 1.00 0.00 C ATOM 1418 O ASP A 110 -14.857 -17.244 12.387 1.00 0.00 O ATOM 1419 CB ASP A 110 -15.619 -17.745 9.173 1.00 0.00 C ATOM 1420 CG ASP A 110 -16.689 -17.048 8.330 1.00 0.00 C ATOM 1421 OD1 ASP A 110 -17.078 -15.951 8.696 1.00 0.00 O ATOM 1422 OD2 ASP A 110 -17.101 -17.620 7.334 1.00 0.00 O ATOM 0 H ASP A 110 -13.634 -16.523 8.368 1.00 0.00 H new ATOM 0 HA ASP A 110 -15.572 -15.943 10.355 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -14.911 -18.258 8.522 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -16.081 -18.505 9.803 1.00 0.00 H new ATOM 1427 N GLU A 111 -13.266 -18.189 11.107 1.00 0.00 N ATOM 1428 CA GLU A 111 -12.655 -18.902 12.223 1.00 0.00 C ATOM 1429 C GLU A 111 -12.208 -17.924 13.302 1.00 0.00 C ATOM 1430 O GLU A 111 -12.544 -18.084 14.476 1.00 0.00 O ATOM 1431 CB GLU A 111 -11.449 -19.703 11.730 1.00 0.00 C ATOM 1432 CG GLU A 111 -10.853 -20.497 12.895 1.00 0.00 C ATOM 1433 CD GLU A 111 -9.673 -21.332 12.407 1.00 0.00 C ATOM 1434 OE1 GLU A 111 -9.228 -21.100 11.295 1.00 0.00 O ATOM 1435 OE2 GLU A 111 -9.232 -22.190 13.153 1.00 0.00 O ATOM 0 H GLU A 111 -12.812 -18.339 10.206 1.00 0.00 H new ATOM 0 HA GLU A 111 -13.396 -19.580 12.647 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.751 -20.380 10.931 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.699 -19.031 11.312 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.527 -19.816 13.681 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.613 -21.146 13.330 1.00 0.00 H new ATOM 1442 N LEU A 112 -11.452 -16.909 12.898 1.00 0.00 N ATOM 1443 CA LEU A 112 -10.964 -15.914 13.845 1.00 0.00 C ATOM 1444 C LEU A 112 -12.123 -15.326 14.643 1.00 0.00 C ATOM 1445 O LEU A 112 -12.029 -15.159 15.859 1.00 0.00 O ATOM 1446 CB LEU A 112 -10.243 -14.790 13.093 1.00 0.00 C ATOM 1447 CG LEU A 112 -9.760 -13.733 14.090 1.00 0.00 C ATOM 1448 CD1 LEU A 112 -8.840 -14.384 15.123 1.00 0.00 C ATOM 1449 CD2 LEU A 112 -8.994 -12.640 13.341 1.00 0.00 C ATOM 0 H LEU A 112 -11.166 -16.754 11.931 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.270 -16.399 14.531 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.397 -15.195 12.538 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.915 -14.337 12.364 1.00 0.00 H new ATOM 0 HG LEU A 112 -10.619 -13.294 14.597 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.497 -13.630 15.832 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.385 -15.162 15.657 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -7.980 -14.825 14.618 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.649 -11.887 14.049 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.136 -13.080 12.833 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.651 -12.174 12.606 1.00 0.00 H new ATOM 1461 N ASP A 113 -13.214 -15.014 13.955 1.00 0.00 N ATOM 1462 CA ASP A 113 -14.384 -14.451 14.617 1.00 0.00 C ATOM 1463 C ASP A 113 -14.911 -15.403 15.683 1.00 0.00 C ATOM 1464 O ASP A 113 -15.233 -14.986 16.796 1.00 0.00 O ATOM 1465 CB ASP A 113 -15.485 -14.175 13.583 1.00 0.00 C ATOM 1466 CG ASP A 113 -15.268 -12.812 12.925 1.00 0.00 C ATOM 1467 OD1 ASP A 113 -14.566 -12.003 13.509 1.00 0.00 O ATOM 1468 OD2 ASP A 113 -15.804 -12.600 11.850 1.00 0.00 O ATOM 0 H ASP A 113 -13.313 -15.140 12.948 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.092 -13.517 15.097 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.484 -14.957 12.824 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -16.462 -14.201 14.066 1.00 0.00 H new ATOM 1473 N GLN A 114 -14.991 -16.684 15.339 1.00 0.00 N ATOM 1474 CA GLN A 114 -15.481 -17.686 16.280 1.00 0.00 C ATOM 1475 C GLN A 114 -14.566 -17.769 17.496 1.00 0.00 C ATOM 1476 O GLN A 114 -15.033 -17.788 18.635 1.00 0.00 O ATOM 1477 CB GLN A 114 -15.545 -19.053 15.596 1.00 0.00 C ATOM 1478 CG GLN A 114 -16.601 -19.023 14.489 1.00 0.00 C ATOM 1479 CD GLN A 114 -17.982 -18.792 15.092 1.00 0.00 C ATOM 1480 OE1 GLN A 114 -18.391 -19.515 16.001 1.00 0.00 O ATOM 1481 NE2 GLN A 114 -18.728 -17.822 14.638 1.00 0.00 N ATOM 0 H GLN A 114 -14.726 -17.051 14.425 1.00 0.00 H new ATOM 0 HA GLN A 114 -16.479 -17.394 16.608 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -14.571 -19.307 15.177 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -15.790 -19.825 16.325 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -16.370 -18.232 13.776 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -16.589 -19.963 13.938 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -18.386 -17.225 13.885 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -19.653 -17.661 15.036 1.00 0.00 H new ATOM 1490 N LEU A 115 -13.261 -17.820 17.249 1.00 0.00 N ATOM 1491 CA LEU A 115 -12.293 -17.903 18.335 1.00 0.00 C ATOM 1492 C LEU A 115 -12.433 -16.707 19.267 1.00 0.00 C ATOM 1493 O LEU A 115 -12.384 -16.852 20.489 1.00 0.00 O ATOM 1494 CB LEU A 115 -10.875 -17.938 17.762 1.00 0.00 C ATOM 1495 CG LEU A 115 -10.656 -19.250 17.007 1.00 0.00 C ATOM 1496 CD1 LEU A 115 -9.315 -19.200 16.271 1.00 0.00 C ATOM 1497 CD2 LEU A 115 -10.655 -20.421 17.996 1.00 0.00 C ATOM 0 H LEU A 115 -12.853 -17.805 16.314 1.00 0.00 H new ATOM 0 HA LEU A 115 -12.483 -18.815 18.900 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.722 -17.092 17.092 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -10.145 -17.844 18.566 1.00 0.00 H new ATOM 0 HG LEU A 115 -11.461 -19.389 16.285 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -9.160 -20.135 15.733 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.319 -18.371 15.563 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.510 -19.058 16.992 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.499 -21.354 17.455 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.853 -20.284 18.722 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -11.612 -20.459 18.516 1.00 0.00 H new ATOM 1509 N CYS A 116 -12.613 -15.527 18.687 1.00 0.00 N ATOM 1510 CA CYS A 116 -12.768 -14.313 19.481 1.00 0.00 C ATOM 1511 C CYS A 116 -14.027 -14.389 20.338 1.00 0.00 C ATOM 1512 O CYS A 116 -14.023 -13.986 21.501 1.00 0.00 O ATOM 1513 CB CYS A 116 -12.850 -13.095 18.560 1.00 0.00 C ATOM 1514 SG CYS A 116 -11.270 -12.878 17.704 1.00 0.00 S ATOM 0 H CYS A 116 -12.655 -15.384 17.678 1.00 0.00 H new ATOM 0 HA CYS A 116 -11.902 -14.217 20.136 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -13.653 -13.227 17.835 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -13.087 -12.203 19.140 1.00 0.00 H new ATOM 0 HG CYS A 116 -11.175 -13.747 16.742 1.00 0.00 H new ATOM 1520 N ASP A 117 -15.104 -14.911 19.757 1.00 0.00 N ATOM 1521 CA ASP A 117 -16.364 -15.035 20.480 1.00 0.00 C ATOM 1522 C ASP A 117 -16.197 -15.942 21.694 1.00 0.00 C ATOM 1523 O ASP A 117 -16.656 -15.621 22.790 1.00 0.00 O ATOM 1524 CB ASP A 117 -17.440 -15.609 19.557 1.00 0.00 C ATOM 1525 CG ASP A 117 -18.755 -15.754 20.315 1.00 0.00 C ATOM 1526 OD1 ASP A 117 -19.280 -14.742 20.750 1.00 0.00 O ATOM 1527 OD2 ASP A 117 -19.218 -16.874 20.451 1.00 0.00 O ATOM 0 H ASP A 117 -15.129 -15.252 18.796 1.00 0.00 H new ATOM 0 HA ASP A 117 -16.666 -14.044 20.819 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -17.578 -14.956 18.695 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -17.123 -16.579 19.174 1.00 0.00 H new ATOM 1532 N GLU A 118 -15.535 -17.078 21.492 1.00 0.00 N ATOM 1533 CA GLU A 118 -15.315 -18.024 22.580 1.00 0.00 C ATOM 1534 C GLU A 118 -14.470 -17.390 23.678 1.00 0.00 C ATOM 1535 O GLU A 118 -14.790 -17.501 24.863 1.00 0.00 O ATOM 1536 CB GLU A 118 -14.614 -19.275 22.046 1.00 0.00 C ATOM 1537 CG GLU A 118 -14.538 -20.329 23.153 1.00 0.00 C ATOM 1538 CD GLU A 118 -14.246 -21.697 22.547 1.00 0.00 C ATOM 1539 OE1 GLU A 118 -14.083 -21.767 21.340 1.00 0.00 O ATOM 1540 OE2 GLU A 118 -14.190 -22.656 23.300 1.00 0.00 O ATOM 0 H GLU A 118 -15.145 -17.363 20.594 1.00 0.00 H new ATOM 0 HA GLU A 118 -16.282 -18.301 23.000 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -15.158 -19.671 21.188 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -13.612 -19.023 21.699 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -13.758 -20.064 23.867 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -15.478 -20.359 23.704 1.00 0.00 H new ATOM 1547 N TRP A 119 -13.396 -16.720 23.278 1.00 0.00 N ATOM 1548 CA TRP A 119 -12.514 -16.064 24.238 1.00 0.00 C ATOM 1549 C TRP A 119 -13.252 -14.942 24.962 1.00 0.00 C ATOM 1550 O TRP A 119 -13.083 -14.750 26.167 1.00 0.00 O ATOM 1551 CB TRP A 119 -11.288 -15.497 23.521 1.00 0.00 C ATOM 1552 CG TRP A 119 -10.520 -14.625 24.460 1.00 0.00 C ATOM 1553 CD1 TRP A 119 -10.412 -13.280 24.358 1.00 0.00 C ATOM 1554 CD2 TRP A 119 -9.754 -15.010 25.637 1.00 0.00 C ATOM 1555 NE1 TRP A 119 -9.628 -12.815 25.398 1.00 0.00 N ATOM 1556 CE2 TRP A 119 -9.198 -13.843 26.215 1.00 0.00 C ATOM 1557 CE3 TRP A 119 -9.490 -16.245 26.256 1.00 0.00 C ATOM 1558 CZ2 TRP A 119 -8.409 -13.899 27.364 1.00 0.00 C ATOM 1559 CZ3 TRP A 119 -8.695 -16.306 27.412 1.00 0.00 C ATOM 1560 CH2 TRP A 119 -8.156 -15.136 27.966 1.00 0.00 C ATOM 0 H TRP A 119 -13.115 -16.616 22.303 1.00 0.00 H new ATOM 0 HA TRP A 119 -12.192 -16.803 24.972 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -10.655 -16.309 23.162 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -11.597 -14.924 22.647 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -10.864 -12.670 23.590 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -9.395 -11.833 25.544 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -9.901 -17.153 25.839 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -7.997 -12.994 27.786 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -8.497 -17.260 27.877 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -7.547 -15.190 28.856 1.00 0.00 H new ATOM 1571 N LYS A 120 -14.066 -14.202 24.219 1.00 0.00 N ATOM 1572 CA LYS A 120 -14.824 -13.099 24.798 1.00 0.00 C ATOM 1573 C LYS A 120 -15.782 -13.614 25.865 1.00 0.00 C ATOM 1574 O LYS A 120 -15.993 -12.964 26.890 1.00 0.00 O ATOM 1575 CB LYS A 120 -15.612 -12.374 23.706 1.00 0.00 C ATOM 1576 CG LYS A 120 -16.302 -11.146 24.303 1.00 0.00 C ATOM 1577 CD LYS A 120 -17.044 -10.390 23.198 1.00 0.00 C ATOM 1578 CE LYS A 120 -17.720 -9.153 23.792 1.00 0.00 C ATOM 1579 NZ LYS A 120 -18.427 -8.406 22.712 1.00 0.00 N ATOM 0 H LYS A 120 -14.218 -14.344 23.220 1.00 0.00 H new ATOM 0 HA LYS A 120 -14.123 -12.403 25.259 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -14.943 -12.072 22.900 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -16.353 -13.045 23.271 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -17.001 -11.451 25.082 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -15.565 -10.494 24.773 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -16.347 -10.095 22.413 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -17.789 -11.038 22.736 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -18.427 -9.449 24.567 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -16.977 -8.512 24.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -18.667 -7.452 23.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -17.809 -8.333 21.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -19.299 -8.911 22.454 1.00 0.00 H new ATOM 1593 N ALA A 121 -16.362 -14.785 25.619 1.00 0.00 N ATOM 1594 CA ALA A 121 -17.298 -15.377 26.567 1.00 0.00 C ATOM 1595 C ALA A 121 -16.589 -15.732 27.870 1.00 0.00 C ATOM 1596 O ALA A 121 -17.102 -15.475 28.959 1.00 0.00 O ATOM 1597 CB ALA A 121 -17.921 -16.638 25.966 1.00 0.00 C ATOM 0 H ALA A 121 -16.202 -15.339 24.778 1.00 0.00 H new ATOM 0 HA ALA A 121 -18.081 -14.648 26.778 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -18.619 -17.075 26.680 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -18.453 -16.380 25.050 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -17.136 -17.359 25.739 1.00 0.00 H new ATOM 1603 N ARG A 122 -15.405 -16.322 27.750 1.00 0.00 N ATOM 1604 CA ARG A 122 -14.635 -16.709 28.924 1.00 0.00 C ATOM 1605 C ARG A 122 -14.312 -15.488 29.778 1.00 0.00 C ATOM 1606 O ARG A 122 -14.410 -15.530 31.005 1.00 0.00 O ATOM 1607 CB ARG A 122 -13.334 -17.387 28.494 1.00 0.00 C ATOM 1608 CG ARG A 122 -12.582 -17.899 29.738 1.00 0.00 C ATOM 1609 CD ARG A 122 -11.168 -17.319 29.760 1.00 0.00 C ATOM 1610 NE ARG A 122 -10.400 -17.909 30.845 1.00 0.00 N ATOM 1611 CZ ARG A 122 -9.183 -17.466 31.144 1.00 0.00 C ATOM 1612 NH1 ARG A 122 -8.512 -18.011 32.120 1.00 0.00 N ATOM 1613 NH2 ARG A 122 -8.659 -16.486 30.459 1.00 0.00 N ATOM 0 H ARG A 122 -14.961 -16.541 26.858 1.00 0.00 H new ATOM 0 HA ARG A 122 -15.232 -17.405 29.513 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -13.550 -18.216 27.820 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -12.710 -16.683 27.944 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -13.118 -17.611 30.643 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -12.539 -18.988 29.726 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -10.673 -17.511 28.808 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -11.213 -16.237 29.883 1.00 0.00 H new ATOM 0 HE ARG A 122 -10.802 -18.675 31.385 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -8.921 -18.778 32.654 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -7.578 -17.671 32.349 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -9.183 -16.060 29.695 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -7.725 -16.146 30.688 1.00 0.00 H new ATOM 1627 N LEU A 123 -13.929 -14.398 29.121 1.00 0.00 N ATOM 1628 CA LEU A 123 -13.598 -13.168 29.830 1.00 0.00 C ATOM 1629 C LEU A 123 -14.816 -12.639 30.577 1.00 0.00 C ATOM 1630 O LEU A 123 -14.701 -12.157 31.701 1.00 0.00 O ATOM 1631 CB LEU A 123 -13.103 -12.111 28.841 1.00 0.00 C ATOM 1632 CG LEU A 123 -11.726 -12.514 28.306 1.00 0.00 C ATOM 1633 CD1 LEU A 123 -11.303 -11.544 27.197 1.00 0.00 C ATOM 1634 CD2 LEU A 123 -10.700 -12.471 29.447 1.00 0.00 C ATOM 0 H LEU A 123 -13.841 -14.341 28.106 1.00 0.00 H new ATOM 0 HA LEU A 123 -12.810 -13.386 30.551 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -13.809 -12.010 28.017 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -13.044 -11.139 29.331 1.00 0.00 H new ATOM 0 HG LEU A 123 -11.775 -13.525 27.902 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -10.323 -11.831 26.817 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -12.031 -11.578 26.387 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.254 -10.532 27.598 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -9.720 -12.758 29.066 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -10.650 -11.461 29.853 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -11.001 -13.164 30.233 1.00 0.00 H new ATOM 1646 N SER A 124 -15.979 -12.736 29.946 1.00 0.00 N ATOM 1647 CA SER A 124 -17.215 -12.266 30.562 1.00 0.00 C ATOM 1648 C SER A 124 -17.587 -13.143 31.754 1.00 0.00 C ATOM 1649 O SER A 124 -18.043 -12.647 32.784 1.00 0.00 O ATOM 1650 CB SER A 124 -18.348 -12.278 29.538 1.00 0.00 C ATOM 1651 OG SER A 124 -19.532 -11.776 30.143 1.00 0.00 O ATOM 0 H SER A 124 -16.093 -13.133 29.014 1.00 0.00 H new ATOM 0 HA SER A 124 -17.059 -11.246 30.913 1.00 0.00 H new ATOM 0 HB2 SER A 124 -18.080 -11.669 28.675 1.00 0.00 H new ATOM 0 HB3 SER A 124 -18.514 -13.292 29.173 1.00 0.00 H new ATOM 0 HG SER A 124 -20.261 -11.781 29.488 1.00 0.00 H new ATOM 1657 N GLU A 125 -17.396 -14.450 31.603 1.00 0.00 N ATOM 1658 CA GLU A 125 -17.722 -15.389 32.669 1.00 0.00 C ATOM 1659 C GLU A 125 -16.915 -15.072 33.924 1.00 0.00 C ATOM 1660 O GLU A 125 -17.439 -15.112 35.037 1.00 0.00 O ATOM 1661 CB GLU A 125 -17.421 -16.819 32.215 1.00 0.00 C ATOM 1662 CG GLU A 125 -17.810 -17.799 33.323 1.00 0.00 C ATOM 1663 CD GLU A 125 -17.531 -19.230 32.876 1.00 0.00 C ATOM 1664 OE1 GLU A 125 -16.449 -19.470 32.367 1.00 0.00 O ATOM 1665 OE2 GLU A 125 -18.405 -20.064 33.048 1.00 0.00 O ATOM 0 H GLU A 125 -17.020 -14.880 30.758 1.00 0.00 H new ATOM 0 HA GLU A 125 -18.784 -15.297 32.899 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.974 -17.046 31.303 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -16.362 -16.922 31.980 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -17.248 -17.577 34.230 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -18.866 -17.685 33.566 1.00 0.00 H new ATOM 1672 N LEU A 126 -15.640 -14.752 33.735 1.00 0.00 N ATOM 1673 CA LEU A 126 -14.767 -14.421 34.855 1.00 0.00 C ATOM 1674 C LEU A 126 -15.192 -13.105 35.495 1.00 0.00 C ATOM 1675 O LEU A 126 -15.089 -12.931 36.709 1.00 0.00 O ATOM 1676 CB LEU A 126 -13.317 -14.325 34.382 1.00 0.00 C ATOM 1677 CG LEU A 126 -12.835 -15.706 33.931 1.00 0.00 C ATOM 1678 CD1 LEU A 126 -11.452 -15.579 33.290 1.00 0.00 C ATOM 1679 CD2 LEU A 126 -12.755 -16.646 35.140 1.00 0.00 C ATOM 0 H LEU A 126 -15.189 -14.715 32.821 1.00 0.00 H new ATOM 0 HA LEU A 126 -14.848 -15.213 35.600 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -13.238 -13.614 33.560 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -12.684 -13.952 35.188 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.537 -16.114 33.204 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -11.108 -16.562 32.969 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -11.510 -14.915 32.427 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -10.750 -15.169 34.017 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.412 -17.628 34.815 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -12.055 -16.240 35.871 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -13.741 -16.739 35.595 1.00 0.00 H new ATOM 1691 N GLN A 127 -15.664 -12.177 34.667 1.00 0.00 N ATOM 1692 CA GLN A 127 -16.099 -10.876 35.160 1.00 0.00 C ATOM 1693 C GLN A 127 -17.332 -11.020 36.047 1.00 0.00 C ATOM 1694 O GLN A 127 -17.430 -10.383 37.096 1.00 0.00 O ATOM 1695 CB GLN A 127 -16.420 -9.951 33.985 1.00 0.00 C ATOM 1696 CG GLN A 127 -15.117 -9.487 33.328 1.00 0.00 C ATOM 1697 CD GLN A 127 -15.426 -8.662 32.084 1.00 0.00 C ATOM 1698 OE1 GLN A 127 -16.591 -8.405 31.781 1.00 0.00 O ATOM 1699 NE2 GLN A 127 -14.446 -8.231 31.338 1.00 0.00 N ATOM 0 H GLN A 127 -15.754 -12.301 33.659 1.00 0.00 H new ATOM 0 HA GLN A 127 -15.290 -10.446 35.750 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -17.041 -10.473 33.257 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -16.991 -9.090 34.332 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -14.536 -8.893 34.033 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -14.508 -10.350 33.060 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -13.481 -8.445 31.590 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -14.645 -7.680 30.503 1.00 0.00 H new ATOM 1708 N GLN A 128 -18.266 -11.861 35.619 1.00 0.00 N ATOM 1709 CA GLN A 128 -19.489 -12.083 36.382 1.00 0.00 C ATOM 1710 C GLN A 128 -19.159 -12.559 37.791 1.00 0.00 C ATOM 1711 O GLN A 128 -19.823 -12.181 38.757 1.00 0.00 O ATOM 1712 CB GLN A 128 -20.365 -13.121 35.679 1.00 0.00 C ATOM 1713 CG GLN A 128 -20.903 -12.536 34.372 1.00 0.00 C ATOM 1714 CD GLN A 128 -21.711 -13.590 33.623 1.00 0.00 C ATOM 1715 OE1 GLN A 128 -21.168 -14.617 33.216 1.00 0.00 O ATOM 1716 NE2 GLN A 128 -22.985 -13.396 33.415 1.00 0.00 N ATOM 0 H GLN A 128 -18.201 -12.397 34.754 1.00 0.00 H new ATOM 0 HA GLN A 128 -20.031 -11.140 36.447 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -19.787 -14.022 35.475 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -21.192 -13.413 36.327 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -21.528 -11.668 34.582 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -20.076 -12.190 33.751 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -23.433 -12.544 33.753 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -23.532 -14.096 32.914 1.00 0.00 H new ATOM 1725 N TYR A 129 -18.125 -13.385 37.905 1.00 0.00 N ATOM 1726 CA TYR A 129 -17.708 -13.900 39.203 1.00 0.00 C ATOM 1727 C TYR A 129 -17.210 -12.767 40.095 1.00 0.00 C ATOM 1728 O TYR A 129 -17.452 -12.761 41.302 1.00 0.00 O ATOM 1729 CB TYR A 129 -16.600 -14.941 39.026 1.00 0.00 C ATOM 1730 CG TYR A 129 -17.214 -16.289 38.734 1.00 0.00 C ATOM 1731 CD1 TYR A 129 -17.050 -16.879 37.475 1.00 0.00 C ATOM 1732 CD2 TYR A 129 -17.949 -16.950 39.726 1.00 0.00 C ATOM 1733 CE1 TYR A 129 -17.621 -18.129 37.207 1.00 0.00 C ATOM 1734 CE2 TYR A 129 -18.520 -18.200 39.459 1.00 0.00 C ATOM 1735 CZ TYR A 129 -18.355 -18.790 38.200 1.00 0.00 C ATOM 1736 OH TYR A 129 -18.919 -20.022 37.937 1.00 0.00 O ATOM 0 H TYR A 129 -17.563 -13.711 37.119 1.00 0.00 H new ATOM 0 HA TYR A 129 -18.570 -14.369 39.678 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -15.938 -14.647 38.211 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -15.991 -14.995 39.928 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -16.483 -16.370 36.710 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -18.075 -16.495 40.697 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -17.496 -18.583 36.235 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -19.088 -18.709 40.224 1.00 0.00 H new ATOM 0 HH TYR A 129 -19.393 -20.342 38.733 1.00 0.00 H new ATOM 1746 N ARG A 130 -16.509 -11.813 39.492 1.00 0.00 N ATOM 1747 CA ARG A 130 -15.978 -10.680 40.241 1.00 0.00 C ATOM 1748 C ARG A 130 -17.110 -9.886 40.884 1.00 0.00 C ATOM 1749 O ARG A 130 -17.012 -9.467 42.036 1.00 0.00 O ATOM 1750 CB ARG A 130 -15.177 -9.767 39.310 1.00 0.00 C ATOM 1751 CG ARG A 130 -14.552 -8.631 40.123 1.00 0.00 C ATOM 1752 CD ARG A 130 -13.734 -7.730 39.195 1.00 0.00 C ATOM 1753 NE ARG A 130 -14.612 -7.063 38.240 1.00 0.00 N ATOM 1754 CZ ARG A 130 -14.118 -6.295 37.274 1.00 0.00 C ATOM 1755 NH1 ARG A 130 -14.923 -5.709 36.431 1.00 0.00 N ATOM 1756 NH2 ARG A 130 -12.827 -6.129 37.169 1.00 0.00 N ATOM 0 H ARG A 130 -16.296 -11.801 38.494 1.00 0.00 H new ATOM 0 HA ARG A 130 -15.325 -11.061 41.026 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -14.398 -10.338 38.805 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -15.827 -9.359 38.535 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -15.332 -8.051 40.616 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -13.914 -9.039 40.907 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -13.192 -6.988 39.781 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -12.990 -8.323 38.664 1.00 0.00 H new ATOM 0 HE ARG A 130 -15.622 -7.188 38.315 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -15.931 -5.840 36.513 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -14.544 -5.120 35.690 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -12.198 -6.589 37.828 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -12.447 -5.540 36.428 1.00 0.00 H new ATOM 1770 N GLU A 131 -18.186 -9.682 40.131 1.00 0.00 N ATOM 1771 CA GLU A 131 -19.330 -8.937 40.641 1.00 0.00 C ATOM 1772 C GLU A 131 -19.997 -9.691 41.787 1.00 0.00 C ATOM 1773 O GLU A 131 -20.419 -9.093 42.775 1.00 0.00 O ATOM 1774 CB GLU A 131 -20.346 -8.711 39.519 1.00 0.00 C ATOM 1775 CG GLU A 131 -19.755 -7.757 38.479 1.00 0.00 C ATOM 1776 CD GLU A 131 -20.724 -7.593 37.312 1.00 0.00 C ATOM 1777 OE1 GLU A 131 -21.788 -8.187 37.364 1.00 0.00 O ATOM 1778 OE2 GLU A 131 -20.387 -6.874 36.386 1.00 0.00 O ATOM 0 H GLU A 131 -18.289 -10.019 39.174 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.976 -7.976 41.013 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -20.604 -9.661 39.051 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -21.268 -8.296 39.927 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.554 -6.788 38.935 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -18.801 -8.143 38.119 1.00 0.00 H new