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 -153:sc= -0.207 (180deg=-0.974) USER MOD Set 1.2: A 116 CYS SG : rot 77:sc= 0.905 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=-0.34) USER MOD Set 3.1: A 33 SER OG : rot 180:sc= -1.92 USER MOD Set 3.2: A 37 LYS NZ :NH3+ -166:sc= 0.0375 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 HIS : no HE2:sc= 0.545 K(o=0.54,f=-2.7!) USER MOD Single : A 48 LYS NZ :NH3+ -150:sc= 0.99 (180deg=0.108) USER MOD Single : A 49 HIS :FLIP no HD1:sc= -0.403 F(o=-1.3,f=-0.4) USER MOD Single : A 57 SER OG : rot 117:sc= -4.76! 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 -49:sc= -8.14! USER MOD Single : A 84 GLN : amide:sc= -12.4! C(o=-12!,f=-15!) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl -154:sc= -0.184 (180deg=-1.03) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN :FLIP amide:sc= -1.44 F(o=-2.5!,f=-1.4) USER MOD Single : A 98 HIS : no HE2:sc= 0.377! C(o=0.38!,f=-9.4!) USER MOD Single : A 105 THR OG1 : rot -28:sc= 0.0393 USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.758 USER MOD Single : A 114 GLN : amide:sc= -0.234 X(o=-0.23,f=-0.33) USER MOD Single : A 120 LYS NZ :NH3+ -162:sc= 0.805 (180deg=0.0229!) 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= -0.0392 K(o=-0.039,f=-2.6!) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 133 N SER A 33 0.105 -12.654 8.732 1.00 0.00 N ATOM 134 CA SER A 33 -0.317 -12.456 10.104 1.00 0.00 C ATOM 135 C SER A 33 -1.604 -13.221 10.387 1.00 0.00 C ATOM 136 O SER A 33 -1.683 -13.983 11.349 1.00 0.00 O ATOM 137 CB SER A 33 -0.519 -10.956 10.363 1.00 0.00 C ATOM 138 OG SER A 33 -1.615 -10.478 9.591 1.00 0.00 O ATOM 0 HA SER A 33 0.455 -12.837 10.772 1.00 0.00 H new ATOM 0 HB2 SER A 33 -0.705 -10.782 11.423 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.387 -10.408 10.104 1.00 0.00 H new ATOM 0 HG SER A 33 -1.742 -9.521 9.760 1.00 0.00 H new ATOM 144 N LEU A 34 -2.627 -12.980 9.564 1.00 0.00 N ATOM 145 CA LEU A 34 -3.925 -13.611 9.768 1.00 0.00 C ATOM 146 C LEU A 34 -3.757 -15.038 10.245 1.00 0.00 C ATOM 147 O LEU A 34 -4.485 -15.498 11.127 1.00 0.00 O ATOM 148 CB LEU A 34 -4.728 -13.584 8.468 1.00 0.00 C ATOM 149 CG LEU A 34 -6.080 -14.271 8.681 1.00 0.00 C ATOM 150 CD1 LEU A 34 -6.850 -13.570 9.805 1.00 0.00 C ATOM 151 CD2 LEU A 34 -6.891 -14.201 7.386 1.00 0.00 C ATOM 0 H LEU A 34 -2.579 -12.357 8.758 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.465 -13.053 10.534 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.880 -12.554 8.144 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.174 -14.088 7.677 1.00 0.00 H new ATOM 0 HG LEU A 34 -5.916 -15.313 8.957 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -7.811 -14.064 9.951 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -6.272 -13.620 10.728 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -7.016 -12.527 9.537 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.854 -14.689 7.533 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.051 -13.158 7.113 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.347 -14.706 6.588 1.00 0.00 H new ATOM 163 N GLU A 35 -2.795 -15.731 9.665 1.00 0.00 N ATOM 164 CA GLU A 35 -2.535 -17.110 10.041 1.00 0.00 C ATOM 165 C GLU A 35 -2.027 -17.190 11.477 1.00 0.00 C ATOM 166 O GLU A 35 -2.458 -18.043 12.249 1.00 0.00 O ATOM 167 CB GLU A 35 -1.493 -17.714 9.101 1.00 0.00 C ATOM 168 CG GLU A 35 -1.603 -19.237 9.127 1.00 0.00 C ATOM 169 CD GLU A 35 -2.835 -19.683 8.348 1.00 0.00 C ATOM 170 OE1 GLU A 35 -3.134 -20.865 8.378 1.00 0.00 O ATOM 171 OE2 GLU A 35 -3.461 -18.836 7.731 1.00 0.00 O ATOM 0 H GLU A 35 -2.183 -15.365 8.935 1.00 0.00 H new ATOM 0 HA GLU A 35 -3.468 -17.669 9.966 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -1.646 -17.345 8.087 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -0.492 -17.406 9.405 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -0.707 -19.682 8.694 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.667 -19.588 10.157 1.00 0.00 H new ATOM 178 N GLU A 36 -1.107 -16.299 11.827 1.00 0.00 N ATOM 179 CA GLU A 36 -0.547 -16.290 13.171 1.00 0.00 C ATOM 180 C GLU A 36 -1.619 -15.931 14.199 1.00 0.00 C ATOM 181 O GLU A 36 -1.674 -16.515 15.281 1.00 0.00 O ATOM 182 CB GLU A 36 0.593 -15.280 13.250 1.00 0.00 C ATOM 183 CG GLU A 36 1.755 -15.725 12.371 1.00 0.00 C ATOM 184 CD GLU A 36 2.843 -14.655 12.356 1.00 0.00 C ATOM 185 OE1 GLU A 36 2.686 -13.666 13.053 1.00 0.00 O ATOM 186 OE2 GLU A 36 3.816 -14.841 11.645 1.00 0.00 O ATOM 0 H GLU A 36 -0.736 -15.580 11.205 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.168 -17.287 13.393 1.00 0.00 H new ATOM 0 HB2 GLU A 36 0.242 -14.299 12.931 1.00 0.00 H new ATOM 0 HB3 GLU A 36 0.927 -15.178 14.283 1.00 0.00 H new ATOM 0 HG2 GLU A 36 2.163 -16.664 12.743 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.403 -15.911 11.356 1.00 0.00 H new ATOM 193 N LYS A 37 -2.468 -14.965 13.857 1.00 0.00 N ATOM 194 CA LYS A 37 -3.524 -14.534 14.772 1.00 0.00 C ATOM 195 C LYS A 37 -4.414 -15.719 15.138 1.00 0.00 C ATOM 196 O LYS A 37 -4.725 -15.933 16.308 1.00 0.00 O ATOM 197 CB LYS A 37 -4.388 -13.465 14.097 1.00 0.00 C ATOM 198 CG LYS A 37 -3.490 -12.373 13.534 1.00 0.00 C ATOM 199 CD LYS A 37 -4.328 -11.373 12.725 1.00 0.00 C ATOM 200 CE LYS A 37 -3.470 -10.769 11.611 1.00 0.00 C ATOM 201 NZ LYS A 37 -4.347 -10.040 10.643 1.00 0.00 N ATOM 0 H LYS A 37 -2.448 -14.471 12.965 1.00 0.00 H new ATOM 0 HA LYS A 37 -3.061 -14.128 15.672 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -4.981 -13.911 13.299 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.089 -13.041 14.816 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -2.977 -11.858 14.346 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -2.721 -12.814 12.899 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -5.197 -11.873 12.298 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -4.702 -10.585 13.378 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -2.733 -10.087 12.035 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -2.918 -11.555 11.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -3.812 -9.836 9.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -5.172 -10.629 10.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -4.668 -9.148 11.070 1.00 0.00 H new ATOM 215 N ILE A 38 -4.814 -16.493 14.132 1.00 0.00 N ATOM 216 CA ILE A 38 -5.665 -17.655 14.368 1.00 0.00 C ATOM 217 C ILE A 38 -4.926 -18.691 15.215 1.00 0.00 C ATOM 218 O ILE A 38 -5.491 -19.262 16.147 1.00 0.00 O ATOM 219 CB ILE A 38 -6.075 -18.283 13.035 1.00 0.00 C ATOM 220 CG1 ILE A 38 -6.988 -17.316 12.279 1.00 0.00 C ATOM 221 CG2 ILE A 38 -6.833 -19.587 13.295 1.00 0.00 C ATOM 222 CD1 ILE A 38 -7.187 -17.817 10.847 1.00 0.00 C ATOM 0 H ILE A 38 -4.565 -16.339 13.155 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.557 -17.329 14.903 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.183 -18.489 12.443 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.950 -17.237 12.785 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.550 -16.318 12.269 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.125 -20.034 12.345 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.190 -20.279 13.839 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.724 -19.378 13.887 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.838 -17.128 10.308 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.222 -17.874 10.344 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.644 -18.806 10.868 1.00 0.00 H new ATOM 234 N LYS A 39 -3.662 -18.926 14.884 1.00 0.00 N ATOM 235 CA LYS A 39 -2.858 -19.898 15.615 1.00 0.00 C ATOM 236 C LYS A 39 -2.733 -19.482 17.075 1.00 0.00 C ATOM 237 O LYS A 39 -2.790 -20.321 17.976 1.00 0.00 O ATOM 238 CB LYS A 39 -1.466 -19.990 14.986 1.00 0.00 C ATOM 239 CG LYS A 39 -1.580 -20.628 13.598 1.00 0.00 C ATOM 240 CD LYS A 39 -0.266 -20.446 12.821 1.00 0.00 C ATOM 241 CE LYS A 39 0.751 -21.503 13.235 1.00 0.00 C ATOM 242 NZ LYS A 39 1.831 -21.578 12.218 1.00 0.00 N ATOM 0 H LYS A 39 -3.174 -18.460 14.119 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.345 -20.872 15.564 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -1.023 -18.997 14.907 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -0.807 -20.584 15.619 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.810 -21.689 13.695 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -2.403 -20.173 13.047 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -0.457 -20.517 11.750 1.00 0.00 H new ATOM 0 HD3 LYS A 39 0.139 -19.451 13.007 1.00 0.00 H new ATOM 0 HE2 LYS A 39 1.172 -21.256 14.210 1.00 0.00 H new ATOM 0 HE3 LYS A 39 0.263 -22.473 13.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 2.525 -22.299 12.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 1.423 -21.833 11.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 2.303 -20.654 12.144 1.00 0.00 H new ATOM 256 N LEU A 40 -2.556 -18.185 17.306 1.00 0.00 N ATOM 257 CA LEU A 40 -2.425 -17.677 18.666 1.00 0.00 C ATOM 258 C LEU A 40 -3.731 -17.841 19.439 1.00 0.00 C ATOM 259 O LEU A 40 -3.742 -18.331 20.568 1.00 0.00 O ATOM 260 CB LEU A 40 -2.036 -16.197 18.632 1.00 0.00 C ATOM 261 CG LEU A 40 -1.920 -15.661 20.063 1.00 0.00 C ATOM 262 CD1 LEU A 40 -0.890 -16.487 20.838 1.00 0.00 C ATOM 263 CD2 LEU A 40 -1.477 -14.198 20.022 1.00 0.00 C ATOM 0 H LEU A 40 -2.500 -17.474 16.577 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.648 -18.251 19.170 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.088 -16.072 18.109 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.783 -15.627 18.079 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.888 -15.735 20.559 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.808 -16.105 21.856 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.207 -17.530 20.866 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.079 -16.415 20.345 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.394 -13.814 21.039 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.509 -14.125 19.526 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.212 -13.611 19.472 1.00 0.00 H new ATOM 275 N MET A 41 -4.829 -17.427 18.820 1.00 0.00 N ATOM 276 CA MET A 41 -6.139 -17.523 19.447 1.00 0.00 C ATOM 277 C MET A 41 -6.538 -18.982 19.614 1.00 0.00 C ATOM 278 O MET A 41 -7.254 -19.342 20.548 1.00 0.00 O ATOM 279 CB MET A 41 -7.181 -16.785 18.608 1.00 0.00 C ATOM 280 CG MET A 41 -7.029 -15.274 18.803 1.00 0.00 C ATOM 281 SD MET A 41 -7.428 -14.833 20.515 1.00 0.00 S ATOM 282 CE MET A 41 -9.218 -15.076 20.407 1.00 0.00 C ATOM 0 H MET A 41 -4.838 -17.022 17.884 1.00 0.00 H new ATOM 0 HA MET A 41 -6.089 -17.059 20.432 1.00 0.00 H new ATOM 0 HB2 MET A 41 -7.059 -17.039 17.555 1.00 0.00 H new ATOM 0 HB3 MET A 41 -8.184 -17.099 18.898 1.00 0.00 H new ATOM 0 HG2 MET A 41 -6.010 -14.968 18.567 1.00 0.00 H new ATOM 0 HG3 MET A 41 -7.688 -14.741 18.117 1.00 0.00 H new ATOM 0 HE1 MET A 41 -9.716 -14.439 21.137 1.00 0.00 H new ATOM 0 HE2 MET A 41 -9.561 -14.817 19.405 1.00 0.00 H new ATOM 0 HE3 MET A 41 -9.457 -16.119 20.613 1.00 0.00 H new ATOM 292 N ARG A 42 -6.077 -19.820 18.695 1.00 0.00 N ATOM 293 CA ARG A 42 -6.399 -21.238 18.745 1.00 0.00 C ATOM 294 C ARG A 42 -5.799 -21.878 19.988 1.00 0.00 C ATOM 295 O ARG A 42 -6.214 -22.961 20.399 1.00 0.00 O ATOM 296 CB ARG A 42 -5.877 -21.953 17.486 1.00 0.00 C ATOM 297 CG ARG A 42 -6.951 -21.965 16.389 1.00 0.00 C ATOM 298 CD ARG A 42 -6.667 -23.107 15.425 1.00 0.00 C ATOM 299 NE ARG A 42 -5.355 -22.947 14.796 1.00 0.00 N ATOM 300 CZ ARG A 42 -5.226 -22.627 13.512 1.00 0.00 C ATOM 301 NH1 ARG A 42 -4.039 -22.496 12.988 1.00 0.00 N ATOM 302 NH2 ARG A 42 -6.288 -22.447 12.775 1.00 0.00 N ATOM 0 H ARG A 42 -5.484 -19.545 17.912 1.00 0.00 H new ATOM 0 HA ARG A 42 -7.484 -21.340 18.785 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -4.981 -21.451 17.121 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -5.591 -22.975 17.734 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -7.940 -22.084 16.832 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.954 -21.015 15.855 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -6.705 -24.057 15.959 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -7.441 -23.141 14.658 1.00 0.00 H new ATOM 0 HE ARG A 42 -4.516 -23.085 15.359 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -3.209 -22.639 13.563 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -3.941 -22.251 12.003 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.216 -22.552 13.184 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -6.190 -22.201 11.790 1.00 0.00 H new ATOM 316 N LEU A 43 -4.826 -21.206 20.579 1.00 0.00 N ATOM 317 CA LEU A 43 -4.181 -21.717 21.780 1.00 0.00 C ATOM 318 C LEU A 43 -4.831 -21.142 23.031 1.00 0.00 C ATOM 319 O LEU A 43 -4.972 -21.831 24.040 1.00 0.00 O ATOM 320 CB LEU A 43 -2.691 -21.373 21.764 1.00 0.00 C ATOM 321 CG LEU A 43 -1.930 -22.409 20.930 1.00 0.00 C ATOM 322 CD1 LEU A 43 -0.466 -21.986 20.816 1.00 0.00 C ATOM 323 CD2 LEU A 43 -2.015 -23.792 21.603 1.00 0.00 C ATOM 0 H LEU A 43 -4.466 -20.310 20.251 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.300 -22.800 21.796 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.543 -20.377 21.347 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.301 -21.354 22.782 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.375 -22.469 19.937 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.080 -22.720 20.223 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.406 -21.011 20.332 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.027 -21.924 21.812 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.471 -24.522 21.004 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.575 -23.740 22.599 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.059 -24.094 21.684 1.00 0.00 H new ATOM 335 N VAL A 44 -5.215 -19.875 22.959 1.00 0.00 N ATOM 336 CA VAL A 44 -5.839 -19.217 24.100 1.00 0.00 C ATOM 337 C VAL A 44 -7.162 -19.894 24.443 1.00 0.00 C ATOM 338 O VAL A 44 -7.445 -20.171 25.609 1.00 0.00 O ATOM 339 CB VAL A 44 -6.082 -17.739 23.778 1.00 0.00 C ATOM 340 CG1 VAL A 44 -6.690 -17.024 24.994 1.00 0.00 C ATOM 341 CG2 VAL A 44 -4.752 -17.073 23.409 1.00 0.00 C ATOM 0 H VAL A 44 -5.107 -19.287 22.132 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.171 -19.294 24.958 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.776 -17.668 22.941 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -6.858 -15.974 24.753 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -7.639 -17.493 25.255 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -6.005 -17.097 25.839 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.923 -16.021 23.180 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.060 -17.154 24.247 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.326 -17.570 22.537 1.00 0.00 H new ATOM 351 N VAL A 45 -7.968 -20.155 23.423 1.00 0.00 N ATOM 352 CA VAL A 45 -9.260 -20.795 23.624 1.00 0.00 C ATOM 353 C VAL A 45 -9.076 -22.208 24.165 1.00 0.00 C ATOM 354 O VAL A 45 -9.803 -22.644 25.055 1.00 0.00 O ATOM 355 CB VAL A 45 -10.041 -20.836 22.312 1.00 0.00 C ATOM 356 CG1 VAL A 45 -11.265 -21.736 22.472 1.00 0.00 C ATOM 357 CG2 VAL A 45 -10.501 -19.419 21.952 1.00 0.00 C ATOM 0 H VAL A 45 -7.751 -19.934 22.451 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.824 -20.212 24.352 1.00 0.00 H new ATOM 0 HB VAL A 45 -9.401 -21.229 21.522 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -11.821 -21.764 21.535 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -10.944 -22.744 22.734 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -11.905 -21.343 23.262 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -11.059 -19.444 21.016 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -11.140 -19.032 22.745 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.631 -18.772 21.839 1.00 0.00 H new ATOM 367 N ARG A 46 -8.102 -22.918 23.611 1.00 0.00 N ATOM 368 CA ARG A 46 -7.830 -24.284 24.034 1.00 0.00 C ATOM 369 C ARG A 46 -7.334 -24.310 25.476 1.00 0.00 C ATOM 370 O ARG A 46 -7.296 -25.363 26.110 1.00 0.00 O ATOM 371 CB ARG A 46 -6.780 -24.919 23.118 1.00 0.00 C ATOM 372 CG ARG A 46 -6.837 -26.444 23.251 1.00 0.00 C ATOM 373 CD ARG A 46 -7.870 -27.006 22.270 1.00 0.00 C ATOM 374 NE ARG A 46 -7.977 -28.451 22.423 1.00 0.00 N ATOM 375 CZ ARG A 46 -7.192 -29.274 21.737 1.00 0.00 C ATOM 376 NH1 ARG A 46 -7.308 -30.565 21.890 1.00 0.00 N ATOM 377 NH2 ARG A 46 -6.306 -28.792 20.908 1.00 0.00 N ATOM 0 H ARG A 46 -7.490 -22.572 22.872 1.00 0.00 H new ATOM 0 HA ARG A 46 -8.757 -24.854 23.970 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -6.961 -24.627 22.084 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -5.786 -24.558 23.382 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -5.856 -26.874 23.048 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -7.101 -26.721 24.272 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.840 -26.542 22.447 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -7.581 -26.762 21.248 1.00 0.00 H new ATOM 0 HE ARG A 46 -8.666 -28.837 23.068 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -8.001 -30.942 22.536 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -6.705 -31.197 21.363 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -6.216 -27.783 20.787 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -5.703 -29.424 20.381 1.00 0.00 H new ATOM 391 N HIS A 47 -6.949 -23.145 25.987 1.00 0.00 N ATOM 392 CA HIS A 47 -6.454 -23.042 27.358 1.00 0.00 C ATOM 393 C HIS A 47 -7.192 -21.942 28.115 1.00 0.00 C ATOM 394 O HIS A 47 -6.640 -21.329 29.027 1.00 0.00 O ATOM 395 CB HIS A 47 -4.955 -22.747 27.349 1.00 0.00 C ATOM 396 CG HIS A 47 -4.220 -23.899 26.718 1.00 0.00 C ATOM 397 ND1 HIS A 47 -3.685 -23.825 25.441 1.00 0.00 N ATOM 398 CD2 HIS A 47 -3.924 -25.159 27.174 1.00 0.00 C ATOM 399 CE1 HIS A 47 -3.101 -25.007 25.176 1.00 0.00 C ATOM 400 NE2 HIS A 47 -3.216 -25.857 26.200 1.00 0.00 N ATOM 0 H HIS A 47 -6.969 -22.262 25.477 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.633 -23.992 27.862 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -4.758 -21.829 26.795 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -4.599 -22.588 28.367 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -3.727 -23.020 24.816 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.199 -25.550 28.142 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.600 -25.241 24.248 1.00 0.00 H new ATOM 407 N LYS A 48 -8.440 -21.700 27.733 1.00 0.00 N ATOM 408 CA LYS A 48 -9.244 -20.671 28.386 1.00 0.00 C ATOM 409 C LYS A 48 -9.625 -21.102 29.799 1.00 0.00 C ATOM 410 O LYS A 48 -9.812 -20.266 30.684 1.00 0.00 O ATOM 411 CB LYS A 48 -10.508 -20.402 27.572 1.00 0.00 C ATOM 412 CG LYS A 48 -11.369 -21.664 27.530 1.00 0.00 C ATOM 413 CD LYS A 48 -12.605 -21.411 26.664 1.00 0.00 C ATOM 414 CE LYS A 48 -13.463 -22.675 26.617 1.00 0.00 C ATOM 415 NZ LYS A 48 -14.668 -22.428 25.776 1.00 0.00 N ATOM 0 H LYS A 48 -8.916 -22.197 26.980 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.651 -19.758 28.447 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.070 -19.580 28.016 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.243 -20.097 26.560 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -10.793 -22.497 27.126 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.670 -21.945 28.539 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.183 -20.581 27.071 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.304 -21.126 25.656 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -12.885 -23.504 26.209 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -13.763 -22.961 27.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.456 -23.013 26.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.932 -21.424 25.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -14.458 -22.674 24.788 1.00 0.00 H new ATOM 429 N HIS A 49 -9.743 -22.410 30.001 1.00 0.00 N ATOM 430 CA HIS A 49 -10.106 -22.942 31.309 1.00 0.00 C ATOM 431 C HIS A 49 -9.011 -22.649 32.329 1.00 0.00 C ATOM 432 O HIS A 49 -9.295 -22.317 33.480 1.00 0.00 O ATOM 433 CB HIS A 49 -10.328 -24.452 31.217 1.00 0.00 C ATOM 434 CG HIS A 49 -11.613 -24.728 30.486 1.00 0.00 C ATOM 435 ND1 HIS A 49 -12.892 -24.950 30.932 1.00 0.00 N flip ATOM 436 CD2 HIS A 49 -11.677 -24.801 29.104 1.00 0.00 C flip ATOM 437 CE1 HIS A 49 -13.739 -25.157 29.846 1.00 0.00 C flip ATOM 438 NE2 HIS A 49 -12.955 -25.057 28.769 1.00 0.00 N flip ATOM 0 H HIS A 49 -9.594 -23.117 29.281 1.00 0.00 H new ATOM 0 HA HIS A 49 -11.028 -22.459 31.633 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -9.493 -24.922 30.697 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -10.365 -24.886 32.216 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -10.851 -24.675 28.420 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -14.800 -25.355 29.869 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -13.285 -25.162 27.810 1.00 0.00 H new ATOM 445 N GLU A 50 -7.761 -22.773 31.899 1.00 0.00 N ATOM 446 CA GLU A 50 -6.632 -22.518 32.785 1.00 0.00 C ATOM 447 C GLU A 50 -6.854 -21.242 33.587 1.00 0.00 C ATOM 448 O GLU A 50 -6.630 -20.138 33.091 1.00 0.00 O ATOM 449 CB GLU A 50 -5.343 -22.389 31.972 1.00 0.00 C ATOM 450 CG GLU A 50 -4.972 -23.750 31.384 1.00 0.00 C ATOM 451 CD GLU A 50 -3.721 -23.621 30.521 1.00 0.00 C ATOM 452 OE1 GLU A 50 -3.236 -22.511 30.376 1.00 0.00 O ATOM 453 OE2 GLU A 50 -3.264 -24.635 30.020 1.00 0.00 O ATOM 0 H GLU A 50 -7.505 -23.046 30.950 1.00 0.00 H new ATOM 0 HA GLU A 50 -6.545 -23.358 33.474 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.476 -21.660 31.173 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.536 -22.023 32.606 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.798 -24.467 32.186 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -5.798 -24.135 30.786 1.00 0.00 H new ATOM 567 N SER A 57 -0.908 -13.419 35.105 1.00 0.00 N ATOM 568 CA SER A 57 0.295 -13.509 34.291 1.00 0.00 C ATOM 569 C SER A 57 0.597 -14.967 33.940 1.00 0.00 C ATOM 570 O SER A 57 0.833 -15.310 32.782 1.00 0.00 O ATOM 571 CB SER A 57 1.479 -12.920 35.069 1.00 0.00 C ATOM 572 OG SER A 57 2.703 -13.412 34.541 1.00 0.00 O ATOM 0 HA SER A 57 0.138 -12.950 33.369 1.00 0.00 H new ATOM 0 HB2 SER A 57 1.459 -11.832 35.008 1.00 0.00 H new ATOM 0 HB3 SER A 57 1.398 -13.182 36.124 1.00 0.00 H new ATOM 0 HG SER A 57 3.226 -12.667 34.179 1.00 0.00 H new ATOM 578 N GLU A 58 0.575 -15.814 34.962 1.00 0.00 N ATOM 579 CA GLU A 58 0.845 -17.233 34.778 1.00 0.00 C ATOM 580 C GLU A 58 0.139 -17.773 33.541 1.00 0.00 C ATOM 581 O GLU A 58 0.568 -18.766 32.955 1.00 0.00 O ATOM 582 CB GLU A 58 0.377 -17.991 36.019 1.00 0.00 C ATOM 583 CG GLU A 58 0.664 -19.486 35.850 1.00 0.00 C ATOM 584 CD GLU A 58 0.368 -20.228 37.150 1.00 0.00 C ATOM 585 OE1 GLU A 58 -0.191 -19.613 38.043 1.00 0.00 O ATOM 586 OE2 GLU A 58 0.709 -21.395 37.237 1.00 0.00 O ATOM 0 H GLU A 58 0.373 -15.543 35.924 1.00 0.00 H new ATOM 0 HA GLU A 58 1.917 -17.372 34.636 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.888 -17.611 36.903 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.690 -17.831 36.174 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.054 -19.892 35.043 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.706 -19.634 35.567 1.00 0.00 H new ATOM 593 N PHE A 59 -0.945 -17.116 33.148 1.00 0.00 N ATOM 594 CA PHE A 59 -1.701 -17.546 31.979 1.00 0.00 C ATOM 595 C PHE A 59 -1.017 -17.090 30.695 1.00 0.00 C ATOM 596 O PHE A 59 -0.530 -17.906 29.914 1.00 0.00 O ATOM 597 CB PHE A 59 -3.119 -16.974 32.035 1.00 0.00 C ATOM 598 CG PHE A 59 -3.836 -17.280 30.746 1.00 0.00 C ATOM 599 CD1 PHE A 59 -4.028 -18.610 30.352 1.00 0.00 C ATOM 600 CD2 PHE A 59 -4.315 -16.237 29.944 1.00 0.00 C ATOM 601 CE1 PHE A 59 -4.697 -18.897 29.156 1.00 0.00 C ATOM 602 CE2 PHE A 59 -4.985 -16.524 28.749 1.00 0.00 C ATOM 603 CZ PHE A 59 -5.176 -17.854 28.355 1.00 0.00 C ATOM 0 H PHE A 59 -1.318 -16.290 33.617 1.00 0.00 H new ATOM 0 HA PHE A 59 -1.747 -18.635 31.983 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -3.663 -17.403 32.877 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.082 -15.897 32.196 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.660 -19.415 30.971 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -4.168 -15.211 30.247 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.843 -19.923 28.852 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.355 -15.719 28.131 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.693 -18.075 27.433 1.00 0.00 H new ATOM 613 N TYR A 60 -0.986 -15.780 30.486 1.00 0.00 N ATOM 614 CA TYR A 60 -0.368 -15.222 29.294 1.00 0.00 C ATOM 615 C TYR A 60 1.090 -15.667 29.194 1.00 0.00 C ATOM 616 O TYR A 60 1.636 -15.802 28.096 1.00 0.00 O ATOM 617 CB TYR A 60 -0.438 -13.698 29.341 1.00 0.00 C ATOM 618 CG TYR A 60 -1.846 -13.256 29.628 1.00 0.00 C ATOM 619 CD1 TYR A 60 -2.186 -12.796 30.905 1.00 0.00 C ATOM 620 CD2 TYR A 60 -2.818 -13.311 28.621 1.00 0.00 C ATOM 621 CE1 TYR A 60 -3.498 -12.390 31.177 1.00 0.00 C ATOM 622 CE2 TYR A 60 -4.130 -12.905 28.893 1.00 0.00 C ATOM 623 CZ TYR A 60 -4.470 -12.445 30.171 1.00 0.00 C ATOM 624 OH TYR A 60 -5.760 -12.043 30.437 1.00 0.00 O ATOM 0 H TYR A 60 -1.380 -15.088 31.124 1.00 0.00 H new ATOM 0 HA TYR A 60 -0.907 -15.583 28.418 1.00 0.00 H new ATOM 0 HB2 TYR A 60 0.235 -13.318 30.110 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -0.104 -13.281 28.391 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -1.436 -12.754 31.681 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -2.556 -13.666 27.635 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -3.760 -12.035 32.163 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -4.880 -12.947 28.117 1.00 0.00 H new ATOM 0 HH TYR A 60 -6.307 -12.144 29.630 1.00 0.00 H new ATOM 634 N ALA A 61 1.714 -15.897 30.344 1.00 0.00 N ATOM 635 CA ALA A 61 3.106 -16.334 30.379 1.00 0.00 C ATOM 636 C ALA A 61 3.240 -17.746 29.814 1.00 0.00 C ATOM 637 O ALA A 61 4.321 -18.159 29.391 1.00 0.00 O ATOM 638 CB ALA A 61 3.636 -16.296 31.818 1.00 0.00 C ATOM 0 H ALA A 61 1.281 -15.789 31.261 1.00 0.00 H new ATOM 0 HA ALA A 61 3.695 -15.654 29.763 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.675 -16.624 31.832 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.572 -15.278 32.203 1.00 0.00 H new ATOM 0 HB3 ALA A 61 3.038 -16.959 32.444 1.00 0.00 H new ATOM 644 N LYS A 62 2.137 -18.484 29.820 1.00 0.00 N ATOM 645 CA LYS A 62 2.142 -19.848 29.310 1.00 0.00 C ATOM 646 C LYS A 62 1.789 -19.871 27.828 1.00 0.00 C ATOM 647 O LYS A 62 2.307 -20.691 27.070 1.00 0.00 O ATOM 648 CB LYS A 62 1.143 -20.701 30.092 1.00 0.00 C ATOM 649 CG LYS A 62 1.559 -22.173 30.026 1.00 0.00 C ATOM 650 CD LYS A 62 0.640 -23.014 30.918 1.00 0.00 C ATOM 651 CE LYS A 62 1.036 -22.845 32.389 1.00 0.00 C ATOM 652 NZ LYS A 62 0.372 -23.897 33.204 1.00 0.00 N ATOM 0 H LYS A 62 1.234 -18.164 30.170 1.00 0.00 H new ATOM 0 HA LYS A 62 3.144 -20.258 29.435 1.00 0.00 H new ATOM 0 HB2 LYS A 62 1.102 -20.371 31.130 1.00 0.00 H new ATOM 0 HB3 LYS A 62 0.142 -20.577 29.679 1.00 0.00 H new ATOM 0 HG2 LYS A 62 1.507 -22.529 28.997 1.00 0.00 H new ATOM 0 HG3 LYS A 62 2.594 -22.282 30.349 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -0.397 -22.709 30.775 1.00 0.00 H new ATOM 0 HD3 LYS A 62 0.706 -24.064 30.634 1.00 0.00 H new ATOM 0 HE2 LYS A 62 2.118 -22.916 32.496 1.00 0.00 H new ATOM 0 HE3 LYS A 62 0.745 -21.857 32.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 0.640 -23.783 34.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -0.660 -23.809 33.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 0.671 -24.835 32.870 1.00 0.00 H new ATOM 666 N ILE A 63 0.890 -18.978 27.425 1.00 0.00 N ATOM 667 CA ILE A 63 0.464 -18.923 26.032 1.00 0.00 C ATOM 668 C ILE A 63 1.636 -18.569 25.127 1.00 0.00 C ATOM 669 O ILE A 63 1.851 -19.206 24.099 1.00 0.00 O ATOM 670 CB ILE A 63 -0.636 -17.869 25.873 1.00 0.00 C ATOM 671 CG1 ILE A 63 -1.873 -18.291 26.675 1.00 0.00 C ATOM 672 CG2 ILE A 63 -1.011 -17.735 24.394 1.00 0.00 C ATOM 673 CD1 ILE A 63 -2.375 -19.665 26.209 1.00 0.00 C ATOM 0 H ILE A 63 0.447 -18.291 28.035 1.00 0.00 H new ATOM 0 HA ILE A 63 0.082 -19.903 25.746 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.271 -16.911 26.244 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.630 -18.327 27.737 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -2.662 -17.549 26.554 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.794 -16.985 24.284 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.134 -17.431 23.822 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.372 -18.694 24.022 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.253 -19.948 26.790 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.639 -19.617 25.152 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -1.590 -20.407 26.354 1.00 0.00 H new ATOM 685 N ALA A 64 2.397 -17.556 25.519 1.00 0.00 N ATOM 686 CA ALA A 64 3.549 -17.136 24.731 1.00 0.00 C ATOM 687 C ALA A 64 4.626 -18.210 24.750 1.00 0.00 C ATOM 688 O ALA A 64 5.543 -18.197 23.928 1.00 0.00 O ATOM 689 CB ALA A 64 4.106 -15.826 25.287 1.00 0.00 C ATOM 0 H ALA A 64 2.240 -17.014 26.369 1.00 0.00 H new ATOM 0 HA ALA A 64 3.232 -16.982 23.700 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.967 -15.516 24.695 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.337 -15.055 25.240 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.412 -15.971 26.323 1.00 0.00 H new ATOM 695 N ARG A 65 4.519 -19.126 25.700 1.00 0.00 N ATOM 696 CA ARG A 65 5.494 -20.199 25.820 1.00 0.00 C ATOM 697 C ARG A 65 5.179 -21.323 24.840 1.00 0.00 C ATOM 698 O ARG A 65 6.066 -21.825 24.147 1.00 0.00 O ATOM 699 CB ARG A 65 5.500 -20.743 27.248 1.00 0.00 C ATOM 700 CG ARG A 65 6.589 -21.807 27.384 1.00 0.00 C ATOM 701 CD ARG A 65 6.580 -22.368 28.806 1.00 0.00 C ATOM 702 NE ARG A 65 7.001 -21.344 29.756 1.00 0.00 N ATOM 703 CZ ARG A 65 7.057 -21.598 31.059 1.00 0.00 C ATOM 704 NH1 ARG A 65 7.437 -20.665 31.890 1.00 0.00 N ATOM 705 NH2 ARG A 65 6.731 -22.778 31.509 1.00 0.00 N ATOM 0 H ARG A 65 3.772 -19.149 26.395 1.00 0.00 H new ATOM 0 HA ARG A 65 6.479 -19.797 25.584 1.00 0.00 H new ATOM 0 HB2 ARG A 65 5.677 -19.933 27.956 1.00 0.00 H new ATOM 0 HB3 ARG A 65 4.527 -21.170 27.490 1.00 0.00 H new ATOM 0 HG2 ARG A 65 6.421 -22.608 26.665 1.00 0.00 H new ATOM 0 HG3 ARG A 65 7.564 -21.375 27.158 1.00 0.00 H new ATOM 0 HD2 ARG A 65 5.580 -22.720 29.059 1.00 0.00 H new ATOM 0 HD3 ARG A 65 7.246 -23.228 28.869 1.00 0.00 H new ATOM 0 HE ARG A 65 7.257 -20.418 29.414 1.00 0.00 H new ATOM 0 HH11 ARG A 65 7.691 -19.742 31.539 1.00 0.00 H new ATOM 0 HH12 ARG A 65 7.480 -20.860 32.890 1.00 0.00 H new ATOM 0 HH21 ARG A 65 6.433 -23.507 30.860 1.00 0.00 H new ATOM 0 HH22 ARG A 65 6.774 -22.972 32.509 1.00 0.00 H new ATOM 719 N ILE A 66 3.911 -21.714 24.790 1.00 0.00 N ATOM 720 CA ILE A 66 3.481 -22.777 23.892 1.00 0.00 C ATOM 721 C ILE A 66 3.250 -22.233 22.487 1.00 0.00 C ATOM 722 O ILE A 66 3.236 -22.983 21.517 1.00 0.00 O ATOM 723 CB ILE A 66 2.197 -23.423 24.415 1.00 0.00 C ATOM 724 CG1 ILE A 66 2.490 -24.128 25.743 1.00 0.00 C ATOM 725 CG2 ILE A 66 1.687 -24.445 23.398 1.00 0.00 C ATOM 726 CD1 ILE A 66 1.174 -24.542 26.401 1.00 0.00 C ATOM 0 H ILE A 66 3.166 -21.312 25.359 1.00 0.00 H new ATOM 0 HA ILE A 66 4.269 -23.529 23.850 1.00 0.00 H new ATOM 0 HB ILE A 66 1.439 -22.655 24.567 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.115 -25.005 25.572 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.047 -23.464 26.404 1.00 0.00 H new ATOM 0 HG21 ILE A 66 0.772 -24.905 23.772 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.482 -23.945 22.451 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.443 -25.215 23.245 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.382 -25.044 27.346 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.566 -23.657 26.586 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.635 -25.221 25.741 1.00 0.00 H new ATOM 738 N GLY A 67 3.065 -20.923 22.386 1.00 0.00 N ATOM 739 CA GLY A 67 2.834 -20.292 21.092 1.00 0.00 C ATOM 740 C GLY A 67 4.139 -20.150 20.314 1.00 0.00 C ATOM 741 O GLY A 67 4.139 -19.909 19.114 1.00 0.00 O ATOM 0 H GLY A 67 3.070 -20.280 23.178 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.125 -20.886 20.515 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.384 -19.310 21.237 1.00 0.00 H new ATOM 745 N TYR A 68 5.257 -20.293 21.007 1.00 0.00 N ATOM 746 CA TYR A 68 6.563 -20.180 20.361 1.00 0.00 C ATOM 747 C TYR A 68 7.290 -21.518 20.388 1.00 0.00 C ATOM 748 O TYR A 68 8.352 -21.670 19.785 1.00 0.00 O ATOM 749 CB TYR A 68 7.403 -19.121 21.069 1.00 0.00 C ATOM 750 CG TYR A 68 8.783 -19.086 20.459 1.00 0.00 C ATOM 751 CD1 TYR A 68 8.952 -18.663 19.135 1.00 0.00 C ATOM 752 CD2 TYR A 68 9.894 -19.474 21.218 1.00 0.00 C ATOM 753 CE1 TYR A 68 10.233 -18.630 18.569 1.00 0.00 C ATOM 754 CE2 TYR A 68 11.174 -19.440 20.652 1.00 0.00 C ATOM 755 CZ TYR A 68 11.344 -19.017 19.329 1.00 0.00 C ATOM 756 OH TYR A 68 12.605 -18.983 18.771 1.00 0.00 O ATOM 0 H TYR A 68 5.292 -20.486 22.008 1.00 0.00 H new ATOM 0 HA TYR A 68 6.412 -19.886 19.322 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.928 -18.144 20.978 1.00 0.00 H new ATOM 0 HB3 TYR A 68 7.469 -19.346 22.134 1.00 0.00 H new ATOM 0 HD1 TYR A 68 8.095 -18.362 18.550 1.00 0.00 H new ATOM 0 HD2 TYR A 68 9.763 -19.799 22.240 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.364 -18.306 17.547 1.00 0.00 H new ATOM 0 HE2 TYR A 68 12.031 -19.740 21.237 1.00 0.00 H new ATOM 0 HH TYR A 68 13.264 -19.282 19.432 1.00 0.00 H new ATOM 766 N GLU A 69 6.713 -22.487 21.092 1.00 0.00 N ATOM 767 CA GLU A 69 7.314 -23.815 21.194 1.00 0.00 C ATOM 768 C GLU A 69 6.499 -24.838 20.410 1.00 0.00 C ATOM 769 O GLU A 69 6.806 -26.028 20.425 1.00 0.00 O ATOM 770 CB GLU A 69 7.396 -24.238 22.661 1.00 0.00 C ATOM 771 CG GLU A 69 8.410 -23.352 23.390 1.00 0.00 C ATOM 772 CD GLU A 69 8.437 -23.704 24.873 1.00 0.00 C ATOM 773 OE1 GLU A 69 7.708 -24.602 25.261 1.00 0.00 O ATOM 774 OE2 GLU A 69 9.186 -23.071 25.598 1.00 0.00 O ATOM 0 H GLU A 69 5.834 -22.380 21.599 1.00 0.00 H new ATOM 0 HA GLU A 69 8.318 -23.771 20.771 1.00 0.00 H new ATOM 0 HB2 GLU A 69 6.416 -24.151 23.131 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.693 -25.284 22.733 1.00 0.00 H new ATOM 0 HG2 GLU A 69 9.401 -23.487 22.957 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.147 -22.302 23.262 1.00 0.00 H new ATOM 781 N ASP A 70 5.461 -24.364 19.728 1.00 0.00 N ATOM 782 CA ASP A 70 4.608 -25.248 18.939 1.00 0.00 C ATOM 783 C ASP A 70 4.158 -24.556 17.657 1.00 0.00 C ATOM 784 O ASP A 70 4.206 -25.141 16.575 1.00 0.00 O ATOM 785 CB ASP A 70 3.381 -25.663 19.755 1.00 0.00 C ATOM 786 CG ASP A 70 3.783 -26.663 20.834 1.00 0.00 C ATOM 787 OD1 ASP A 70 4.859 -27.224 20.719 1.00 0.00 O ATOM 788 OD2 ASP A 70 3.010 -26.852 21.759 1.00 0.00 O ATOM 0 H ASP A 70 5.191 -23.381 19.705 1.00 0.00 H new ATOM 0 HA ASP A 70 5.185 -26.135 18.677 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.926 -24.785 20.213 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.631 -26.106 19.099 1.00 0.00 H new ATOM 793 N GLU A 71 3.719 -23.310 17.786 1.00 0.00 N ATOM 794 CA GLU A 71 3.257 -22.554 16.628 1.00 0.00 C ATOM 795 C GLU A 71 4.430 -21.872 15.934 1.00 0.00 C ATOM 796 O GLU A 71 4.346 -21.516 14.757 1.00 0.00 O ATOM 797 CB GLU A 71 2.235 -21.498 17.069 1.00 0.00 C ATOM 798 CG GLU A 71 1.041 -22.182 17.729 1.00 0.00 C ATOM 799 CD GLU A 71 0.277 -23.027 16.714 1.00 0.00 C ATOM 800 OE1 GLU A 71 0.596 -22.929 15.541 1.00 0.00 O ATOM 801 OE2 GLU A 71 -0.613 -23.756 17.120 1.00 0.00 O ATOM 0 H GLU A 71 3.673 -22.805 18.671 1.00 0.00 H new ATOM 0 HA GLU A 71 2.787 -23.244 15.928 1.00 0.00 H new ATOM 0 HB2 GLU A 71 2.697 -20.799 17.766 1.00 0.00 H new ATOM 0 HB3 GLU A 71 1.904 -20.917 16.208 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.384 -22.812 18.550 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.377 -21.432 18.159 1.00 0.00 H new ATOM 808 N GLY A 72 5.523 -21.690 16.666 1.00 0.00 N ATOM 809 CA GLY A 72 6.707 -21.054 16.107 1.00 0.00 C ATOM 810 C GLY A 72 6.472 -19.564 15.898 1.00 0.00 C ATOM 811 O GLY A 72 7.146 -18.927 15.089 1.00 0.00 O ATOM 0 H GLY A 72 5.613 -21.972 17.642 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.555 -21.203 16.775 1.00 0.00 H new ATOM 0 HA3 GLY A 72 6.963 -21.523 15.157 1.00 0.00 H new ATOM 893 N GLU A 78 6.074 -11.271 28.508 1.00 0.00 N ATOM 894 CA GLU A 78 4.712 -11.644 28.837 1.00 0.00 C ATOM 895 C GLU A 78 3.793 -10.469 28.509 1.00 0.00 C ATOM 896 O GLU A 78 2.674 -10.641 28.035 1.00 0.00 O ATOM 897 CB GLU A 78 4.609 -12.015 30.309 1.00 0.00 C ATOM 898 CG GLU A 78 3.238 -12.623 30.580 1.00 0.00 C ATOM 899 CD GLU A 78 3.173 -13.097 32.013 1.00 0.00 C ATOM 900 OE1 GLU A 78 2.090 -13.450 32.448 1.00 0.00 O ATOM 901 OE2 GLU A 78 4.204 -13.102 32.666 1.00 0.00 O ATOM 0 HA GLU A 78 4.412 -12.514 28.253 1.00 0.00 H new ATOM 0 HB2 GLU A 78 5.393 -12.725 30.573 1.00 0.00 H new ATOM 0 HB3 GLU A 78 4.757 -11.131 30.930 1.00 0.00 H new ATOM 0 HG2 GLU A 78 2.458 -11.885 30.394 1.00 0.00 H new ATOM 0 HG3 GLU A 78 3.057 -13.456 29.901 1.00 0.00 H new ATOM 908 N SER A 79 4.308 -9.268 28.750 1.00 0.00 N ATOM 909 CA SER A 79 3.563 -8.057 28.470 1.00 0.00 C ATOM 910 C SER A 79 2.997 -8.107 27.054 1.00 0.00 C ATOM 911 O SER A 79 1.813 -7.847 26.839 1.00 0.00 O ATOM 912 CB SER A 79 4.527 -6.874 28.578 1.00 0.00 C ATOM 913 OG SER A 79 3.798 -5.663 28.696 1.00 0.00 O ATOM 0 H SER A 79 5.238 -9.113 29.138 1.00 0.00 H new ATOM 0 HA SER A 79 2.740 -7.956 29.177 1.00 0.00 H new ATOM 0 HB2 SER A 79 5.177 -7.002 29.443 1.00 0.00 H new ATOM 0 HB3 SER A 79 5.170 -6.837 27.699 1.00 0.00 H new ATOM 0 HG SER A 79 4.422 -4.911 28.766 1.00 0.00 H new ATOM 919 N ALA A 80 3.847 -8.464 26.100 1.00 0.00 N ATOM 920 CA ALA A 80 3.421 -8.562 24.708 1.00 0.00 C ATOM 921 C ALA A 80 2.259 -9.547 24.579 1.00 0.00 C ATOM 922 O ALA A 80 1.430 -9.432 23.679 1.00 0.00 O ATOM 923 CB ALA A 80 4.605 -9.016 23.832 1.00 0.00 C ATOM 0 H ALA A 80 4.829 -8.689 26.261 1.00 0.00 H new ATOM 0 HA ALA A 80 3.084 -7.582 24.369 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.283 -9.088 22.793 1.00 0.00 H new ATOM 0 HB2 ALA A 80 5.415 -8.291 23.911 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.956 -9.991 24.171 1.00 0.00 H new ATOM 929 N CYS A 81 2.210 -10.518 25.480 1.00 0.00 N ATOM 930 CA CYS A 81 1.154 -11.520 25.450 1.00 0.00 C ATOM 931 C CYS A 81 -0.169 -10.913 25.893 1.00 0.00 C ATOM 932 O CYS A 81 -1.225 -11.533 25.763 1.00 0.00 O ATOM 933 CB CYS A 81 1.524 -12.665 26.373 1.00 0.00 C ATOM 934 SG CYS A 81 3.246 -13.096 26.096 1.00 0.00 S ATOM 0 H CYS A 81 2.885 -10.633 26.236 1.00 0.00 H new ATOM 0 HA CYS A 81 1.043 -11.888 24.430 1.00 0.00 H new ATOM 0 HB2 CYS A 81 1.369 -12.377 27.413 1.00 0.00 H new ATOM 0 HB3 CYS A 81 0.884 -13.526 26.182 1.00 0.00 H new ATOM 0 HG CYS A 81 3.459 -13.233 24.821 1.00 0.00 H new ATOM 940 N ARG A 82 -0.103 -9.695 26.421 1.00 0.00 N ATOM 941 CA ARG A 82 -1.300 -9.006 26.880 1.00 0.00 C ATOM 942 C ARG A 82 -1.691 -7.914 25.904 1.00 0.00 C ATOM 943 O ARG A 82 -2.842 -7.520 25.857 1.00 0.00 O ATOM 944 CB ARG A 82 -1.069 -8.393 28.260 1.00 0.00 C ATOM 945 CG ARG A 82 -0.946 -9.509 29.297 1.00 0.00 C ATOM 946 CD ARG A 82 -0.917 -8.901 30.700 1.00 0.00 C ATOM 947 NE ARG A 82 0.297 -8.119 30.894 1.00 0.00 N ATOM 948 CZ ARG A 82 1.419 -8.688 31.323 1.00 0.00 C ATOM 949 NH1 ARG A 82 2.495 -7.969 31.486 1.00 0.00 N ATOM 950 NH2 ARG A 82 1.444 -9.967 31.580 1.00 0.00 N ATOM 0 H ARG A 82 0.762 -9.169 26.541 1.00 0.00 H new ATOM 0 HA ARG A 82 -2.107 -9.736 26.943 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -0.164 -7.786 28.254 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -1.895 -7.731 28.519 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -1.785 -10.199 29.205 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -0.038 -10.086 29.120 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -1.792 -8.267 30.846 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -0.969 -9.693 31.447 1.00 0.00 H new ATOM 0 HE ARG A 82 0.286 -7.118 30.697 1.00 0.00 H new ATOM 0 HH11 ARG A 82 2.476 -6.969 31.284 1.00 0.00 H new ATOM 0 HH12 ARG A 82 3.356 -8.406 31.815 1.00 0.00 H new ATOM 0 HH21 ARG A 82 0.603 -10.530 31.452 1.00 0.00 H new ATOM 0 HH22 ARG A 82 2.305 -10.404 31.909 1.00 0.00 H new ATOM 964 N ASN A 83 -0.725 -7.428 25.131 1.00 0.00 N ATOM 965 CA ASN A 83 -0.993 -6.377 24.154 1.00 0.00 C ATOM 966 C ASN A 83 -1.489 -6.973 22.838 1.00 0.00 C ATOM 967 O ASN A 83 -2.459 -6.494 22.250 1.00 0.00 O ATOM 968 CB ASN A 83 0.278 -5.573 23.903 1.00 0.00 C ATOM 969 CG ASN A 83 0.825 -5.048 25.230 1.00 0.00 C ATOM 970 OD1 ASN A 83 0.061 -4.601 26.087 1.00 0.00 O ATOM 971 ND2 ASN A 83 2.111 -5.079 25.450 1.00 0.00 N ATOM 0 H ASN A 83 0.245 -7.742 25.161 1.00 0.00 H new ATOM 0 HA ASN A 83 -1.769 -5.724 24.554 1.00 0.00 H new ATOM 0 HB2 ASN A 83 1.024 -6.198 23.413 1.00 0.00 H new ATOM 0 HB3 ASN A 83 0.067 -4.741 23.231 1.00 0.00 H new ATOM 0 HD21 ASN A 83 2.486 -4.733 26.333 1.00 0.00 H new ATOM 0 HD22 ASN A 83 2.741 -5.450 24.739 1.00 0.00 H new ATOM 978 N GLN A 84 -0.806 -8.016 22.377 1.00 0.00 N ATOM 979 CA GLN A 84 -1.174 -8.665 21.121 1.00 0.00 C ATOM 980 C GLN A 84 -2.609 -9.172 21.175 1.00 0.00 C ATOM 981 O GLN A 84 -3.454 -8.755 20.382 1.00 0.00 O ATOM 982 CB GLN A 84 -0.232 -9.844 20.859 1.00 0.00 C ATOM 983 CG GLN A 84 1.033 -9.346 20.172 1.00 0.00 C ATOM 984 CD GLN A 84 1.837 -8.465 21.119 1.00 0.00 C ATOM 985 OE1 GLN A 84 1.371 -7.397 21.518 1.00 0.00 O ATOM 986 NE2 GLN A 84 3.021 -8.850 21.508 1.00 0.00 N ATOM 0 H GLN A 84 -0.001 -8.428 22.849 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.090 -7.934 20.317 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.022 -10.335 21.798 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.728 -10.587 20.235 1.00 0.00 H new ATOM 0 HG2 GLN A 84 1.638 -10.194 19.851 1.00 0.00 H new ATOM 0 HG3 GLN A 84 0.771 -8.784 19.276 1.00 0.00 H new ATOM 0 HE21 GLN A 84 3.404 -9.735 21.176 1.00 0.00 H new ATOM 0 HE22 GLN A 84 3.564 -8.266 22.144 1.00 0.00 H new ATOM 995 N ILE A 85 -2.879 -10.065 22.119 1.00 0.00 N ATOM 996 CA ILE A 85 -4.216 -10.627 22.270 1.00 0.00 C ATOM 997 C ILE A 85 -5.227 -9.509 22.459 1.00 0.00 C ATOM 998 O ILE A 85 -6.322 -9.553 21.901 1.00 0.00 O ATOM 999 CB ILE A 85 -4.260 -11.572 23.466 1.00 0.00 C ATOM 1000 CG1 ILE A 85 -3.425 -12.818 23.161 1.00 0.00 C ATOM 1001 CG2 ILE A 85 -5.707 -11.981 23.740 1.00 0.00 C ATOM 1002 CD1 ILE A 85 -3.244 -13.635 24.442 1.00 0.00 C ATOM 0 H ILE A 85 -2.194 -10.415 22.789 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.465 -11.188 21.369 1.00 0.00 H new ATOM 0 HB ILE A 85 -3.854 -11.068 24.343 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -3.917 -13.421 22.398 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -2.453 -12.529 22.761 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -5.739 -12.657 24.595 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -6.301 -11.093 23.957 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -6.115 -12.485 22.864 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -2.650 -14.523 24.226 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -2.733 -13.029 25.191 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -4.220 -13.936 24.823 1.00 0.00 H new ATOM 1014 N ILE A 86 -4.856 -8.498 23.230 1.00 0.00 N ATOM 1015 CA ILE A 86 -5.748 -7.363 23.452 1.00 0.00 C ATOM 1016 C ILE A 86 -6.053 -6.646 22.144 1.00 0.00 C ATOM 1017 O ILE A 86 -7.189 -6.280 21.878 1.00 0.00 O ATOM 1018 CB ILE A 86 -5.121 -6.365 24.459 1.00 0.00 C ATOM 1019 CG1 ILE A 86 -5.548 -6.712 25.901 1.00 0.00 C ATOM 1020 CG2 ILE A 86 -5.512 -4.910 24.121 1.00 0.00 C ATOM 1021 CD1 ILE A 86 -5.217 -5.531 26.832 1.00 0.00 C ATOM 0 H ILE A 86 -3.957 -8.437 23.708 1.00 0.00 H new ATOM 0 HA ILE A 86 -6.680 -7.749 23.865 1.00 0.00 H new ATOM 0 HB ILE A 86 -4.037 -6.451 24.383 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -6.616 -6.927 25.934 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -5.032 -7.611 26.238 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.057 -4.234 24.845 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -5.159 -4.661 23.120 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.596 -4.806 24.159 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.518 -5.775 27.851 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -4.145 -5.338 26.807 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.754 -4.643 26.498 1.00 0.00 H new ATOM 1033 N SER A 87 -5.029 -6.411 21.350 1.00 0.00 N ATOM 1034 CA SER A 87 -5.222 -5.699 20.100 1.00 0.00 C ATOM 1035 C SER A 87 -6.222 -6.432 19.220 1.00 0.00 C ATOM 1036 O SER A 87 -7.109 -5.816 18.624 1.00 0.00 O ATOM 1037 CB SER A 87 -3.896 -5.582 19.373 1.00 0.00 C ATOM 1038 OG SER A 87 -4.140 -5.204 18.024 1.00 0.00 O ATOM 0 H SER A 87 -4.069 -6.696 21.541 1.00 0.00 H new ATOM 0 HA SER A 87 -5.610 -4.704 20.319 1.00 0.00 H new ATOM 0 HB2 SER A 87 -3.262 -4.843 19.862 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.363 -6.532 19.407 1.00 0.00 H new ATOM 0 HG SER A 87 -3.287 -5.125 17.547 1.00 0.00 H new ATOM 1044 N ILE A 88 -6.075 -7.749 19.150 1.00 0.00 N ATOM 1045 CA ILE A 88 -6.975 -8.560 18.349 1.00 0.00 C ATOM 1046 C ILE A 88 -8.416 -8.345 18.794 1.00 0.00 C ATOM 1047 O ILE A 88 -9.337 -8.503 18.022 1.00 0.00 O ATOM 1048 CB ILE A 88 -6.626 -10.039 18.488 1.00 0.00 C ATOM 1049 CG1 ILE A 88 -5.247 -10.296 17.882 1.00 0.00 C ATOM 1050 CG2 ILE A 88 -7.671 -10.885 17.755 1.00 0.00 C ATOM 1051 CD1 ILE A 88 -4.787 -11.709 18.245 1.00 0.00 C ATOM 0 H ILE A 88 -5.346 -8.273 19.635 1.00 0.00 H new ATOM 0 HA ILE A 88 -6.866 -8.259 17.307 1.00 0.00 H new ATOM 0 HB ILE A 88 -6.617 -10.311 19.544 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -5.287 -10.182 16.799 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -4.532 -9.562 18.254 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -7.420 -11.941 17.856 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -8.655 -10.703 18.188 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -7.683 -10.614 16.699 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -3.803 -11.894 17.813 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -4.731 -11.806 19.329 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -5.498 -12.435 17.852 1.00 0.00 H new ATOM 1063 N MET A 89 -8.614 -8.004 20.053 1.00 0.00 N ATOM 1064 CA MET A 89 -9.971 -7.779 20.554 1.00 0.00 C ATOM 1065 C MET A 89 -10.563 -6.494 19.972 1.00 0.00 C ATOM 1066 O MET A 89 -11.676 -6.493 19.444 1.00 0.00 O ATOM 1067 CB MET A 89 -9.942 -7.666 22.077 1.00 0.00 C ATOM 1068 CG MET A 89 -9.514 -9.002 22.679 1.00 0.00 C ATOM 1069 SD MET A 89 -10.758 -10.259 22.301 1.00 0.00 S ATOM 1070 CE MET A 89 -12.047 -9.637 23.408 1.00 0.00 C ATOM 0 H MET A 89 -7.873 -7.877 20.742 1.00 0.00 H new ATOM 0 HA MET A 89 -10.591 -8.622 20.250 1.00 0.00 H new ATOM 0 HB2 MET A 89 -9.251 -6.880 22.381 1.00 0.00 H new ATOM 0 HB3 MET A 89 -10.927 -7.386 22.450 1.00 0.00 H new ATOM 0 HG2 MET A 89 -8.546 -9.301 22.277 1.00 0.00 H new ATOM 0 HG3 MET A 89 -9.395 -8.905 23.758 1.00 0.00 H new ATOM 0 HE1 MET A 89 -12.704 -10.457 23.698 1.00 0.00 H new ATOM 0 HE2 MET A 89 -11.586 -9.209 24.298 1.00 0.00 H new ATOM 0 HE3 MET A 89 -12.628 -8.870 22.895 1.00 0.00 H new ATOM 1080 N ARG A 90 -9.809 -5.405 20.067 1.00 0.00 N ATOM 1081 CA ARG A 90 -10.272 -4.120 19.555 1.00 0.00 C ATOM 1082 C ARG A 90 -10.776 -4.272 18.125 1.00 0.00 C ATOM 1083 O ARG A 90 -11.798 -3.700 17.752 1.00 0.00 O ATOM 1084 CB ARG A 90 -9.123 -3.105 19.594 1.00 0.00 C ATOM 1085 CG ARG A 90 -9.640 -1.735 19.159 1.00 0.00 C ATOM 1086 CD ARG A 90 -8.487 -0.729 19.130 1.00 0.00 C ATOM 1087 NE ARG A 90 -7.533 -1.088 18.086 1.00 0.00 N ATOM 1088 CZ ARG A 90 -6.515 -0.290 17.783 1.00 0.00 C ATOM 1089 NH1 ARG A 90 -5.674 -0.634 16.845 1.00 0.00 N ATOM 1090 NH2 ARG A 90 -6.355 0.836 18.422 1.00 0.00 N ATOM 0 H ARG A 90 -8.881 -5.385 20.490 1.00 0.00 H new ATOM 0 HA ARG A 90 -11.091 -3.765 20.181 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.709 -3.047 20.601 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.316 -3.427 18.936 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.097 -1.806 18.172 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.415 -1.394 19.846 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -8.874 0.274 18.950 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -7.987 -0.709 20.099 1.00 0.00 H new ATOM 0 HE ARG A 90 -7.650 -1.966 17.580 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.799 -1.515 16.346 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -4.892 -0.022 16.612 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.012 1.104 19.155 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -5.573 1.448 18.189 1.00 0.00 H new ATOM 1104 N VAL A 91 -10.052 -5.040 17.330 1.00 0.00 N ATOM 1105 CA VAL A 91 -10.431 -5.261 15.941 1.00 0.00 C ATOM 1106 C VAL A 91 -11.711 -6.099 15.851 1.00 0.00 C ATOM 1107 O VAL A 91 -12.572 -5.859 14.999 1.00 0.00 O ATOM 1108 CB VAL A 91 -9.274 -5.964 15.201 1.00 0.00 C ATOM 1109 CG1 VAL A 91 -7.917 -5.336 15.631 1.00 0.00 C ATOM 1110 CG2 VAL A 91 -9.290 -7.485 15.508 1.00 0.00 C ATOM 0 H VAL A 91 -9.200 -5.521 17.619 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.629 -4.298 15.471 1.00 0.00 H new ATOM 0 HB VAL A 91 -9.400 -5.828 14.127 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.102 -5.835 15.106 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -7.912 -4.275 15.382 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -7.784 -5.457 16.706 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -8.469 -7.971 14.981 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -9.175 -7.641 16.581 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -10.237 -7.913 15.179 1.00 0.00 H new ATOM 1120 N TYR A 92 -11.818 -7.091 16.735 1.00 0.00 N ATOM 1121 CA TYR A 92 -12.960 -7.972 16.757 1.00 0.00 C ATOM 1122 C TYR A 92 -14.205 -7.187 17.087 1.00 0.00 C ATOM 1123 O TYR A 92 -15.243 -7.386 16.473 1.00 0.00 O ATOM 1124 CB TYR A 92 -12.752 -9.094 17.779 1.00 0.00 C ATOM 1125 CG TYR A 92 -14.017 -9.910 17.892 1.00 0.00 C ATOM 1126 CD1 TYR A 92 -14.354 -10.833 16.896 1.00 0.00 C ATOM 1127 CD2 TYR A 92 -14.856 -9.736 19.000 1.00 0.00 C ATOM 1128 CE1 TYR A 92 -15.531 -11.584 17.006 1.00 0.00 C ATOM 1129 CE2 TYR A 92 -16.034 -10.486 19.109 1.00 0.00 C ATOM 1130 CZ TYR A 92 -16.371 -11.410 18.112 1.00 0.00 C ATOM 1131 OH TYR A 92 -17.531 -12.149 18.221 1.00 0.00 O ATOM 0 H TYR A 92 -11.116 -7.296 17.446 1.00 0.00 H new ATOM 0 HA TYR A 92 -13.076 -8.423 15.772 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -11.922 -9.730 17.473 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -12.490 -8.673 18.750 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -13.706 -10.966 16.042 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -14.595 -9.024 19.769 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -15.790 -12.297 16.238 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -16.683 -10.352 19.962 1.00 0.00 H new ATOM 0 HH TYR A 92 -17.997 -11.906 19.048 1.00 0.00 H new ATOM 1141 N GLU A 93 -14.088 -6.287 18.058 1.00 0.00 N ATOM 1142 CA GLU A 93 -15.218 -5.464 18.464 1.00 0.00 C ATOM 1143 C GLU A 93 -15.537 -4.414 17.403 1.00 0.00 C ATOM 1144 O GLU A 93 -16.701 -4.096 17.161 1.00 0.00 O ATOM 1145 CB GLU A 93 -14.912 -4.777 19.795 1.00 0.00 C ATOM 1146 CG GLU A 93 -14.789 -5.834 20.895 1.00 0.00 C ATOM 1147 CD GLU A 93 -16.124 -6.546 21.090 1.00 0.00 C ATOM 1148 OE1 GLU A 93 -17.119 -5.861 21.263 1.00 0.00 O ATOM 1149 OE2 GLU A 93 -16.132 -7.765 21.064 1.00 0.00 O ATOM 0 H GLU A 93 -13.227 -6.111 18.575 1.00 0.00 H new ATOM 0 HA GLU A 93 -16.087 -6.112 18.581 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -13.986 -4.206 19.718 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -15.703 -4.069 20.042 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.018 -6.557 20.630 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.479 -5.364 21.828 1.00 0.00 H new ATOM 1156 N GLN A 94 -14.494 -3.876 16.778 1.00 0.00 N ATOM 1157 CA GLN A 94 -14.679 -2.861 15.748 1.00 0.00 C ATOM 1158 C GLN A 94 -15.406 -3.439 14.539 1.00 0.00 C ATOM 1159 O GLN A 94 -16.425 -2.903 14.104 1.00 0.00 O ATOM 1160 CB GLN A 94 -13.320 -2.303 15.309 1.00 0.00 C ATOM 1161 CG GLN A 94 -12.876 -1.198 16.272 1.00 0.00 C ATOM 1162 CD GLN A 94 -11.596 -0.545 15.758 1.00 0.00 C ATOM 1163 OE1 GLN A 94 -10.669 -0.193 16.605 1.00 0.00 O flip ATOM 1164 NE2 GLN A 94 -11.441 -0.346 14.553 1.00 0.00 N flip ATOM 0 H GLN A 94 -13.522 -4.123 16.964 1.00 0.00 H new ATOM 0 HA GLN A 94 -15.284 -2.058 16.169 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -12.578 -3.101 15.290 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -13.389 -1.908 14.295 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -13.663 -0.450 16.369 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -12.709 -1.615 17.265 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -12.168 -0.622 13.893 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -10.586 0.095 14.215 1.00 0.00 H new ATOM 1173 N ARG A 95 -14.878 -4.532 14.004 1.00 0.00 N ATOM 1174 CA ARG A 95 -15.483 -5.173 12.843 1.00 0.00 C ATOM 1175 C ARG A 95 -16.803 -5.833 13.229 1.00 0.00 C ATOM 1176 O ARG A 95 -17.577 -6.251 12.368 1.00 0.00 O ATOM 1177 CB ARG A 95 -14.525 -6.211 12.260 1.00 0.00 C ATOM 1178 CG ARG A 95 -14.993 -6.607 10.860 1.00 0.00 C ATOM 1179 CD ARG A 95 -14.006 -7.602 10.255 1.00 0.00 C ATOM 1180 NE ARG A 95 -12.700 -6.975 10.082 1.00 0.00 N ATOM 1181 CZ ARG A 95 -12.426 -6.239 9.009 1.00 0.00 C ATOM 1182 NH1 ARG A 95 -11.251 -5.687 8.879 1.00 0.00 N ATOM 1183 NH2 ARG A 95 -13.334 -6.067 8.087 1.00 0.00 N ATOM 0 H ARG A 95 -14.037 -4.992 14.353 1.00 0.00 H new ATOM 0 HA ARG A 95 -15.683 -4.413 12.088 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -13.515 -5.805 12.216 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -14.487 -7.089 12.904 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -15.988 -7.050 10.909 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -15.069 -5.723 10.227 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -13.916 -8.475 10.902 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -14.378 -7.955 9.293 1.00 0.00 H new ATOM 0 HE ARG A 95 -11.984 -7.104 10.797 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -10.542 -5.820 9.601 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -11.041 -5.122 8.056 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -14.253 -6.497 8.190 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -13.124 -5.502 7.264 1.00 0.00 H new ATOM 1197 N LEU A 96 -17.052 -5.924 14.531 1.00 0.00 N ATOM 1198 CA LEU A 96 -18.286 -6.523 15.029 1.00 0.00 C ATOM 1199 C LEU A 96 -19.449 -5.543 14.929 1.00 0.00 C ATOM 1200 O LEU A 96 -20.585 -5.936 14.668 1.00 0.00 O ATOM 1201 CB LEU A 96 -18.113 -6.979 16.477 1.00 0.00 C ATOM 1202 CG LEU A 96 -19.437 -7.501 17.024 1.00 0.00 C ATOM 1203 CD1 LEU A 96 -19.954 -8.618 16.117 1.00 0.00 C ATOM 1204 CD2 LEU A 96 -19.215 -8.053 18.434 1.00 0.00 C ATOM 0 H LEU A 96 -16.419 -5.592 15.259 1.00 0.00 H new ATOM 0 HA LEU A 96 -18.511 -7.390 14.408 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -17.355 -7.760 16.532 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -17.760 -6.148 17.088 1.00 0.00 H new ATOM 0 HG LEU A 96 -20.167 -6.692 17.057 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -20.901 -8.993 16.506 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -20.104 -8.229 15.110 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -19.227 -9.429 16.088 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -20.158 -8.428 18.831 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -18.489 -8.865 18.397 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -18.839 -7.260 19.080 1.00 0.00 H new ATOM 1216 N ALA A 97 -19.159 -4.267 15.163 1.00 0.00 N ATOM 1217 CA ALA A 97 -20.192 -3.240 15.115 1.00 0.00 C ATOM 1218 C ALA A 97 -20.432 -2.786 13.682 1.00 0.00 C ATOM 1219 O ALA A 97 -21.531 -2.353 13.334 1.00 0.00 O ATOM 1220 CB ALA A 97 -19.771 -2.039 15.966 1.00 0.00 C ATOM 0 H ALA A 97 -18.225 -3.922 15.386 1.00 0.00 H new ATOM 0 HA ALA A 97 -21.116 -3.663 15.509 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -20.547 -1.275 15.926 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -19.628 -2.357 16.999 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -18.838 -1.629 15.580 1.00 0.00 H new ATOM 1226 N HIS A 98 -19.399 -2.889 12.854 1.00 0.00 N ATOM 1227 CA HIS A 98 -19.509 -2.488 11.457 1.00 0.00 C ATOM 1228 C HIS A 98 -20.356 -3.487 10.676 1.00 0.00 C ATOM 1229 O HIS A 98 -20.278 -4.693 10.904 1.00 0.00 O ATOM 1230 CB HIS A 98 -18.118 -2.396 10.828 1.00 0.00 C ATOM 1231 CG HIS A 98 -17.413 -1.174 11.347 1.00 0.00 C ATOM 1232 ND1 HIS A 98 -16.804 -1.143 12.591 1.00 0.00 N ATOM 1233 CD2 HIS A 98 -17.211 0.070 10.801 1.00 0.00 C ATOM 1234 CE1 HIS A 98 -16.269 0.081 12.752 1.00 0.00 C ATOM 1235 NE2 HIS A 98 -16.489 0.861 11.689 1.00 0.00 N ATOM 0 H HIS A 98 -18.482 -3.244 13.123 1.00 0.00 H new ATOM 0 HA HIS A 98 -19.991 -1.511 11.418 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -17.541 -3.290 11.064 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -18.201 -2.348 9.742 1.00 0.00 H new ATOM 0 HD1 HIS A 98 -16.768 -1.909 13.263 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -17.560 0.386 9.829 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -15.728 0.395 13.632 1.00 0.00 H new ATOM 1343 N THR A 105 -18.032 -13.533 2.341 1.00 0.00 N ATOM 1344 CA THR A 105 -17.424 -13.956 3.596 1.00 0.00 C ATOM 1345 C THR A 105 -16.193 -14.814 3.333 1.00 0.00 C ATOM 1346 O THR A 105 -15.949 -15.234 2.201 1.00 0.00 O ATOM 1347 CB THR A 105 -18.433 -14.751 4.427 1.00 0.00 C ATOM 1348 OG1 THR A 105 -18.767 -15.951 3.744 1.00 0.00 O ATOM 1349 CG2 THR A 105 -19.694 -13.912 4.637 1.00 0.00 C ATOM 0 HA THR A 105 -17.122 -13.065 4.147 1.00 0.00 H new ATOM 0 HB THR A 105 -17.996 -14.995 5.395 1.00 0.00 H new ATOM 0 HG1 THR A 105 -18.674 -15.814 2.778 1.00 0.00 H new ATOM 0 HG21 THR A 105 -20.413 -14.478 5.229 1.00 0.00 H new ATOM 0 HG22 THR A 105 -19.436 -12.992 5.162 1.00 0.00 H new ATOM 0 HG23 THR A 105 -20.133 -13.667 3.670 1.00 0.00 H new ATOM 1357 N THR A 106 -15.417 -15.072 4.383 1.00 0.00 N ATOM 1358 CA THR A 106 -14.211 -15.885 4.248 1.00 0.00 C ATOM 1359 C THR A 106 -14.113 -16.899 5.390 1.00 0.00 C ATOM 1360 O THR A 106 -14.621 -16.658 6.487 1.00 0.00 O ATOM 1361 CB THR A 106 -12.973 -14.985 4.257 1.00 0.00 C ATOM 1362 OG1 THR A 106 -13.177 -13.914 5.167 1.00 0.00 O ATOM 1363 CG2 THR A 106 -12.736 -14.427 2.853 1.00 0.00 C ATOM 0 H THR A 106 -15.599 -14.734 5.328 1.00 0.00 H new ATOM 0 HA THR A 106 -14.264 -16.425 3.302 1.00 0.00 H new ATOM 0 HB THR A 106 -12.103 -15.564 4.566 1.00 0.00 H new ATOM 0 HG1 THR A 106 -12.385 -13.337 5.176 1.00 0.00 H new ATOM 0 HG21 THR A 106 -11.854 -13.786 2.860 1.00 0.00 H new ATOM 0 HG22 THR A 106 -12.581 -15.250 2.156 1.00 0.00 H new ATOM 0 HG23 THR A 106 -13.604 -13.846 2.541 1.00 0.00 H new ATOM 1371 N PRO A 107 -13.473 -18.019 5.156 1.00 0.00 N ATOM 1372 CA PRO A 107 -13.311 -19.079 6.194 1.00 0.00 C ATOM 1373 C PRO A 107 -12.319 -18.673 7.283 1.00 0.00 C ATOM 1374 O PRO A 107 -12.512 -18.982 8.459 1.00 0.00 O ATOM 1375 CB PRO A 107 -12.792 -20.285 5.403 1.00 0.00 C ATOM 1376 CG PRO A 107 -12.130 -19.715 4.194 1.00 0.00 C ATOM 1377 CD PRO A 107 -12.831 -18.395 3.886 1.00 0.00 C ATOM 0 HA PRO A 107 -14.243 -19.279 6.723 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -12.089 -20.870 5.996 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -13.608 -20.953 5.126 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -11.067 -19.555 4.375 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -12.210 -20.401 3.350 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -12.122 -17.635 3.559 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -13.565 -18.511 3.088 1.00 0.00 H new ATOM 1385 N GLU A 108 -11.257 -17.980 6.882 1.00 0.00 N ATOM 1386 CA GLU A 108 -10.242 -17.542 7.832 1.00 0.00 C ATOM 1387 C GLU A 108 -10.805 -16.483 8.770 1.00 0.00 C ATOM 1388 O GLU A 108 -10.660 -16.578 9.989 1.00 0.00 O ATOM 1389 CB GLU A 108 -9.034 -16.971 7.083 1.00 0.00 C ATOM 1390 CG GLU A 108 -8.347 -18.080 6.279 1.00 0.00 C ATOM 1391 CD GLU A 108 -8.999 -18.215 4.907 1.00 0.00 C ATOM 1392 OE1 GLU A 108 -9.988 -17.538 4.674 1.00 0.00 O ATOM 1393 OE2 GLU A 108 -8.501 -18.992 4.109 1.00 0.00 O ATOM 0 H GLU A 108 -11.078 -17.712 5.914 1.00 0.00 H new ATOM 0 HA GLU A 108 -9.930 -18.404 8.421 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -9.354 -16.171 6.416 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -8.330 -16.533 7.791 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -7.287 -17.854 6.165 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -8.415 -19.025 6.817 1.00 0.00 H new ATOM 1400 N GLU A 109 -11.451 -15.476 8.194 1.00 0.00 N ATOM 1401 CA GLU A 109 -12.037 -14.404 8.988 1.00 0.00 C ATOM 1402 C GLU A 109 -13.137 -14.953 9.888 1.00 0.00 C ATOM 1403 O GLU A 109 -13.340 -14.470 11.002 1.00 0.00 O ATOM 1404 CB GLU A 109 -12.607 -13.324 8.069 1.00 0.00 C ATOM 1405 CG GLU A 109 -13.183 -12.186 8.912 1.00 0.00 C ATOM 1406 CD GLU A 109 -13.740 -11.099 8.002 1.00 0.00 C ATOM 1407 OE1 GLU A 109 -13.864 -11.348 6.815 1.00 0.00 O ATOM 1408 OE2 GLU A 109 -14.037 -10.029 8.509 1.00 0.00 O ATOM 0 H GLU A 109 -11.582 -15.380 7.187 1.00 0.00 H new ATOM 0 HA GLU A 109 -11.258 -13.966 9.613 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -11.826 -12.943 7.410 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -13.383 -13.747 7.432 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -13.970 -12.566 9.563 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -12.408 -11.771 9.557 1.00 0.00 H new ATOM 1415 N ASP A 110 -13.857 -15.953 9.391 1.00 0.00 N ATOM 1416 CA ASP A 110 -14.935 -16.558 10.162 1.00 0.00 C ATOM 1417 C ASP A 110 -14.391 -17.268 11.396 1.00 0.00 C ATOM 1418 O ASP A 110 -14.908 -17.101 12.500 1.00 0.00 O ATOM 1419 CB ASP A 110 -15.702 -17.560 9.287 1.00 0.00 C ATOM 1420 CG ASP A 110 -16.761 -16.836 8.458 1.00 0.00 C ATOM 1421 OD1 ASP A 110 -16.932 -15.646 8.662 1.00 0.00 O ATOM 1422 OD2 ASP A 110 -17.386 -17.483 7.634 1.00 0.00 O ATOM 0 H ASP A 110 -13.715 -16.358 8.466 1.00 0.00 H new ATOM 0 HA ASP A 110 -15.608 -15.765 10.488 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -15.009 -18.083 8.628 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -16.175 -18.315 9.915 1.00 0.00 H new ATOM 1427 N GLU A 111 -13.339 -18.059 11.204 1.00 0.00 N ATOM 1428 CA GLU A 111 -12.738 -18.793 12.311 1.00 0.00 C ATOM 1429 C GLU A 111 -12.259 -17.835 13.394 1.00 0.00 C ATOM 1430 O GLU A 111 -12.575 -18.005 14.571 1.00 0.00 O ATOM 1431 CB GLU A 111 -11.551 -19.615 11.806 1.00 0.00 C ATOM 1432 CG GLU A 111 -10.961 -20.426 12.961 1.00 0.00 C ATOM 1433 CD GLU A 111 -9.800 -21.278 12.461 1.00 0.00 C ATOM 1434 OE1 GLU A 111 -9.359 -21.049 11.347 1.00 0.00 O ATOM 1435 OE2 GLU A 111 -9.369 -22.147 13.200 1.00 0.00 O ATOM 0 H GLU A 111 -12.889 -18.207 10.301 1.00 0.00 H new ATOM 0 HA GLU A 111 -13.494 -19.456 12.733 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.872 -20.282 11.006 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.791 -18.956 11.386 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.618 -19.755 13.749 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.729 -21.064 13.398 1.00 0.00 H new ATOM 1442 N LEU A 112 -11.501 -16.823 12.989 1.00 0.00 N ATOM 1443 CA LEU A 112 -10.981 -15.849 13.941 1.00 0.00 C ATOM 1444 C LEU A 112 -12.123 -15.244 14.748 1.00 0.00 C ATOM 1445 O LEU A 112 -12.016 -15.080 15.963 1.00 0.00 O ATOM 1446 CB LEU A 112 -10.241 -14.736 13.192 1.00 0.00 C ATOM 1447 CG LEU A 112 -9.727 -13.695 14.190 1.00 0.00 C ATOM 1448 CD1 LEU A 112 -8.807 -14.371 15.209 1.00 0.00 C ATOM 1449 CD2 LEU A 112 -8.949 -12.610 13.439 1.00 0.00 C ATOM 0 H LEU A 112 -11.235 -16.656 12.019 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.291 -16.353 14.618 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.408 -15.156 12.628 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.908 -14.264 12.471 1.00 0.00 H new ATOM 0 HG LEU A 112 -10.572 -13.243 14.710 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.442 -13.628 15.919 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.361 -15.142 15.744 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -7.962 -14.824 14.691 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.582 -11.868 14.148 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.105 -13.062 12.918 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.605 -12.127 12.715 1.00 0.00 H new ATOM 1461 N ASP A 113 -13.212 -14.906 14.069 1.00 0.00 N ATOM 1462 CA ASP A 113 -14.365 -14.324 14.744 1.00 0.00 C ATOM 1463 C ASP A 113 -14.904 -15.273 15.807 1.00 0.00 C ATOM 1464 O ASP A 113 -15.211 -14.860 16.924 1.00 0.00 O ATOM 1465 CB ASP A 113 -15.466 -14.018 13.720 1.00 0.00 C ATOM 1466 CG ASP A 113 -15.224 -12.659 13.067 1.00 0.00 C ATOM 1467 OD1 ASP A 113 -14.306 -11.977 13.493 1.00 0.00 O ATOM 1468 OD2 ASP A 113 -15.959 -12.320 12.154 1.00 0.00 O ATOM 0 H ASP A 113 -13.321 -15.023 13.062 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.051 -13.400 15.230 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.488 -14.796 12.957 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -16.439 -14.025 14.210 1.00 0.00 H new ATOM 1473 N GLN A 114 -15.007 -16.551 15.457 1.00 0.00 N ATOM 1474 CA GLN A 114 -15.512 -17.548 16.394 1.00 0.00 C ATOM 1475 C GLN A 114 -14.591 -17.662 17.604 1.00 0.00 C ATOM 1476 O GLN A 114 -15.051 -17.695 18.745 1.00 0.00 O ATOM 1477 CB GLN A 114 -15.608 -18.909 15.703 1.00 0.00 C ATOM 1478 CG GLN A 114 -16.672 -18.853 14.605 1.00 0.00 C ATOM 1479 CD GLN A 114 -18.044 -18.603 15.222 1.00 0.00 C ATOM 1480 OE1 GLN A 114 -18.458 -19.323 16.130 1.00 0.00 O ATOM 1481 NE2 GLN A 114 -18.777 -17.617 14.780 1.00 0.00 N ATOM 0 H GLN A 114 -14.750 -16.918 14.541 1.00 0.00 H new ATOM 0 HA GLN A 114 -16.501 -17.235 16.729 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -14.643 -19.180 15.275 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -15.862 -19.680 16.430 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -16.433 -18.061 13.896 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -16.680 -19.789 14.047 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -18.431 -17.022 14.027 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -19.696 -17.442 15.187 1.00 0.00 H new ATOM 1490 N LEU A 115 -13.291 -17.722 17.348 1.00 0.00 N ATOM 1491 CA LEU A 115 -12.320 -17.840 18.425 1.00 0.00 C ATOM 1492 C LEU A 115 -12.427 -16.645 19.366 1.00 0.00 C ATOM 1493 O LEU A 115 -12.368 -16.797 20.586 1.00 0.00 O ATOM 1494 CB LEU A 115 -10.910 -17.900 17.844 1.00 0.00 C ATOM 1495 CG LEU A 115 -10.728 -19.195 17.047 1.00 0.00 C ATOM 1496 CD1 LEU A 115 -9.375 -19.171 16.328 1.00 0.00 C ATOM 1497 CD2 LEU A 115 -10.785 -20.399 17.995 1.00 0.00 C ATOM 0 H LEU A 115 -12.888 -17.691 16.412 1.00 0.00 H new ATOM 0 HA LEU A 115 -12.526 -18.754 18.983 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.736 -17.039 17.199 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -10.174 -17.851 18.647 1.00 0.00 H new ATOM 0 HG LEU A 115 -11.527 -19.279 16.311 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -9.248 -20.093 15.762 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.339 -18.320 15.648 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.574 -19.083 17.062 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.655 -21.318 17.424 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.990 -20.317 18.736 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -11.751 -20.419 18.500 1.00 0.00 H new ATOM 1509 N CYS A 116 -12.590 -15.459 18.794 1.00 0.00 N ATOM 1510 CA CYS A 116 -12.710 -14.248 19.597 1.00 0.00 C ATOM 1511 C CYS A 116 -13.966 -14.304 20.462 1.00 0.00 C ATOM 1512 O CYS A 116 -13.948 -13.907 21.627 1.00 0.00 O ATOM 1513 CB CYS A 116 -12.775 -13.023 18.684 1.00 0.00 C ATOM 1514 SG CYS A 116 -11.199 -12.831 17.819 1.00 0.00 S ATOM 0 H CYS A 116 -12.642 -15.309 17.786 1.00 0.00 H new ATOM 0 HA CYS A 116 -11.837 -14.174 20.245 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -13.586 -13.135 17.964 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -12.991 -12.130 19.271 1.00 0.00 H new ATOM 0 HG CYS A 116 -11.128 -13.694 16.849 1.00 0.00 H new ATOM 1520 N ASP A 117 -15.056 -14.803 19.886 1.00 0.00 N ATOM 1521 CA ASP A 117 -16.312 -14.906 20.617 1.00 0.00 C ATOM 1522 C ASP A 117 -16.156 -15.825 21.825 1.00 0.00 C ATOM 1523 O ASP A 117 -16.608 -15.503 22.924 1.00 0.00 O ATOM 1524 CB ASP A 117 -17.408 -15.453 19.698 1.00 0.00 C ATOM 1525 CG ASP A 117 -18.725 -15.557 20.460 1.00 0.00 C ATOM 1526 OD1 ASP A 117 -18.713 -15.330 21.658 1.00 0.00 O ATOM 1527 OD2 ASP A 117 -19.727 -15.862 19.833 1.00 0.00 O ATOM 0 H ASP A 117 -15.094 -15.139 18.924 1.00 0.00 H new ATOM 0 HA ASP A 117 -16.590 -13.911 20.964 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -17.529 -14.800 18.834 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -17.120 -16.433 19.318 1.00 0.00 H new ATOM 1532 N GLU A 118 -15.515 -16.970 21.612 1.00 0.00 N ATOM 1533 CA GLU A 118 -15.312 -17.928 22.693 1.00 0.00 C ATOM 1534 C GLU A 118 -14.446 -17.318 23.789 1.00 0.00 C ATOM 1535 O GLU A 118 -14.757 -17.431 24.975 1.00 0.00 O ATOM 1536 CB GLU A 118 -14.640 -19.190 22.146 1.00 0.00 C ATOM 1537 CG GLU A 118 -14.659 -20.282 23.218 1.00 0.00 C ATOM 1538 CD GLU A 118 -14.222 -21.611 22.613 1.00 0.00 C ATOM 1539 OE1 GLU A 118 -14.204 -21.706 21.396 1.00 0.00 O ATOM 1540 OE2 GLU A 118 -13.917 -22.515 23.373 1.00 0.00 O ATOM 0 H GLU A 118 -15.131 -17.255 20.711 1.00 0.00 H new ATOM 0 HA GLU A 118 -16.282 -18.188 23.117 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -15.160 -19.534 21.252 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -13.613 -18.971 21.853 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -13.995 -20.010 24.038 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -15.661 -20.375 23.637 1.00 0.00 H new ATOM 1547 N TRP A 119 -13.361 -16.665 23.385 1.00 0.00 N ATOM 1548 CA TRP A 119 -12.459 -16.033 24.341 1.00 0.00 C ATOM 1549 C TRP A 119 -13.171 -14.903 25.079 1.00 0.00 C ATOM 1550 O TRP A 119 -12.989 -14.722 26.284 1.00 0.00 O ATOM 1551 CB TRP A 119 -11.228 -15.486 23.619 1.00 0.00 C ATOM 1552 CG TRP A 119 -10.424 -14.652 24.563 1.00 0.00 C ATOM 1553 CD1 TRP A 119 -10.267 -13.311 24.476 1.00 0.00 C ATOM 1554 CD2 TRP A 119 -9.668 -15.078 25.734 1.00 0.00 C ATOM 1555 NE1 TRP A 119 -9.462 -12.887 25.519 1.00 0.00 N ATOM 1556 CE2 TRP A 119 -9.068 -13.939 26.322 1.00 0.00 C ATOM 1557 CE3 TRP A 119 -9.448 -16.329 26.338 1.00 0.00 C ATOM 1558 CZ2 TRP A 119 -8.277 -14.039 27.466 1.00 0.00 C ATOM 1559 CZ3 TRP A 119 -8.652 -16.433 27.490 1.00 0.00 C ATOM 1560 CH2 TRP A 119 -8.068 -15.289 28.053 1.00 0.00 C ATOM 0 H TRP A 119 -13.086 -16.560 22.408 1.00 0.00 H new ATOM 0 HA TRP A 119 -12.144 -16.782 25.067 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -10.622 -16.308 23.237 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -11.533 -14.889 22.760 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -10.699 -12.676 23.717 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -9.193 -11.916 25.675 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -9.894 -17.216 25.913 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -7.829 -13.155 27.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -8.489 -17.399 27.945 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -7.457 -15.374 28.940 1.00 0.00 H new ATOM 1571 N LYS A 120 -13.973 -14.139 24.345 1.00 0.00 N ATOM 1572 CA LYS A 120 -14.709 -13.029 24.937 1.00 0.00 C ATOM 1573 C LYS A 120 -15.668 -13.532 26.008 1.00 0.00 C ATOM 1574 O LYS A 120 -15.856 -12.886 27.039 1.00 0.00 O ATOM 1575 CB LYS A 120 -15.490 -12.281 23.854 1.00 0.00 C ATOM 1576 CG LYS A 120 -16.151 -11.042 24.463 1.00 0.00 C ATOM 1577 CD LYS A 120 -16.884 -10.265 23.368 1.00 0.00 C ATOM 1578 CE LYS A 120 -17.533 -9.019 23.974 1.00 0.00 C ATOM 1579 NZ LYS A 120 -18.230 -8.251 22.903 1.00 0.00 N ATOM 0 H LYS A 120 -14.129 -14.267 23.345 1.00 0.00 H new ATOM 0 HA LYS A 120 -13.993 -12.349 25.400 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -14.821 -11.988 23.045 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -16.247 -12.934 23.421 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -16.851 -11.337 25.245 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -15.398 -10.408 24.932 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -16.186 -9.978 22.581 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -17.644 -10.896 22.906 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -18.242 -9.306 24.750 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -16.775 -8.396 24.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -18.404 -7.279 23.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -17.636 -8.228 22.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -19.137 -8.709 22.681 1.00 0.00 H new ATOM 1593 N ALA A 121 -16.275 -14.687 25.756 1.00 0.00 N ATOM 1594 CA ALA A 121 -17.214 -15.266 26.709 1.00 0.00 C ATOM 1595 C ALA A 121 -16.505 -15.645 28.003 1.00 0.00 C ATOM 1596 O ALA A 121 -17.009 -15.393 29.098 1.00 0.00 O ATOM 1597 CB ALA A 121 -17.866 -16.511 26.105 1.00 0.00 C ATOM 0 H ALA A 121 -16.135 -15.236 24.908 1.00 0.00 H new ATOM 0 HA ALA A 121 -17.978 -14.522 26.932 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -18.567 -16.939 26.822 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -18.400 -16.237 25.195 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -17.097 -17.245 25.867 1.00 0.00 H new ATOM 1603 N ARG A 122 -15.332 -16.253 27.872 1.00 0.00 N ATOM 1604 CA ARG A 122 -14.565 -16.665 29.037 1.00 0.00 C ATOM 1605 C ARG A 122 -14.212 -15.456 29.897 1.00 0.00 C ATOM 1606 O ARG A 122 -14.303 -15.506 31.123 1.00 0.00 O ATOM 1607 CB ARG A 122 -13.279 -17.365 28.596 1.00 0.00 C ATOM 1608 CG ARG A 122 -12.525 -17.908 29.832 1.00 0.00 C ATOM 1609 CD ARG A 122 -11.106 -17.343 29.868 1.00 0.00 C ATOM 1610 NE ARG A 122 -10.359 -17.935 30.966 1.00 0.00 N ATOM 1611 CZ ARG A 122 -9.157 -17.478 31.300 1.00 0.00 C ATOM 1612 NH1 ARG A 122 -8.502 -18.026 32.286 1.00 0.00 N ATOM 1613 NH2 ARG A 122 -8.631 -16.483 30.640 1.00 0.00 N ATOM 0 H ARG A 122 -14.895 -16.470 26.976 1.00 0.00 H new ATOM 0 HA ARG A 122 -15.173 -17.354 29.623 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -13.515 -18.183 27.915 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -12.644 -16.668 28.049 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -13.058 -17.634 30.743 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -12.491 -18.997 29.798 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -10.601 -17.546 28.923 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -11.141 -16.260 29.984 1.00 0.00 H new ATOM 0 HE ARG A 122 -10.764 -18.713 31.488 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -8.913 -18.805 32.800 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -7.579 -17.675 32.543 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -9.143 -16.056 29.868 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -7.708 -16.132 30.896 1.00 0.00 H new ATOM 1627 N LEU A 123 -13.811 -14.371 29.245 1.00 0.00 N ATOM 1628 CA LEU A 123 -13.451 -13.152 29.958 1.00 0.00 C ATOM 1629 C LEU A 123 -14.653 -12.610 30.718 1.00 0.00 C ATOM 1630 O LEU A 123 -14.524 -12.149 31.850 1.00 0.00 O ATOM 1631 CB LEU A 123 -12.943 -12.096 28.974 1.00 0.00 C ATOM 1632 CG LEU A 123 -11.576 -12.523 28.424 1.00 0.00 C ATOM 1633 CD1 LEU A 123 -11.146 -11.557 27.311 1.00 0.00 C ATOM 1634 CD2 LEU A 123 -10.533 -12.510 29.555 1.00 0.00 C ATOM 0 H LEU A 123 -13.727 -14.310 28.230 1.00 0.00 H new ATOM 0 HA LEU A 123 -12.659 -13.388 30.669 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -13.654 -11.974 28.156 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -12.861 -11.130 29.472 1.00 0.00 H new ATOM 0 HG LEU A 123 -11.650 -13.532 28.018 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -10.175 -11.861 26.921 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -11.882 -11.577 26.508 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.075 -10.547 27.714 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -9.564 -12.814 29.160 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -10.457 -11.504 29.968 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -10.838 -13.203 30.339 1.00 0.00 H new ATOM 1646 N SER A 124 -15.820 -12.668 30.091 1.00 0.00 N ATOM 1647 CA SER A 124 -17.042 -12.183 30.719 1.00 0.00 C ATOM 1648 C SER A 124 -17.422 -13.059 31.910 1.00 0.00 C ATOM 1649 O SER A 124 -17.861 -12.560 32.947 1.00 0.00 O ATOM 1650 CB SER A 124 -18.184 -12.169 29.704 1.00 0.00 C ATOM 1651 OG SER A 124 -19.354 -11.649 30.322 1.00 0.00 O ATOM 0 H SER A 124 -15.947 -13.045 29.152 1.00 0.00 H new ATOM 0 HA SER A 124 -16.864 -11.168 31.075 1.00 0.00 H new ATOM 0 HB2 SER A 124 -17.912 -11.560 28.842 1.00 0.00 H new ATOM 0 HB3 SER A 124 -18.371 -13.178 29.335 1.00 0.00 H new ATOM 0 HG SER A 124 -20.089 -11.637 29.674 1.00 0.00 H new ATOM 1657 N GLU A 125 -17.258 -14.370 31.750 1.00 0.00 N ATOM 1658 CA GLU A 125 -17.595 -15.308 32.815 1.00 0.00 C ATOM 1659 C GLU A 125 -16.774 -15.014 34.065 1.00 0.00 C ATOM 1660 O GLU A 125 -17.291 -15.046 35.181 1.00 0.00 O ATOM 1661 CB GLU A 125 -17.325 -16.742 32.350 1.00 0.00 C ATOM 1662 CG GLU A 125 -17.738 -17.722 33.448 1.00 0.00 C ATOM 1663 CD GLU A 125 -17.511 -19.156 32.981 1.00 0.00 C ATOM 1664 OE1 GLU A 125 -17.327 -19.348 31.791 1.00 0.00 O ATOM 1665 OE2 GLU A 125 -17.526 -20.041 33.821 1.00 0.00 O ATOM 0 H GLU A 125 -16.897 -14.803 30.900 1.00 0.00 H new ATOM 0 HA GLU A 125 -18.653 -15.196 33.054 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.880 -16.949 31.435 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -16.268 -16.866 32.116 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -17.162 -17.530 34.353 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -18.788 -17.575 33.701 1.00 0.00 H new ATOM 1672 N LEU A 126 -15.494 -14.721 33.868 1.00 0.00 N ATOM 1673 CA LEU A 126 -14.606 -14.411 34.982 1.00 0.00 C ATOM 1674 C LEU A 126 -15.007 -13.092 35.635 1.00 0.00 C ATOM 1675 O LEU A 126 -14.904 -12.933 36.852 1.00 0.00 O ATOM 1676 CB LEU A 126 -13.159 -14.338 34.499 1.00 0.00 C ATOM 1677 CG LEU A 126 -12.704 -15.728 34.045 1.00 0.00 C ATOM 1678 CD1 LEU A 126 -11.324 -15.624 33.392 1.00 0.00 C ATOM 1679 CD2 LEU A 126 -12.632 -16.677 35.252 1.00 0.00 C ATOM 0 H LEU A 126 -15.049 -14.692 32.951 1.00 0.00 H new ATOM 0 HA LEU A 126 -14.692 -15.206 35.723 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -13.074 -13.629 33.676 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -12.514 -13.976 35.300 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.421 -16.122 33.325 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -10.999 -16.613 33.068 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -11.379 -14.960 32.529 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -10.610 -15.225 34.112 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.308 -17.663 34.920 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -11.921 -16.287 35.980 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -13.617 -16.755 35.713 1.00 0.00 H new ATOM 1691 N GLN A 127 -15.457 -12.147 34.816 1.00 0.00 N ATOM 1692 CA GLN A 127 -15.869 -10.842 35.321 1.00 0.00 C ATOM 1693 C GLN A 127 -17.099 -10.967 36.214 1.00 0.00 C ATOM 1694 O GLN A 127 -17.181 -10.332 37.266 1.00 0.00 O ATOM 1695 CB GLN A 127 -16.178 -9.904 34.153 1.00 0.00 C ATOM 1696 CG GLN A 127 -14.872 -9.463 33.490 1.00 0.00 C ATOM 1697 CD GLN A 127 -15.173 -8.628 32.250 1.00 0.00 C ATOM 1698 OE1 GLN A 127 -16.335 -8.343 31.960 1.00 0.00 O ATOM 1699 NE2 GLN A 127 -14.191 -8.216 31.497 1.00 0.00 N ATOM 0 H GLN A 127 -15.545 -12.259 33.806 1.00 0.00 H new ATOM 0 HA GLN A 127 -15.050 -10.432 35.912 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -16.814 -10.409 33.426 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -16.729 -9.033 34.508 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -14.275 -8.882 34.194 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -14.281 -10.337 33.216 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -13.229 -8.453 31.739 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -14.385 -7.657 30.666 1.00 0.00 H new ATOM 1708 N GLN A 128 -18.050 -11.791 35.790 1.00 0.00 N ATOM 1709 CA GLN A 128 -19.272 -11.992 36.559 1.00 0.00 C ATOM 1710 C GLN A 128 -18.943 -12.485 37.964 1.00 0.00 C ATOM 1711 O GLN A 128 -19.598 -12.107 38.933 1.00 0.00 O ATOM 1712 CB GLN A 128 -20.173 -13.009 35.856 1.00 0.00 C ATOM 1713 CG GLN A 128 -20.711 -12.404 34.557 1.00 0.00 C ATOM 1714 CD GLN A 128 -21.546 -13.438 33.809 1.00 0.00 C ATOM 1715 OE1 GLN A 128 -21.027 -14.471 33.388 1.00 0.00 O ATOM 1716 NE2 GLN A 128 -22.819 -13.219 33.616 1.00 0.00 N ATOM 0 H GLN A 128 -18.000 -12.327 34.924 1.00 0.00 H new ATOM 0 HA GLN A 128 -19.794 -11.038 36.633 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -19.613 -13.919 35.641 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -21.000 -13.290 36.508 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -21.317 -11.526 34.779 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -19.883 -12.070 33.931 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -23.248 -12.362 33.966 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -23.384 -13.905 33.116 1.00 0.00 H new ATOM 1725 N TYR A 129 -17.924 -13.327 38.065 1.00 0.00 N ATOM 1726 CA TYR A 129 -17.515 -13.866 39.357 1.00 0.00 C ATOM 1727 C TYR A 129 -17.112 -12.739 40.302 1.00 0.00 C ATOM 1728 O TYR A 129 -17.417 -12.777 41.494 1.00 0.00 O ATOM 1729 CB TYR A 129 -16.338 -14.831 39.175 1.00 0.00 C ATOM 1730 CG TYR A 129 -16.857 -16.209 38.835 1.00 0.00 C ATOM 1731 CD1 TYR A 129 -17.794 -16.372 37.808 1.00 0.00 C ATOM 1732 CD2 TYR A 129 -16.404 -17.323 39.552 1.00 0.00 C ATOM 1733 CE1 TYR A 129 -18.277 -17.649 37.496 1.00 0.00 C ATOM 1734 CE2 TYR A 129 -16.887 -18.600 39.242 1.00 0.00 C ATOM 1735 CZ TYR A 129 -17.823 -18.763 38.214 1.00 0.00 C ATOM 1736 OH TYR A 129 -18.299 -20.021 37.907 1.00 0.00 O ATOM 0 H TYR A 129 -17.368 -13.651 37.274 1.00 0.00 H new ATOM 0 HA TYR A 129 -18.359 -14.404 39.789 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -15.681 -14.473 38.382 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -15.743 -14.871 40.088 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -18.145 -15.513 37.256 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -15.681 -17.197 40.345 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -18.999 -17.775 36.703 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -16.538 -19.459 39.796 1.00 0.00 H new ATOM 0 HH TYR A 129 -17.882 -20.682 38.498 1.00 0.00 H new ATOM 1746 N ARG A 130 -16.423 -11.739 39.765 1.00 0.00 N ATOM 1747 CA ARG A 130 -15.985 -10.611 40.575 1.00 0.00 C ATOM 1748 C ARG A 130 -17.183 -9.901 41.196 1.00 0.00 C ATOM 1749 O ARG A 130 -17.163 -9.544 42.374 1.00 0.00 O ATOM 1750 CB ARG A 130 -15.200 -9.623 39.709 1.00 0.00 C ATOM 1751 CG ARG A 130 -14.667 -8.486 40.584 1.00 0.00 C ATOM 1752 CD ARG A 130 -13.874 -7.505 39.718 1.00 0.00 C ATOM 1753 NE ARG A 130 -14.752 -6.872 38.740 1.00 0.00 N ATOM 1754 CZ ARG A 130 -15.434 -5.772 39.038 1.00 0.00 C ATOM 1755 NH1 ARG A 130 -16.213 -5.224 38.146 1.00 0.00 N ATOM 1756 NH2 ARG A 130 -15.326 -5.239 40.226 1.00 0.00 N ATOM 0 H ARG A 130 -16.158 -11.687 38.781 1.00 0.00 H new ATOM 0 HA ARG A 130 -15.345 -10.987 41.373 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -14.373 -10.134 39.215 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -15.841 -9.222 38.924 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -15.494 -7.970 41.072 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -14.031 -8.887 41.373 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -13.411 -6.745 40.348 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -13.067 -8.030 39.207 1.00 0.00 H new ATOM 0 HE ARG A 130 -14.844 -7.282 37.810 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -16.299 -5.640 37.219 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -16.736 -4.379 38.376 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -14.718 -5.668 40.924 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -15.850 -4.394 40.455 1.00 0.00 H new ATOM 1770 N GLU A 131 -18.227 -9.700 40.399 1.00 0.00 N ATOM 1771 CA GLU A 131 -19.431 -9.034 40.886 1.00 0.00 C ATOM 1772 C GLU A 131 -20.172 -9.920 41.883 1.00 0.00 C ATOM 1773 O GLU A 131 -20.659 -9.446 42.908 1.00 0.00 O ATOM 1774 CB GLU A 131 -20.353 -8.700 39.714 1.00 0.00 C ATOM 1775 CG GLU A 131 -19.700 -7.627 38.841 1.00 0.00 C ATOM 1776 CD GLU A 131 -20.569 -7.350 37.619 1.00 0.00 C ATOM 1777 OE1 GLU A 131 -21.618 -7.964 37.511 1.00 0.00 O ATOM 1778 OE2 GLU A 131 -20.174 -6.527 36.810 1.00 0.00 O ATOM 0 H GLU A 131 -18.265 -9.986 39.421 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.134 -8.114 41.389 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -20.547 -9.595 39.124 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -21.316 -8.347 40.084 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.564 -6.711 39.416 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -18.709 -7.955 38.526 1.00 0.00 H new