USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 959 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 52 CYS SG : rot 86:sc= 0.162 USER MOD Set 1.2: A 54 TYR OH : rot -87:sc= 0.395 USER MOD Single : A 13 THR OG1 : rot -28:sc= 0.139 USER MOD Single : A 17 THR OG1 : rot 79:sc= 0.284 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0.161 K(o=0.16,f=-1.8) USER MOD Single : A 38 ASN : amide:sc= -0.0993 K(o=-0.099,f=-1.1) USER MOD Single : A 39 CYS SG : rot 14:sc= 0.119 USER MOD Single : A 43 TYR OH : rot 159:sc= 0.134 USER MOD Single : A 44 CYS SG : rot 180:sc= -0.603 USER MOD Single : A 45 ASN : amide:sc= -0.517 K(o=-0.52,f=-3!) USER MOD Single : A 49 CYS SG : rot 48:sc= 0.323 USER MOD Single : A 55 SER OG : rot 180:sc= -0.0163 USER MOD Single : A 60 MET CE :methyl 174:sc= 0 (180deg=-0.0436) USER MOD Single : A 61 GLN : amide:sc= -0.0103 X(o=-0.01,f=-0.27) USER MOD Single : A 64 CYS SG : rot 180:sc= 0.00394 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot 68:sc= 0.38 USER MOD Single : A 70 HIS :FLIP no HD1:sc= -0.931 F(o=-1.8,f=-0.93) USER MOD Single : A 74 THR OG1 : rot -55:sc= 1.66 USER MOD Single : A 75 GLN : amide:sc= 0.884 K(o=0.88,f=-8.3!) USER MOD Single : A 81 GLN : amide:sc= 0.675 K(o=0.68,f=-3.8!) USER MOD Single : A 84 GLN : amide:sc= -0.0737 X(o=-0.074,f=-0.074) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 180:sc= 0 USER MOD Single : A 108 CYS SG : rot 21:sc= 0.515 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= 1.11 K(o=1.1,f=-3.1!) USER MOD Single : A 124 MET CE :methyl -177:sc= -0.0913 (180deg=-0.112) USER MOD Single : A 128 ASN : amide:sc= 1.05 K(o=1.1,f=-0.26) USER MOD Single : A 133 MET CE :methyl -172:sc= 0 (180deg=-0.101) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 191 N THR A 13 19.554 -2.086 -10.215 1.00 0.00 N ATOM 192 CA THR A 13 19.769 -1.250 -9.011 1.00 0.00 C ATOM 193 C THR A 13 20.815 -0.150 -9.185 1.00 0.00 C ATOM 194 O THR A 13 20.634 0.951 -8.666 1.00 0.00 O ATOM 195 CB THR A 13 20.155 -2.120 -7.806 1.00 0.00 C ATOM 196 OG1 THR A 13 21.287 -2.902 -8.132 1.00 0.00 O ATOM 197 CG2 THR A 13 19.016 -3.057 -7.406 1.00 0.00 C ATOM 0 HA THR A 13 18.814 -0.754 -8.840 1.00 0.00 H new ATOM 0 HB THR A 13 20.373 -1.455 -6.970 1.00 0.00 H new ATOM 0 HG1 THR A 13 21.299 -3.073 -9.097 1.00 0.00 H new ATOM 0 HG21 THR A 13 19.323 -3.658 -6.550 1.00 0.00 H new ATOM 0 HG22 THR A 13 18.138 -2.469 -7.140 1.00 0.00 H new ATOM 0 HG23 THR A 13 18.774 -3.713 -8.242 1.00 0.00 H new ATOM 205 N PHE A 14 21.879 -0.418 -9.948 1.00 0.00 N ATOM 206 CA PHE A 14 22.921 0.566 -10.259 1.00 0.00 C ATOM 207 C PHE A 14 22.365 1.730 -11.089 1.00 0.00 C ATOM 208 O PHE A 14 22.529 2.890 -10.720 1.00 0.00 O ATOM 209 CB PHE A 14 24.074 -0.131 -10.992 1.00 0.00 C ATOM 210 CG PHE A 14 25.379 0.644 -10.933 1.00 0.00 C ATOM 211 CD1 PHE A 14 25.618 1.711 -11.822 1.00 0.00 C ATOM 212 CD2 PHE A 14 26.351 0.312 -9.968 1.00 0.00 C ATOM 213 CE1 PHE A 14 26.819 2.441 -11.745 1.00 0.00 C ATOM 214 CE2 PHE A 14 27.555 1.035 -9.900 1.00 0.00 C ATOM 215 CZ PHE A 14 27.788 2.100 -10.787 1.00 0.00 C ATOM 0 H PHE A 14 22.043 -1.332 -10.371 1.00 0.00 H new ATOM 0 HA PHE A 14 23.292 0.990 -9.326 1.00 0.00 H new ATOM 0 HB2 PHE A 14 24.226 -1.119 -10.558 1.00 0.00 H new ATOM 0 HB3 PHE A 14 23.795 -0.280 -12.035 1.00 0.00 H new ATOM 0 HD1 PHE A 14 24.878 1.969 -12.565 1.00 0.00 H new ATOM 0 HD2 PHE A 14 26.171 -0.500 -9.279 1.00 0.00 H new ATOM 0 HE1 PHE A 14 26.995 3.263 -12.423 1.00 0.00 H new ATOM 0 HE2 PHE A 14 28.302 0.772 -9.165 1.00 0.00 H new ATOM 0 HZ PHE A 14 28.712 2.656 -10.732 1.00 0.00 H new ATOM 225 N LEU A 15 21.661 1.415 -12.183 1.00 0.00 N ATOM 226 CA LEU A 15 20.968 2.388 -13.036 1.00 0.00 C ATOM 227 C LEU A 15 19.818 3.069 -12.284 1.00 0.00 C ATOM 228 O LEU A 15 19.619 4.271 -12.420 1.00 0.00 O ATOM 229 CB LEU A 15 20.476 1.660 -14.303 1.00 0.00 C ATOM 230 CG LEU A 15 19.609 2.528 -15.236 1.00 0.00 C ATOM 231 CD1 LEU A 15 20.381 3.726 -15.810 1.00 0.00 C ATOM 232 CD2 LEU A 15 19.065 1.667 -16.384 1.00 0.00 C ATOM 0 H LEU A 15 21.555 0.454 -12.507 1.00 0.00 H new ATOM 0 HA LEU A 15 21.655 3.184 -13.324 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.341 1.300 -14.860 1.00 0.00 H new ATOM 0 HB3 LEU A 15 19.902 0.783 -14.004 1.00 0.00 H new ATOM 0 HG LEU A 15 18.788 2.926 -14.639 1.00 0.00 H new ATOM 0 HD11 LEU A 15 19.724 4.304 -16.460 1.00 0.00 H new ATOM 0 HD12 LEU A 15 20.732 4.358 -14.994 1.00 0.00 H new ATOM 0 HD13 LEU A 15 21.235 3.367 -16.384 1.00 0.00 H new ATOM 0 HD21 LEU A 15 18.452 2.283 -17.042 1.00 0.00 H new ATOM 0 HD22 LEU A 15 19.897 1.248 -16.950 1.00 0.00 H new ATOM 0 HD23 LEU A 15 18.459 0.858 -15.976 1.00 0.00 H new ATOM 244 N ASP A 16 19.093 2.331 -11.444 1.00 0.00 N ATOM 245 CA ASP A 16 17.986 2.854 -10.631 1.00 0.00 C ATOM 246 C ASP A 16 18.444 3.945 -9.650 1.00 0.00 C ATOM 247 O ASP A 16 17.693 4.876 -9.352 1.00 0.00 O ATOM 248 CB ASP A 16 17.352 1.689 -9.869 1.00 0.00 C ATOM 249 CG ASP A 16 16.013 2.078 -9.221 1.00 0.00 C ATOM 250 OD1 ASP A 16 15.045 2.353 -9.971 1.00 0.00 O ATOM 251 OD2 ASP A 16 15.928 2.078 -7.970 1.00 0.00 O ATOM 0 H ASP A 16 19.258 1.334 -11.304 1.00 0.00 H new ATOM 0 HA ASP A 16 17.259 3.319 -11.297 1.00 0.00 H new ATOM 0 HB2 ASP A 16 17.194 0.854 -10.551 1.00 0.00 H new ATOM 0 HB3 ASP A 16 18.040 1.344 -9.097 1.00 0.00 H new ATOM 256 N THR A 17 19.711 3.858 -9.222 1.00 0.00 N ATOM 257 CA THR A 17 20.389 4.867 -8.395 1.00 0.00 C ATOM 258 C THR A 17 20.686 6.134 -9.192 1.00 0.00 C ATOM 259 O THR A 17 20.727 7.215 -8.616 1.00 0.00 O ATOM 260 CB THR A 17 21.639 4.266 -7.735 1.00 0.00 C ATOM 261 OG1 THR A 17 21.202 3.310 -6.792 1.00 0.00 O ATOM 262 CG2 THR A 17 22.495 5.285 -6.980 1.00 0.00 C ATOM 0 H THR A 17 20.309 3.063 -9.447 1.00 0.00 H new ATOM 0 HA THR A 17 19.718 5.170 -7.592 1.00 0.00 H new ATOM 0 HB THR A 17 22.254 3.851 -8.533 1.00 0.00 H new ATOM 0 HG1 THR A 17 20.960 2.481 -7.255 1.00 0.00 H new ATOM 0 HG21 THR A 17 23.358 4.783 -6.543 1.00 0.00 H new ATOM 0 HG22 THR A 17 22.836 6.057 -7.670 1.00 0.00 H new ATOM 0 HG23 THR A 17 21.902 5.743 -6.188 1.00 0.00 H new ATOM 270 N ILE A 18 20.818 6.042 -10.516 1.00 0.00 N ATOM 271 CA ILE A 18 20.958 7.206 -11.413 1.00 0.00 C ATOM 272 C ILE A 18 19.583 7.799 -11.730 1.00 0.00 C ATOM 273 O ILE A 18 19.400 9.010 -11.657 1.00 0.00 O ATOM 274 CB ILE A 18 21.714 6.820 -12.706 1.00 0.00 C ATOM 275 CG1 ILE A 18 22.910 5.874 -12.456 1.00 0.00 C ATOM 276 CG2 ILE A 18 22.162 8.084 -13.459 1.00 0.00 C ATOM 277 CD1 ILE A 18 23.969 6.368 -11.462 1.00 0.00 C ATOM 0 H ILE A 18 20.832 5.149 -11.009 1.00 0.00 H new ATOM 0 HA ILE A 18 21.548 7.968 -10.903 1.00 0.00 H new ATOM 0 HB ILE A 18 21.012 6.261 -13.325 1.00 0.00 H new ATOM 0 HG12 ILE A 18 22.523 4.920 -12.098 1.00 0.00 H new ATOM 0 HG13 ILE A 18 23.400 5.681 -13.411 1.00 0.00 H new ATOM 0 HG21 ILE A 18 22.693 7.798 -14.367 1.00 0.00 H new ATOM 0 HG22 ILE A 18 21.288 8.680 -13.722 1.00 0.00 H new ATOM 0 HG23 ILE A 18 22.823 8.672 -12.822 1.00 0.00 H new ATOM 0 HD11 ILE A 18 24.757 5.621 -11.369 1.00 0.00 H new ATOM 0 HD12 ILE A 18 24.397 7.304 -11.821 1.00 0.00 H new ATOM 0 HD13 ILE A 18 23.506 6.531 -10.488 1.00 0.00 H new ATOM 289 N ILE A 19 18.589 6.951 -12.008 1.00 0.00 N ATOM 290 CA ILE A 19 17.203 7.376 -12.268 1.00 0.00 C ATOM 291 C ILE A 19 16.656 8.204 -11.093 1.00 0.00 C ATOM 292 O ILE A 19 16.092 9.271 -11.331 1.00 0.00 O ATOM 293 CB ILE A 19 16.320 6.151 -12.612 1.00 0.00 C ATOM 294 CG1 ILE A 19 16.767 5.527 -13.959 1.00 0.00 C ATOM 295 CG2 ILE A 19 14.831 6.546 -12.688 1.00 0.00 C ATOM 296 CD1 ILE A 19 16.146 4.154 -14.248 1.00 0.00 C ATOM 0 H ILE A 19 18.721 5.941 -12.060 1.00 0.00 H new ATOM 0 HA ILE A 19 17.185 8.032 -13.139 1.00 0.00 H new ATOM 0 HB ILE A 19 16.442 5.415 -11.817 1.00 0.00 H new ATOM 0 HG12 ILE A 19 16.506 6.210 -14.768 1.00 0.00 H new ATOM 0 HG13 ILE A 19 17.853 5.431 -13.960 1.00 0.00 H new ATOM 0 HG21 ILE A 19 14.233 5.667 -12.931 1.00 0.00 H new ATOM 0 HG22 ILE A 19 14.512 6.947 -11.726 1.00 0.00 H new ATOM 0 HG23 ILE A 19 14.694 7.303 -13.461 1.00 0.00 H new ATOM 0 HD11 ILE A 19 16.508 3.785 -15.208 1.00 0.00 H new ATOM 0 HD12 ILE A 19 16.427 3.454 -13.461 1.00 0.00 H new ATOM 0 HD13 ILE A 19 15.060 4.245 -14.281 1.00 0.00 H new ATOM 308 N ARG A 20 16.877 7.788 -9.839 1.00 0.00 N ATOM 309 CA ARG A 20 16.377 8.524 -8.663 1.00 0.00 C ATOM 310 C ARG A 20 17.087 9.862 -8.393 1.00 0.00 C ATOM 311 O ARG A 20 16.522 10.727 -7.723 1.00 0.00 O ATOM 312 CB ARG A 20 16.329 7.617 -7.428 1.00 0.00 C ATOM 313 CG ARG A 20 17.703 7.266 -6.841 1.00 0.00 C ATOM 314 CD ARG A 20 17.559 6.272 -5.679 1.00 0.00 C ATOM 315 NE ARG A 20 18.863 5.887 -5.103 1.00 0.00 N ATOM 316 CZ ARG A 20 19.601 6.584 -4.244 1.00 0.00 C ATOM 317 NH1 ARG A 20 19.261 7.790 -3.833 1.00 0.00 N ATOM 318 NH2 ARG A 20 20.712 6.061 -3.772 1.00 0.00 N ATOM 0 H ARG A 20 17.400 6.943 -9.609 1.00 0.00 H new ATOM 0 HA ARG A 20 15.356 8.817 -8.907 1.00 0.00 H new ATOM 0 HB2 ARG A 20 15.733 8.106 -6.657 1.00 0.00 H new ATOM 0 HB3 ARG A 20 15.814 6.693 -7.691 1.00 0.00 H new ATOM 0 HG2 ARG A 20 18.337 6.837 -7.617 1.00 0.00 H new ATOM 0 HG3 ARG A 20 18.197 8.173 -6.492 1.00 0.00 H new ATOM 0 HD2 ARG A 20 16.937 6.715 -4.901 1.00 0.00 H new ATOM 0 HD3 ARG A 20 17.042 5.379 -6.030 1.00 0.00 H new ATOM 0 HE ARG A 20 19.240 4.986 -5.397 1.00 0.00 H new ATOM 0 HH11 ARG A 20 18.403 8.222 -4.175 1.00 0.00 H new ATOM 0 HH12 ARG A 20 19.856 8.290 -3.173 1.00 0.00 H new ATOM 0 HH21 ARG A 20 21.001 5.128 -4.065 1.00 0.00 H new ATOM 0 HH22 ARG A 20 21.284 6.589 -3.113 1.00 0.00 H new ATOM 332 N LYS A 21 18.294 10.069 -8.934 1.00 0.00 N ATOM 333 CA LYS A 21 18.983 11.371 -8.939 1.00 0.00 C ATOM 334 C LYS A 21 18.426 12.308 -10.028 1.00 0.00 C ATOM 335 O LYS A 21 18.318 13.519 -9.810 1.00 0.00 O ATOM 336 CB LYS A 21 20.481 11.124 -9.177 1.00 0.00 C ATOM 337 CG LYS A 21 21.158 10.414 -7.991 1.00 0.00 C ATOM 338 CD LYS A 21 22.580 9.936 -8.315 1.00 0.00 C ATOM 339 CE LYS A 21 23.503 11.114 -8.660 1.00 0.00 C ATOM 340 NZ LYS A 21 24.929 10.698 -8.764 1.00 0.00 N ATOM 0 H LYS A 21 18.829 9.328 -9.387 1.00 0.00 H new ATOM 0 HA LYS A 21 18.820 11.860 -7.978 1.00 0.00 H new ATOM 0 HB2 LYS A 21 20.608 10.522 -10.077 1.00 0.00 H new ATOM 0 HB3 LYS A 21 20.979 12.077 -9.358 1.00 0.00 H new ATOM 0 HG2 LYS A 21 21.194 11.093 -7.139 1.00 0.00 H new ATOM 0 HG3 LYS A 21 20.552 9.559 -7.692 1.00 0.00 H new ATOM 0 HD2 LYS A 21 22.986 9.392 -7.462 1.00 0.00 H new ATOM 0 HD3 LYS A 21 22.549 9.239 -9.152 1.00 0.00 H new ATOM 0 HE2 LYS A 21 23.186 11.558 -9.604 1.00 0.00 H new ATOM 0 HE3 LYS A 21 23.406 11.886 -7.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 25.515 11.524 -8.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 25.241 10.298 -7.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 25.028 9.981 -9.511 1.00 0.00 H new ATOM 354 N PHE A 22 18.067 11.749 -11.190 1.00 0.00 N ATOM 355 CA PHE A 22 17.532 12.483 -12.339 1.00 0.00 C ATOM 356 C PHE A 22 16.038 12.818 -12.181 1.00 0.00 C ATOM 357 O PHE A 22 15.616 13.896 -12.605 1.00 0.00 O ATOM 358 CB PHE A 22 17.772 11.656 -13.618 1.00 0.00 C ATOM 359 CG PHE A 22 19.134 11.848 -14.275 1.00 0.00 C ATOM 360 CD1 PHE A 22 20.326 11.558 -13.580 1.00 0.00 C ATOM 361 CD2 PHE A 22 19.210 12.308 -15.605 1.00 0.00 C ATOM 362 CE1 PHE A 22 21.575 11.727 -14.206 1.00 0.00 C ATOM 363 CE2 PHE A 22 20.458 12.477 -16.232 1.00 0.00 C ATOM 364 CZ PHE A 22 21.642 12.185 -15.532 1.00 0.00 C ATOM 0 H PHE A 22 18.143 10.746 -11.360 1.00 0.00 H new ATOM 0 HA PHE A 22 18.055 13.437 -12.406 1.00 0.00 H new ATOM 0 HB2 PHE A 22 17.650 10.600 -13.376 1.00 0.00 H new ATOM 0 HB3 PHE A 22 16.999 11.908 -14.344 1.00 0.00 H new ATOM 0 HD1 PHE A 22 20.280 11.204 -12.561 1.00 0.00 H new ATOM 0 HD2 PHE A 22 18.303 12.532 -16.147 1.00 0.00 H new ATOM 0 HE1 PHE A 22 22.483 11.504 -13.666 1.00 0.00 H new ATOM 0 HE2 PHE A 22 20.507 12.831 -17.251 1.00 0.00 H new ATOM 0 HZ PHE A 22 22.601 12.313 -16.013 1.00 0.00 H new ATOM 374 N GLU A 23 15.237 11.920 -11.596 1.00 0.00 N ATOM 375 CA GLU A 23 13.771 12.062 -11.556 1.00 0.00 C ATOM 376 C GLU A 23 13.260 12.888 -10.354 1.00 0.00 C ATOM 377 O GLU A 23 13.926 12.998 -9.321 1.00 0.00 O ATOM 378 CB GLU A 23 13.083 10.685 -11.666 1.00 0.00 C ATOM 379 CG GLU A 23 12.959 9.920 -10.344 1.00 0.00 C ATOM 380 CD GLU A 23 12.414 8.488 -10.518 1.00 0.00 C ATOM 381 OE1 GLU A 23 11.656 8.220 -11.482 1.00 0.00 O ATOM 382 OE2 GLU A 23 12.698 7.632 -9.647 1.00 0.00 O ATOM 0 H GLU A 23 15.582 11.076 -11.138 1.00 0.00 H new ATOM 0 HA GLU A 23 13.489 12.647 -12.431 1.00 0.00 H new ATOM 0 HB2 GLU A 23 12.086 10.825 -12.083 1.00 0.00 H new ATOM 0 HB3 GLU A 23 13.641 10.071 -12.373 1.00 0.00 H new ATOM 0 HG2 GLU A 23 13.937 9.874 -9.866 1.00 0.00 H new ATOM 0 HG3 GLU A 23 12.302 10.473 -9.672 1.00 0.00 H new ATOM 424 N ARG A 27 8.385 11.358 -3.686 1.00 0.00 N ATOM 425 CA ARG A 27 7.271 10.837 -2.880 1.00 0.00 C ATOM 426 C ARG A 27 7.455 9.343 -2.552 1.00 0.00 C ATOM 427 O ARG A 27 8.326 8.657 -3.088 1.00 0.00 O ATOM 428 CB ARG A 27 5.917 11.090 -3.575 1.00 0.00 C ATOM 429 CG ARG A 27 5.492 12.567 -3.709 1.00 0.00 C ATOM 430 CD ARG A 27 6.220 13.374 -4.797 1.00 0.00 C ATOM 431 NE ARG A 27 5.585 14.691 -4.993 1.00 0.00 N ATOM 432 CZ ARG A 27 5.938 15.629 -5.867 1.00 0.00 C ATOM 433 NH1 ARG A 27 6.960 15.491 -6.689 1.00 0.00 N ATOM 434 NH2 ARG A 27 5.250 16.749 -5.927 1.00 0.00 N ATOM 0 HA ARG A 27 7.272 11.380 -1.935 1.00 0.00 H new ATOM 0 HB2 ARG A 27 5.955 10.652 -4.572 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.142 10.558 -3.022 1.00 0.00 H new ATOM 0 HG2 ARG A 27 4.422 12.601 -3.912 1.00 0.00 H new ATOM 0 HG3 ARG A 27 5.650 13.060 -2.750 1.00 0.00 H new ATOM 0 HD2 ARG A 27 7.265 13.508 -4.517 1.00 0.00 H new ATOM 0 HD3 ARG A 27 6.210 12.818 -5.735 1.00 0.00 H new ATOM 0 HE ARG A 27 4.789 14.905 -4.393 1.00 0.00 H new ATOM 0 HH11 ARG A 27 7.517 14.637 -6.671 1.00 0.00 H new ATOM 0 HH12 ARG A 27 7.193 16.238 -7.343 1.00 0.00 H new ATOM 0 HH21 ARG A 27 4.453 16.892 -5.306 1.00 0.00 H new ATOM 0 HH22 ARG A 27 5.513 17.474 -6.594 1.00 0.00 H new ATOM 448 N LYS A 28 6.614 8.816 -1.660 1.00 0.00 N ATOM 449 CA LYS A 28 6.709 7.447 -1.139 1.00 0.00 C ATOM 450 C LYS A 28 5.885 6.470 -1.994 1.00 0.00 C ATOM 451 O LYS A 28 4.738 6.758 -2.333 1.00 0.00 O ATOM 452 CB LYS A 28 6.234 7.430 0.328 1.00 0.00 C ATOM 453 CG LYS A 28 6.883 8.508 1.215 1.00 0.00 C ATOM 454 CD LYS A 28 5.945 9.708 1.461 1.00 0.00 C ATOM 455 CE LYS A 28 6.756 10.863 2.060 1.00 0.00 C ATOM 456 NZ LYS A 28 5.997 12.146 2.117 1.00 0.00 N ATOM 0 H LYS A 28 5.830 9.339 -1.270 1.00 0.00 H new ATOM 0 HA LYS A 28 7.748 7.120 -1.185 1.00 0.00 H new ATOM 0 HB2 LYS A 28 5.152 7.561 0.349 1.00 0.00 H new ATOM 0 HB3 LYS A 28 6.445 6.449 0.755 1.00 0.00 H new ATOM 0 HG2 LYS A 28 7.164 8.067 2.172 1.00 0.00 H new ATOM 0 HG3 LYS A 28 7.801 8.858 0.744 1.00 0.00 H new ATOM 0 HD2 LYS A 28 5.480 10.020 0.526 1.00 0.00 H new ATOM 0 HD3 LYS A 28 5.139 9.423 2.138 1.00 0.00 H new ATOM 0 HE2 LYS A 28 7.074 10.591 3.067 1.00 0.00 H new ATOM 0 HE3 LYS A 28 7.660 11.009 1.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 6.598 12.887 2.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 5.715 12.426 1.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 5.148 12.021 2.704 1.00 0.00 H new ATOM 470 N PHE A 29 6.440 5.292 -2.283 1.00 0.00 N ATOM 471 CA PHE A 29 5.774 4.202 -3.007 1.00 0.00 C ATOM 472 C PHE A 29 6.502 2.857 -2.884 1.00 0.00 C ATOM 473 O PHE A 29 7.686 2.801 -2.551 1.00 0.00 O ATOM 474 CB PHE A 29 5.573 4.585 -4.487 1.00 0.00 C ATOM 475 CG PHE A 29 6.846 4.915 -5.246 1.00 0.00 C ATOM 476 CD1 PHE A 29 7.625 3.884 -5.806 1.00 0.00 C ATOM 477 CD2 PHE A 29 7.255 6.256 -5.387 1.00 0.00 C ATOM 478 CE1 PHE A 29 8.816 4.188 -6.490 1.00 0.00 C ATOM 479 CE2 PHE A 29 8.444 6.558 -6.075 1.00 0.00 C ATOM 480 CZ PHE A 29 9.224 5.525 -6.624 1.00 0.00 C ATOM 0 H PHE A 29 7.396 5.060 -2.012 1.00 0.00 H new ATOM 0 HA PHE A 29 4.801 4.063 -2.536 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.069 3.762 -4.994 1.00 0.00 H new ATOM 0 HB3 PHE A 29 4.906 5.446 -4.536 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.307 2.856 -5.710 1.00 0.00 H new ATOM 0 HD2 PHE A 29 6.656 7.051 -4.967 1.00 0.00 H new ATOM 0 HE1 PHE A 29 9.416 3.395 -6.911 1.00 0.00 H new ATOM 0 HE2 PHE A 29 8.759 7.586 -6.182 1.00 0.00 H new ATOM 0 HZ PHE A 29 10.138 5.760 -7.149 1.00 0.00 H new ATOM 490 N ILE A 30 5.785 1.775 -3.199 1.00 0.00 N ATOM 491 CA ILE A 30 6.282 0.387 -3.267 1.00 0.00 C ATOM 492 C ILE A 30 5.630 -0.365 -4.435 1.00 0.00 C ATOM 493 O ILE A 30 4.511 -0.045 -4.824 1.00 0.00 O ATOM 494 CB ILE A 30 6.052 -0.350 -1.923 1.00 0.00 C ATOM 495 CG1 ILE A 30 4.551 -0.498 -1.578 1.00 0.00 C ATOM 496 CG2 ILE A 30 6.802 0.350 -0.779 1.00 0.00 C ATOM 497 CD1 ILE A 30 4.301 -1.086 -0.187 1.00 0.00 C ATOM 0 H ILE A 30 4.793 1.840 -3.426 1.00 0.00 H new ATOM 0 HA ILE A 30 7.357 0.417 -3.447 1.00 0.00 H new ATOM 0 HB ILE A 30 6.454 -1.356 -2.044 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.073 0.480 -1.642 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.076 -1.135 -2.324 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.625 -0.186 0.154 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.870 0.358 -0.996 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.443 1.375 -0.682 1.00 0.00 H new ATOM 0 HD11 ILE A 30 3.228 -1.162 -0.011 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.750 -2.077 -0.125 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.747 -0.438 0.567 1.00 0.00 H new ATOM 509 N ILE A 31 6.312 -1.367 -4.992 1.00 0.00 N ATOM 510 CA ILE A 31 5.853 -2.210 -6.104 1.00 0.00 C ATOM 511 C ILE A 31 5.537 -3.607 -5.571 1.00 0.00 C ATOM 512 O ILE A 31 6.373 -4.228 -4.915 1.00 0.00 O ATOM 513 CB ILE A 31 6.923 -2.314 -7.224 1.00 0.00 C ATOM 514 CG1 ILE A 31 7.531 -0.934 -7.574 1.00 0.00 C ATOM 515 CG2 ILE A 31 6.301 -3.005 -8.461 1.00 0.00 C ATOM 516 CD1 ILE A 31 8.530 -0.943 -8.738 1.00 0.00 C ATOM 0 H ILE A 31 7.243 -1.627 -4.667 1.00 0.00 H new ATOM 0 HA ILE A 31 4.962 -1.753 -6.535 1.00 0.00 H new ATOM 0 HB ILE A 31 7.753 -2.922 -6.863 1.00 0.00 H new ATOM 0 HG12 ILE A 31 6.720 -0.247 -7.816 1.00 0.00 H new ATOM 0 HG13 ILE A 31 8.030 -0.539 -6.689 1.00 0.00 H new ATOM 0 HG21 ILE A 31 7.049 -3.080 -9.250 1.00 0.00 H new ATOM 0 HG22 ILE A 31 5.961 -4.004 -8.187 1.00 0.00 H new ATOM 0 HG23 ILE A 31 5.454 -2.419 -8.818 1.00 0.00 H new ATOM 0 HD11 ILE A 31 8.900 0.068 -8.907 1.00 0.00 H new ATOM 0 HD12 ILE A 31 9.365 -1.600 -8.495 1.00 0.00 H new ATOM 0 HD13 ILE A 31 8.035 -1.304 -9.640 1.00 0.00 H new ATOM 528 N ALA A 32 4.364 -4.131 -5.908 1.00 0.00 N ATOM 529 CA ALA A 32 3.910 -5.466 -5.543 1.00 0.00 C ATOM 530 C ALA A 32 3.415 -6.232 -6.773 1.00 0.00 C ATOM 531 O ALA A 32 2.784 -5.655 -7.659 1.00 0.00 O ATOM 532 CB ALA A 32 2.817 -5.287 -4.491 1.00 0.00 C ATOM 0 H ALA A 32 3.679 -3.618 -6.463 1.00 0.00 H new ATOM 0 HA ALA A 32 4.725 -6.064 -5.134 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.443 -6.264 -4.185 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.227 -4.767 -3.625 1.00 0.00 H new ATOM 0 HB3 ALA A 32 1.999 -4.702 -4.912 1.00 0.00 H new ATOM 538 N ASN A 33 3.686 -7.536 -6.840 1.00 0.00 N ATOM 539 CA ASN A 33 3.209 -8.374 -7.936 1.00 0.00 C ATOM 540 C ASN A 33 1.683 -8.579 -7.854 1.00 0.00 C ATOM 541 O ASN A 33 1.171 -9.035 -6.831 1.00 0.00 O ATOM 542 CB ASN A 33 3.970 -9.703 -7.912 1.00 0.00 C ATOM 543 CG ASN A 33 3.851 -10.401 -9.257 1.00 0.00 C ATOM 544 OD1 ASN A 33 2.806 -10.924 -9.614 1.00 0.00 O ATOM 545 ND2 ASN A 33 4.901 -10.360 -10.051 1.00 0.00 N ATOM 0 H ASN A 33 4.237 -8.036 -6.142 1.00 0.00 H new ATOM 0 HA ASN A 33 3.402 -7.879 -8.888 1.00 0.00 H new ATOM 0 HB2 ASN A 33 5.020 -9.525 -7.678 1.00 0.00 H new ATOM 0 HB3 ASN A 33 3.572 -10.344 -7.125 1.00 0.00 H new ATOM 0 HD21 ASN A 33 4.851 -10.770 -10.984 1.00 0.00 H new ATOM 0 HD22 ASN A 33 5.764 -9.918 -9.733 1.00 0.00 H new ATOM 552 N ALA A 34 0.955 -8.268 -8.931 1.00 0.00 N ATOM 553 CA ALA A 34 -0.509 -8.382 -8.982 1.00 0.00 C ATOM 554 C ALA A 34 -0.980 -9.846 -9.067 1.00 0.00 C ATOM 555 O ALA A 34 -2.014 -10.210 -8.510 1.00 0.00 O ATOM 556 CB ALA A 34 -1.012 -7.569 -10.186 1.00 0.00 C ATOM 0 H ALA A 34 1.367 -7.927 -9.800 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.927 -7.986 -8.057 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.098 -7.639 -10.244 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.722 -6.525 -10.067 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.573 -7.966 -11.102 1.00 0.00 H new ATOM 562 N ARG A 35 -0.191 -10.716 -9.712 1.00 0.00 N ATOM 563 CA ARG A 35 -0.514 -12.125 -10.004 1.00 0.00 C ATOM 564 C ARG A 35 -0.278 -13.056 -8.789 1.00 0.00 C ATOM 565 O ARG A 35 0.209 -14.177 -8.935 1.00 0.00 O ATOM 566 CB ARG A 35 0.273 -12.573 -11.259 1.00 0.00 C ATOM 567 CG ARG A 35 0.196 -11.619 -12.470 1.00 0.00 C ATOM 568 CD ARG A 35 -1.226 -11.334 -12.971 1.00 0.00 C ATOM 569 NE ARG A 35 -1.888 -12.549 -13.482 1.00 0.00 N ATOM 570 CZ ARG A 35 -3.155 -12.653 -13.871 1.00 0.00 C ATOM 571 NH1 ARG A 35 -3.983 -11.628 -13.844 1.00 0.00 N ATOM 572 NH2 ARG A 35 -3.612 -13.809 -14.301 1.00 0.00 N ATOM 0 H ARG A 35 0.730 -10.449 -10.061 1.00 0.00 H new ATOM 0 HA ARG A 35 -1.581 -12.204 -10.212 1.00 0.00 H new ATOM 0 HB2 ARG A 35 1.320 -12.698 -10.984 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -0.095 -13.552 -11.566 1.00 0.00 H new ATOM 0 HG2 ARG A 35 0.668 -10.674 -12.202 1.00 0.00 H new ATOM 0 HG3 ARG A 35 0.777 -12.045 -13.288 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -1.819 -10.913 -12.159 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -1.188 -10.583 -13.760 1.00 0.00 H new ATOM 0 HE ARG A 35 -1.318 -13.392 -13.543 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -3.658 -10.718 -13.517 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -4.949 -11.745 -14.150 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -2.995 -14.621 -14.335 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -4.583 -13.894 -14.601 1.00 0.00 H new ATOM 586 N VAL A 36 -0.579 -12.569 -7.580 1.00 0.00 N ATOM 587 CA VAL A 36 -0.301 -13.203 -6.272 1.00 0.00 C ATOM 588 C VAL A 36 -1.462 -12.896 -5.320 1.00 0.00 C ATOM 589 O VAL A 36 -1.894 -11.748 -5.237 1.00 0.00 O ATOM 590 CB VAL A 36 1.039 -12.699 -5.666 1.00 0.00 C ATOM 591 CG1 VAL A 36 1.309 -13.281 -4.266 1.00 0.00 C ATOM 592 CG2 VAL A 36 2.247 -13.030 -6.557 1.00 0.00 C ATOM 0 H VAL A 36 -1.050 -11.671 -7.474 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.207 -14.279 -6.416 1.00 0.00 H new ATOM 0 HB VAL A 36 0.922 -11.618 -5.595 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.257 -12.897 -3.889 1.00 0.00 H new ATOM 0 HG12 VAL A 36 0.505 -12.990 -3.590 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.357 -14.368 -4.327 1.00 0.00 H new ATOM 0 HG21 VAL A 36 3.158 -12.657 -6.089 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.321 -14.110 -6.684 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.120 -12.558 -7.531 1.00 0.00 H new ATOM 602 N GLU A 37 -1.944 -13.907 -4.587 1.00 0.00 N ATOM 603 CA GLU A 37 -3.171 -13.841 -3.771 1.00 0.00 C ATOM 604 C GLU A 37 -3.204 -12.715 -2.721 1.00 0.00 C ATOM 605 O GLU A 37 -4.256 -12.128 -2.467 1.00 0.00 O ATOM 606 CB GLU A 37 -3.411 -15.203 -3.093 1.00 0.00 C ATOM 607 CG GLU A 37 -2.312 -15.686 -2.136 1.00 0.00 C ATOM 608 CD GLU A 37 -2.626 -17.101 -1.626 1.00 0.00 C ATOM 609 OE1 GLU A 37 -3.339 -17.236 -0.603 1.00 0.00 O ATOM 610 OE2 GLU A 37 -2.158 -18.088 -2.241 1.00 0.00 O ATOM 0 H GLU A 37 -1.484 -14.816 -4.541 1.00 0.00 H new ATOM 0 HA GLU A 37 -3.973 -13.599 -4.468 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -4.348 -15.150 -2.539 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -3.543 -15.955 -3.871 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -1.349 -15.683 -2.647 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.228 -15.000 -1.293 1.00 0.00 H new ATOM 617 N ASN A 38 -2.048 -12.402 -2.128 1.00 0.00 N ATOM 618 CA ASN A 38 -1.877 -11.376 -1.088 1.00 0.00 C ATOM 619 C ASN A 38 -1.187 -10.093 -1.609 1.00 0.00 C ATOM 620 O ASN A 38 -1.009 -9.143 -0.848 1.00 0.00 O ATOM 621 CB ASN A 38 -1.128 -12.023 0.091 1.00 0.00 C ATOM 622 CG ASN A 38 0.282 -12.476 -0.271 1.00 0.00 C ATOM 623 OD1 ASN A 38 1.222 -11.694 -0.269 1.00 0.00 O ATOM 624 ND2 ASN A 38 0.452 -13.737 -0.637 1.00 0.00 N ATOM 0 H ASN A 38 -1.174 -12.871 -2.365 1.00 0.00 H new ATOM 0 HA ASN A 38 -2.856 -11.030 -0.755 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -1.074 -11.310 0.914 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -1.698 -12.881 0.449 1.00 0.00 H new ATOM 0 HD21 ASN A 38 1.375 -14.066 -0.921 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -0.340 -14.380 -0.635 1.00 0.00 H new ATOM 631 N CYS A 39 -0.785 -10.064 -2.892 1.00 0.00 N ATOM 632 CA CYS A 39 -0.009 -8.985 -3.536 1.00 0.00 C ATOM 633 C CYS A 39 1.248 -8.602 -2.724 1.00 0.00 C ATOM 634 O CYS A 39 1.323 -7.523 -2.132 1.00 0.00 O ATOM 635 CB CYS A 39 -0.935 -7.793 -3.848 1.00 0.00 C ATOM 636 SG CYS A 39 -2.146 -8.259 -5.120 1.00 0.00 S ATOM 0 H CYS A 39 -1.000 -10.824 -3.538 1.00 0.00 H new ATOM 0 HA CYS A 39 0.382 -9.349 -4.486 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -1.451 -7.477 -2.942 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.344 -6.944 -4.191 1.00 0.00 H new ATOM 0 HG CYS A 39 -2.149 -9.551 -5.264 1.00 0.00 H new ATOM 642 N ALA A 40 2.228 -9.510 -2.670 1.00 0.00 N ATOM 643 CA ALA A 40 3.479 -9.324 -1.929 1.00 0.00 C ATOM 644 C ALA A 40 4.348 -8.197 -2.529 1.00 0.00 C ATOM 645 O ALA A 40 4.498 -8.125 -3.750 1.00 0.00 O ATOM 646 CB ALA A 40 4.234 -10.663 -1.895 1.00 0.00 C ATOM 0 H ALA A 40 2.173 -10.409 -3.148 1.00 0.00 H new ATOM 0 HA ALA A 40 3.245 -9.011 -0.911 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.168 -10.540 -1.346 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.619 -11.415 -1.401 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.451 -10.984 -2.914 1.00 0.00 H new ATOM 652 N VAL A 41 4.951 -7.353 -1.682 1.00 0.00 N ATOM 653 CA VAL A 41 5.911 -6.309 -2.110 1.00 0.00 C ATOM 654 C VAL A 41 7.161 -6.976 -2.689 1.00 0.00 C ATOM 655 O VAL A 41 7.809 -7.779 -2.018 1.00 0.00 O ATOM 656 CB VAL A 41 6.316 -5.321 -0.981 1.00 0.00 C ATOM 657 CG1 VAL A 41 7.199 -4.186 -1.512 1.00 0.00 C ATOM 658 CG2 VAL A 41 5.068 -4.698 -0.331 1.00 0.00 C ATOM 0 H VAL A 41 4.791 -7.369 -0.675 1.00 0.00 H new ATOM 0 HA VAL A 41 5.402 -5.711 -2.866 1.00 0.00 H new ATOM 0 HB VAL A 41 6.877 -5.897 -0.245 1.00 0.00 H new ATOM 0 HG11 VAL A 41 7.462 -3.516 -0.693 1.00 0.00 H new ATOM 0 HG12 VAL A 41 8.108 -4.604 -1.945 1.00 0.00 H new ATOM 0 HG13 VAL A 41 6.656 -3.630 -2.276 1.00 0.00 H new ATOM 0 HG21 VAL A 41 5.373 -4.009 0.457 1.00 0.00 H new ATOM 0 HG22 VAL A 41 4.497 -4.156 -1.085 1.00 0.00 H new ATOM 0 HG23 VAL A 41 4.448 -5.486 0.096 1.00 0.00 H new ATOM 668 N ILE A 42 7.496 -6.625 -3.934 1.00 0.00 N ATOM 669 CA ILE A 42 8.698 -7.090 -4.653 1.00 0.00 C ATOM 670 C ILE A 42 9.794 -6.020 -4.718 1.00 0.00 C ATOM 671 O ILE A 42 10.960 -6.356 -4.924 1.00 0.00 O ATOM 672 CB ILE A 42 8.344 -7.592 -6.075 1.00 0.00 C ATOM 673 CG1 ILE A 42 7.638 -6.522 -6.941 1.00 0.00 C ATOM 674 CG2 ILE A 42 7.510 -8.879 -5.968 1.00 0.00 C ATOM 675 CD1 ILE A 42 7.465 -6.926 -8.408 1.00 0.00 C ATOM 0 H ILE A 42 6.924 -5.990 -4.491 1.00 0.00 H new ATOM 0 HA ILE A 42 9.096 -7.926 -4.079 1.00 0.00 H new ATOM 0 HB ILE A 42 9.278 -7.808 -6.594 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.657 -6.312 -6.514 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.210 -5.596 -6.895 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.259 -9.234 -6.968 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.085 -9.643 -5.445 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.593 -8.674 -5.416 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.962 -6.124 -8.949 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.443 -7.107 -8.853 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.866 -7.835 -8.467 1.00 0.00 H new ATOM 687 N TYR A 43 9.436 -4.746 -4.517 1.00 0.00 N ATOM 688 CA TYR A 43 10.371 -3.619 -4.509 1.00 0.00 C ATOM 689 C TYR A 43 9.818 -2.430 -3.712 1.00 0.00 C ATOM 690 O TYR A 43 8.621 -2.166 -3.733 1.00 0.00 O ATOM 691 CB TYR A 43 10.689 -3.208 -5.958 1.00 0.00 C ATOM 692 CG TYR A 43 12.048 -2.554 -6.125 1.00 0.00 C ATOM 693 CD1 TYR A 43 13.212 -3.347 -6.120 1.00 0.00 C ATOM 694 CD2 TYR A 43 12.154 -1.157 -6.270 1.00 0.00 C ATOM 695 CE1 TYR A 43 14.479 -2.750 -6.279 1.00 0.00 C ATOM 696 CE2 TYR A 43 13.416 -0.554 -6.437 1.00 0.00 C ATOM 697 CZ TYR A 43 14.585 -1.351 -6.446 1.00 0.00 C ATOM 698 OH TYR A 43 15.810 -0.777 -6.607 1.00 0.00 O ATOM 0 H TYR A 43 8.469 -4.466 -4.352 1.00 0.00 H new ATOM 0 HA TYR A 43 11.289 -3.935 -4.014 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.640 -4.091 -6.595 1.00 0.00 H new ATOM 0 HB3 TYR A 43 9.920 -2.520 -6.308 1.00 0.00 H new ATOM 0 HD1 TYR A 43 13.133 -4.417 -5.994 1.00 0.00 H new ATOM 0 HD2 TYR A 43 11.264 -0.546 -6.253 1.00 0.00 H new ATOM 0 HE1 TYR A 43 15.369 -3.362 -6.273 1.00 0.00 H new ATOM 0 HE2 TYR A 43 13.491 0.517 -6.558 1.00 0.00 H new ATOM 0 HH TYR A 43 15.708 0.097 -7.038 1.00 0.00 H new ATOM 708 N CYS A 44 10.683 -1.681 -3.032 1.00 0.00 N ATOM 709 CA CYS A 44 10.321 -0.462 -2.285 1.00 0.00 C ATOM 710 C CYS A 44 11.165 0.758 -2.709 1.00 0.00 C ATOM 711 O CYS A 44 12.281 0.572 -3.194 1.00 0.00 O ATOM 712 CB CYS A 44 10.476 -0.718 -0.773 1.00 0.00 C ATOM 713 SG CYS A 44 9.876 -2.344 -0.224 1.00 0.00 S ATOM 0 H CYS A 44 11.677 -1.902 -2.979 1.00 0.00 H new ATOM 0 HA CYS A 44 9.282 -0.227 -2.517 1.00 0.00 H new ATOM 0 HB2 CYS A 44 11.529 -0.623 -0.506 1.00 0.00 H new ATOM 0 HB3 CYS A 44 9.938 0.058 -0.228 1.00 0.00 H new ATOM 0 HG CYS A 44 10.052 -2.461 1.059 1.00 0.00 H new ATOM 719 N ASN A 45 10.685 1.986 -2.462 1.00 0.00 N ATOM 720 CA ASN A 45 11.527 3.199 -2.567 1.00 0.00 C ATOM 721 C ASN A 45 12.502 3.314 -1.356 1.00 0.00 C ATOM 722 O ASN A 45 12.843 2.309 -0.734 1.00 0.00 O ATOM 723 CB ASN A 45 10.612 4.439 -2.753 1.00 0.00 C ATOM 724 CG ASN A 45 11.322 5.650 -3.374 1.00 0.00 C ATOM 725 OD1 ASN A 45 12.526 5.655 -3.594 1.00 0.00 O ATOM 726 ND2 ASN A 45 10.618 6.736 -3.629 1.00 0.00 N ATOM 0 H ASN A 45 9.720 2.171 -2.188 1.00 0.00 H new ATOM 0 HA ASN A 45 12.170 3.135 -3.445 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.767 4.163 -3.384 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.205 4.727 -1.783 1.00 0.00 H new ATOM 0 HD21 ASN A 45 11.078 7.565 -4.005 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.614 6.746 -3.451 1.00 0.00 H new ATOM 733 N ASP A 46 12.918 4.526 -0.966 1.00 0.00 N ATOM 734 CA ASP A 46 13.574 4.830 0.321 1.00 0.00 C ATOM 735 C ASP A 46 12.736 5.756 1.227 1.00 0.00 C ATOM 736 O ASP A 46 12.905 5.744 2.447 1.00 0.00 O ATOM 737 CB ASP A 46 14.943 5.471 0.044 1.00 0.00 C ATOM 738 CG ASP A 46 15.934 4.484 -0.594 1.00 0.00 C ATOM 739 OD1 ASP A 46 16.490 3.633 0.144 1.00 0.00 O ATOM 740 OD2 ASP A 46 16.180 4.580 -1.820 1.00 0.00 O ATOM 0 H ASP A 46 12.805 5.352 -1.554 1.00 0.00 H new ATOM 0 HA ASP A 46 13.686 3.889 0.860 1.00 0.00 H new ATOM 0 HB2 ASP A 46 14.813 6.329 -0.616 1.00 0.00 H new ATOM 0 HB3 ASP A 46 15.360 5.848 0.978 1.00 0.00 H new ATOM 745 N GLY A 47 11.793 6.522 0.659 1.00 0.00 N ATOM 746 CA GLY A 47 10.952 7.478 1.396 1.00 0.00 C ATOM 747 C GLY A 47 9.863 6.796 2.219 1.00 0.00 C ATOM 748 O GLY A 47 9.557 7.227 3.327 1.00 0.00 O ATOM 0 H GLY A 47 11.590 6.495 -0.340 1.00 0.00 H new ATOM 0 HA2 GLY A 47 11.581 8.074 2.057 1.00 0.00 H new ATOM 0 HA3 GLY A 47 10.489 8.167 0.690 1.00 0.00 H new ATOM 752 N PHE A 48 9.315 5.691 1.698 1.00 0.00 N ATOM 753 CA PHE A 48 8.297 4.866 2.362 1.00 0.00 C ATOM 754 C PHE A 48 8.789 4.334 3.732 1.00 0.00 C ATOM 755 O PHE A 48 8.038 4.303 4.704 1.00 0.00 O ATOM 756 CB PHE A 48 7.896 3.724 1.394 1.00 0.00 C ATOM 757 CG PHE A 48 8.778 2.487 1.491 1.00 0.00 C ATOM 758 CD1 PHE A 48 10.157 2.551 1.202 1.00 0.00 C ATOM 759 CD2 PHE A 48 8.251 1.314 2.052 1.00 0.00 C ATOM 760 CE1 PHE A 48 11.011 1.513 1.624 1.00 0.00 C ATOM 761 CE2 PHE A 48 9.099 0.259 2.419 1.00 0.00 C ATOM 762 CZ PHE A 48 10.486 0.373 2.250 1.00 0.00 C ATOM 0 H PHE A 48 9.574 5.336 0.778 1.00 0.00 H new ATOM 0 HA PHE A 48 7.419 5.472 2.587 1.00 0.00 H new ATOM 0 HB2 PHE A 48 6.864 3.437 1.595 1.00 0.00 H new ATOM 0 HB3 PHE A 48 7.929 4.101 0.372 1.00 0.00 H new ATOM 0 HD1 PHE A 48 10.557 3.394 0.658 1.00 0.00 H new ATOM 0 HD2 PHE A 48 7.185 1.223 2.202 1.00 0.00 H new ATOM 0 HE1 PHE A 48 12.076 1.596 1.465 1.00 0.00 H new ATOM 0 HE2 PHE A 48 8.681 -0.646 2.834 1.00 0.00 H new ATOM 0 HZ PHE A 48 11.144 -0.409 2.598 1.00 0.00 H new ATOM 772 N CYS A 49 10.080 3.978 3.823 1.00 0.00 N ATOM 773 CA CYS A 49 10.760 3.556 5.051 1.00 0.00 C ATOM 774 C CYS A 49 10.698 4.646 6.132 1.00 0.00 C ATOM 775 O CYS A 49 10.224 4.384 7.236 1.00 0.00 O ATOM 776 CB CYS A 49 12.195 3.155 4.669 1.00 0.00 C ATOM 777 SG CYS A 49 13.172 2.755 6.142 1.00 0.00 S ATOM 0 H CYS A 49 10.699 3.977 3.012 1.00 0.00 H new ATOM 0 HA CYS A 49 10.260 2.696 5.497 1.00 0.00 H new ATOM 0 HB2 CYS A 49 12.170 2.295 4.000 1.00 0.00 H new ATOM 0 HB3 CYS A 49 12.671 3.970 4.123 1.00 0.00 H new ATOM 0 HG CYS A 49 12.493 1.955 6.909 1.00 0.00 H new ATOM 783 N GLU A 50 11.096 5.876 5.799 1.00 0.00 N ATOM 784 CA GLU A 50 11.097 7.006 6.741 1.00 0.00 C ATOM 785 C GLU A 50 9.681 7.497 7.101 1.00 0.00 C ATOM 786 O GLU A 50 9.475 8.027 8.196 1.00 0.00 O ATOM 787 CB GLU A 50 11.937 8.163 6.180 1.00 0.00 C ATOM 788 CG GLU A 50 13.409 7.763 6.029 1.00 0.00 C ATOM 789 CD GLU A 50 14.281 8.983 5.703 1.00 0.00 C ATOM 790 OE1 GLU A 50 14.367 9.380 4.516 1.00 0.00 O ATOM 791 OE2 GLU A 50 14.895 9.558 6.634 1.00 0.00 O ATOM 0 H GLU A 50 11.428 6.121 4.866 1.00 0.00 H new ATOM 0 HA GLU A 50 11.543 6.642 7.666 1.00 0.00 H new ATOM 0 HB2 GLU A 50 11.540 8.467 5.212 1.00 0.00 H new ATOM 0 HB3 GLU A 50 11.859 9.026 6.842 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.759 7.297 6.950 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.508 7.019 5.238 1.00 0.00 H new ATOM 798 N LEU A 51 8.696 7.286 6.216 1.00 0.00 N ATOM 799 CA LEU A 51 7.274 7.542 6.481 1.00 0.00 C ATOM 800 C LEU A 51 6.731 6.656 7.618 1.00 0.00 C ATOM 801 O LEU A 51 5.941 7.126 8.438 1.00 0.00 O ATOM 802 CB LEU A 51 6.503 7.308 5.162 1.00 0.00 C ATOM 803 CG LEU A 51 4.991 7.596 5.194 1.00 0.00 C ATOM 804 CD1 LEU A 51 4.723 9.098 5.328 1.00 0.00 C ATOM 805 CD2 LEU A 51 4.317 7.026 3.943 1.00 0.00 C ATOM 0 H LEU A 51 8.870 6.926 5.278 1.00 0.00 H new ATOM 0 HA LEU A 51 7.141 8.570 6.818 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.953 7.930 4.388 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.647 6.270 4.861 1.00 0.00 H new ATOM 0 HG LEU A 51 4.563 7.105 6.068 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.648 9.275 5.348 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.169 9.466 6.252 1.00 0.00 H new ATOM 0 HD13 LEU A 51 5.161 9.623 4.479 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.248 7.236 3.978 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.749 7.487 3.055 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.474 5.948 3.905 1.00 0.00 H new ATOM 817 N CYS A 52 7.133 5.378 7.654 1.00 0.00 N ATOM 818 CA CYS A 52 6.528 4.356 8.523 1.00 0.00 C ATOM 819 C CYS A 52 7.389 3.931 9.727 1.00 0.00 C ATOM 820 O CYS A 52 6.838 3.573 10.772 1.00 0.00 O ATOM 821 CB CYS A 52 6.171 3.142 7.652 1.00 0.00 C ATOM 822 SG CYS A 52 5.154 3.650 6.233 1.00 0.00 S ATOM 0 H CYS A 52 7.894 5.020 7.076 1.00 0.00 H new ATOM 0 HA CYS A 52 5.642 4.802 8.974 1.00 0.00 H new ATOM 0 HB2 CYS A 52 7.083 2.660 7.299 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.632 2.406 8.248 1.00 0.00 H new ATOM 0 HG CYS A 52 5.927 4.039 5.263 1.00 0.00 H new ATOM 828 N GLY A 53 8.716 3.946 9.580 1.00 0.00 N ATOM 829 CA GLY A 53 9.700 3.564 10.600 1.00 0.00 C ATOM 830 C GLY A 53 10.082 2.080 10.588 1.00 0.00 C ATOM 831 O GLY A 53 10.767 1.625 11.502 1.00 0.00 O ATOM 0 H GLY A 53 9.156 4.238 8.707 1.00 0.00 H new ATOM 0 HA2 GLY A 53 10.602 4.160 10.458 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.303 3.816 11.583 1.00 0.00 H new ATOM 835 N TYR A 54 9.658 1.327 9.564 1.00 0.00 N ATOM 836 CA TYR A 54 10.104 -0.046 9.298 1.00 0.00 C ATOM 837 C TYR A 54 11.405 -0.070 8.457 1.00 0.00 C ATOM 838 O TYR A 54 12.251 0.810 8.602 1.00 0.00 O ATOM 839 CB TYR A 54 8.910 -0.847 8.740 1.00 0.00 C ATOM 840 CG TYR A 54 8.110 -0.306 7.560 1.00 0.00 C ATOM 841 CD1 TYR A 54 8.674 0.527 6.573 1.00 0.00 C ATOM 842 CD2 TYR A 54 6.756 -0.681 7.450 1.00 0.00 C ATOM 843 CE1 TYR A 54 7.888 0.979 5.493 1.00 0.00 C ATOM 844 CE2 TYR A 54 5.967 -0.235 6.374 1.00 0.00 C ATOM 845 CZ TYR A 54 6.532 0.593 5.383 1.00 0.00 C ATOM 846 OH TYR A 54 5.778 1.003 4.326 1.00 0.00 O ATOM 0 H TYR A 54 8.979 1.664 8.882 1.00 0.00 H new ATOM 0 HA TYR A 54 10.406 -0.553 10.214 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.285 -1.829 8.453 1.00 0.00 H new ATOM 0 HB3 TYR A 54 8.211 -1.000 9.562 1.00 0.00 H new ATOM 0 HD1 TYR A 54 9.711 0.820 6.644 1.00 0.00 H new ATOM 0 HD2 TYR A 54 6.318 -1.320 8.202 1.00 0.00 H new ATOM 0 HE1 TYR A 54 8.324 1.624 4.745 1.00 0.00 H new ATOM 0 HE2 TYR A 54 4.929 -0.527 6.307 1.00 0.00 H new ATOM 0 HH TYR A 54 5.382 1.877 4.526 1.00 0.00 H new ATOM 856 N SER A 55 11.570 -1.048 7.562 1.00 0.00 N ATOM 857 CA SER A 55 12.632 -1.088 6.539 1.00 0.00 C ATOM 858 C SER A 55 12.302 -2.110 5.440 1.00 0.00 C ATOM 859 O SER A 55 11.439 -2.976 5.629 1.00 0.00 O ATOM 860 CB SER A 55 13.999 -1.413 7.168 1.00 0.00 C ATOM 861 OG SER A 55 15.053 -1.214 6.234 1.00 0.00 O ATOM 0 H SER A 55 10.953 -1.860 7.524 1.00 0.00 H new ATOM 0 HA SER A 55 12.687 -0.097 6.088 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.160 -0.782 8.042 1.00 0.00 H new ATOM 0 HB3 SER A 55 14.007 -2.446 7.515 1.00 0.00 H new ATOM 0 HG SER A 55 15.911 -1.426 6.659 1.00 0.00 H new ATOM 867 N ARG A 56 13.032 -2.070 4.317 1.00 0.00 N ATOM 868 CA ARG A 56 12.873 -3.025 3.208 1.00 0.00 C ATOM 869 C ARG A 56 13.007 -4.469 3.709 1.00 0.00 C ATOM 870 O ARG A 56 12.144 -5.281 3.413 1.00 0.00 O ATOM 871 CB ARG A 56 13.857 -2.702 2.061 1.00 0.00 C ATOM 872 CG ARG A 56 13.712 -3.701 0.895 1.00 0.00 C ATOM 873 CD ARG A 56 14.703 -3.488 -0.255 1.00 0.00 C ATOM 874 NE ARG A 56 14.304 -2.396 -1.166 1.00 0.00 N ATOM 875 CZ ARG A 56 15.082 -1.889 -2.127 1.00 0.00 C ATOM 876 NH1 ARG A 56 16.288 -2.364 -2.363 1.00 0.00 N ATOM 877 NH2 ARG A 56 14.676 -0.896 -2.887 1.00 0.00 N ATOM 0 H ARG A 56 13.755 -1.370 4.150 1.00 0.00 H new ATOM 0 HA ARG A 56 11.867 -2.924 2.800 1.00 0.00 H new ATOM 0 HB2 ARG A 56 13.676 -1.690 1.699 1.00 0.00 H new ATOM 0 HB3 ARG A 56 14.879 -2.728 2.439 1.00 0.00 H new ATOM 0 HG2 ARG A 56 13.837 -4.712 1.282 1.00 0.00 H new ATOM 0 HG3 ARG A 56 12.698 -3.634 0.501 1.00 0.00 H new ATOM 0 HD2 ARG A 56 15.688 -3.268 0.157 1.00 0.00 H new ATOM 0 HD3 ARG A 56 14.795 -4.413 -0.824 1.00 0.00 H new ATOM 0 HE ARG A 56 13.370 -2.002 -1.054 1.00 0.00 H new ATOM 0 HH11 ARG A 56 16.649 -3.138 -1.806 1.00 0.00 H new ATOM 0 HH12 ARG A 56 16.860 -1.958 -3.103 1.00 0.00 H new ATOM 0 HH21 ARG A 56 13.748 -0.495 -2.750 1.00 0.00 H new ATOM 0 HH22 ARG A 56 15.289 -0.527 -3.614 1.00 0.00 H new ATOM 891 N ALA A 57 13.990 -4.774 4.561 1.00 0.00 N ATOM 892 CA ALA A 57 14.172 -6.104 5.166 1.00 0.00 C ATOM 893 C ALA A 57 12.927 -6.629 5.919 1.00 0.00 C ATOM 894 O ALA A 57 12.715 -7.840 5.988 1.00 0.00 O ATOM 895 CB ALA A 57 15.387 -6.026 6.100 1.00 0.00 C ATOM 0 H ALA A 57 14.694 -4.097 4.856 1.00 0.00 H new ATOM 0 HA ALA A 57 14.332 -6.824 4.364 1.00 0.00 H new ATOM 0 HB1 ALA A 57 15.551 -6.998 6.566 1.00 0.00 H new ATOM 0 HB2 ALA A 57 16.270 -5.746 5.526 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.205 -5.279 6.873 1.00 0.00 H new ATOM 901 N GLU A 58 12.091 -5.725 6.448 1.00 0.00 N ATOM 902 CA GLU A 58 10.842 -6.044 7.154 1.00 0.00 C ATOM 903 C GLU A 58 9.638 -6.077 6.199 1.00 0.00 C ATOM 904 O GLU A 58 8.766 -6.932 6.350 1.00 0.00 O ATOM 905 CB GLU A 58 10.565 -4.994 8.245 1.00 0.00 C ATOM 906 CG GLU A 58 11.785 -4.645 9.103 1.00 0.00 C ATOM 907 CD GLU A 58 12.337 -5.858 9.869 1.00 0.00 C ATOM 908 OE1 GLU A 58 11.618 -6.414 10.732 1.00 0.00 O ATOM 909 OE2 GLU A 58 13.504 -6.251 9.630 1.00 0.00 O ATOM 0 H GLU A 58 12.270 -4.722 6.395 1.00 0.00 H new ATOM 0 HA GLU A 58 10.970 -7.032 7.596 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.195 -4.084 7.773 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.771 -5.362 8.895 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.568 -4.236 8.465 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.513 -3.864 9.814 1.00 0.00 H new ATOM 916 N VAL A 59 9.593 -5.149 5.231 1.00 0.00 N ATOM 917 CA VAL A 59 8.501 -4.981 4.247 1.00 0.00 C ATOM 918 C VAL A 59 8.606 -5.984 3.079 1.00 0.00 C ATOM 919 O VAL A 59 7.613 -6.257 2.403 1.00 0.00 O ATOM 920 CB VAL A 59 8.416 -3.501 3.778 1.00 0.00 C ATOM 921 CG1 VAL A 59 7.350 -3.284 2.686 1.00 0.00 C ATOM 922 CG2 VAL A 59 8.055 -2.631 4.990 1.00 0.00 C ATOM 0 H VAL A 59 10.341 -4.468 5.103 1.00 0.00 H new ATOM 0 HA VAL A 59 7.558 -5.217 4.741 1.00 0.00 H new ATOM 0 HB VAL A 59 9.383 -3.230 3.354 1.00 0.00 H new ATOM 0 HG11 VAL A 59 7.334 -2.233 2.396 1.00 0.00 H new ATOM 0 HG12 VAL A 59 7.590 -3.896 1.817 1.00 0.00 H new ATOM 0 HG13 VAL A 59 6.371 -3.569 3.072 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.990 -1.587 4.682 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.094 -2.950 5.394 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.824 -2.737 5.756 1.00 0.00 H new ATOM 932 N MET A 60 9.772 -6.606 2.868 1.00 0.00 N ATOM 933 CA MET A 60 9.935 -7.723 1.922 1.00 0.00 C ATOM 934 C MET A 60 9.063 -8.928 2.323 1.00 0.00 C ATOM 935 O MET A 60 9.020 -9.308 3.493 1.00 0.00 O ATOM 936 CB MET A 60 11.416 -8.126 1.810 1.00 0.00 C ATOM 937 CG MET A 60 12.177 -7.201 0.850 1.00 0.00 C ATOM 938 SD MET A 60 13.960 -7.525 0.735 1.00 0.00 S ATOM 939 CE MET A 60 13.946 -9.118 -0.129 1.00 0.00 C ATOM 0 H MET A 60 10.634 -6.350 3.349 1.00 0.00 H new ATOM 0 HA MET A 60 9.598 -7.386 0.942 1.00 0.00 H new ATOM 0 HB2 MET A 60 11.880 -8.091 2.796 1.00 0.00 H new ATOM 0 HB3 MET A 60 11.489 -9.156 1.460 1.00 0.00 H new ATOM 0 HG2 MET A 60 11.740 -7.294 -0.144 1.00 0.00 H new ATOM 0 HG3 MET A 60 12.029 -6.169 1.168 1.00 0.00 H new ATOM 0 HE1 MET A 60 14.968 -9.408 -0.374 1.00 0.00 H new ATOM 0 HE2 MET A 60 13.497 -9.876 0.513 1.00 0.00 H new ATOM 0 HE3 MET A 60 13.364 -9.029 -1.047 1.00 0.00 H new ATOM 949 N GLN A 61 8.346 -9.496 1.340 1.00 0.00 N ATOM 950 CA GLN A 61 7.412 -10.637 1.462 1.00 0.00 C ATOM 951 C GLN A 61 6.072 -10.274 2.141 1.00 0.00 C ATOM 952 O GLN A 61 5.210 -11.133 2.329 1.00 0.00 O ATOM 953 CB GLN A 61 8.124 -11.850 2.117 1.00 0.00 C ATOM 954 CG GLN A 61 7.498 -13.235 1.855 1.00 0.00 C ATOM 955 CD GLN A 61 7.560 -13.727 0.406 1.00 0.00 C ATOM 956 OE1 GLN A 61 8.238 -13.186 -0.460 1.00 0.00 O ATOM 957 NE2 GLN A 61 6.848 -14.788 0.098 1.00 0.00 N ATOM 0 H GLN A 61 8.403 -9.154 0.381 1.00 0.00 H new ATOM 0 HA GLN A 61 7.123 -10.928 0.452 1.00 0.00 H new ATOM 0 HB2 GLN A 61 9.156 -11.870 1.768 1.00 0.00 H new ATOM 0 HB3 GLN A 61 8.155 -11.687 3.194 1.00 0.00 H new ATOM 0 HG2 GLN A 61 7.999 -13.966 2.490 1.00 0.00 H new ATOM 0 HG3 GLN A 61 6.454 -13.206 2.165 1.00 0.00 H new ATOM 0 HE21 GLN A 61 6.280 -15.246 0.811 1.00 0.00 H new ATOM 0 HE22 GLN A 61 6.863 -15.154 -0.854 1.00 0.00 H new ATOM 966 N ARG A 62 5.856 -8.997 2.473 1.00 0.00 N ATOM 967 CA ARG A 62 4.609 -8.509 3.086 1.00 0.00 C ATOM 968 C ARG A 62 3.556 -8.209 2.018 1.00 0.00 C ATOM 969 O ARG A 62 3.936 -7.809 0.911 1.00 0.00 O ATOM 970 CB ARG A 62 4.835 -7.236 3.923 1.00 0.00 C ATOM 971 CG ARG A 62 5.823 -7.413 5.077 1.00 0.00 C ATOM 972 CD ARG A 62 5.410 -8.423 6.151 1.00 0.00 C ATOM 973 NE ARG A 62 6.562 -8.685 7.026 1.00 0.00 N ATOM 974 CZ ARG A 62 6.657 -9.584 7.996 1.00 0.00 C ATOM 975 NH1 ARG A 62 5.650 -10.366 8.331 1.00 0.00 N ATOM 976 NH2 ARG A 62 7.793 -9.707 8.648 1.00 0.00 N ATOM 0 H ARG A 62 6.548 -8.262 2.323 1.00 0.00 H new ATOM 0 HA ARG A 62 4.258 -9.305 3.743 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.197 -6.443 3.268 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.878 -6.905 4.326 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.784 -7.720 4.665 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.975 -6.445 5.553 1.00 0.00 H new ATOM 0 HD2 ARG A 62 4.575 -8.034 6.733 1.00 0.00 H new ATOM 0 HD3 ARG A 62 5.071 -9.349 5.687 1.00 0.00 H new ATOM 0 HE ARG A 62 7.387 -8.106 6.868 1.00 0.00 H new ATOM 0 HH11 ARG A 62 4.760 -10.291 7.838 1.00 0.00 H new ATOM 0 HH12 ARG A 62 5.761 -11.046 9.083 1.00 0.00 H new ATOM 0 HH21 ARG A 62 8.587 -9.115 8.405 1.00 0.00 H new ATOM 0 HH22 ARG A 62 7.880 -10.395 9.396 1.00 0.00 H new ATOM 990 N PRO A 63 2.255 -8.323 2.346 1.00 0.00 N ATOM 991 CA PRO A 63 1.186 -7.858 1.477 1.00 0.00 C ATOM 992 C PRO A 63 1.189 -6.328 1.433 1.00 0.00 C ATOM 993 O PRO A 63 1.267 -5.664 2.467 1.00 0.00 O ATOM 994 CB PRO A 63 -0.097 -8.424 2.084 1.00 0.00 C ATOM 995 CG PRO A 63 0.212 -8.576 3.571 1.00 0.00 C ATOM 996 CD PRO A 63 1.719 -8.825 3.610 1.00 0.00 C ATOM 0 HA PRO A 63 1.296 -8.189 0.444 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -0.941 -7.754 1.921 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -0.359 -9.382 1.634 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -0.059 -7.680 4.129 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -0.341 -9.405 4.011 1.00 0.00 H new ATOM 0 HD2 PRO A 63 2.175 -8.311 4.456 1.00 0.00 H new ATOM 0 HD3 PRO A 63 1.934 -9.887 3.728 1.00 0.00 H new ATOM 1004 N CYS A 64 1.100 -5.759 0.228 1.00 0.00 N ATOM 1005 CA CYS A 64 1.155 -4.305 0.010 1.00 0.00 C ATOM 1006 C CYS A 64 -0.043 -3.521 0.585 1.00 0.00 C ATOM 1007 O CYS A 64 0.002 -2.288 0.632 1.00 0.00 O ATOM 1008 CB CYS A 64 1.344 -4.050 -1.488 1.00 0.00 C ATOM 1009 SG CYS A 64 -0.102 -4.632 -2.421 1.00 0.00 S ATOM 0 H CYS A 64 0.987 -6.295 -0.632 1.00 0.00 H new ATOM 0 HA CYS A 64 2.005 -3.919 0.573 1.00 0.00 H new ATOM 0 HB2 CYS A 64 1.494 -2.985 -1.665 1.00 0.00 H new ATOM 0 HB3 CYS A 64 2.240 -4.561 -1.839 1.00 0.00 H new ATOM 0 HG CYS A 64 0.079 -4.404 -3.688 1.00 0.00 H new ATOM 1015 N THR A 65 -1.072 -4.225 1.076 1.00 0.00 N ATOM 1016 CA THR A 65 -2.179 -3.672 1.874 1.00 0.00 C ATOM 1017 C THR A 65 -1.697 -3.013 3.168 1.00 0.00 C ATOM 1018 O THR A 65 -2.371 -2.104 3.651 1.00 0.00 O ATOM 1019 CB THR A 65 -3.190 -4.767 2.227 1.00 0.00 C ATOM 1020 OG1 THR A 65 -2.497 -5.825 2.857 1.00 0.00 O ATOM 1021 CG2 THR A 65 -3.903 -5.316 0.991 1.00 0.00 C ATOM 0 H THR A 65 -1.161 -5.230 0.924 1.00 0.00 H new ATOM 0 HA THR A 65 -2.650 -2.908 1.255 1.00 0.00 H new ATOM 0 HB THR A 65 -3.946 -4.333 2.882 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.129 -6.536 3.092 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.610 -6.089 1.292 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.439 -4.509 0.492 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.169 -5.742 0.307 1.00 0.00 H new ATOM 1029 N CYS A 66 -0.549 -3.454 3.712 1.00 0.00 N ATOM 1030 CA CYS A 66 0.068 -2.915 4.934 1.00 0.00 C ATOM 1031 C CYS A 66 -0.877 -2.979 6.159 1.00 0.00 C ATOM 1032 O CYS A 66 -0.921 -2.057 6.973 1.00 0.00 O ATOM 1033 CB CYS A 66 0.642 -1.511 4.659 1.00 0.00 C ATOM 1034 SG CYS A 66 1.865 -1.557 3.313 1.00 0.00 S ATOM 0 H CYS A 66 -0.011 -4.217 3.301 1.00 0.00 H new ATOM 0 HA CYS A 66 0.905 -3.556 5.211 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -0.167 -0.829 4.397 1.00 0.00 H new ATOM 0 HB3 CYS A 66 1.107 -1.121 5.564 1.00 0.00 H new ATOM 0 HG CYS A 66 1.267 -1.838 2.193 1.00 0.00 H new ATOM 1040 N ASP A 67 -1.621 -4.084 6.301 1.00 0.00 N ATOM 1041 CA ASP A 67 -2.647 -4.294 7.338 1.00 0.00 C ATOM 1042 C ASP A 67 -2.100 -4.127 8.769 1.00 0.00 C ATOM 1043 O ASP A 67 -2.805 -3.672 9.674 1.00 0.00 O ATOM 1044 CB ASP A 67 -3.240 -5.697 7.137 1.00 0.00 C ATOM 1045 CG ASP A 67 -4.317 -6.052 8.177 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -5.499 -5.687 7.974 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -3.986 -6.740 9.173 1.00 0.00 O ATOM 0 H ASP A 67 -1.524 -4.885 5.677 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.416 -3.529 7.229 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -3.672 -5.763 6.138 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -2.439 -6.434 7.187 1.00 0.00 H new ATOM 1052 N PHE A 68 -0.813 -4.431 8.958 1.00 0.00 N ATOM 1053 CA PHE A 68 -0.093 -4.260 10.215 1.00 0.00 C ATOM 1054 C PHE A 68 -0.003 -2.793 10.697 1.00 0.00 C ATOM 1055 O PHE A 68 0.271 -2.564 11.877 1.00 0.00 O ATOM 1056 CB PHE A 68 1.296 -4.907 10.066 1.00 0.00 C ATOM 1057 CG PHE A 68 2.111 -4.391 8.893 1.00 0.00 C ATOM 1058 CD1 PHE A 68 2.792 -3.165 8.998 1.00 0.00 C ATOM 1059 CD2 PHE A 68 2.165 -5.117 7.687 1.00 0.00 C ATOM 1060 CE1 PHE A 68 3.510 -2.661 7.902 1.00 0.00 C ATOM 1061 CE2 PHE A 68 2.895 -4.617 6.594 1.00 0.00 C ATOM 1062 CZ PHE A 68 3.565 -3.386 6.699 1.00 0.00 C ATOM 0 H PHE A 68 -0.229 -4.815 8.215 1.00 0.00 H new ATOM 0 HA PHE A 68 -0.660 -4.759 11.001 1.00 0.00 H new ATOM 0 HB2 PHE A 68 1.860 -4.741 10.984 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.171 -5.984 9.959 1.00 0.00 H new ATOM 0 HD1 PHE A 68 2.763 -2.610 9.924 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.645 -6.060 7.602 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.022 -1.713 7.983 1.00 0.00 H new ATOM 0 HE2 PHE A 68 2.941 -5.179 5.673 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.120 -2.998 5.858 1.00 0.00 H new ATOM 1072 N LEU A 69 -0.253 -1.801 9.826 1.00 0.00 N ATOM 1073 CA LEU A 69 -0.318 -0.376 10.192 1.00 0.00 C ATOM 1074 C LEU A 69 -1.648 0.039 10.847 1.00 0.00 C ATOM 1075 O LEU A 69 -1.753 1.166 11.331 1.00 0.00 O ATOM 1076 CB LEU A 69 -0.098 0.498 8.944 1.00 0.00 C ATOM 1077 CG LEU A 69 1.262 0.381 8.232 1.00 0.00 C ATOM 1078 CD1 LEU A 69 1.244 1.352 7.044 1.00 0.00 C ATOM 1079 CD2 LEU A 69 2.440 0.730 9.155 1.00 0.00 C ATOM 0 H LEU A 69 -0.418 -1.969 8.834 1.00 0.00 H new ATOM 0 HA LEU A 69 0.470 -0.224 10.930 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.879 0.258 8.222 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -0.240 1.540 9.232 1.00 0.00 H new ATOM 0 HG LEU A 69 1.404 -0.652 7.913 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.195 1.296 6.514 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.434 1.082 6.366 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.090 2.368 7.407 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.375 0.632 8.604 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.333 1.755 9.509 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.448 0.051 10.008 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.678 -0.810 10.843 1.00 0.00 N ATOM 1092 CA HIS A 70 -3.984 -0.465 11.398 1.00 0.00 C ATOM 1093 C HIS A 70 -3.929 -0.347 12.939 1.00 0.00 C ATOM 1094 O HIS A 70 -3.633 -1.317 13.648 1.00 0.00 O ATOM 1095 CB HIS A 70 -5.033 -1.496 10.944 1.00 0.00 C ATOM 1096 CG HIS A 70 -5.217 -1.661 9.448 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -4.694 -0.894 8.435 1.00 0.00 N flip ATOM 1098 CD2 HIS A 70 -5.962 -2.649 8.844 1.00 0.00 C flip ATOM 1099 CE1 HIS A 70 -5.141 -1.405 7.211 1.00 0.00 C flip ATOM 1100 NE2 HIS A 70 -5.894 -2.475 7.514 1.00 0.00 N flip ATOM 0 H HIS A 70 -2.628 -1.752 10.456 1.00 0.00 H new ATOM 0 HA HIS A 70 -4.277 0.514 11.019 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.762 -2.465 11.363 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -5.994 -1.218 11.377 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -6.508 -3.430 9.353 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -4.925 -1.019 6.226 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -6.352 -3.074 6.827 1.00 0.00 H new ATOM 1108 N GLY A 71 -4.238 0.850 13.451 1.00 0.00 N ATOM 1109 CA GLY A 71 -4.385 1.171 14.876 1.00 0.00 C ATOM 1110 C GLY A 71 -5.861 1.233 15.307 1.00 0.00 C ATOM 1111 O GLY A 71 -6.731 0.746 14.578 1.00 0.00 O ATOM 0 H GLY A 71 -4.400 1.661 12.854 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -3.865 0.420 15.472 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -3.907 2.129 15.082 1.00 0.00 H new ATOM 1115 N PRO A 72 -6.171 1.843 16.471 1.00 0.00 N ATOM 1116 CA PRO A 72 -7.540 1.947 16.981 1.00 0.00 C ATOM 1117 C PRO A 72 -8.417 2.915 16.167 1.00 0.00 C ATOM 1118 O PRO A 72 -9.629 2.709 16.095 1.00 0.00 O ATOM 1119 CB PRO A 72 -7.392 2.400 18.438 1.00 0.00 C ATOM 1120 CG PRO A 72 -6.076 3.176 18.446 1.00 0.00 C ATOM 1121 CD PRO A 72 -5.228 2.425 17.421 1.00 0.00 C ATOM 0 HA PRO A 72 -8.057 0.991 16.899 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -8.228 3.027 18.749 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -7.360 1.550 19.120 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -6.221 4.219 18.164 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -5.612 3.174 19.432 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -4.534 3.099 16.919 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -4.629 1.651 17.901 1.00 0.00 H new ATOM 1129 N ARG A 73 -7.827 3.943 15.532 1.00 0.00 N ATOM 1130 CA ARG A 73 -8.558 4.936 14.726 1.00 0.00 C ATOM 1131 C ARG A 73 -8.806 4.479 13.271 1.00 0.00 C ATOM 1132 O ARG A 73 -9.651 5.065 12.589 1.00 0.00 O ATOM 1133 CB ARG A 73 -7.782 6.270 14.794 1.00 0.00 C ATOM 1134 CG ARG A 73 -8.465 7.495 14.155 1.00 0.00 C ATOM 1135 CD ARG A 73 -9.873 7.770 14.704 1.00 0.00 C ATOM 1136 NE ARG A 73 -10.465 8.973 14.089 1.00 0.00 N ATOM 1137 CZ ARG A 73 -11.714 9.403 14.251 1.00 0.00 C ATOM 1138 NH1 ARG A 73 -12.573 8.780 15.033 1.00 0.00 N ATOM 1139 NH2 ARG A 73 -12.122 10.481 13.618 1.00 0.00 N ATOM 0 H ARG A 73 -6.821 4.109 15.564 1.00 0.00 H new ATOM 0 HA ARG A 73 -9.557 5.063 15.144 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -7.585 6.497 15.842 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -6.815 6.128 14.311 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -7.842 8.374 14.319 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -8.527 7.345 13.077 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -10.514 6.909 14.513 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.825 7.898 15.785 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.860 9.527 13.483 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -12.288 7.940 15.537 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -13.523 9.138 15.134 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -11.482 10.985 13.005 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -13.079 10.813 13.740 1.00 0.00 H new ATOM 1153 N THR A 74 -8.076 3.466 12.780 1.00 0.00 N ATOM 1154 CA THR A 74 -8.060 3.043 11.366 1.00 0.00 C ATOM 1155 C THR A 74 -9.443 2.606 10.887 1.00 0.00 C ATOM 1156 O THR A 74 -10.134 1.840 11.558 1.00 0.00 O ATOM 1157 CB THR A 74 -7.021 1.944 11.140 1.00 0.00 C ATOM 1158 OG1 THR A 74 -5.783 2.426 11.599 1.00 0.00 O ATOM 1159 CG2 THR A 74 -6.879 1.621 9.658 1.00 0.00 C ATOM 0 H THR A 74 -7.463 2.902 13.369 1.00 0.00 H new ATOM 0 HA THR A 74 -7.775 3.908 10.768 1.00 0.00 H new ATOM 0 HB THR A 74 -7.333 1.043 11.668 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.575 3.273 11.151 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.134 0.836 9.526 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.838 1.280 9.266 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.564 2.515 9.119 1.00 0.00 H new ATOM 1167 N GLN A 75 -9.842 3.111 9.719 1.00 0.00 N ATOM 1168 CA GLN A 75 -11.188 2.967 9.171 1.00 0.00 C ATOM 1169 C GLN A 75 -11.316 1.640 8.406 1.00 0.00 C ATOM 1170 O GLN A 75 -10.762 1.495 7.314 1.00 0.00 O ATOM 1171 CB GLN A 75 -11.509 4.160 8.243 1.00 0.00 C ATOM 1172 CG GLN A 75 -11.494 5.542 8.926 1.00 0.00 C ATOM 1173 CD GLN A 75 -10.103 6.126 9.192 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -9.074 5.642 8.729 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -10.015 7.185 9.963 1.00 0.00 N ATOM 0 H GLN A 75 -9.220 3.646 9.113 1.00 0.00 H new ATOM 0 HA GLN A 75 -11.904 2.959 9.992 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -10.788 4.168 7.425 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.492 4.001 7.800 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -12.051 6.242 8.304 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -12.025 5.466 9.875 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.859 7.601 10.357 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -9.103 7.592 10.168 1.00 0.00 H new ATOM 1184 N ARG A 76 -12.106 0.689 8.924 1.00 0.00 N ATOM 1185 CA ARG A 76 -12.353 -0.612 8.272 1.00 0.00 C ATOM 1186 C ARG A 76 -12.955 -0.459 6.862 1.00 0.00 C ATOM 1187 O ARG A 76 -12.608 -1.214 5.952 1.00 0.00 O ATOM 1188 CB ARG A 76 -13.274 -1.476 9.159 1.00 0.00 C ATOM 1189 CG ARG A 76 -12.667 -1.872 10.518 1.00 0.00 C ATOM 1190 CD ARG A 76 -11.464 -2.816 10.390 1.00 0.00 C ATOM 1191 NE ARG A 76 -11.001 -3.261 11.717 1.00 0.00 N ATOM 1192 CZ ARG A 76 -10.163 -4.261 11.971 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -9.618 -4.981 11.012 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -9.858 -4.554 13.218 1.00 0.00 N ATOM 0 H ARG A 76 -12.596 0.798 9.812 1.00 0.00 H new ATOM 0 HA ARG A 76 -11.389 -1.107 8.153 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -14.202 -0.932 9.335 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -13.535 -2.383 8.614 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -12.359 -0.971 11.048 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -13.434 -2.352 11.126 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -11.738 -3.682 9.787 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -10.652 -2.309 9.868 1.00 0.00 H new ATOM 0 HE ARG A 76 -11.361 -2.749 12.523 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -9.835 -4.778 10.036 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -8.979 -5.741 11.245 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -10.264 -4.015 13.983 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -9.216 -5.320 13.419 1.00 0.00 H new ATOM 1208 N ARG A 77 -13.788 0.572 6.653 1.00 0.00 N ATOM 1209 CA ARG A 77 -14.372 0.924 5.347 1.00 0.00 C ATOM 1210 C ARG A 77 -13.299 1.296 4.311 1.00 0.00 C ATOM 1211 O ARG A 77 -13.393 0.874 3.162 1.00 0.00 O ATOM 1212 CB ARG A 77 -15.389 2.066 5.549 1.00 0.00 C ATOM 1213 CG ARG A 77 -16.272 2.374 4.322 1.00 0.00 C ATOM 1214 CD ARG A 77 -17.153 1.205 3.849 1.00 0.00 C ATOM 1215 NE ARG A 77 -18.103 0.774 4.894 1.00 0.00 N ATOM 1216 CZ ARG A 77 -18.777 -0.371 4.934 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -18.670 -1.283 3.988 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -19.584 -0.617 5.943 1.00 0.00 N ATOM 0 H ARG A 77 -14.081 1.198 7.403 1.00 0.00 H new ATOM 0 HA ARG A 77 -14.883 0.050 4.943 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -16.035 1.813 6.389 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -14.847 2.971 5.825 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -16.915 3.222 4.559 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -15.629 2.682 3.498 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -17.705 1.504 2.958 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -16.520 0.365 3.565 1.00 0.00 H new ATOM 0 HE ARG A 77 -18.258 1.423 5.666 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -18.054 -1.121 3.191 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -19.203 -2.150 4.053 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -19.690 0.069 6.690 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -20.103 -1.494 5.978 1.00 0.00 H new ATOM 1232 N ALA A 78 -12.255 2.029 4.714 1.00 0.00 N ATOM 1233 CA ALA A 78 -11.117 2.392 3.864 1.00 0.00 C ATOM 1234 C ALA A 78 -10.138 1.226 3.672 1.00 0.00 C ATOM 1235 O ALA A 78 -9.723 0.968 2.546 1.00 0.00 O ATOM 1236 CB ALA A 78 -10.425 3.609 4.486 1.00 0.00 C ATOM 0 H ALA A 78 -12.177 2.395 5.663 1.00 0.00 H new ATOM 0 HA ALA A 78 -11.480 2.639 2.866 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.574 3.898 3.870 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -11.130 4.439 4.543 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -10.079 3.358 5.488 1.00 0.00 H new ATOM 1242 N ALA A 79 -9.838 0.456 4.723 1.00 0.00 N ATOM 1243 CA ALA A 79 -8.990 -0.745 4.636 1.00 0.00 C ATOM 1244 C ALA A 79 -9.472 -1.741 3.559 1.00 0.00 C ATOM 1245 O ALA A 79 -8.663 -2.365 2.871 1.00 0.00 O ATOM 1246 CB ALA A 79 -8.955 -1.393 6.025 1.00 0.00 C ATOM 0 H ALA A 79 -10.177 0.647 5.666 1.00 0.00 H new ATOM 0 HA ALA A 79 -7.987 -0.453 4.326 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.333 -2.288 5.994 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -8.540 -0.688 6.745 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -9.967 -1.665 6.325 1.00 0.00 H new ATOM 1252 N ALA A 80 -10.792 -1.819 3.354 1.00 0.00 N ATOM 1253 CA ALA A 80 -11.431 -2.586 2.283 1.00 0.00 C ATOM 1254 C ALA A 80 -11.154 -2.006 0.895 1.00 0.00 C ATOM 1255 O ALA A 80 -10.885 -2.752 -0.041 1.00 0.00 O ATOM 1256 CB ALA A 80 -12.938 -2.563 2.550 1.00 0.00 C ATOM 0 H ALA A 80 -11.464 -1.334 3.949 1.00 0.00 H new ATOM 0 HA ALA A 80 -11.026 -3.598 2.285 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.454 -3.125 1.772 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -13.142 -3.015 3.521 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.292 -1.532 2.548 1.00 0.00 H new ATOM 1262 N GLN A 81 -11.189 -0.678 0.750 1.00 0.00 N ATOM 1263 CA GLN A 81 -10.914 -0.015 -0.524 1.00 0.00 C ATOM 1264 C GLN A 81 -9.469 -0.243 -0.974 1.00 0.00 C ATOM 1265 O GLN A 81 -9.244 -0.382 -2.171 1.00 0.00 O ATOM 1266 CB GLN A 81 -11.229 1.488 -0.441 1.00 0.00 C ATOM 1267 CG GLN A 81 -12.680 1.863 -0.104 1.00 0.00 C ATOM 1268 CD GLN A 81 -13.722 1.061 -0.883 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -13.665 0.942 -2.100 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -14.675 0.454 -0.208 1.00 0.00 N ATOM 0 H GLN A 81 -11.408 -0.036 1.511 1.00 0.00 H new ATOM 0 HA GLN A 81 -11.568 -0.460 -1.273 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -10.577 1.933 0.311 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -10.971 1.945 -1.397 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -12.845 1.715 0.963 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -12.827 2.924 -0.305 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -14.724 0.552 0.806 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -15.365 -0.115 -0.699 1.00 0.00 H new ATOM 1279 N ILE A 82 -8.498 -0.360 -0.052 1.00 0.00 N ATOM 1280 CA ILE A 82 -7.125 -0.775 -0.409 1.00 0.00 C ATOM 1281 C ILE A 82 -7.134 -2.165 -1.066 1.00 0.00 C ATOM 1282 O ILE A 82 -6.459 -2.364 -2.071 1.00 0.00 O ATOM 1283 CB ILE A 82 -6.173 -0.740 0.813 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -6.227 0.624 1.537 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -4.731 -1.041 0.355 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -5.338 0.707 2.781 1.00 0.00 C ATOM 0 H ILE A 82 -8.634 -0.175 0.942 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.741 -0.055 -1.132 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.500 -1.502 1.520 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.930 1.406 0.838 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -7.258 0.829 1.826 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.063 -1.016 1.216 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -4.694 -2.029 -0.104 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.416 -0.291 -0.371 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.433 1.695 3.231 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -5.648 -0.050 3.501 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -4.299 0.535 2.498 1.00 0.00 H new ATOM 1298 N ALA A 83 -7.932 -3.110 -0.558 1.00 0.00 N ATOM 1299 CA ALA A 83 -8.078 -4.439 -1.158 1.00 0.00 C ATOM 1300 C ALA A 83 -8.879 -4.419 -2.477 1.00 0.00 C ATOM 1301 O ALA A 83 -8.542 -5.156 -3.404 1.00 0.00 O ATOM 1302 CB ALA A 83 -8.691 -5.380 -0.112 1.00 0.00 C ATOM 0 H ALA A 83 -8.495 -2.974 0.282 1.00 0.00 H new ATOM 0 HA ALA A 83 -7.093 -4.808 -1.442 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -8.807 -6.375 -0.541 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -8.036 -5.434 0.757 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -9.666 -5.000 0.192 1.00 0.00 H new ATOM 1308 N GLN A 84 -9.895 -3.552 -2.606 1.00 0.00 N ATOM 1309 CA GLN A 84 -10.612 -3.345 -3.876 1.00 0.00 C ATOM 1310 C GLN A 84 -9.690 -2.749 -4.951 1.00 0.00 C ATOM 1311 O GLN A 84 -9.782 -3.128 -6.117 1.00 0.00 O ATOM 1312 CB GLN A 84 -11.843 -2.437 -3.691 1.00 0.00 C ATOM 1313 CG GLN A 84 -12.962 -2.998 -2.793 1.00 0.00 C ATOM 1314 CD GLN A 84 -13.530 -4.328 -3.295 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -14.277 -4.391 -4.263 1.00 0.00 O ATOM 1316 NE2 GLN A 84 -13.186 -5.441 -2.676 1.00 0.00 N ATOM 0 H GLN A 84 -10.242 -2.977 -1.838 1.00 0.00 H new ATOM 0 HA GLN A 84 -10.950 -4.327 -4.208 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -11.510 -1.487 -3.274 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -12.264 -2.224 -4.673 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -12.575 -3.134 -1.783 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -13.768 -2.267 -2.729 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -12.564 -5.404 -1.868 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -13.542 -6.339 -3.005 1.00 0.00 H new ATOM 1325 N ALA A 85 -8.754 -1.869 -4.576 1.00 0.00 N ATOM 1326 CA ALA A 85 -7.795 -1.265 -5.502 1.00 0.00 C ATOM 1327 C ALA A 85 -6.878 -2.304 -6.194 1.00 0.00 C ATOM 1328 O ALA A 85 -6.347 -2.029 -7.270 1.00 0.00 O ATOM 1329 CB ALA A 85 -6.993 -0.215 -4.729 1.00 0.00 C ATOM 0 H ALA A 85 -8.642 -1.555 -3.612 1.00 0.00 H new ATOM 0 HA ALA A 85 -8.340 -0.794 -6.320 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -6.269 0.253 -5.396 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -7.670 0.545 -4.338 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -6.469 -0.694 -3.902 1.00 0.00 H new ATOM 1335 N LEU A 86 -6.725 -3.502 -5.607 1.00 0.00 N ATOM 1336 CA LEU A 86 -5.929 -4.625 -6.130 1.00 0.00 C ATOM 1337 C LEU A 86 -6.707 -5.556 -7.081 1.00 0.00 C ATOM 1338 O LEU A 86 -6.097 -6.405 -7.731 1.00 0.00 O ATOM 1339 CB LEU A 86 -5.377 -5.452 -4.955 1.00 0.00 C ATOM 1340 CG LEU A 86 -4.572 -4.661 -3.908 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -4.229 -5.586 -2.736 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -3.293 -4.042 -4.480 1.00 0.00 C ATOM 0 H LEU A 86 -7.171 -3.724 -4.717 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.125 -4.182 -6.717 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.212 -5.940 -4.453 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.741 -6.241 -5.356 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.195 -3.832 -3.573 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.659 -5.032 -1.990 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -5.149 -5.959 -2.286 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.635 -6.426 -3.097 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.769 -3.498 -3.694 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.648 -4.831 -4.866 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.550 -3.356 -5.287 1.00 0.00 H new ATOM 1354 N LEU A 87 -8.038 -5.423 -7.173 1.00 0.00 N ATOM 1355 CA LEU A 87 -8.857 -6.108 -8.194 1.00 0.00 C ATOM 1356 C LEU A 87 -9.313 -5.181 -9.339 1.00 0.00 C ATOM 1357 O LEU A 87 -9.927 -5.649 -10.300 1.00 0.00 O ATOM 1358 CB LEU A 87 -9.987 -6.926 -7.528 1.00 0.00 C ATOM 1359 CG LEU A 87 -11.024 -6.188 -6.659 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -11.945 -5.247 -7.450 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -11.894 -7.226 -5.932 1.00 0.00 C ATOM 0 H LEU A 87 -8.582 -4.836 -6.541 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.220 -6.830 -8.706 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.529 -7.445 -8.319 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -9.519 -7.690 -6.907 1.00 0.00 H new ATOM 0 HG LEU A 87 -10.459 -5.567 -5.964 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -12.646 -4.766 -6.768 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -11.345 -4.487 -7.950 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -12.498 -5.820 -8.194 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -12.631 -6.714 -5.314 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -12.405 -7.850 -6.665 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.263 -7.851 -5.301 1.00 0.00 H new ATOM 1373 N GLY A 88 -8.982 -3.884 -9.266 1.00 0.00 N ATOM 1374 CA GLY A 88 -9.246 -2.887 -10.310 1.00 0.00 C ATOM 1375 C GLY A 88 -8.095 -2.769 -11.315 1.00 0.00 C ATOM 1376 O GLY A 88 -6.923 -2.839 -10.944 1.00 0.00 O ATOM 0 H GLY A 88 -8.509 -3.489 -8.453 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.160 -3.154 -10.840 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -9.419 -1.916 -9.845 1.00 0.00 H new ATOM 1380 N ALA A 89 -8.431 -2.534 -12.588 1.00 0.00 N ATOM 1381 CA ALA A 89 -7.470 -2.310 -13.681 1.00 0.00 C ATOM 1382 C ALA A 89 -7.084 -0.828 -13.882 1.00 0.00 C ATOM 1383 O ALA A 89 -6.276 -0.516 -14.760 1.00 0.00 O ATOM 1384 CB ALA A 89 -8.084 -2.883 -14.963 1.00 0.00 C ATOM 0 H ALA A 89 -9.402 -2.493 -12.898 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.538 -2.813 -13.421 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -7.396 -2.733 -15.795 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -8.269 -3.949 -14.833 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -9.025 -2.375 -15.175 1.00 0.00 H new ATOM 1390 N GLU A 90 -7.675 0.080 -13.099 1.00 0.00 N ATOM 1391 CA GLU A 90 -7.538 1.536 -13.211 1.00 0.00 C ATOM 1392 C GLU A 90 -7.048 2.143 -11.879 1.00 0.00 C ATOM 1393 O GLU A 90 -7.174 1.518 -10.822 1.00 0.00 O ATOM 1394 CB GLU A 90 -8.902 2.117 -13.630 1.00 0.00 C ATOM 1395 CG GLU A 90 -8.754 3.384 -14.472 1.00 0.00 C ATOM 1396 CD GLU A 90 -10.126 3.920 -14.906 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -10.738 4.718 -14.157 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -10.606 3.551 -16.005 1.00 0.00 O ATOM 0 H GLU A 90 -8.291 -0.193 -12.333 1.00 0.00 H new ATOM 0 HA GLU A 90 -6.791 1.787 -13.964 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -9.456 1.368 -14.197 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -9.489 2.341 -12.739 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -8.227 4.146 -13.899 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -8.148 3.171 -15.352 1.00 0.00 H new ATOM 1405 N GLU A 91 -6.476 3.350 -11.918 1.00 0.00 N ATOM 1406 CA GLU A 91 -5.961 4.064 -10.745 1.00 0.00 C ATOM 1407 C GLU A 91 -7.054 4.268 -9.676 1.00 0.00 C ATOM 1408 O GLU A 91 -8.184 4.658 -9.991 1.00 0.00 O ATOM 1409 CB GLU A 91 -5.374 5.433 -11.142 1.00 0.00 C ATOM 1410 CG GLU A 91 -4.098 5.385 -12.002 1.00 0.00 C ATOM 1411 CD GLU A 91 -4.293 4.925 -13.462 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -5.434 4.938 -13.984 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -3.284 4.560 -14.107 1.00 0.00 O ATOM 0 H GLU A 91 -6.355 3.871 -12.787 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.171 3.444 -10.321 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.136 5.991 -11.686 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -5.157 5.993 -10.232 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.650 6.378 -12.010 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -3.383 4.717 -11.522 1.00 0.00 H new ATOM 1420 N ARG A 92 -6.699 4.024 -8.405 1.00 0.00 N ATOM 1421 CA ARG A 92 -7.634 4.032 -7.268 1.00 0.00 C ATOM 1422 C ARG A 92 -6.952 4.608 -6.022 1.00 0.00 C ATOM 1423 O ARG A 92 -5.935 4.083 -5.562 1.00 0.00 O ATOM 1424 CB ARG A 92 -8.166 2.594 -7.055 1.00 0.00 C ATOM 1425 CG ARG A 92 -9.603 2.484 -6.512 1.00 0.00 C ATOM 1426 CD ARG A 92 -9.832 3.088 -5.120 1.00 0.00 C ATOM 1427 NE ARG A 92 -11.148 2.693 -4.578 1.00 0.00 N ATOM 1428 CZ ARG A 92 -12.315 3.304 -4.781 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -12.429 4.375 -5.539 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -13.409 2.838 -4.220 1.00 0.00 N ATOM 0 H ARG A 92 -5.739 3.812 -8.134 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.487 4.679 -7.474 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.116 2.064 -8.006 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.497 2.078 -6.366 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.277 2.972 -7.216 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -9.882 1.431 -6.482 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.043 2.759 -4.443 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -9.770 4.175 -5.177 1.00 0.00 H new ATOM 0 HE ARG A 92 -11.166 1.864 -3.985 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.605 4.766 -5.996 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -13.341 4.813 -5.669 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -13.365 2.008 -3.629 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.302 3.306 -4.376 1.00 0.00 H new ATOM 1444 N LYS A 93 -7.515 5.686 -5.472 1.00 0.00 N ATOM 1445 CA LYS A 93 -7.042 6.367 -4.258 1.00 0.00 C ATOM 1446 C LYS A 93 -7.945 6.061 -3.043 1.00 0.00 C ATOM 1447 O LYS A 93 -9.161 5.947 -3.187 1.00 0.00 O ATOM 1448 CB LYS A 93 -6.944 7.881 -4.527 1.00 0.00 C ATOM 1449 CG LYS A 93 -6.120 8.202 -5.790 1.00 0.00 C ATOM 1450 CD LYS A 93 -5.654 9.662 -5.854 1.00 0.00 C ATOM 1451 CE LYS A 93 -6.837 10.643 -5.902 1.00 0.00 C ATOM 1452 NZ LYS A 93 -6.385 12.051 -6.079 1.00 0.00 N ATOM 0 H LYS A 93 -8.343 6.127 -5.872 1.00 0.00 H new ATOM 0 HA LYS A 93 -6.051 5.989 -4.007 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.947 8.293 -4.637 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.490 8.372 -3.666 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -5.249 7.548 -5.823 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.719 7.980 -6.673 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -5.035 9.883 -4.985 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -5.029 9.805 -6.735 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.502 10.370 -6.721 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.415 10.560 -4.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -7.212 12.680 -6.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.771 12.321 -5.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.856 12.136 -6.970 1.00 0.00 H new ATOM 1466 N VAL A 94 -7.349 5.917 -1.855 1.00 0.00 N ATOM 1467 CA VAL A 94 -8.024 5.574 -0.581 1.00 0.00 C ATOM 1468 C VAL A 94 -7.436 6.430 0.536 1.00 0.00 C ATOM 1469 O VAL A 94 -6.216 6.508 0.656 1.00 0.00 O ATOM 1470 CB VAL A 94 -7.858 4.073 -0.218 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -8.590 3.720 1.080 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -8.324 3.191 -1.372 1.00 0.00 C ATOM 0 H VAL A 94 -6.343 6.039 -1.741 1.00 0.00 H new ATOM 0 HA VAL A 94 -9.090 5.769 -0.701 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.798 3.885 -0.048 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.450 2.662 1.300 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.188 4.317 1.898 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -9.654 3.930 0.966 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.201 2.142 -1.101 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -9.375 3.391 -1.581 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.730 3.409 -2.259 1.00 0.00 H new ATOM 1482 N GLU A 95 -8.289 7.053 1.351 1.00 0.00 N ATOM 1483 CA GLU A 95 -7.872 7.860 2.501 1.00 0.00 C ATOM 1484 C GLU A 95 -8.097 7.096 3.814 1.00 0.00 C ATOM 1485 O GLU A 95 -9.185 6.568 4.045 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.639 9.189 2.479 1.00 0.00 C ATOM 1487 CG GLU A 95 -8.220 10.148 3.596 1.00 0.00 C ATOM 1488 CD GLU A 95 -9.030 11.453 3.527 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -8.851 12.241 2.569 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -9.864 11.696 4.432 1.00 0.00 O ATOM 0 H GLU A 95 -9.301 7.011 1.230 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.804 8.069 2.437 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.484 9.674 1.515 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.706 8.986 2.565 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -8.370 9.672 4.565 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.156 10.370 3.511 1.00 0.00 H new ATOM 1497 N ILE A 96 -7.076 7.027 4.677 1.00 0.00 N ATOM 1498 CA ILE A 96 -7.039 6.099 5.825 1.00 0.00 C ATOM 1499 C ILE A 96 -6.041 6.549 6.901 1.00 0.00 C ATOM 1500 O ILE A 96 -4.973 7.065 6.583 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.750 4.662 5.311 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -6.918 3.622 6.439 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -5.374 4.552 4.625 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -6.879 2.170 5.947 1.00 0.00 C ATOM 0 H ILE A 96 -6.246 7.615 4.602 1.00 0.00 H new ATOM 0 HA ILE A 96 -8.013 6.103 6.314 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.493 4.438 4.545 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -6.129 3.768 7.177 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.866 3.799 6.947 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -5.219 3.529 4.283 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.338 5.229 3.772 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.591 4.820 5.335 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -7.003 1.495 6.794 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.685 2.006 5.232 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.921 1.975 5.465 1.00 0.00 H new ATOM 1516 N ALA A 97 -6.369 6.361 8.182 1.00 0.00 N ATOM 1517 CA ALA A 97 -5.452 6.632 9.292 1.00 0.00 C ATOM 1518 C ALA A 97 -4.563 5.417 9.573 1.00 0.00 C ATOM 1519 O ALA A 97 -5.070 4.344 9.896 1.00 0.00 O ATOM 1520 CB ALA A 97 -6.261 7.044 10.533 1.00 0.00 C ATOM 0 H ALA A 97 -7.281 6.015 8.479 1.00 0.00 H new ATOM 0 HA ALA A 97 -4.790 7.455 9.022 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.581 7.246 11.360 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -6.838 7.942 10.310 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -6.939 6.237 10.810 1.00 0.00 H new ATOM 1526 N PHE A 98 -3.244 5.596 9.495 1.00 0.00 N ATOM 1527 CA PHE A 98 -2.246 4.600 9.882 1.00 0.00 C ATOM 1528 C PHE A 98 -1.500 5.006 11.159 1.00 0.00 C ATOM 1529 O PHE A 98 -1.350 6.191 11.461 1.00 0.00 O ATOM 1530 CB PHE A 98 -1.253 4.440 8.728 1.00 0.00 C ATOM 1531 CG PHE A 98 -1.779 3.756 7.478 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -2.538 2.571 7.550 1.00 0.00 C ATOM 1533 CD2 PHE A 98 -1.437 4.281 6.220 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -2.930 1.910 6.371 1.00 0.00 C ATOM 1535 CE2 PHE A 98 -1.823 3.621 5.042 1.00 0.00 C ATOM 1536 CZ PHE A 98 -2.567 2.430 5.118 1.00 0.00 C ATOM 0 H PHE A 98 -2.829 6.462 9.151 1.00 0.00 H new ATOM 0 HA PHE A 98 -2.753 3.658 10.090 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -0.890 5.429 8.450 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -0.394 3.876 9.091 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -2.820 2.169 8.512 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -0.873 5.200 6.159 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -3.511 1.001 6.430 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -1.549 4.027 4.080 1.00 0.00 H new ATOM 0 HZ PHE A 98 -2.859 1.916 4.214 1.00 0.00 H new ATOM 1546 N TYR A 99 -0.980 4.003 11.870 1.00 0.00 N ATOM 1547 CA TYR A 99 -0.150 4.143 13.071 1.00 0.00 C ATOM 1548 C TYR A 99 1.282 3.644 12.799 1.00 0.00 C ATOM 1549 O TYR A 99 1.480 2.568 12.227 1.00 0.00 O ATOM 1550 CB TYR A 99 -0.815 3.353 14.209 1.00 0.00 C ATOM 1551 CG TYR A 99 0.015 3.228 15.473 1.00 0.00 C ATOM 1552 CD1 TYR A 99 0.014 4.261 16.430 1.00 0.00 C ATOM 1553 CD2 TYR A 99 0.790 2.071 15.692 1.00 0.00 C ATOM 1554 CE1 TYR A 99 0.773 4.134 17.608 1.00 0.00 C ATOM 1555 CE2 TYR A 99 1.557 1.941 16.865 1.00 0.00 C ATOM 1556 CZ TYR A 99 1.547 2.972 17.831 1.00 0.00 C ATOM 1557 OH TYR A 99 2.272 2.848 18.980 1.00 0.00 O ATOM 0 H TYR A 99 -1.132 3.027 11.614 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.072 5.192 13.357 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -1.761 3.833 14.460 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -1.051 2.352 13.847 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.571 5.153 16.259 1.00 0.00 H new ATOM 0 HD2 TYR A 99 0.795 1.280 14.956 1.00 0.00 H new ATOM 0 HE1 TYR A 99 0.764 4.925 18.343 1.00 0.00 H new ATOM 0 HE2 TYR A 99 2.152 1.054 17.026 1.00 0.00 H new ATOM 0 HH TYR A 99 2.746 1.990 18.977 1.00 0.00 H new ATOM 1567 N ARG A 100 2.280 4.456 13.166 1.00 0.00 N ATOM 1568 CA ARG A 100 3.698 4.292 12.792 1.00 0.00 C ATOM 1569 C ARG A 100 4.572 3.799 13.963 1.00 0.00 C ATOM 1570 O ARG A 100 4.172 3.873 15.125 1.00 0.00 O ATOM 1571 CB ARG A 100 4.227 5.628 12.229 1.00 0.00 C ATOM 1572 CG ARG A 100 3.327 6.321 11.185 1.00 0.00 C ATOM 1573 CD ARG A 100 2.829 5.433 10.035 1.00 0.00 C ATOM 1574 NE ARG A 100 2.096 6.230 9.032 1.00 0.00 N ATOM 1575 CZ ARG A 100 1.906 5.924 7.753 1.00 0.00 C ATOM 1576 NH1 ARG A 100 2.326 4.795 7.232 1.00 0.00 N ATOM 1577 NH2 ARG A 100 1.267 6.761 6.965 1.00 0.00 N ATOM 0 H ARG A 100 2.122 5.276 13.752 1.00 0.00 H new ATOM 0 HA ARG A 100 3.759 3.517 12.028 1.00 0.00 H new ATOM 0 HB2 ARG A 100 4.381 6.315 13.061 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.203 5.449 11.778 1.00 0.00 H new ATOM 0 HG2 ARG A 100 2.460 6.737 11.699 1.00 0.00 H new ATOM 0 HG3 ARG A 100 3.877 7.160 10.759 1.00 0.00 H new ATOM 0 HD2 ARG A 100 3.676 4.936 9.562 1.00 0.00 H new ATOM 0 HD3 ARG A 100 2.180 4.651 10.429 1.00 0.00 H new ATOM 0 HE ARG A 100 1.692 7.109 9.355 1.00 0.00 H new ATOM 0 HH11 ARG A 100 2.817 4.116 7.814 1.00 0.00 H new ATOM 0 HH12 ARG A 100 2.161 4.596 6.245 1.00 0.00 H new ATOM 0 HH21 ARG A 100 0.918 7.645 7.336 1.00 0.00 H new ATOM 0 HH22 ARG A 100 1.121 6.526 5.983 1.00 0.00 H new ATOM 1591 N LYS A 101 5.800 3.348 13.672 1.00 0.00 N ATOM 1592 CA LYS A 101 6.763 2.842 14.682 1.00 0.00 C ATOM 1593 C LYS A 101 7.162 3.896 15.738 1.00 0.00 C ATOM 1594 O LYS A 101 7.503 3.545 16.868 1.00 0.00 O ATOM 1595 CB LYS A 101 8.033 2.314 13.977 1.00 0.00 C ATOM 1596 CG LYS A 101 8.051 0.801 13.722 1.00 0.00 C ATOM 1597 CD LYS A 101 7.119 0.347 12.593 1.00 0.00 C ATOM 1598 CE LYS A 101 7.157 -1.189 12.518 1.00 0.00 C ATOM 1599 NZ LYS A 101 6.017 -1.750 11.740 1.00 0.00 N ATOM 0 H LYS A 101 6.165 3.321 12.720 1.00 0.00 H new ATOM 0 HA LYS A 101 6.255 2.039 15.216 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.142 2.829 13.023 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.901 2.576 14.581 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.070 0.495 13.483 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.771 0.285 14.640 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.102 0.692 12.779 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.434 0.781 11.644 1.00 0.00 H new ATOM 0 HE2 LYS A 101 8.095 -1.504 12.061 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.141 -1.599 13.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 6.088 -2.787 11.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 5.121 -1.473 12.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 6.045 -1.381 10.768 1.00 0.00 H new ATOM 1613 N ASP A 102 7.091 5.182 15.384 1.00 0.00 N ATOM 1614 CA ASP A 102 7.391 6.322 16.266 1.00 0.00 C ATOM 1615 C ASP A 102 6.351 6.532 17.390 1.00 0.00 C ATOM 1616 O ASP A 102 6.568 7.355 18.283 1.00 0.00 O ATOM 1617 CB ASP A 102 7.496 7.591 15.404 1.00 0.00 C ATOM 1618 CG ASP A 102 8.656 7.518 14.399 1.00 0.00 C ATOM 1619 OD1 ASP A 102 9.806 7.837 14.786 1.00 0.00 O ATOM 1620 OD2 ASP A 102 8.411 7.146 13.227 1.00 0.00 O ATOM 0 H ASP A 102 6.814 5.472 14.446 1.00 0.00 H new ATOM 0 HA ASP A 102 8.333 6.104 16.770 1.00 0.00 H new ATOM 0 HB2 ASP A 102 6.560 7.740 14.865 1.00 0.00 H new ATOM 0 HB3 ASP A 102 7.633 8.457 16.051 1.00 0.00 H new ATOM 1625 N GLY A 103 5.215 5.820 17.341 1.00 0.00 N ATOM 1626 CA GLY A 103 4.055 6.021 18.222 1.00 0.00 C ATOM 1627 C GLY A 103 3.068 7.067 17.693 1.00 0.00 C ATOM 1628 O GLY A 103 2.061 7.351 18.341 1.00 0.00 O ATOM 0 H GLY A 103 5.074 5.067 16.668 1.00 0.00 H new ATOM 0 HA2 GLY A 103 3.535 5.072 18.349 1.00 0.00 H new ATOM 0 HA3 GLY A 103 4.405 6.327 19.208 1.00 0.00 H new ATOM 1632 N SER A 104 3.348 7.647 16.526 1.00 0.00 N ATOM 1633 CA SER A 104 2.513 8.655 15.861 1.00 0.00 C ATOM 1634 C SER A 104 1.417 8.010 14.995 1.00 0.00 C ATOM 1635 O SER A 104 1.595 6.909 14.465 1.00 0.00 O ATOM 1636 CB SER A 104 3.389 9.554 14.967 1.00 0.00 C ATOM 1637 OG SER A 104 4.490 10.123 15.672 1.00 0.00 O ATOM 0 H SER A 104 4.191 7.422 15.997 1.00 0.00 H new ATOM 0 HA SER A 104 2.033 9.246 16.641 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.764 8.970 14.127 1.00 0.00 H new ATOM 0 HB3 SER A 104 2.776 10.354 14.551 1.00 0.00 H new ATOM 0 HG SER A 104 5.015 10.682 15.062 1.00 0.00 H new ATOM 1643 N CYS A 105 0.307 8.722 14.773 1.00 0.00 N ATOM 1644 CA CYS A 105 -0.695 8.375 13.761 1.00 0.00 C ATOM 1645 C CYS A 105 -1.097 9.599 12.923 1.00 0.00 C ATOM 1646 O CYS A 105 -0.984 10.741 13.374 1.00 0.00 O ATOM 1647 CB CYS A 105 -1.900 7.679 14.421 1.00 0.00 C ATOM 1648 SG CYS A 105 -2.767 8.785 15.575 1.00 0.00 S ATOM 0 H CYS A 105 0.077 9.566 15.298 1.00 0.00 H new ATOM 0 HA CYS A 105 -0.255 7.665 13.060 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -2.593 7.342 13.650 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.560 6.791 14.954 1.00 0.00 H new ATOM 0 HG CYS A 105 -3.775 8.157 16.104 1.00 0.00 H new ATOM 1654 N PHE A 106 -1.544 9.349 11.691 1.00 0.00 N ATOM 1655 CA PHE A 106 -1.937 10.372 10.712 1.00 0.00 C ATOM 1656 C PHE A 106 -2.682 9.786 9.506 1.00 0.00 C ATOM 1657 O PHE A 106 -2.557 8.601 9.191 1.00 0.00 O ATOM 1658 CB PHE A 106 -0.725 11.230 10.285 1.00 0.00 C ATOM 1659 CG PHE A 106 0.560 10.502 9.928 1.00 0.00 C ATOM 1660 CD1 PHE A 106 1.528 10.258 10.922 1.00 0.00 C ATOM 1661 CD2 PHE A 106 0.839 10.159 8.591 1.00 0.00 C ATOM 1662 CE1 PHE A 106 2.774 9.705 10.584 1.00 0.00 C ATOM 1663 CE2 PHE A 106 2.091 9.612 8.254 1.00 0.00 C ATOM 1664 CZ PHE A 106 3.060 9.392 9.246 1.00 0.00 C ATOM 0 H PHE A 106 -1.647 8.400 11.333 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.649 11.030 11.211 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -1.023 11.828 9.424 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -0.504 11.926 11.095 1.00 0.00 H new ATOM 0 HD1 PHE A 106 1.310 10.498 11.952 1.00 0.00 H new ATOM 0 HD2 PHE A 106 0.093 10.315 7.826 1.00 0.00 H new ATOM 0 HE1 PHE A 106 3.511 9.521 11.352 1.00 0.00 H new ATOM 0 HE2 PHE A 106 2.308 9.360 7.226 1.00 0.00 H new ATOM 0 HZ PHE A 106 4.023 8.983 8.980 1.00 0.00 H new ATOM 1674 N LEU A 107 -3.460 10.639 8.830 1.00 0.00 N ATOM 1675 CA LEU A 107 -4.196 10.302 7.610 1.00 0.00 C ATOM 1676 C LEU A 107 -3.247 10.240 6.411 1.00 0.00 C ATOM 1677 O LEU A 107 -2.643 11.238 6.004 1.00 0.00 O ATOM 1678 CB LEU A 107 -5.310 11.329 7.331 1.00 0.00 C ATOM 1679 CG LEU A 107 -6.679 11.144 8.010 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -7.315 9.787 7.691 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -6.602 11.349 9.527 1.00 0.00 C ATOM 0 H LEU A 107 -3.597 11.606 9.125 1.00 0.00 H new ATOM 0 HA LEU A 107 -4.653 9.324 7.760 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -4.931 12.311 7.615 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.476 11.350 6.254 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.322 11.919 7.593 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -8.278 9.709 8.195 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.460 9.697 6.614 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.659 8.988 8.036 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.591 11.209 9.964 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.909 10.626 9.957 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -6.251 12.359 9.740 1.00 0.00 H new ATOM 1693 N CYS A 108 -3.192 9.064 5.803 1.00 0.00 N ATOM 1694 CA CYS A 108 -2.492 8.786 4.561 1.00 0.00 C ATOM 1695 C CYS A 108 -3.488 8.676 3.396 1.00 0.00 C ATOM 1696 O CYS A 108 -4.593 8.148 3.552 1.00 0.00 O ATOM 1697 CB CYS A 108 -1.713 7.484 4.773 1.00 0.00 C ATOM 1698 SG CYS A 108 -0.568 7.206 3.393 1.00 0.00 S ATOM 0 H CYS A 108 -3.657 8.239 6.182 1.00 0.00 H new ATOM 0 HA CYS A 108 -1.806 9.592 4.301 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -1.159 7.532 5.711 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -2.406 6.646 4.854 1.00 0.00 H new ATOM 0 HG CYS A 108 -0.341 8.332 2.784 1.00 0.00 H new ATOM 1704 N LEU A 109 -3.076 9.133 2.216 1.00 0.00 N ATOM 1705 CA LEU A 109 -3.699 8.802 0.941 1.00 0.00 C ATOM 1706 C LEU A 109 -2.870 7.675 0.299 1.00 0.00 C ATOM 1707 O LEU A 109 -1.707 7.886 -0.046 1.00 0.00 O ATOM 1708 CB LEU A 109 -3.755 10.078 0.068 1.00 0.00 C ATOM 1709 CG LEU A 109 -4.911 10.079 -0.952 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -6.275 10.250 -0.270 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -4.714 11.219 -1.961 1.00 0.00 C ATOM 0 H LEU A 109 -2.278 9.761 2.120 1.00 0.00 H new ATOM 0 HA LEU A 109 -4.724 8.450 1.058 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.854 10.948 0.717 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.811 10.184 -0.466 1.00 0.00 H new ATOM 0 HG LEU A 109 -4.899 9.114 -1.459 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -7.062 10.245 -1.024 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -6.438 9.430 0.429 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -6.296 11.197 0.270 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -5.534 11.215 -2.679 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -4.698 12.173 -1.434 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.770 11.080 -2.487 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.458 6.482 0.182 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.895 5.335 -0.554 1.00 0.00 C ATOM 1725 C VAL A 110 -3.440 5.383 -1.984 1.00 0.00 C ATOM 1726 O VAL A 110 -4.647 5.232 -2.167 1.00 0.00 O ATOM 1727 CB VAL A 110 -3.256 3.970 0.084 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -2.589 2.818 -0.658 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -2.902 3.904 1.578 1.00 0.00 C ATOM 0 H VAL A 110 -4.363 6.276 0.606 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.808 5.415 -0.528 1.00 0.00 H new ATOM 0 HB VAL A 110 -4.338 3.871 -0.004 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.862 1.874 -0.186 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.921 2.814 -1.696 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.507 2.941 -0.623 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -3.176 2.926 1.974 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.831 4.060 1.705 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -3.448 4.679 2.116 1.00 0.00 H new ATOM 1739 N ASP A 111 -2.585 5.578 -2.990 1.00 0.00 N ATOM 1740 CA ASP A 111 -2.957 5.633 -4.397 1.00 0.00 C ATOM 1741 C ASP A 111 -2.350 4.416 -5.087 1.00 0.00 C ATOM 1742 O ASP A 111 -1.135 4.347 -5.248 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.435 6.932 -5.037 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.807 8.222 -4.284 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -3.795 8.222 -3.515 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -2.117 9.244 -4.511 1.00 0.00 O ATOM 0 H ASP A 111 -1.584 5.705 -2.838 1.00 0.00 H new ATOM 0 HA ASP A 111 -4.042 5.624 -4.504 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -1.349 6.872 -5.111 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.820 6.999 -6.054 1.00 0.00 H new ATOM 1751 N VAL A 112 -3.161 3.444 -5.497 1.00 0.00 N ATOM 1752 CA VAL A 112 -2.650 2.335 -6.312 1.00 0.00 C ATOM 1753 C VAL A 112 -2.597 2.797 -7.762 1.00 0.00 C ATOM 1754 O VAL A 112 -3.597 3.270 -8.303 1.00 0.00 O ATOM 1755 CB VAL A 112 -3.513 1.077 -6.202 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -3.065 -0.044 -7.154 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -3.513 0.499 -4.787 1.00 0.00 C ATOM 0 H VAL A 112 -4.158 3.397 -5.285 1.00 0.00 H new ATOM 0 HA VAL A 112 -1.659 2.068 -5.945 1.00 0.00 H new ATOM 0 HB VAL A 112 -4.514 1.410 -6.476 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -3.716 -0.909 -7.029 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -3.123 0.308 -8.184 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -2.038 -0.327 -6.925 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -4.139 -0.393 -4.758 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -2.494 0.237 -4.501 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -3.906 1.240 -4.091 1.00 0.00 H new ATOM 1767 N VAL A 113 -1.440 2.605 -8.388 1.00 0.00 N ATOM 1768 CA VAL A 113 -1.240 2.805 -9.826 1.00 0.00 C ATOM 1769 C VAL A 113 -1.005 1.423 -10.453 1.00 0.00 C ATOM 1770 O VAL A 113 0.009 0.793 -10.137 1.00 0.00 O ATOM 1771 CB VAL A 113 -0.081 3.794 -10.086 1.00 0.00 C ATOM 1772 CG1 VAL A 113 0.336 3.835 -11.566 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -0.487 5.211 -9.646 1.00 0.00 C ATOM 0 H VAL A 113 -0.596 2.300 -7.903 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.116 3.258 -10.289 1.00 0.00 H new ATOM 0 HB VAL A 113 0.770 3.441 -9.504 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.153 4.545 -11.694 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.664 2.844 -11.879 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.513 4.145 -12.175 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.336 5.900 -9.833 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.363 5.530 -10.211 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.723 5.208 -8.582 1.00 0.00 H new ATOM 1783 N PRO A 114 -1.931 0.912 -11.289 1.00 0.00 N ATOM 1784 CA PRO A 114 -1.784 -0.377 -11.952 1.00 0.00 C ATOM 1785 C PRO A 114 -0.764 -0.265 -13.087 1.00 0.00 C ATOM 1786 O PRO A 114 -0.859 0.620 -13.935 1.00 0.00 O ATOM 1787 CB PRO A 114 -3.180 -0.743 -12.466 1.00 0.00 C ATOM 1788 CG PRO A 114 -3.845 0.611 -12.691 1.00 0.00 C ATOM 1789 CD PRO A 114 -3.225 1.500 -11.617 1.00 0.00 C ATOM 0 HA PRO A 114 -1.412 -1.152 -11.282 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -3.129 -1.323 -13.388 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -3.729 -1.344 -11.741 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -3.646 0.994 -13.692 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -4.928 0.548 -12.583 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -3.106 2.521 -11.980 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -3.864 1.547 -10.736 1.00 0.00 H new ATOM 1797 N VAL A 115 0.207 -1.180 -13.098 1.00 0.00 N ATOM 1798 CA VAL A 115 1.227 -1.283 -14.156 1.00 0.00 C ATOM 1799 C VAL A 115 0.857 -2.434 -15.089 1.00 0.00 C ATOM 1800 O VAL A 115 0.804 -3.590 -14.666 1.00 0.00 O ATOM 1801 CB VAL A 115 2.642 -1.493 -13.569 1.00 0.00 C ATOM 1802 CG1 VAL A 115 3.715 -1.624 -14.664 1.00 0.00 C ATOM 1803 CG2 VAL A 115 3.029 -0.341 -12.630 1.00 0.00 C ATOM 0 H VAL A 115 0.313 -1.882 -12.365 1.00 0.00 H new ATOM 0 HA VAL A 115 1.249 -0.346 -14.713 1.00 0.00 H new ATOM 0 HB VAL A 115 2.602 -2.427 -13.009 1.00 0.00 H new ATOM 0 HG11 VAL A 115 4.691 -1.770 -14.201 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.483 -2.478 -15.300 1.00 0.00 H new ATOM 0 HG13 VAL A 115 3.732 -0.717 -15.268 1.00 0.00 H new ATOM 0 HG21 VAL A 115 4.029 -0.516 -12.232 1.00 0.00 H new ATOM 0 HG22 VAL A 115 3.018 0.598 -13.183 1.00 0.00 H new ATOM 0 HG23 VAL A 115 2.316 -0.287 -11.808 1.00 0.00 H new ATOM 1813 N LYS A 116 0.626 -2.121 -16.367 1.00 0.00 N ATOM 1814 CA LYS A 116 0.417 -3.119 -17.422 1.00 0.00 C ATOM 1815 C LYS A 116 1.739 -3.578 -18.066 1.00 0.00 C ATOM 1816 O LYS A 116 2.721 -2.834 -18.112 1.00 0.00 O ATOM 1817 CB LYS A 116 -0.557 -2.592 -18.488 1.00 0.00 C ATOM 1818 CG LYS A 116 -1.981 -2.482 -17.926 1.00 0.00 C ATOM 1819 CD LYS A 116 -2.991 -2.086 -19.011 1.00 0.00 C ATOM 1820 CE LYS A 116 -4.359 -2.686 -18.659 1.00 0.00 C ATOM 1821 NZ LYS A 116 -5.387 -2.361 -19.686 1.00 0.00 N ATOM 0 H LYS A 116 0.578 -1.159 -16.702 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.026 -3.995 -16.948 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.224 -1.615 -18.839 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -0.553 -3.258 -19.350 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -2.274 -3.436 -17.487 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -2.000 -1.743 -17.125 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -3.062 -1.001 -19.082 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -2.660 -2.448 -19.984 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -4.268 -3.768 -18.566 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -4.683 -2.309 -17.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -6.297 -2.784 -19.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -5.492 -1.329 -19.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -5.091 -2.743 -20.607 1.00 0.00 H new ATOM 1835 N ASN A 117 1.742 -4.809 -18.584 1.00 0.00 N ATOM 1836 CA ASN A 117 2.866 -5.390 -19.323 1.00 0.00 C ATOM 1837 C ASN A 117 2.745 -5.125 -20.836 1.00 0.00 C ATOM 1838 O ASN A 117 1.828 -4.445 -21.298 1.00 0.00 O ATOM 1839 CB ASN A 117 3.003 -6.888 -18.970 1.00 0.00 C ATOM 1840 CG ASN A 117 2.059 -7.811 -19.733 1.00 0.00 C ATOM 1841 OD1 ASN A 117 2.458 -8.456 -20.690 1.00 0.00 O ATOM 1842 ND2 ASN A 117 0.789 -7.869 -19.381 1.00 0.00 N ATOM 0 H ASN A 117 0.947 -5.442 -18.500 1.00 0.00 H new ATOM 0 HA ASN A 117 3.791 -4.900 -19.019 1.00 0.00 H new ATOM 0 HB2 ASN A 117 4.029 -7.200 -19.163 1.00 0.00 H new ATOM 0 HB3 ASN A 117 2.827 -7.013 -17.902 1.00 0.00 H new ATOM 0 HD21 ASN A 117 0.140 -8.453 -19.908 1.00 0.00 H new ATOM 0 HD22 ASN A 117 0.456 -7.330 -18.582 1.00 0.00 H new ATOM 1849 N GLU A 118 3.652 -5.725 -21.603 1.00 0.00 N ATOM 1850 CA GLU A 118 3.708 -5.636 -23.072 1.00 0.00 C ATOM 1851 C GLU A 118 2.446 -6.167 -23.793 1.00 0.00 C ATOM 1852 O GLU A 118 2.178 -5.772 -24.929 1.00 0.00 O ATOM 1853 CB GLU A 118 4.971 -6.351 -23.586 1.00 0.00 C ATOM 1854 CG GLU A 118 5.075 -7.819 -23.145 1.00 0.00 C ATOM 1855 CD GLU A 118 6.246 -8.520 -23.847 1.00 0.00 C ATOM 1856 OE1 GLU A 118 7.386 -8.476 -23.324 1.00 0.00 O ATOM 1857 OE2 GLU A 118 6.041 -9.127 -24.926 1.00 0.00 O ATOM 0 H GLU A 118 4.394 -6.306 -21.214 1.00 0.00 H new ATOM 0 HA GLU A 118 3.749 -4.574 -23.314 1.00 0.00 H new ATOM 0 HB2 GLU A 118 4.985 -6.307 -24.675 1.00 0.00 H new ATOM 0 HB3 GLU A 118 5.851 -5.812 -23.234 1.00 0.00 H new ATOM 0 HG2 GLU A 118 5.211 -7.870 -22.065 1.00 0.00 H new ATOM 0 HG3 GLU A 118 4.145 -8.339 -23.374 1.00 0.00 H new ATOM 1864 N ASP A 119 1.650 -7.028 -23.146 1.00 0.00 N ATOM 1865 CA ASP A 119 0.404 -7.600 -23.685 1.00 0.00 C ATOM 1866 C ASP A 119 -0.846 -6.756 -23.344 1.00 0.00 C ATOM 1867 O ASP A 119 -1.949 -7.057 -23.807 1.00 0.00 O ATOM 1868 CB ASP A 119 0.268 -9.039 -23.154 1.00 0.00 C ATOM 1869 CG ASP A 119 -0.843 -9.841 -23.853 1.00 0.00 C ATOM 1870 OD1 ASP A 119 -0.762 -10.035 -25.091 1.00 0.00 O ATOM 1871 OD2 ASP A 119 -1.773 -10.314 -23.156 1.00 0.00 O ATOM 0 H ASP A 119 1.860 -7.357 -22.204 1.00 0.00 H new ATOM 0 HA ASP A 119 0.463 -7.600 -24.773 1.00 0.00 H new ATOM 0 HB2 ASP A 119 1.218 -9.558 -23.283 1.00 0.00 H new ATOM 0 HB3 ASP A 119 0.065 -9.007 -22.084 1.00 0.00 H new ATOM 1876 N GLY A 120 -0.687 -5.702 -22.530 1.00 0.00 N ATOM 1877 CA GLY A 120 -1.775 -4.810 -22.104 1.00 0.00 C ATOM 1878 C GLY A 120 -2.629 -5.353 -20.952 1.00 0.00 C ATOM 1879 O GLY A 120 -3.759 -4.901 -20.779 1.00 0.00 O ATOM 0 H GLY A 120 0.219 -5.441 -22.142 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -1.347 -3.854 -21.803 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.423 -4.614 -22.959 1.00 0.00 H new ATOM 1883 N ALA A 121 -2.100 -6.289 -20.154 1.00 0.00 N ATOM 1884 CA ALA A 121 -2.714 -6.793 -18.917 1.00 0.00 C ATOM 1885 C ALA A 121 -1.942 -6.268 -17.699 1.00 0.00 C ATOM 1886 O ALA A 121 -0.731 -6.073 -17.789 1.00 0.00 O ATOM 1887 CB ALA A 121 -2.734 -8.331 -18.950 1.00 0.00 C ATOM 0 H ALA A 121 -1.204 -6.731 -20.357 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.741 -6.437 -18.839 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -3.189 -8.709 -18.034 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -3.314 -8.669 -19.809 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -1.714 -8.707 -19.030 1.00 0.00 H new ATOM 1893 N VAL A 122 -2.609 -6.048 -16.566 1.00 0.00 N ATOM 1894 CA VAL A 122 -1.975 -5.550 -15.324 1.00 0.00 C ATOM 1895 C VAL A 122 -1.275 -6.692 -14.577 1.00 0.00 C ATOM 1896 O VAL A 122 -1.875 -7.730 -14.304 1.00 0.00 O ATOM 1897 CB VAL A 122 -2.945 -4.726 -14.439 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -4.265 -5.449 -14.162 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -2.318 -4.272 -13.110 1.00 0.00 C ATOM 0 H VAL A 122 -3.612 -6.208 -16.473 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.200 -4.838 -15.608 1.00 0.00 H new ATOM 0 HB VAL A 122 -3.159 -3.838 -15.033 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -4.900 -4.820 -13.538 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -4.772 -5.654 -15.105 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -4.064 -6.388 -13.646 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -3.050 -3.700 -12.539 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -2.011 -5.146 -12.535 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.448 -3.647 -13.313 1.00 0.00 H new ATOM 1909 N ILE A 123 0.014 -6.493 -14.273 1.00 0.00 N ATOM 1910 CA ILE A 123 0.893 -7.524 -13.668 1.00 0.00 C ATOM 1911 C ILE A 123 1.605 -7.065 -12.388 1.00 0.00 C ATOM 1912 O ILE A 123 1.945 -7.894 -11.548 1.00 0.00 O ATOM 1913 CB ILE A 123 1.892 -8.096 -14.704 1.00 0.00 C ATOM 1914 CG1 ILE A 123 3.136 -7.225 -15.002 1.00 0.00 C ATOM 1915 CG2 ILE A 123 1.186 -8.513 -16.005 1.00 0.00 C ATOM 1916 CD1 ILE A 123 2.925 -5.775 -15.452 1.00 0.00 C ATOM 0 H ILE A 123 0.489 -5.606 -14.439 1.00 0.00 H new ATOM 0 HA ILE A 123 0.228 -8.329 -13.355 1.00 0.00 H new ATOM 0 HB ILE A 123 2.294 -8.980 -14.209 1.00 0.00 H new ATOM 0 HG12 ILE A 123 3.750 -7.206 -14.102 1.00 0.00 H new ATOM 0 HG13 ILE A 123 3.717 -7.730 -15.774 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.920 -8.909 -16.707 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.443 -9.280 -15.786 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.694 -7.646 -16.446 1.00 0.00 H new ATOM 0 HD11 ILE A 123 3.892 -5.302 -15.620 1.00 0.00 H new ATOM 0 HD12 ILE A 123 2.349 -5.761 -16.377 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.383 -5.229 -14.679 1.00 0.00 H new ATOM 1928 N MET A 124 1.777 -5.757 -12.197 1.00 0.00 N ATOM 1929 CA MET A 124 2.231 -5.138 -10.938 1.00 0.00 C ATOM 1930 C MET A 124 1.324 -3.978 -10.507 1.00 0.00 C ATOM 1931 O MET A 124 0.757 -3.266 -11.336 1.00 0.00 O ATOM 1932 CB MET A 124 3.680 -4.646 -11.091 1.00 0.00 C ATOM 1933 CG MET A 124 4.688 -5.799 -11.174 1.00 0.00 C ATOM 1934 SD MET A 124 6.347 -5.287 -11.686 1.00 0.00 S ATOM 1935 CE MET A 124 6.050 -5.032 -13.455 1.00 0.00 C ATOM 0 H MET A 124 1.601 -5.073 -12.933 1.00 0.00 H new ATOM 0 HA MET A 124 2.181 -5.898 -10.159 1.00 0.00 H new ATOM 0 HB2 MET A 124 3.759 -4.034 -11.989 1.00 0.00 H new ATOM 0 HB3 MET A 124 3.934 -4.006 -10.246 1.00 0.00 H new ATOM 0 HG2 MET A 124 4.752 -6.283 -10.200 1.00 0.00 H new ATOM 0 HG3 MET A 124 4.315 -6.545 -11.876 1.00 0.00 H new ATOM 0 HE1 MET A 124 6.985 -4.762 -13.946 1.00 0.00 H new ATOM 0 HE2 MET A 124 5.661 -5.950 -13.895 1.00 0.00 H new ATOM 0 HE3 MET A 124 5.325 -4.230 -13.590 1.00 0.00 H new ATOM 1945 N PHE A 125 1.244 -3.753 -9.197 1.00 0.00 N ATOM 1946 CA PHE A 125 0.670 -2.561 -8.576 1.00 0.00 C ATOM 1947 C PHE A 125 1.786 -1.743 -7.935 1.00 0.00 C ATOM 1948 O PHE A 125 2.626 -2.282 -7.219 1.00 0.00 O ATOM 1949 CB PHE A 125 -0.357 -2.988 -7.516 1.00 0.00 C ATOM 1950 CG PHE A 125 -1.588 -3.654 -8.098 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -2.428 -2.932 -8.967 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -1.889 -4.992 -7.783 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -3.549 -3.554 -9.542 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -3.017 -5.608 -8.352 1.00 0.00 C ATOM 1955 CZ PHE A 125 -3.833 -4.896 -9.248 1.00 0.00 C ATOM 0 H PHE A 125 1.591 -4.424 -8.511 1.00 0.00 H new ATOM 0 HA PHE A 125 0.170 -1.950 -9.327 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.120 -3.673 -6.815 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -0.664 -2.111 -6.945 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.210 -1.898 -9.192 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -1.255 -5.544 -7.106 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.192 -2.999 -10.210 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -3.257 -6.630 -8.100 1.00 0.00 H new ATOM 0 HZ PHE A 125 -4.679 -5.382 -9.710 1.00 0.00 H new ATOM 1965 N ILE A 126 1.772 -0.430 -8.154 1.00 0.00 N ATOM 1966 CA ILE A 126 2.542 0.520 -7.345 1.00 0.00 C ATOM 1967 C ILE A 126 1.570 1.092 -6.317 1.00 0.00 C ATOM 1968 O ILE A 126 0.600 1.732 -6.723 1.00 0.00 O ATOM 1969 CB ILE A 126 3.176 1.622 -8.227 1.00 0.00 C ATOM 1970 CG1 ILE A 126 4.086 1.017 -9.321 1.00 0.00 C ATOM 1971 CG2 ILE A 126 3.973 2.600 -7.344 1.00 0.00 C ATOM 1972 CD1 ILE A 126 4.532 2.029 -10.384 1.00 0.00 C ATOM 0 H ILE A 126 1.227 0.008 -8.897 1.00 0.00 H new ATOM 0 HA ILE A 126 3.379 0.031 -6.846 1.00 0.00 H new ATOM 0 HB ILE A 126 2.373 2.162 -8.729 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.969 0.587 -8.849 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.556 0.200 -9.810 1.00 0.00 H new ATOM 0 HG21 ILE A 126 4.418 3.374 -7.969 1.00 0.00 H new ATOM 0 HG22 ILE A 126 3.305 3.060 -6.616 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.761 2.058 -6.821 1.00 0.00 H new ATOM 0 HD11 ILE A 126 5.167 1.531 -11.117 1.00 0.00 H new ATOM 0 HD12 ILE A 126 3.656 2.442 -10.884 1.00 0.00 H new ATOM 0 HD13 ILE A 126 5.091 2.835 -9.908 1.00 0.00 H new ATOM 1984 N LEU A 127 1.801 0.866 -5.022 1.00 0.00 N ATOM 1985 CA LEU A 127 1.075 1.549 -3.948 1.00 0.00 C ATOM 1986 C LEU A 127 1.872 2.807 -3.649 1.00 0.00 C ATOM 1987 O LEU A 127 3.033 2.700 -3.259 1.00 0.00 O ATOM 1988 CB LEU A 127 0.990 0.681 -2.671 1.00 0.00 C ATOM 1989 CG LEU A 127 -0.095 -0.408 -2.613 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -1.433 0.190 -2.190 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -0.178 -1.265 -3.885 1.00 0.00 C ATOM 0 H LEU A 127 2.499 0.202 -4.687 1.00 0.00 H new ATOM 0 HA LEU A 127 0.051 1.760 -4.255 1.00 0.00 H new ATOM 0 HB2 LEU A 127 1.957 0.198 -2.530 1.00 0.00 H new ATOM 0 HB3 LEU A 127 0.840 1.348 -1.822 1.00 0.00 H new ATOM 0 HG LEU A 127 0.201 -1.119 -1.841 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.188 -0.596 -2.155 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -1.334 0.642 -1.203 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -1.735 0.951 -2.909 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -0.965 -2.011 -3.771 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.404 -0.627 -4.739 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.776 -1.766 -4.049 1.00 0.00 H new ATOM 2003 N ASN A 128 1.274 3.980 -3.833 1.00 0.00 N ATOM 2004 CA ASN A 128 1.916 5.245 -3.438 1.00 0.00 C ATOM 2005 C ASN A 128 1.297 5.788 -2.145 1.00 0.00 C ATOM 2006 O ASN A 128 0.087 5.681 -1.969 1.00 0.00 O ATOM 2007 CB ASN A 128 1.860 6.319 -4.531 1.00 0.00 C ATOM 2008 CG ASN A 128 2.149 5.830 -5.946 1.00 0.00 C ATOM 2009 OD1 ASN A 128 3.231 6.017 -6.488 1.00 0.00 O ATOM 2010 ND2 ASN A 128 1.178 5.217 -6.594 1.00 0.00 N ATOM 0 H ASN A 128 0.350 4.089 -4.251 1.00 0.00 H new ATOM 0 HA ASN A 128 2.968 5.010 -3.273 1.00 0.00 H new ATOM 0 HB2 ASN A 128 0.870 6.775 -4.518 1.00 0.00 H new ATOM 0 HB3 ASN A 128 2.575 7.103 -4.283 1.00 0.00 H new ATOM 0 HD21 ASN A 128 1.326 4.896 -7.551 1.00 0.00 H new ATOM 0 HD22 ASN A 128 0.278 5.063 -6.138 1.00 0.00 H new ATOM 2017 N PHE A 129 2.103 6.396 -1.270 1.00 0.00 N ATOM 2018 CA PHE A 129 1.669 6.953 0.010 1.00 0.00 C ATOM 2019 C PHE A 129 1.950 8.462 0.061 1.00 0.00 C ATOM 2020 O PHE A 129 3.043 8.909 -0.288 1.00 0.00 O ATOM 2021 CB PHE A 129 2.388 6.207 1.149 1.00 0.00 C ATOM 2022 CG PHE A 129 2.338 4.693 1.059 1.00 0.00 C ATOM 2023 CD1 PHE A 129 1.098 4.030 1.081 1.00 0.00 C ATOM 2024 CD2 PHE A 129 3.527 3.946 0.945 1.00 0.00 C ATOM 2025 CE1 PHE A 129 1.043 2.627 0.997 1.00 0.00 C ATOM 2026 CE2 PHE A 129 3.471 2.544 0.861 1.00 0.00 C ATOM 2027 CZ PHE A 129 2.230 1.884 0.889 1.00 0.00 C ATOM 0 H PHE A 129 3.102 6.517 -1.439 1.00 0.00 H new ATOM 0 HA PHE A 129 0.593 6.820 0.127 1.00 0.00 H new ATOM 0 HB2 PHE A 129 3.432 6.520 1.165 1.00 0.00 H new ATOM 0 HB3 PHE A 129 1.948 6.514 2.098 1.00 0.00 H new ATOM 0 HD1 PHE A 129 0.184 4.600 1.163 1.00 0.00 H new ATOM 0 HD2 PHE A 129 4.482 4.451 0.922 1.00 0.00 H new ATOM 0 HE1 PHE A 129 0.089 2.121 1.016 1.00 0.00 H new ATOM 0 HE2 PHE A 129 4.383 1.973 0.775 1.00 0.00 H new ATOM 0 HZ PHE A 129 2.189 0.807 0.828 1.00 0.00 H new ATOM 2037 N GLU A 130 0.982 9.243 0.538 1.00 0.00 N ATOM 2038 CA GLU A 130 1.096 10.678 0.793 1.00 0.00 C ATOM 2039 C GLU A 130 0.398 10.987 2.119 1.00 0.00 C ATOM 2040 O GLU A 130 -0.544 10.297 2.491 1.00 0.00 O ATOM 2041 CB GLU A 130 0.453 11.480 -0.355 1.00 0.00 C ATOM 2042 CG GLU A 130 1.403 11.616 -1.553 1.00 0.00 C ATOM 2043 CD GLU A 130 0.889 12.648 -2.568 1.00 0.00 C ATOM 2044 OE1 GLU A 130 0.944 13.867 -2.278 1.00 0.00 O ATOM 2045 OE2 GLU A 130 0.452 12.257 -3.676 1.00 0.00 O ATOM 0 H GLU A 130 0.058 8.877 0.767 1.00 0.00 H new ATOM 0 HA GLU A 130 2.146 10.964 0.851 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -0.466 10.987 -0.673 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.176 12.471 0.004 1.00 0.00 H new ATOM 0 HG2 GLU A 130 2.392 11.911 -1.202 1.00 0.00 H new ATOM 0 HG3 GLU A 130 1.514 10.648 -2.042 1.00 0.00 H new ATOM 2052 N VAL A 131 0.847 12.012 2.839 1.00 0.00 N ATOM 2053 CA VAL A 131 0.238 12.435 4.114 1.00 0.00 C ATOM 2054 C VAL A 131 -0.772 13.543 3.817 1.00 0.00 C ATOM 2055 O VAL A 131 -0.385 14.632 3.395 1.00 0.00 O ATOM 2056 CB VAL A 131 1.300 12.897 5.140 1.00 0.00 C ATOM 2057 CG1 VAL A 131 0.637 13.316 6.466 1.00 0.00 C ATOM 2058 CG2 VAL A 131 2.298 11.763 5.404 1.00 0.00 C ATOM 0 H VAL A 131 1.647 12.580 2.560 1.00 0.00 H new ATOM 0 HA VAL A 131 -0.268 11.585 4.571 1.00 0.00 H new ATOM 0 HB VAL A 131 1.824 13.758 4.724 1.00 0.00 H new ATOM 0 HG11 VAL A 131 1.404 13.637 7.171 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -0.054 14.139 6.283 1.00 0.00 H new ATOM 0 HG13 VAL A 131 0.092 12.470 6.883 1.00 0.00 H new ATOM 0 HG21 VAL A 131 3.043 12.095 6.127 1.00 0.00 H new ATOM 0 HG22 VAL A 131 1.768 10.897 5.800 1.00 0.00 H new ATOM 0 HG23 VAL A 131 2.793 11.490 4.472 1.00 0.00 H new ATOM 2068 N VAL A 132 -2.062 13.253 4.022 1.00 0.00 N ATOM 2069 CA VAL A 132 -3.151 14.210 3.724 1.00 0.00 C ATOM 2070 C VAL A 132 -3.532 15.083 4.931 1.00 0.00 C ATOM 2071 O VAL A 132 -4.016 16.198 4.746 1.00 0.00 O ATOM 2072 CB VAL A 132 -4.383 13.508 3.102 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -5.265 12.797 4.118 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -5.220 14.465 2.240 1.00 0.00 C ATOM 0 H VAL A 132 -2.385 12.360 4.395 1.00 0.00 H new ATOM 0 HA VAL A 132 -2.756 14.894 2.973 1.00 0.00 H new ATOM 0 HB VAL A 132 -3.966 12.735 2.457 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -6.106 12.330 3.606 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -4.683 12.032 4.632 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -5.638 13.519 4.845 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -6.073 13.929 1.825 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -5.576 15.292 2.855 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -4.606 14.855 1.428 1.00 0.00 H new ATOM 2084 N MET A 133 -3.295 14.597 6.160 1.00 0.00 N ATOM 2085 CA MET A 133 -3.679 15.268 7.412 1.00 0.00 C ATOM 2086 C MET A 133 -2.955 14.639 8.613 1.00 0.00 C ATOM 2087 O MET A 133 -3.063 13.439 8.849 1.00 0.00 O ATOM 2088 CB MET A 133 -5.221 15.251 7.542 1.00 0.00 C ATOM 2089 CG MET A 133 -5.738 15.513 8.960 1.00 0.00 C ATOM 2090 SD MET A 133 -7.542 15.467 9.147 1.00 0.00 S ATOM 2091 CE MET A 133 -7.996 16.971 8.246 1.00 0.00 C ATOM 0 H MET A 133 -2.821 13.707 6.314 1.00 0.00 H new ATOM 0 HA MET A 133 -3.364 16.311 7.395 1.00 0.00 H new ATOM 0 HB2 MET A 133 -5.639 16.002 6.871 1.00 0.00 H new ATOM 0 HB3 MET A 133 -5.591 14.282 7.206 1.00 0.00 H new ATOM 0 HG2 MET A 133 -5.301 14.774 9.631 1.00 0.00 H new ATOM 0 HG3 MET A 133 -5.380 16.490 9.285 1.00 0.00 H new ATOM 0 HE1 MET A 133 -9.059 17.171 8.384 1.00 0.00 H new ATOM 0 HE2 MET A 133 -7.416 17.812 8.627 1.00 0.00 H new ATOM 0 HE3 MET A 133 -7.786 16.837 7.185 1.00 0.00 H new ATOM 2101 N GLU A 134 -2.243 15.444 9.401 1.00 0.00 N ATOM 2102 CA GLU A 134 -1.588 14.992 10.634 1.00 0.00 C ATOM 2103 C GLU A 134 -2.582 15.012 11.811 1.00 0.00 C ATOM 2104 O GLU A 134 -3.234 16.036 12.051 1.00 0.00 O ATOM 2105 CB GLU A 134 -0.355 15.868 10.905 1.00 0.00 C ATOM 2106 CG GLU A 134 0.492 15.350 12.073 1.00 0.00 C ATOM 2107 CD GLU A 134 1.743 16.220 12.261 1.00 0.00 C ATOM 2108 OE1 GLU A 134 1.674 17.245 12.982 1.00 0.00 O ATOM 2109 OE2 GLU A 134 2.810 15.888 11.691 1.00 0.00 O ATOM 0 H GLU A 134 -2.102 16.435 9.203 1.00 0.00 H new ATOM 0 HA GLU A 134 -1.254 13.961 10.518 1.00 0.00 H new ATOM 0 HB2 GLU A 134 0.260 15.911 10.006 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -0.678 16.887 11.119 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -0.100 15.353 12.988 1.00 0.00 H new ATOM 0 HG3 GLU A 134 0.786 14.317 11.886 1.00 0.00 H new ATOM 2116 N LYS A 135 -2.702 13.892 12.542 1.00 0.00 N ATOM 2117 CA LYS A 135 -3.529 13.785 13.762 1.00 0.00 C ATOM 2118 C LYS A 135 -2.761 14.146 15.046 1.00 0.00 C ATOM 2119 O LYS A 135 -3.376 14.784 15.931 1.00 0.00 O ATOM 2120 CB LYS A 135 -4.157 12.381 13.866 1.00 0.00 C ATOM 2121 CG LYS A 135 -5.190 12.035 12.776 1.00 0.00 C ATOM 2122 CD LYS A 135 -6.617 12.567 13.019 1.00 0.00 C ATOM 2123 CE LYS A 135 -6.762 14.088 12.852 1.00 0.00 C ATOM 2124 NZ LYS A 135 -8.188 14.521 12.898 1.00 0.00 N ATOM 2125 OXT LYS A 135 -1.561 13.807 15.177 1.00 0.00 O ATOM 0 H LYS A 135 -2.223 13.024 12.302 1.00 0.00 H new ATOM 0 HA LYS A 135 -4.325 14.523 13.669 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -3.358 11.641 13.833 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.637 12.288 14.840 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -4.832 12.427 11.824 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -5.238 10.951 12.677 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -7.300 12.071 12.329 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -6.928 12.293 14.027 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -6.204 14.594 13.640 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -6.321 14.392 11.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -8.241 15.553 12.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -8.716 14.058 12.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -8.603 14.254 13.814 1.00 0.00 H new