USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 818 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 29 ASN : amide:sc= -2.91 K(o=-5.1,f=-5.8!) USER MOD Set 1.2: A 73 ASN : amide:sc= -2.23! C(o=-5.1!,f=-13!) USER MOD Single : A 14 THR OG1 : rot -35:sc= 0.259 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 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 LYS NZ :NH3+ -153:sc= -0.435 (180deg=-1.34) USER MOD Single : A 35 HIS : no HD1:sc= -0.966 X(o=-0.97,f=-0.67) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ -153:sc=-0.00376 (180deg=-0.552) USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.166 USER MOD Single : A 66 ASN : amide:sc= -3.16! C(o=-3.2!,f=-10!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot -68:sc= 1.24 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 152:sc= 1.01 USER MOD Single : A 89 THR OG1 : rot -28:sc= 0.325 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0.0559 K(o=0.056,f=-1.4) USER MOD Single : A 99 ASN : amide:sc= 0.313 K(o=0.31,f=-3.5!) USER MOD Single : A 102 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0142) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 ASN : amide:sc= -0.557 K(o=-0.56,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 182 N THR A 14 -0.838 6.307 5.480 1.00 0.00 N ATOM 183 CA THR A 14 -1.785 5.460 4.767 1.00 0.00 C ATOM 184 C THR A 14 -2.239 4.291 5.634 1.00 0.00 C ATOM 185 O THR A 14 -1.442 3.699 6.361 1.00 0.00 O ATOM 186 CB THR A 14 -1.175 4.910 3.463 1.00 0.00 C ATOM 187 OG1 THR A 14 0.152 4.431 3.707 1.00 0.00 O ATOM 188 CG2 THR A 14 -1.142 5.984 2.386 1.00 0.00 C ATOM 0 HA THR A 14 -2.645 6.084 4.523 1.00 0.00 H new ATOM 0 HB THR A 14 -1.799 4.087 3.114 1.00 0.00 H new ATOM 0 HG1 THR A 14 0.586 4.998 4.379 1.00 0.00 H new ATOM 0 HG21 THR A 14 -0.707 5.573 1.475 1.00 0.00 H new ATOM 0 HG22 THR A 14 -2.157 6.326 2.182 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.538 6.824 2.729 1.00 0.00 H new ATOM 196 N ALA A 15 -3.524 3.964 5.551 1.00 0.00 N ATOM 197 CA ALA A 15 -4.084 2.864 6.327 1.00 0.00 C ATOM 198 C ALA A 15 -3.349 1.559 6.039 1.00 0.00 C ATOM 199 O ALA A 15 -2.859 1.325 4.933 1.00 0.00 O ATOM 200 CB ALA A 15 -5.569 2.711 6.031 1.00 0.00 C ATOM 0 H ALA A 15 -4.197 4.445 4.954 1.00 0.00 H new ATOM 0 HA ALA A 15 -3.957 3.097 7.384 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.974 1.886 6.617 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -6.089 3.632 6.293 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.709 2.505 4.970 1.00 0.00 H new ATOM 206 N PRO A 16 -3.267 0.688 7.055 1.00 0.00 N ATOM 207 CA PRO A 16 -2.592 -0.608 6.935 1.00 0.00 C ATOM 208 C PRO A 16 -3.354 -1.577 6.037 1.00 0.00 C ATOM 209 O PRO A 16 -4.562 -1.762 6.190 1.00 0.00 O ATOM 210 CB PRO A 16 -2.560 -1.126 8.375 1.00 0.00 C ATOM 211 CG PRO A 16 -3.707 -0.452 9.046 1.00 0.00 C ATOM 212 CD PRO A 16 -3.827 0.901 8.400 1.00 0.00 C ATOM 0 HA PRO A 16 -1.606 -0.514 6.480 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -2.664 -2.211 8.408 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -1.617 -0.881 8.863 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -4.625 -1.027 8.921 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -3.532 -0.359 10.118 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -4.864 1.234 8.355 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -3.272 1.660 8.951 1.00 0.00 H new ATOM 220 N VAL A 17 -2.641 -2.194 5.100 1.00 0.00 N ATOM 221 CA VAL A 17 -3.250 -3.145 4.179 1.00 0.00 C ATOM 222 C VAL A 17 -3.368 -4.526 4.814 1.00 0.00 C ATOM 223 O VAL A 17 -2.463 -4.979 5.514 1.00 0.00 O ATOM 224 CB VAL A 17 -2.440 -3.260 2.874 1.00 0.00 C ATOM 225 CG1 VAL A 17 -3.052 -4.307 1.955 1.00 0.00 C ATOM 226 CG2 VAL A 17 -2.357 -1.910 2.178 1.00 0.00 C ATOM 0 H VAL A 17 -1.641 -2.052 4.959 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.246 -2.768 3.948 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.427 -3.578 3.122 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.466 -4.374 1.038 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -3.053 -5.275 2.456 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.076 -4.023 1.711 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.781 -2.010 1.258 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.362 -1.560 1.941 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.868 -1.191 2.836 1.00 0.00 H new ATOM 236 N ALA A 18 -4.491 -5.192 4.563 1.00 0.00 N ATOM 237 CA ALA A 18 -4.727 -6.523 5.108 1.00 0.00 C ATOM 238 C ALA A 18 -5.177 -7.491 4.019 1.00 0.00 C ATOM 239 O ALA A 18 -6.366 -7.586 3.712 1.00 0.00 O ATOM 240 CB ALA A 18 -5.762 -6.461 6.222 1.00 0.00 C ATOM 0 H ALA A 18 -5.251 -4.831 3.986 1.00 0.00 H new ATOM 0 HA ALA A 18 -3.787 -6.892 5.519 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.929 -7.462 6.620 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -5.401 -5.809 7.018 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.698 -6.067 5.827 1.00 0.00 H new ATOM 246 N LEU A 19 -4.221 -8.206 3.437 1.00 0.00 N ATOM 247 CA LEU A 19 -4.519 -9.166 2.381 1.00 0.00 C ATOM 248 C LEU A 19 -4.491 -10.593 2.918 1.00 0.00 C ATOM 249 O LEU A 19 -3.983 -10.846 4.011 1.00 0.00 O ATOM 250 CB LEU A 19 -3.516 -9.021 1.235 1.00 0.00 C ATOM 251 CG LEU A 19 -3.555 -7.696 0.473 1.00 0.00 C ATOM 252 CD1 LEU A 19 -2.259 -7.483 -0.296 1.00 0.00 C ATOM 253 CD2 LEU A 19 -4.748 -7.658 -0.470 1.00 0.00 C ATOM 0 H LEU A 19 -3.232 -8.139 3.679 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.522 -8.958 2.007 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.512 -9.156 1.638 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.686 -9.831 0.525 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.662 -6.887 1.196 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.306 -6.535 -0.832 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.421 -7.465 0.401 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.121 -8.296 -1.009 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.760 -6.708 -1.004 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.672 -8.476 -1.187 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.669 -7.763 0.104 1.00 0.00 H new ATOM 265 N ARG A 20 -5.037 -11.523 2.142 1.00 0.00 N ATOM 266 CA ARG A 20 -5.074 -12.925 2.540 1.00 0.00 C ATOM 267 C ARG A 20 -4.032 -13.735 1.774 1.00 0.00 C ATOM 268 O ARG A 20 -3.779 -13.482 0.597 1.00 0.00 O ATOM 269 CB ARG A 20 -6.468 -13.509 2.299 1.00 0.00 C ATOM 270 CG ARG A 20 -6.839 -14.619 3.269 1.00 0.00 C ATOM 271 CD ARG A 20 -8.317 -14.964 3.182 1.00 0.00 C ATOM 272 NE ARG A 20 -8.791 -15.650 4.381 1.00 0.00 N ATOM 273 CZ ARG A 20 -10.027 -16.116 4.521 1.00 0.00 C ATOM 274 NH1 ARG A 20 -10.909 -15.969 3.542 1.00 0.00 N ATOM 275 NH2 ARG A 20 -10.383 -16.729 5.643 1.00 0.00 N ATOM 0 H ARG A 20 -5.460 -11.331 1.234 1.00 0.00 H new ATOM 0 HA ARG A 20 -4.843 -12.981 3.604 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.206 -12.710 2.375 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -6.520 -13.895 1.281 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -6.244 -15.506 3.053 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -6.595 -14.311 4.286 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -8.894 -14.051 3.035 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -8.491 -15.595 2.311 1.00 0.00 H new ATOM 0 HE ARG A 20 -8.137 -15.778 5.153 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -10.639 -15.497 2.679 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -11.857 -16.328 3.652 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -9.707 -16.843 6.399 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -11.332 -17.087 5.750 1.00 0.00 H new ATOM 289 N GLU A 21 -3.432 -14.709 2.451 1.00 0.00 N ATOM 290 CA GLU A 21 -2.417 -15.554 1.834 1.00 0.00 C ATOM 291 C GLU A 21 -3.031 -16.851 1.314 1.00 0.00 C ATOM 292 O GLU A 21 -3.547 -17.659 2.085 1.00 0.00 O ATOM 293 CB GLU A 21 -1.305 -15.870 2.837 1.00 0.00 C ATOM 294 CG GLU A 21 -1.782 -16.656 4.047 1.00 0.00 C ATOM 295 CD GLU A 21 -1.702 -18.156 3.836 1.00 0.00 C ATOM 296 OE1 GLU A 21 -0.645 -18.635 3.375 1.00 0.00 O ATOM 297 OE2 GLU A 21 -2.697 -18.850 4.133 1.00 0.00 O ATOM 0 H GLU A 21 -3.631 -14.932 3.426 1.00 0.00 H new ATOM 0 HA GLU A 21 -1.992 -15.009 0.991 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.522 -16.436 2.332 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -0.856 -14.936 3.175 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -1.181 -16.382 4.914 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.812 -16.379 4.273 1.00 0.00 H new ATOM 304 N GLY A 22 -2.972 -17.042 0.000 1.00 0.00 N ATOM 305 CA GLY A 22 -3.526 -18.241 -0.602 1.00 0.00 C ATOM 306 C GLY A 22 -4.263 -17.953 -1.895 1.00 0.00 C ATOM 307 O GLY A 22 -4.123 -18.688 -2.872 1.00 0.00 O ATOM 0 H GLY A 22 -2.550 -16.388 -0.659 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.722 -18.951 -0.796 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.208 -18.716 0.103 1.00 0.00 H new ATOM 311 N GLU A 23 -5.051 -16.883 -1.900 1.00 0.00 N ATOM 312 CA GLU A 23 -5.815 -16.503 -3.083 1.00 0.00 C ATOM 313 C GLU A 23 -5.051 -15.478 -3.917 1.00 0.00 C ATOM 314 O GLU A 23 -4.256 -14.701 -3.389 1.00 0.00 O ATOM 315 CB GLU A 23 -7.176 -15.934 -2.677 1.00 0.00 C ATOM 316 CG GLU A 23 -7.088 -14.596 -1.963 1.00 0.00 C ATOM 317 CD GLU A 23 -8.361 -14.250 -1.214 1.00 0.00 C ATOM 318 OE1 GLU A 23 -9.023 -15.179 -0.707 1.00 0.00 O ATOM 319 OE2 GLU A 23 -8.695 -13.049 -1.137 1.00 0.00 O ATOM 0 H GLU A 23 -5.177 -16.264 -1.099 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.969 -17.397 -3.688 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -7.793 -15.821 -3.568 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -7.681 -16.650 -2.028 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -6.253 -14.616 -1.263 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -6.875 -13.813 -2.691 1.00 0.00 H new ATOM 326 N ASP A 24 -5.299 -15.484 -5.222 1.00 0.00 N ATOM 327 CA ASP A 24 -4.636 -14.555 -6.130 1.00 0.00 C ATOM 328 C ASP A 24 -5.218 -13.152 -5.992 1.00 0.00 C ATOM 329 O ASP A 24 -6.434 -12.965 -6.044 1.00 0.00 O ATOM 330 CB ASP A 24 -4.772 -15.038 -7.575 1.00 0.00 C ATOM 331 CG ASP A 24 -3.794 -16.147 -7.910 1.00 0.00 C ATOM 332 OD1 ASP A 24 -2.595 -15.847 -8.084 1.00 0.00 O ATOM 333 OD2 ASP A 24 -4.229 -17.315 -7.998 1.00 0.00 O ATOM 0 H ASP A 24 -5.954 -16.121 -5.675 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.579 -14.517 -5.865 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -5.789 -15.392 -7.742 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.611 -14.199 -8.252 1.00 0.00 H new ATOM 338 N LEU A 25 -4.342 -12.169 -5.816 1.00 0.00 N ATOM 339 CA LEU A 25 -4.769 -10.781 -5.669 1.00 0.00 C ATOM 340 C LEU A 25 -4.552 -10.006 -6.964 1.00 0.00 C ATOM 341 O LEU A 25 -3.627 -9.201 -7.070 1.00 0.00 O ATOM 342 CB LEU A 25 -4.005 -10.111 -4.526 1.00 0.00 C ATOM 343 CG LEU A 25 -3.659 -11.005 -3.335 1.00 0.00 C ATOM 344 CD1 LEU A 25 -2.629 -10.330 -2.442 1.00 0.00 C ATOM 345 CD2 LEU A 25 -4.912 -11.347 -2.542 1.00 0.00 C ATOM 0 H LEU A 25 -3.332 -12.307 -5.772 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.834 -10.776 -5.438 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.079 -9.700 -4.927 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.597 -9.270 -4.164 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.229 -11.932 -3.715 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -2.395 -10.981 -1.600 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -1.722 -10.137 -3.014 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.031 -9.387 -2.071 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.646 -11.984 -1.698 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.371 -10.430 -2.174 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.618 -11.873 -3.185 1.00 0.00 H new ATOM 357 N SER A 26 -5.413 -10.252 -7.946 1.00 0.00 N ATOM 358 CA SER A 26 -5.316 -9.577 -9.236 1.00 0.00 C ATOM 359 C SER A 26 -6.221 -8.350 -9.277 1.00 0.00 C ATOM 360 O SER A 26 -5.770 -7.240 -9.561 1.00 0.00 O ATOM 361 CB SER A 26 -5.688 -10.538 -10.367 1.00 0.00 C ATOM 362 OG SER A 26 -5.245 -10.046 -11.620 1.00 0.00 O ATOM 0 H SER A 26 -6.186 -10.914 -7.874 1.00 0.00 H new ATOM 0 HA SER A 26 -4.285 -9.250 -9.371 1.00 0.00 H new ATOM 0 HB2 SER A 26 -5.244 -11.515 -10.179 1.00 0.00 H new ATOM 0 HB3 SER A 26 -6.769 -10.678 -10.389 1.00 0.00 H new ATOM 0 HG SER A 26 -5.493 -10.679 -12.326 1.00 0.00 H new ATOM 368 N LYS A 27 -7.501 -8.557 -8.990 1.00 0.00 N ATOM 369 CA LYS A 27 -8.472 -7.469 -8.992 1.00 0.00 C ATOM 370 C LYS A 27 -8.273 -6.560 -7.784 1.00 0.00 C ATOM 371 O LYS A 27 -8.619 -5.379 -7.818 1.00 0.00 O ATOM 372 CB LYS A 27 -9.897 -8.029 -8.993 1.00 0.00 C ATOM 373 CG LYS A 27 -10.925 -7.074 -9.573 1.00 0.00 C ATOM 374 CD LYS A 27 -12.144 -7.817 -10.095 1.00 0.00 C ATOM 375 CE LYS A 27 -11.965 -8.230 -11.548 1.00 0.00 C ATOM 376 NZ LYS A 27 -12.908 -9.315 -11.936 1.00 0.00 N ATOM 0 H LYS A 27 -7.891 -9.469 -8.753 1.00 0.00 H new ATOM 0 HA LYS A 27 -8.319 -6.881 -9.897 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -9.913 -8.957 -9.564 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -10.181 -8.278 -7.971 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -11.232 -6.361 -8.808 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.474 -6.500 -10.382 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.322 -8.702 -9.483 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.026 -7.183 -10.002 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -12.121 -7.365 -12.193 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -10.940 -8.566 -11.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.755 -9.568 -12.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -12.743 -10.149 -11.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.887 -8.986 -11.809 1.00 0.00 H new ATOM 390 N LYS A 28 -7.713 -7.118 -6.716 1.00 0.00 N ATOM 391 CA LYS A 28 -7.465 -6.357 -5.496 1.00 0.00 C ATOM 392 C LYS A 28 -6.662 -5.095 -5.796 1.00 0.00 C ATOM 393 O LYS A 28 -7.073 -3.989 -5.449 1.00 0.00 O ATOM 394 CB LYS A 28 -6.718 -7.219 -4.476 1.00 0.00 C ATOM 395 CG LYS A 28 -7.493 -8.449 -4.036 1.00 0.00 C ATOM 396 CD LYS A 28 -8.526 -8.107 -2.976 1.00 0.00 C ATOM 397 CE LYS A 28 -7.882 -7.911 -1.612 1.00 0.00 C ATOM 398 NZ LYS A 28 -8.699 -7.026 -0.735 1.00 0.00 N ATOM 0 H LYS A 28 -7.422 -8.095 -6.670 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.428 -6.063 -5.078 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.767 -7.534 -4.906 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.487 -6.613 -3.600 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.989 -8.895 -4.898 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.802 -9.195 -3.644 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -9.056 -7.199 -3.263 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -9.267 -8.904 -2.918 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -7.751 -8.880 -1.130 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -6.888 -7.481 -1.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -8.227 -6.917 0.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -8.803 -6.093 -1.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -9.639 -7.449 -0.594 1.00 0.00 H new ATOM 412 N ASN A 29 -5.515 -5.269 -6.445 1.00 0.00 N ATOM 413 CA ASN A 29 -4.655 -4.144 -6.792 1.00 0.00 C ATOM 414 C ASN A 29 -5.421 -3.104 -7.604 1.00 0.00 C ATOM 415 O ASN A 29 -6.375 -3.416 -8.317 1.00 0.00 O ATOM 416 CB ASN A 29 -3.439 -4.630 -7.584 1.00 0.00 C ATOM 417 CG ASN A 29 -3.828 -5.316 -8.879 1.00 0.00 C ATOM 418 OD1 ASN A 29 -4.595 -4.774 -9.675 1.00 0.00 O ATOM 419 ND2 ASN A 29 -3.300 -6.515 -9.095 1.00 0.00 N ATOM 0 H ASN A 29 -5.160 -6.178 -6.741 1.00 0.00 H new ATOM 0 HA ASN A 29 -4.316 -3.679 -5.866 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -2.791 -3.782 -7.806 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -2.861 -5.321 -6.970 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -3.526 -7.025 -9.949 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -2.669 -6.926 -8.407 1.00 0.00 H new ATOM 426 N PRO A 30 -4.995 -1.837 -7.495 1.00 0.00 N ATOM 427 CA PRO A 30 -3.861 -1.453 -6.649 1.00 0.00 C ATOM 428 C PRO A 30 -4.178 -1.577 -5.163 1.00 0.00 C ATOM 429 O PRO A 30 -5.210 -1.094 -4.696 1.00 0.00 O ATOM 430 CB PRO A 30 -3.619 0.011 -7.023 1.00 0.00 C ATOM 431 CG PRO A 30 -4.936 0.498 -7.521 1.00 0.00 C ATOM 432 CD PRO A 30 -5.588 -0.681 -8.189 1.00 0.00 C ATOM 0 HA PRO A 30 -2.997 -2.097 -6.810 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.283 0.589 -6.162 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -2.848 0.102 -7.788 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -5.550 0.870 -6.701 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -4.807 1.322 -8.223 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.672 -0.658 -8.077 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.379 -0.704 -9.258 1.00 0.00 H new ATOM 440 N ILE A 31 -3.285 -2.227 -4.424 1.00 0.00 N ATOM 441 CA ILE A 31 -3.470 -2.413 -2.991 1.00 0.00 C ATOM 442 C ILE A 31 -2.825 -1.279 -2.201 1.00 0.00 C ATOM 443 O ILE A 31 -2.648 -1.376 -0.988 1.00 0.00 O ATOM 444 CB ILE A 31 -2.879 -3.754 -2.516 1.00 0.00 C ATOM 445 CG1 ILE A 31 -1.430 -3.893 -2.987 1.00 0.00 C ATOM 446 CG2 ILE A 31 -3.721 -4.914 -3.026 1.00 0.00 C ATOM 447 CD1 ILE A 31 -0.572 -4.730 -2.064 1.00 0.00 C ATOM 0 H ILE A 31 -2.426 -2.634 -4.795 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.545 -2.414 -2.810 1.00 0.00 H new ATOM 0 HB ILE A 31 -2.890 -3.774 -1.426 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -1.421 -4.339 -3.982 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.989 -2.900 -3.079 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -3.291 -5.855 -2.682 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -4.738 -4.820 -2.646 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.738 -4.900 -4.116 1.00 0.00 H new ATOM 0 HD11 ILE A 31 0.442 -4.785 -2.460 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -0.550 -4.274 -1.074 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -0.989 -5.735 -1.991 1.00 0.00 H new ATOM 459 N ALA A 32 -2.478 -0.202 -2.900 1.00 0.00 N ATOM 460 CA ALA A 32 -1.857 0.953 -2.264 1.00 0.00 C ATOM 461 C ALA A 32 -1.730 2.116 -3.242 1.00 0.00 C ATOM 462 O ALA A 32 -1.612 1.914 -4.451 1.00 0.00 O ATOM 463 CB ALA A 32 -0.491 0.578 -1.707 1.00 0.00 C ATOM 0 H ALA A 32 -2.617 -0.106 -3.906 1.00 0.00 H new ATOM 0 HA ALA A 32 -2.498 1.272 -1.442 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -0.039 1.450 -1.235 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.604 -0.216 -0.969 1.00 0.00 H new ATOM 0 HB3 ALA A 32 0.150 0.231 -2.518 1.00 0.00 H new ATOM 469 N LYS A 33 -1.757 3.334 -2.712 1.00 0.00 N ATOM 470 CA LYS A 33 -1.645 4.531 -3.538 1.00 0.00 C ATOM 471 C LYS A 33 -1.350 5.757 -2.681 1.00 0.00 C ATOM 472 O LYS A 33 -2.047 6.023 -1.701 1.00 0.00 O ATOM 473 CB LYS A 33 -2.934 4.749 -4.333 1.00 0.00 C ATOM 474 CG LYS A 33 -4.101 5.219 -3.483 1.00 0.00 C ATOM 475 CD LYS A 33 -5.415 5.134 -4.242 1.00 0.00 C ATOM 476 CE LYS A 33 -6.084 3.782 -4.046 1.00 0.00 C ATOM 477 NZ LYS A 33 -5.613 2.780 -5.042 1.00 0.00 N ATOM 0 H LYS A 33 -1.856 3.519 -1.714 1.00 0.00 H new ATOM 0 HA LYS A 33 -0.817 4.387 -4.232 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -2.748 5.483 -5.117 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.208 3.817 -4.828 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.162 4.612 -2.580 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.930 6.247 -3.165 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -6.084 5.925 -3.903 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -5.235 5.302 -5.304 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -5.878 3.418 -3.039 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -7.165 3.896 -4.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.355 2.067 -5.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -5.401 3.258 -5.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.754 2.314 -4.686 1.00 0.00 H new ATOM 491 N ILE A 34 -0.315 6.501 -3.056 1.00 0.00 N ATOM 492 CA ILE A 34 0.070 7.700 -2.323 1.00 0.00 C ATOM 493 C ILE A 34 -0.394 8.960 -3.047 1.00 0.00 C ATOM 494 O ILE A 34 -0.034 9.194 -4.201 1.00 0.00 O ATOM 495 CB ILE A 34 1.595 7.771 -2.120 1.00 0.00 C ATOM 496 CG1 ILE A 34 2.321 7.176 -3.328 1.00 0.00 C ATOM 497 CG2 ILE A 34 1.993 7.044 -0.844 1.00 0.00 C ATOM 498 CD1 ILE A 34 3.760 7.626 -3.450 1.00 0.00 C ATOM 0 H ILE A 34 0.272 6.294 -3.864 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.416 7.643 -1.349 1.00 0.00 H new ATOM 0 HB ILE A 34 1.886 8.817 -2.025 1.00 0.00 H new ATOM 0 HG12 ILE A 34 2.293 6.089 -3.259 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.784 7.451 -4.236 1.00 0.00 H new ATOM 0 HG21 ILE A 34 3.074 7.103 -0.714 1.00 0.00 H new ATOM 0 HG22 ILE A 34 1.499 7.509 0.009 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.692 5.999 -0.912 1.00 0.00 H new ATOM 0 HD11 ILE A 34 4.212 7.165 -4.328 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.795 8.711 -3.551 1.00 0.00 H new ATOM 0 HD13 ILE A 34 4.312 7.327 -2.559 1.00 0.00 H new ATOM 510 N HIS A 35 -1.195 9.769 -2.361 1.00 0.00 N ATOM 511 CA HIS A 35 -1.707 11.007 -2.938 1.00 0.00 C ATOM 512 C HIS A 35 -0.800 12.184 -2.591 1.00 0.00 C ATOM 513 O HIS A 35 -0.678 12.564 -1.427 1.00 0.00 O ATOM 514 CB HIS A 35 -3.127 11.278 -2.439 1.00 0.00 C ATOM 515 CG HIS A 35 -3.262 11.207 -0.949 1.00 0.00 C ATOM 516 ND1 HIS A 35 -3.239 12.321 -0.137 1.00 0.00 N ATOM 517 CD2 HIS A 35 -3.423 10.146 -0.124 1.00 0.00 C ATOM 518 CE1 HIS A 35 -3.379 11.948 1.123 1.00 0.00 C ATOM 519 NE2 HIS A 35 -3.493 10.633 1.158 1.00 0.00 N ATOM 0 H HIS A 35 -1.503 9.590 -1.405 1.00 0.00 H new ATOM 0 HA HIS A 35 -1.726 10.893 -4.022 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -3.440 12.266 -2.777 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -3.806 10.556 -2.892 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -3.485 9.109 -0.419 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -3.397 12.607 1.979 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -3.613 10.070 2.000 1.00 0.00 H new ATOM 528 N SER A 36 -0.165 12.756 -3.610 1.00 0.00 N ATOM 529 CA SER A 36 0.734 13.886 -3.412 1.00 0.00 C ATOM 530 C SER A 36 0.020 15.204 -3.694 1.00 0.00 C ATOM 531 O SER A 36 0.355 16.240 -3.118 1.00 0.00 O ATOM 532 CB SER A 36 1.961 13.753 -4.317 1.00 0.00 C ATOM 533 OG SER A 36 3.087 14.397 -3.747 1.00 0.00 O ATOM 0 H SER A 36 -0.257 12.455 -4.580 1.00 0.00 H new ATOM 0 HA SER A 36 1.057 13.884 -2.371 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.185 12.699 -4.479 1.00 0.00 H new ATOM 0 HB3 SER A 36 1.745 14.187 -5.293 1.00 0.00 H new ATOM 0 HG SER A 36 3.858 14.296 -4.343 1.00 0.00 H new ATOM 539 N ASP A 37 -0.965 15.157 -4.584 1.00 0.00 N ATOM 540 CA ASP A 37 -1.728 16.347 -4.943 1.00 0.00 C ATOM 541 C ASP A 37 -0.805 17.544 -5.147 1.00 0.00 C ATOM 542 O ASP A 37 -1.221 18.694 -5.001 1.00 0.00 O ATOM 543 CB ASP A 37 -2.761 16.663 -3.859 1.00 0.00 C ATOM 544 CG ASP A 37 -4.083 15.961 -4.098 1.00 0.00 C ATOM 545 OD1 ASP A 37 -4.476 15.819 -5.274 1.00 0.00 O ATOM 546 OD2 ASP A 37 -4.726 15.554 -3.107 1.00 0.00 O ATOM 0 H ASP A 37 -1.254 14.308 -5.070 1.00 0.00 H new ATOM 0 HA ASP A 37 -2.246 16.147 -5.881 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -2.366 16.367 -2.887 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -2.926 17.740 -3.821 1.00 0.00 H new ATOM 551 N LEU A 38 0.449 17.266 -5.484 1.00 0.00 N ATOM 552 CA LEU A 38 1.433 18.320 -5.708 1.00 0.00 C ATOM 553 C LEU A 38 1.962 18.277 -7.138 1.00 0.00 C ATOM 554 O LEU A 38 2.485 19.268 -7.647 1.00 0.00 O ATOM 555 CB LEU A 38 2.592 18.181 -4.719 1.00 0.00 C ATOM 556 CG LEU A 38 2.404 18.865 -3.364 1.00 0.00 C ATOM 557 CD1 LEU A 38 3.455 18.387 -2.375 1.00 0.00 C ATOM 558 CD2 LEU A 38 2.461 20.378 -3.517 1.00 0.00 C ATOM 0 H LEU A 38 0.809 16.320 -5.608 1.00 0.00 H new ATOM 0 HA LEU A 38 0.942 19.280 -5.551 1.00 0.00 H new ATOM 0 HB2 LEU A 38 2.770 17.120 -4.546 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.491 18.584 -5.185 1.00 0.00 H new ATOM 0 HG LEU A 38 1.421 18.597 -2.976 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.306 18.884 -1.417 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.366 17.309 -2.242 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.448 18.625 -2.756 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.325 20.848 -2.543 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.429 20.666 -3.927 1.00 0.00 H new ATOM 0 HD23 LEU A 38 1.670 20.706 -4.191 1.00 0.00 H new ATOM 570 N ALA A 39 1.820 17.123 -7.781 1.00 0.00 N ATOM 571 CA ALA A 39 2.279 16.952 -9.154 1.00 0.00 C ATOM 572 C ALA A 39 1.327 17.622 -10.139 1.00 0.00 C ATOM 573 O ALA A 39 1.742 18.442 -10.957 1.00 0.00 O ATOM 574 CB ALA A 39 2.426 15.473 -9.481 1.00 0.00 C ATOM 0 H ALA A 39 1.391 16.292 -7.373 1.00 0.00 H new ATOM 0 HA ALA A 39 3.253 17.432 -9.248 1.00 0.00 H new ATOM 0 HB1 ALA A 39 2.769 15.360 -10.509 1.00 0.00 H new ATOM 0 HB2 ALA A 39 3.151 15.021 -8.805 1.00 0.00 H new ATOM 0 HB3 ALA A 39 1.463 14.977 -9.364 1.00 0.00 H new ATOM 580 N GLU A 40 0.049 17.266 -10.054 1.00 0.00 N ATOM 581 CA GLU A 40 -0.961 17.833 -10.940 1.00 0.00 C ATOM 582 C GLU A 40 -1.235 19.293 -10.590 1.00 0.00 C ATOM 583 O GLU A 40 -1.802 20.037 -11.389 1.00 0.00 O ATOM 584 CB GLU A 40 -2.258 17.025 -10.855 1.00 0.00 C ATOM 585 CG GLU A 40 -3.377 17.576 -11.722 1.00 0.00 C ATOM 586 CD GLU A 40 -4.503 16.581 -11.923 1.00 0.00 C ATOM 587 OE1 GLU A 40 -5.212 16.281 -10.939 1.00 0.00 O ATOM 588 OE2 GLU A 40 -4.676 16.102 -13.063 1.00 0.00 O ATOM 0 H GLU A 40 -0.311 16.589 -9.382 1.00 0.00 H new ATOM 0 HA GLU A 40 -0.579 17.787 -11.960 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -2.055 15.996 -11.150 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -2.593 16.999 -9.818 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -3.775 18.481 -11.263 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -2.972 17.862 -12.693 1.00 0.00 H new ATOM 595 N GLU A 41 -0.828 19.694 -9.390 1.00 0.00 N ATOM 596 CA GLU A 41 -1.030 21.064 -8.934 1.00 0.00 C ATOM 597 C GLU A 41 0.027 21.995 -9.521 1.00 0.00 C ATOM 598 O GLU A 41 -0.298 23.011 -10.136 1.00 0.00 O ATOM 599 CB GLU A 41 -0.989 21.127 -7.405 1.00 0.00 C ATOM 600 CG GLU A 41 -2.343 20.913 -6.751 1.00 0.00 C ATOM 601 CD GLU A 41 -3.324 22.027 -7.061 1.00 0.00 C ATOM 602 OE1 GLU A 41 -2.992 23.201 -6.798 1.00 0.00 O ATOM 603 OE2 GLU A 41 -4.424 21.723 -7.568 1.00 0.00 O ATOM 0 H GLU A 41 -0.357 19.090 -8.716 1.00 0.00 H new ATOM 0 HA GLU A 41 -2.010 21.394 -9.278 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -0.294 20.372 -7.037 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -0.597 22.097 -7.100 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -2.759 19.964 -7.088 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -2.213 20.839 -5.671 1.00 0.00 H new ATOM 610 N ARG A 42 1.293 21.640 -9.327 1.00 0.00 N ATOM 611 CA ARG A 42 2.398 22.444 -9.835 1.00 0.00 C ATOM 612 C ARG A 42 2.807 21.985 -11.232 1.00 0.00 C ATOM 613 O ARG A 42 3.482 22.709 -11.962 1.00 0.00 O ATOM 614 CB ARG A 42 3.596 22.359 -8.888 1.00 0.00 C ATOM 615 CG ARG A 42 3.269 22.747 -7.455 1.00 0.00 C ATOM 616 CD ARG A 42 3.400 24.247 -7.240 1.00 0.00 C ATOM 617 NE ARG A 42 4.792 24.686 -7.283 1.00 0.00 N ATOM 618 CZ ARG A 42 5.162 25.962 -7.257 1.00 0.00 C ATOM 619 NH1 ARG A 42 4.247 26.919 -7.187 1.00 0.00 N ATOM 620 NH2 ARG A 42 6.449 26.282 -7.299 1.00 0.00 N ATOM 0 H ARG A 42 1.579 20.801 -8.822 1.00 0.00 H new ATOM 0 HA ARG A 42 2.063 23.480 -9.895 1.00 0.00 H new ATOM 0 HB2 ARG A 42 3.986 21.341 -8.900 1.00 0.00 H new ATOM 0 HB3 ARG A 42 4.389 23.009 -9.259 1.00 0.00 H new ATOM 0 HG2 ARG A 42 2.254 22.431 -7.214 1.00 0.00 H new ATOM 0 HG3 ARG A 42 3.937 22.221 -6.773 1.00 0.00 H new ATOM 0 HD2 ARG A 42 2.830 24.774 -8.005 1.00 0.00 H new ATOM 0 HD3 ARG A 42 2.965 24.515 -6.277 1.00 0.00 H new ATOM 0 HE ARG A 42 5.520 23.974 -7.336 1.00 0.00 H new ATOM 0 HH11 ARG A 42 3.257 26.676 -7.153 1.00 0.00 H new ATOM 0 HH12 ARG A 42 4.533 27.898 -7.167 1.00 0.00 H new ATOM 0 HH21 ARG A 42 7.156 25.548 -7.351 1.00 0.00 H new ATOM 0 HH22 ARG A 42 6.732 27.262 -7.279 1.00 0.00 H new ATOM 634 N GLY A 43 2.393 20.775 -11.596 1.00 0.00 N ATOM 635 CA GLY A 43 2.726 20.239 -12.903 1.00 0.00 C ATOM 636 C GLY A 43 4.110 19.622 -12.941 1.00 0.00 C ATOM 637 O GLY A 43 4.789 19.665 -13.968 1.00 0.00 O ATOM 0 H GLY A 43 1.833 20.157 -11.009 1.00 0.00 H new ATOM 0 HA2 GLY A 43 1.988 19.487 -13.182 1.00 0.00 H new ATOM 0 HA3 GLY A 43 2.666 21.035 -13.645 1.00 0.00 H new ATOM 641 N LEU A 44 4.530 19.046 -11.820 1.00 0.00 N ATOM 642 CA LEU A 44 5.843 18.418 -11.728 1.00 0.00 C ATOM 643 C LEU A 44 5.796 16.981 -12.237 1.00 0.00 C ATOM 644 O LEU A 44 4.721 16.401 -12.394 1.00 0.00 O ATOM 645 CB LEU A 44 6.342 18.443 -10.282 1.00 0.00 C ATOM 646 CG LEU A 44 6.304 19.802 -9.583 1.00 0.00 C ATOM 647 CD1 LEU A 44 6.152 19.624 -8.080 1.00 0.00 C ATOM 648 CD2 LEU A 44 7.558 20.602 -9.903 1.00 0.00 C ATOM 0 H LEU A 44 3.980 19.001 -10.962 1.00 0.00 H new ATOM 0 HA LEU A 44 6.534 18.983 -12.354 1.00 0.00 H new ATOM 0 HB2 LEU A 44 5.745 17.741 -9.700 1.00 0.00 H new ATOM 0 HB3 LEU A 44 7.369 18.077 -10.267 1.00 0.00 H new ATOM 0 HG LEU A 44 5.441 20.355 -9.952 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.127 20.602 -7.599 1.00 0.00 H new ATOM 0 HD12 LEU A 44 5.225 19.091 -7.869 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.995 19.051 -7.694 1.00 0.00 H new ATOM 0 HD21 LEU A 44 7.513 21.566 -9.397 1.00 0.00 H new ATOM 0 HD22 LEU A 44 8.436 20.054 -9.562 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.624 20.760 -10.979 1.00 0.00 H new ATOM 660 N LYS A 45 6.968 16.410 -12.491 1.00 0.00 N ATOM 661 CA LYS A 45 7.063 15.039 -12.979 1.00 0.00 C ATOM 662 C LYS A 45 7.299 14.067 -11.828 1.00 0.00 C ATOM 663 O LYS A 45 7.827 12.972 -12.026 1.00 0.00 O ATOM 664 CB LYS A 45 8.193 14.917 -14.004 1.00 0.00 C ATOM 665 CG LYS A 45 8.486 16.211 -14.743 1.00 0.00 C ATOM 666 CD LYS A 45 9.012 15.946 -16.144 1.00 0.00 C ATOM 667 CE LYS A 45 7.878 15.717 -17.131 1.00 0.00 C ATOM 668 NZ LYS A 45 7.262 16.998 -17.575 1.00 0.00 N ATOM 0 H LYS A 45 7.867 16.876 -12.367 1.00 0.00 H new ATOM 0 HA LYS A 45 6.118 14.784 -13.458 1.00 0.00 H new ATOM 0 HB2 LYS A 45 9.099 14.585 -13.496 1.00 0.00 H new ATOM 0 HB3 LYS A 45 7.933 14.145 -14.729 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.578 16.811 -14.802 1.00 0.00 H new ATOM 0 HG3 LYS A 45 9.217 16.793 -14.183 1.00 0.00 H new ATOM 0 HD2 LYS A 45 9.617 16.791 -16.473 1.00 0.00 H new ATOM 0 HD3 LYS A 45 9.665 15.073 -16.130 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.255 15.176 -17.999 1.00 0.00 H new ATOM 0 HE3 LYS A 45 7.116 15.088 -16.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 6.493 16.799 -18.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 6.879 17.503 -16.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 7.983 17.588 -18.038 1.00 0.00 H new ATOM 682 N ILE A 46 6.904 14.473 -10.626 1.00 0.00 N ATOM 683 CA ILE A 46 7.071 13.636 -9.444 1.00 0.00 C ATOM 684 C ILE A 46 6.923 12.159 -9.791 1.00 0.00 C ATOM 685 O ILE A 46 6.117 11.788 -10.645 1.00 0.00 O ATOM 686 CB ILE A 46 6.052 14.000 -8.348 1.00 0.00 C ATOM 687 CG1 ILE A 46 6.538 15.212 -7.551 1.00 0.00 C ATOM 688 CG2 ILE A 46 5.819 12.812 -7.427 1.00 0.00 C ATOM 689 CD1 ILE A 46 5.417 16.091 -7.044 1.00 0.00 C ATOM 0 H ILE A 46 6.466 15.376 -10.445 1.00 0.00 H new ATOM 0 HA ILE A 46 8.077 13.819 -9.067 1.00 0.00 H new ATOM 0 HB ILE A 46 5.106 14.258 -8.823 1.00 0.00 H new ATOM 0 HG12 ILE A 46 7.129 14.866 -6.703 1.00 0.00 H new ATOM 0 HG13 ILE A 46 7.200 15.808 -8.179 1.00 0.00 H new ATOM 0 HG21 ILE A 46 5.097 13.084 -6.658 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.433 11.973 -8.006 1.00 0.00 H new ATOM 0 HG23 ILE A 46 6.760 12.526 -6.957 1.00 0.00 H new ATOM 0 HD11 ILE A 46 5.836 16.930 -6.488 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.839 16.467 -7.888 1.00 0.00 H new ATOM 0 HD13 ILE A 46 4.767 15.510 -6.389 1.00 0.00 H new ATOM 701 N THR A 47 7.704 11.317 -9.121 1.00 0.00 N ATOM 702 CA THR A 47 7.659 9.880 -9.357 1.00 0.00 C ATOM 703 C THR A 47 7.542 9.111 -8.047 1.00 0.00 C ATOM 704 O THR A 47 8.155 9.477 -7.044 1.00 0.00 O ATOM 705 CB THR A 47 8.911 9.396 -10.114 1.00 0.00 C ATOM 706 OG1 THR A 47 9.075 10.147 -11.321 1.00 0.00 O ATOM 707 CG2 THR A 47 8.805 7.914 -10.442 1.00 0.00 C ATOM 0 H THR A 47 8.376 11.606 -8.410 1.00 0.00 H new ATOM 0 HA THR A 47 6.777 9.687 -9.968 1.00 0.00 H new ATOM 0 HB THR A 47 9.779 9.549 -9.472 1.00 0.00 H new ATOM 0 HG1 THR A 47 9.874 9.834 -11.795 1.00 0.00 H new ATOM 0 HG21 THR A 47 9.700 7.595 -10.976 1.00 0.00 H new ATOM 0 HG22 THR A 47 8.711 7.343 -9.518 1.00 0.00 H new ATOM 0 HG23 THR A 47 7.929 7.741 -11.067 1.00 0.00 H new ATOM 715 N TYR A 48 6.753 8.043 -8.062 1.00 0.00 N ATOM 716 CA TYR A 48 6.554 7.222 -6.873 1.00 0.00 C ATOM 717 C TYR A 48 7.426 5.972 -6.922 1.00 0.00 C ATOM 718 O TYR A 48 7.410 5.226 -7.902 1.00 0.00 O ATOM 719 CB TYR A 48 5.082 6.826 -6.741 1.00 0.00 C ATOM 720 CG TYR A 48 4.126 7.988 -6.896 1.00 0.00 C ATOM 721 CD1 TYR A 48 4.504 9.275 -6.535 1.00 0.00 C ATOM 722 CD2 TYR A 48 2.846 7.797 -7.401 1.00 0.00 C ATOM 723 CE1 TYR A 48 3.634 10.340 -6.674 1.00 0.00 C ATOM 724 CE2 TYR A 48 1.970 8.855 -7.545 1.00 0.00 C ATOM 725 CZ TYR A 48 2.368 10.125 -7.179 1.00 0.00 C ATOM 726 OH TYR A 48 1.498 11.181 -7.320 1.00 0.00 O ATOM 0 H TYR A 48 6.240 7.725 -8.884 1.00 0.00 H new ATOM 0 HA TYR A 48 6.844 7.811 -6.003 1.00 0.00 H new ATOM 0 HB2 TYR A 48 4.849 6.072 -7.492 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.925 6.364 -5.766 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.494 9.446 -6.139 1.00 0.00 H new ATOM 0 HD2 TYR A 48 2.531 6.804 -7.686 1.00 0.00 H new ATOM 0 HE1 TYR A 48 3.943 11.335 -6.389 1.00 0.00 H new ATOM 0 HE2 TYR A 48 0.979 8.690 -7.942 1.00 0.00 H new ATOM 0 HH TYR A 48 0.650 10.859 -7.690 1.00 0.00 H new ATOM 736 N LYS A 49 8.188 5.747 -5.857 1.00 0.00 N ATOM 737 CA LYS A 49 9.066 4.587 -5.774 1.00 0.00 C ATOM 738 C LYS A 49 8.766 3.764 -4.525 1.00 0.00 C ATOM 739 O LYS A 49 8.175 4.265 -3.568 1.00 0.00 O ATOM 740 CB LYS A 49 10.531 5.030 -5.766 1.00 0.00 C ATOM 741 CG LYS A 49 11.501 3.932 -6.167 1.00 0.00 C ATOM 742 CD LYS A 49 12.903 4.478 -6.384 1.00 0.00 C ATOM 743 CE LYS A 49 13.567 4.846 -5.066 1.00 0.00 C ATOM 744 NZ LYS A 49 14.985 5.260 -5.257 1.00 0.00 N ATOM 0 H LYS A 49 8.215 6.354 -5.038 1.00 0.00 H new ATOM 0 HA LYS A 49 8.886 3.964 -6.650 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.650 5.874 -6.445 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.789 5.385 -4.768 1.00 0.00 H new ATOM 0 HG2 LYS A 49 11.524 3.165 -5.393 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.151 3.452 -7.081 1.00 0.00 H new ATOM 0 HD2 LYS A 49 13.508 3.734 -6.903 1.00 0.00 H new ATOM 0 HD3 LYS A 49 12.857 5.357 -7.027 1.00 0.00 H new ATOM 0 HE2 LYS A 49 13.012 5.657 -4.594 1.00 0.00 H new ATOM 0 HE3 LYS A 49 13.525 3.994 -4.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 15.403 5.503 -4.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 15.520 4.478 -5.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 15.023 6.089 -5.884 1.00 0.00 H new ATOM 758 N TYR A 50 9.178 2.501 -4.541 1.00 0.00 N ATOM 759 CA TYR A 50 8.952 1.610 -3.410 1.00 0.00 C ATOM 760 C TYR A 50 10.169 0.724 -3.163 1.00 0.00 C ATOM 761 O TYR A 50 10.644 0.034 -4.066 1.00 0.00 O ATOM 762 CB TYR A 50 7.717 0.742 -3.656 1.00 0.00 C ATOM 763 CG TYR A 50 6.430 1.366 -3.165 1.00 0.00 C ATOM 764 CD1 TYR A 50 6.008 1.195 -1.853 1.00 0.00 C ATOM 765 CD2 TYR A 50 5.637 2.129 -4.014 1.00 0.00 C ATOM 766 CE1 TYR A 50 4.833 1.763 -1.401 1.00 0.00 C ATOM 767 CE2 TYR A 50 4.461 2.702 -3.570 1.00 0.00 C ATOM 768 CZ TYR A 50 4.063 2.516 -2.263 1.00 0.00 C ATOM 769 OH TYR A 50 2.892 3.085 -1.816 1.00 0.00 O ATOM 0 H TYR A 50 9.670 2.072 -5.325 1.00 0.00 H new ATOM 0 HA TYR A 50 8.786 2.224 -2.525 1.00 0.00 H new ATOM 0 HB2 TYR A 50 7.630 0.543 -4.724 1.00 0.00 H new ATOM 0 HB3 TYR A 50 7.856 -0.220 -3.163 1.00 0.00 H new ATOM 0 HD1 TYR A 50 6.609 0.608 -1.174 1.00 0.00 H new ATOM 0 HD2 TYR A 50 5.945 2.276 -5.038 1.00 0.00 H new ATOM 0 HE1 TYR A 50 4.519 1.618 -0.378 1.00 0.00 H new ATOM 0 HE2 TYR A 50 3.857 3.292 -4.243 1.00 0.00 H new ATOM 0 HH TYR A 50 2.471 3.583 -2.547 1.00 0.00 H new ATOM 779 N THR A 51 10.670 0.746 -1.931 1.00 0.00 N ATOM 780 CA THR A 51 11.831 -0.053 -1.564 1.00 0.00 C ATOM 781 C THR A 51 11.569 -0.851 -0.291 1.00 0.00 C ATOM 782 O THR A 51 10.993 -0.337 0.667 1.00 0.00 O ATOM 783 CB THR A 51 13.077 0.828 -1.356 1.00 0.00 C ATOM 784 OG1 THR A 51 12.914 1.641 -0.189 1.00 0.00 O ATOM 785 CG2 THR A 51 13.320 1.715 -2.568 1.00 0.00 C ATOM 0 H THR A 51 10.289 1.309 -1.171 1.00 0.00 H new ATOM 0 HA THR A 51 12.015 -0.740 -2.390 1.00 0.00 H new ATOM 0 HB THR A 51 13.939 0.174 -1.224 1.00 0.00 H new ATOM 0 HG1 THR A 51 13.711 2.197 -0.063 1.00 0.00 H new ATOM 0 HG21 THR A 51 14.205 2.328 -2.398 1.00 0.00 H new ATOM 0 HG22 THR A 51 13.473 1.093 -3.450 1.00 0.00 H new ATOM 0 HG23 THR A 51 12.456 2.361 -2.726 1.00 0.00 H new ATOM 793 N GLY A 52 11.997 -2.109 -0.288 1.00 0.00 N ATOM 794 CA GLY A 52 11.800 -2.957 0.874 1.00 0.00 C ATOM 795 C GLY A 52 11.556 -4.406 0.499 1.00 0.00 C ATOM 796 O GLY A 52 11.299 -4.720 -0.663 1.00 0.00 O ATOM 0 H GLY A 52 12.477 -2.557 -1.069 1.00 0.00 H new ATOM 0 HA2 GLY A 52 12.677 -2.894 1.519 1.00 0.00 H new ATOM 0 HA3 GLY A 52 10.953 -2.586 1.451 1.00 0.00 H new ATOM 800 N LYS A 53 11.638 -5.292 1.486 1.00 0.00 N ATOM 801 CA LYS A 53 11.424 -6.716 1.256 1.00 0.00 C ATOM 802 C LYS A 53 10.337 -6.941 0.209 1.00 0.00 C ATOM 803 O LYS A 53 9.258 -6.355 0.285 1.00 0.00 O ATOM 804 CB LYS A 53 11.040 -7.413 2.563 1.00 0.00 C ATOM 805 CG LYS A 53 11.115 -8.928 2.489 1.00 0.00 C ATOM 806 CD LYS A 53 11.370 -9.541 3.856 1.00 0.00 C ATOM 807 CE LYS A 53 10.075 -9.731 4.631 1.00 0.00 C ATOM 808 NZ LYS A 53 9.615 -8.464 5.264 1.00 0.00 N ATOM 0 H LYS A 53 11.851 -5.049 2.453 1.00 0.00 H new ATOM 0 HA LYS A 53 12.356 -7.142 0.884 1.00 0.00 H new ATOM 0 HB2 LYS A 53 11.698 -7.063 3.358 1.00 0.00 H new ATOM 0 HB3 LYS A 53 10.026 -7.121 2.837 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.183 -9.320 2.082 1.00 0.00 H new ATOM 0 HG3 LYS A 53 11.910 -9.221 1.804 1.00 0.00 H new ATOM 0 HD2 LYS A 53 11.869 -10.503 3.737 1.00 0.00 H new ATOM 0 HD3 LYS A 53 12.044 -8.900 4.424 1.00 0.00 H new ATOM 0 HE2 LYS A 53 9.301 -10.103 3.959 1.00 0.00 H new ATOM 0 HE3 LYS A 53 10.220 -10.489 5.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 9.048 -8.683 6.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 10.440 -7.894 5.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.035 -7.928 4.587 1.00 0.00 H new ATOM 822 N GLY A 54 10.630 -7.795 -0.767 1.00 0.00 N ATOM 823 CA GLY A 54 9.667 -8.083 -1.814 1.00 0.00 C ATOM 824 C GLY A 54 10.029 -7.427 -3.132 1.00 0.00 C ATOM 825 O GLY A 54 9.554 -7.840 -4.190 1.00 0.00 O ATOM 0 H GLY A 54 11.517 -8.292 -0.851 1.00 0.00 H new ATOM 0 HA2 GLY A 54 9.600 -9.162 -1.955 1.00 0.00 H new ATOM 0 HA3 GLY A 54 8.681 -7.741 -1.500 1.00 0.00 H new ATOM 829 N ILE A 55 10.871 -6.401 -3.068 1.00 0.00 N ATOM 830 CA ILE A 55 11.296 -5.686 -4.265 1.00 0.00 C ATOM 831 C ILE A 55 12.813 -5.719 -4.416 1.00 0.00 C ATOM 832 O ILE A 55 13.343 -6.300 -5.364 1.00 0.00 O ATOM 833 CB ILE A 55 10.825 -4.220 -4.243 1.00 0.00 C ATOM 834 CG1 ILE A 55 9.317 -4.150 -3.990 1.00 0.00 C ATOM 835 CG2 ILE A 55 11.180 -3.530 -5.551 1.00 0.00 C ATOM 836 CD1 ILE A 55 8.839 -2.779 -3.567 1.00 0.00 C ATOM 0 H ILE A 55 11.272 -6.046 -2.200 1.00 0.00 H new ATOM 0 HA ILE A 55 10.838 -6.193 -5.114 1.00 0.00 H new ATOM 0 HB ILE A 55 11.336 -3.702 -3.431 1.00 0.00 H new ATOM 0 HG12 ILE A 55 8.790 -4.446 -4.897 1.00 0.00 H new ATOM 0 HG13 ILE A 55 9.052 -4.873 -3.218 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.841 -2.495 -5.520 1.00 0.00 H new ATOM 0 HG22 ILE A 55 12.260 -3.554 -5.693 1.00 0.00 H new ATOM 0 HG23 ILE A 55 10.694 -4.047 -6.379 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.761 -2.803 -3.405 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.338 -2.489 -2.643 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.072 -2.055 -4.348 1.00 0.00 H new ATOM 848 N THR A 56 13.510 -5.092 -3.473 1.00 0.00 N ATOM 849 CA THR A 56 14.966 -5.049 -3.500 1.00 0.00 C ATOM 850 C THR A 56 15.564 -6.323 -2.915 1.00 0.00 C ATOM 851 O THR A 56 16.321 -7.027 -3.583 1.00 0.00 O ATOM 852 CB THR A 56 15.507 -3.836 -2.719 1.00 0.00 C ATOM 853 OG1 THR A 56 15.049 -3.883 -1.363 1.00 0.00 O ATOM 854 CG2 THR A 56 15.060 -2.533 -3.365 1.00 0.00 C ATOM 0 H THR A 56 13.089 -4.607 -2.681 1.00 0.00 H new ATOM 0 HA THR A 56 15.260 -4.959 -4.546 1.00 0.00 H new ATOM 0 HB THR A 56 16.596 -3.877 -2.736 1.00 0.00 H new ATOM 0 HG1 THR A 56 15.398 -3.110 -0.873 1.00 0.00 H new ATOM 0 HG21 THR A 56 15.454 -1.691 -2.796 1.00 0.00 H new ATOM 0 HG22 THR A 56 15.434 -2.487 -4.388 1.00 0.00 H new ATOM 0 HG23 THR A 56 13.971 -2.487 -3.375 1.00 0.00 H new ATOM 862 N GLU A 57 15.220 -6.613 -1.664 1.00 0.00 N ATOM 863 CA GLU A 57 15.725 -7.804 -0.990 1.00 0.00 C ATOM 864 C GLU A 57 14.849 -9.015 -1.298 1.00 0.00 C ATOM 865 O GLU A 57 13.627 -8.917 -1.409 1.00 0.00 O ATOM 866 CB GLU A 57 15.785 -7.575 0.521 1.00 0.00 C ATOM 867 CG GLU A 57 16.789 -6.513 0.937 1.00 0.00 C ATOM 868 CD GLU A 57 16.427 -5.850 2.252 1.00 0.00 C ATOM 869 OE1 GLU A 57 15.296 -5.331 2.362 1.00 0.00 O ATOM 870 OE2 GLU A 57 17.274 -5.850 3.170 1.00 0.00 O ATOM 0 H GLU A 57 14.594 -6.040 -1.097 1.00 0.00 H new ATOM 0 HA GLU A 57 16.731 -8.001 -1.360 1.00 0.00 H new ATOM 0 HB2 GLU A 57 14.796 -7.286 0.876 1.00 0.00 H new ATOM 0 HB3 GLU A 57 16.038 -8.514 1.012 1.00 0.00 H new ATOM 0 HG2 GLU A 57 17.777 -6.966 1.023 1.00 0.00 H new ATOM 0 HG3 GLU A 57 16.853 -5.754 0.157 1.00 0.00 H new ATOM 877 N PRO A 58 15.488 -10.186 -1.440 1.00 0.00 N ATOM 878 CA PRO A 58 14.788 -11.439 -1.737 1.00 0.00 C ATOM 879 C PRO A 58 13.950 -11.927 -0.560 1.00 0.00 C ATOM 880 O PRO A 58 14.252 -11.659 0.602 1.00 0.00 O ATOM 881 CB PRO A 58 15.926 -12.421 -2.027 1.00 0.00 C ATOM 882 CG PRO A 58 17.098 -11.872 -1.289 1.00 0.00 C ATOM 883 CD PRO A 58 16.944 -10.376 -1.321 1.00 0.00 C ATOM 0 HA PRO A 58 14.083 -11.327 -2.561 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.678 -13.426 -1.685 1.00 0.00 H new ATOM 0 HB3 PRO A 58 16.128 -12.489 -3.096 1.00 0.00 H new ATOM 0 HG2 PRO A 58 17.121 -12.240 -0.263 1.00 0.00 H new ATOM 0 HG3 PRO A 58 18.033 -12.178 -1.758 1.00 0.00 H new ATOM 0 HD2 PRO A 58 17.337 -9.912 -0.417 1.00 0.00 H new ATOM 0 HD3 PRO A 58 17.477 -9.935 -2.163 1.00 0.00 H new ATOM 891 N PRO A 59 12.870 -12.663 -0.867 1.00 0.00 N ATOM 892 CA PRO A 59 12.500 -12.988 -2.247 1.00 0.00 C ATOM 893 C PRO A 59 12.009 -11.768 -3.019 1.00 0.00 C ATOM 894 O PRO A 59 11.131 -11.039 -2.555 1.00 0.00 O ATOM 895 CB PRO A 59 11.369 -14.006 -2.080 1.00 0.00 C ATOM 896 CG PRO A 59 10.785 -13.707 -0.742 1.00 0.00 C ATOM 897 CD PRO A 59 11.928 -13.232 0.111 1.00 0.00 C ATOM 0 HA PRO A 59 13.349 -13.363 -2.819 1.00 0.00 H new ATOM 0 HB2 PRO A 59 10.624 -13.903 -2.869 1.00 0.00 H new ATOM 0 HB3 PRO A 59 11.746 -15.028 -2.128 1.00 0.00 H new ATOM 0 HG2 PRO A 59 10.010 -12.944 -0.816 1.00 0.00 H new ATOM 0 HG3 PRO A 59 10.319 -14.594 -0.312 1.00 0.00 H new ATOM 0 HD2 PRO A 59 11.604 -12.487 0.838 1.00 0.00 H new ATOM 0 HD3 PRO A 59 12.378 -14.051 0.673 1.00 0.00 H new ATOM 905 N PHE A 60 12.580 -11.550 -4.198 1.00 0.00 N ATOM 906 CA PHE A 60 12.201 -10.417 -5.034 1.00 0.00 C ATOM 907 C PHE A 60 11.271 -10.859 -6.161 1.00 0.00 C ATOM 908 O PHE A 60 10.961 -12.042 -6.296 1.00 0.00 O ATOM 909 CB PHE A 60 13.447 -9.748 -5.619 1.00 0.00 C ATOM 910 CG PHE A 60 14.591 -10.696 -5.835 1.00 0.00 C ATOM 911 CD1 PHE A 60 14.446 -11.804 -6.653 1.00 0.00 C ATOM 912 CD2 PHE A 60 15.813 -10.479 -5.218 1.00 0.00 C ATOM 913 CE1 PHE A 60 15.497 -12.678 -6.854 1.00 0.00 C ATOM 914 CE2 PHE A 60 16.868 -11.350 -5.415 1.00 0.00 C ATOM 915 CZ PHE A 60 16.710 -12.451 -6.233 1.00 0.00 C ATOM 0 H PHE A 60 13.308 -12.143 -4.597 1.00 0.00 H new ATOM 0 HA PHE A 60 11.670 -9.698 -4.409 1.00 0.00 H new ATOM 0 HB2 PHE A 60 13.187 -9.282 -6.570 1.00 0.00 H new ATOM 0 HB3 PHE A 60 13.769 -8.950 -4.950 1.00 0.00 H new ATOM 0 HD1 PHE A 60 13.500 -11.987 -7.140 1.00 0.00 H new ATOM 0 HD2 PHE A 60 15.942 -9.620 -4.576 1.00 0.00 H new ATOM 0 HE1 PHE A 60 15.370 -13.537 -7.496 1.00 0.00 H new ATOM 0 HE2 PHE A 60 17.816 -11.169 -4.929 1.00 0.00 H new ATOM 0 HZ PHE A 60 17.533 -13.133 -6.387 1.00 0.00 H new ATOM 925 N GLY A 61 10.829 -9.899 -6.967 1.00 0.00 N ATOM 926 CA GLY A 61 9.939 -10.208 -8.070 1.00 0.00 C ATOM 927 C GLY A 61 8.505 -10.409 -7.620 1.00 0.00 C ATOM 928 O GLY A 61 7.732 -11.102 -8.282 1.00 0.00 O ATOM 0 H GLY A 61 11.072 -8.912 -6.876 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.977 -9.400 -8.801 1.00 0.00 H new ATOM 0 HA3 GLY A 61 10.288 -11.110 -8.573 1.00 0.00 H new ATOM 932 N ILE A 62 8.151 -9.805 -6.491 1.00 0.00 N ATOM 933 CA ILE A 62 6.801 -9.922 -5.953 1.00 0.00 C ATOM 934 C ILE A 62 5.973 -8.682 -6.272 1.00 0.00 C ATOM 935 O ILE A 62 5.055 -8.729 -7.091 1.00 0.00 O ATOM 936 CB ILE A 62 6.820 -10.136 -4.428 1.00 0.00 C ATOM 937 CG1 ILE A 62 7.520 -11.452 -4.084 1.00 0.00 C ATOM 938 CG2 ILE A 62 5.403 -10.123 -3.875 1.00 0.00 C ATOM 939 CD1 ILE A 62 7.501 -11.778 -2.607 1.00 0.00 C ATOM 0 H ILE A 62 8.780 -9.230 -5.931 1.00 0.00 H new ATOM 0 HA ILE A 62 6.346 -10.791 -6.428 1.00 0.00 H new ATOM 0 HB ILE A 62 7.377 -9.320 -3.968 1.00 0.00 H new ATOM 0 HG12 ILE A 62 7.042 -12.263 -4.633 1.00 0.00 H new ATOM 0 HG13 ILE A 62 8.555 -11.404 -4.424 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.432 -10.275 -2.796 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.936 -9.163 -4.093 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.824 -10.922 -4.339 1.00 0.00 H new ATOM 0 HD11 ILE A 62 8.015 -12.724 -2.437 1.00 0.00 H new ATOM 0 HD12 ILE A 62 8.005 -10.986 -2.053 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.469 -11.859 -2.266 1.00 0.00 H new ATOM 951 N PHE A 63 6.304 -7.572 -5.620 1.00 0.00 N ATOM 952 CA PHE A 63 5.592 -6.318 -5.834 1.00 0.00 C ATOM 953 C PHE A 63 6.243 -5.506 -6.950 1.00 0.00 C ATOM 954 O PHE A 63 7.466 -5.497 -7.094 1.00 0.00 O ATOM 955 CB PHE A 63 5.560 -5.498 -4.543 1.00 0.00 C ATOM 956 CG PHE A 63 4.936 -6.226 -3.386 1.00 0.00 C ATOM 957 CD1 PHE A 63 3.568 -6.168 -3.171 1.00 0.00 C ATOM 958 CD2 PHE A 63 5.717 -6.968 -2.515 1.00 0.00 C ATOM 959 CE1 PHE A 63 2.992 -6.836 -2.106 1.00 0.00 C ATOM 960 CE2 PHE A 63 5.146 -7.638 -1.449 1.00 0.00 C ATOM 961 CZ PHE A 63 3.782 -7.573 -1.246 1.00 0.00 C ATOM 0 H PHE A 63 7.061 -7.516 -4.939 1.00 0.00 H new ATOM 0 HA PHE A 63 4.570 -6.556 -6.130 1.00 0.00 H new ATOM 0 HB2 PHE A 63 6.578 -5.214 -4.277 1.00 0.00 H new ATOM 0 HB3 PHE A 63 5.008 -4.575 -4.722 1.00 0.00 H new ATOM 0 HD1 PHE A 63 2.945 -5.595 -3.842 1.00 0.00 H new ATOM 0 HD2 PHE A 63 6.784 -7.024 -2.671 1.00 0.00 H new ATOM 0 HE1 PHE A 63 1.925 -6.781 -1.947 1.00 0.00 H new ATOM 0 HE2 PHE A 63 5.766 -8.211 -0.776 1.00 0.00 H new ATOM 0 HZ PHE A 63 3.333 -8.098 -0.416 1.00 0.00 H new ATOM 971 N VAL A 64 5.417 -4.824 -7.737 1.00 0.00 N ATOM 972 CA VAL A 64 5.912 -4.008 -8.840 1.00 0.00 C ATOM 973 C VAL A 64 5.277 -2.622 -8.825 1.00 0.00 C ATOM 974 O VAL A 64 4.211 -2.422 -8.244 1.00 0.00 O ATOM 975 CB VAL A 64 5.632 -4.674 -10.200 1.00 0.00 C ATOM 976 CG1 VAL A 64 6.628 -5.793 -10.462 1.00 0.00 C ATOM 977 CG2 VAL A 64 4.204 -5.197 -10.253 1.00 0.00 C ATOM 0 H VAL A 64 4.402 -4.820 -7.632 1.00 0.00 H new ATOM 0 HA VAL A 64 6.989 -3.913 -8.705 1.00 0.00 H new ATOM 0 HB VAL A 64 5.750 -3.925 -10.983 1.00 0.00 H new ATOM 0 HG11 VAL A 64 6.414 -6.252 -11.427 1.00 0.00 H new ATOM 0 HG12 VAL A 64 7.639 -5.386 -10.470 1.00 0.00 H new ATOM 0 HG13 VAL A 64 6.546 -6.545 -9.677 1.00 0.00 H new ATOM 0 HG21 VAL A 64 4.023 -5.664 -11.221 1.00 0.00 H new ATOM 0 HG22 VAL A 64 4.056 -5.932 -9.462 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.508 -4.370 -10.114 1.00 0.00 H new ATOM 987 N PHE A 65 5.941 -1.667 -9.468 1.00 0.00 N ATOM 988 CA PHE A 65 5.442 -0.298 -9.529 1.00 0.00 C ATOM 989 C PHE A 65 5.893 0.389 -10.814 1.00 0.00 C ATOM 990 O PHE A 65 6.939 0.059 -11.373 1.00 0.00 O ATOM 991 CB PHE A 65 5.927 0.498 -8.315 1.00 0.00 C ATOM 992 CG PHE A 65 7.385 0.853 -8.374 1.00 0.00 C ATOM 993 CD1 PHE A 65 7.818 1.939 -9.118 1.00 0.00 C ATOM 994 CD2 PHE A 65 8.323 0.099 -7.687 1.00 0.00 C ATOM 995 CE1 PHE A 65 9.159 2.268 -9.174 1.00 0.00 C ATOM 996 CE2 PHE A 65 9.666 0.424 -7.739 1.00 0.00 C ATOM 997 CZ PHE A 65 10.084 1.509 -8.484 1.00 0.00 C ATOM 0 H PHE A 65 6.825 -1.816 -9.954 1.00 0.00 H new ATOM 0 HA PHE A 65 4.353 -0.334 -9.520 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.341 1.414 -8.234 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.739 -0.082 -7.412 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.099 2.535 -9.660 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.002 -0.752 -7.105 1.00 0.00 H new ATOM 0 HE1 PHE A 65 9.483 3.118 -9.757 1.00 0.00 H new ATOM 0 HE2 PHE A 65 10.387 -0.170 -7.198 1.00 0.00 H new ATOM 0 HZ PHE A 65 11.133 1.764 -8.527 1.00 0.00 H new ATOM 1007 N ASN A 66 5.096 1.346 -11.278 1.00 0.00 N ATOM 1008 CA ASN A 66 5.412 2.079 -12.499 1.00 0.00 C ATOM 1009 C ASN A 66 5.931 3.477 -12.175 1.00 0.00 C ATOM 1010 O ASN A 66 5.896 3.913 -11.024 1.00 0.00 O ATOM 1011 CB ASN A 66 4.176 2.176 -13.394 1.00 0.00 C ATOM 1012 CG ASN A 66 4.490 2.778 -14.750 1.00 0.00 C ATOM 1013 OD1 ASN A 66 4.577 3.997 -14.896 1.00 0.00 O ATOM 1014 ND2 ASN A 66 4.661 1.922 -15.752 1.00 0.00 N ATOM 0 H ASN A 66 4.227 1.632 -10.827 1.00 0.00 H new ATOM 0 HA ASN A 66 6.194 1.534 -13.029 1.00 0.00 H new ATOM 0 HB2 ASN A 66 3.751 1.182 -13.531 1.00 0.00 H new ATOM 0 HB3 ASN A 66 3.418 2.782 -12.897 1.00 0.00 H new ATOM 0 HD21 ASN A 66 4.874 2.268 -16.688 1.00 0.00 H new ATOM 0 HD22 ASN A 66 4.580 0.919 -15.585 1.00 0.00 H new ATOM 1021 N LYS A 67 6.411 4.175 -13.198 1.00 0.00 N ATOM 1022 CA LYS A 67 6.936 5.524 -13.025 1.00 0.00 C ATOM 1023 C LYS A 67 5.880 6.568 -13.373 1.00 0.00 C ATOM 1024 O LYS A 67 5.636 7.499 -12.606 1.00 0.00 O ATOM 1025 CB LYS A 67 8.176 5.728 -13.898 1.00 0.00 C ATOM 1026 CG LYS A 67 8.365 7.161 -14.362 1.00 0.00 C ATOM 1027 CD LYS A 67 9.836 7.501 -14.538 1.00 0.00 C ATOM 1028 CE LYS A 67 10.020 8.907 -15.090 1.00 0.00 C ATOM 1029 NZ LYS A 67 11.399 9.419 -14.853 1.00 0.00 N ATOM 0 H LYS A 67 6.447 3.828 -14.157 1.00 0.00 H new ATOM 0 HA LYS A 67 7.212 5.647 -11.978 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.058 5.417 -13.339 1.00 0.00 H new ATOM 0 HB3 LYS A 67 8.106 5.079 -14.771 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.841 7.311 -15.306 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.918 7.841 -13.637 1.00 0.00 H new ATOM 0 HD2 LYS A 67 10.348 7.415 -13.579 1.00 0.00 H new ATOM 0 HD3 LYS A 67 10.299 6.781 -15.212 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.811 8.908 -16.160 1.00 0.00 H new ATOM 0 HE3 LYS A 67 9.298 9.578 -14.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 11.485 10.379 -15.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 11.590 9.442 -13.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 12.087 8.793 -15.319 1.00 0.00 H new ATOM 1043 N ASP A 68 5.255 6.405 -14.534 1.00 0.00 N ATOM 1044 CA ASP A 68 4.222 7.332 -14.983 1.00 0.00 C ATOM 1045 C ASP A 68 3.042 7.340 -14.016 1.00 0.00 C ATOM 1046 O ASP A 68 2.868 8.280 -13.239 1.00 0.00 O ATOM 1047 CB ASP A 68 3.745 6.956 -16.387 1.00 0.00 C ATOM 1048 CG ASP A 68 4.843 7.081 -17.424 1.00 0.00 C ATOM 1049 OD1 ASP A 68 5.399 8.189 -17.568 1.00 0.00 O ATOM 1050 OD2 ASP A 68 5.145 6.070 -18.093 1.00 0.00 O ATOM 0 H ASP A 68 5.445 5.640 -15.181 1.00 0.00 H new ATOM 0 HA ASP A 68 4.653 8.333 -15.010 1.00 0.00 H new ATOM 0 HB2 ASP A 68 3.372 5.932 -16.379 1.00 0.00 H new ATOM 0 HB3 ASP A 68 2.909 7.597 -16.668 1.00 0.00 H new ATOM 1055 N THR A 69 2.232 6.287 -14.070 1.00 0.00 N ATOM 1056 CA THR A 69 1.067 6.174 -13.201 1.00 0.00 C ATOM 1057 C THR A 69 1.482 5.949 -11.752 1.00 0.00 C ATOM 1058 O THR A 69 1.018 6.643 -10.848 1.00 0.00 O ATOM 1059 CB THR A 69 0.145 5.023 -13.645 1.00 0.00 C ATOM 1060 OG1 THR A 69 -1.053 5.025 -12.861 1.00 0.00 O ATOM 1061 CG2 THR A 69 0.848 3.681 -13.502 1.00 0.00 C ATOM 0 H THR A 69 2.361 5.500 -14.706 1.00 0.00 H new ATOM 0 HA THR A 69 0.523 7.115 -13.277 1.00 0.00 H new ATOM 0 HB THR A 69 -0.108 5.173 -14.695 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.635 4.291 -13.150 1.00 0.00 H new ATOM 0 HG21 THR A 69 0.178 2.883 -13.821 1.00 0.00 H new ATOM 0 HG22 THR A 69 1.744 3.672 -14.122 1.00 0.00 H new ATOM 0 HG23 THR A 69 1.126 3.525 -12.460 1.00 0.00 H new ATOM 1069 N GLY A 70 2.359 4.973 -11.537 1.00 0.00 N ATOM 1070 CA GLY A 70 2.823 4.674 -10.194 1.00 0.00 C ATOM 1071 C GLY A 70 1.768 3.974 -9.360 1.00 0.00 C ATOM 1072 O GLY A 70 1.154 4.585 -8.486 1.00 0.00 O ATOM 0 H GLY A 70 2.757 4.384 -12.269 1.00 0.00 H new ATOM 0 HA2 GLY A 70 3.712 4.046 -10.251 1.00 0.00 H new ATOM 0 HA3 GLY A 70 3.118 5.600 -9.700 1.00 0.00 H new ATOM 1076 N GLU A 71 1.557 2.690 -9.632 1.00 0.00 N ATOM 1077 CA GLU A 71 0.567 1.908 -8.900 1.00 0.00 C ATOM 1078 C GLU A 71 1.183 0.621 -8.359 1.00 0.00 C ATOM 1079 O GLU A 71 2.021 -0.002 -9.012 1.00 0.00 O ATOM 1080 CB GLU A 71 -0.622 1.577 -9.804 1.00 0.00 C ATOM 1081 CG GLU A 71 -1.325 2.804 -10.360 1.00 0.00 C ATOM 1082 CD GLU A 71 -2.131 3.542 -9.309 1.00 0.00 C ATOM 1083 OE1 GLU A 71 -1.523 4.282 -8.508 1.00 0.00 O ATOM 1084 OE2 GLU A 71 -3.369 3.378 -9.287 1.00 0.00 O ATOM 0 H GLU A 71 2.057 2.170 -10.353 1.00 0.00 H new ATOM 0 HA GLU A 71 0.219 2.506 -8.058 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -0.276 0.960 -10.633 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.340 0.981 -9.241 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -0.584 3.481 -10.785 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -1.985 2.502 -11.173 1.00 0.00 H new ATOM 1091 N LEU A 72 0.762 0.230 -7.161 1.00 0.00 N ATOM 1092 CA LEU A 72 1.272 -0.983 -6.530 1.00 0.00 C ATOM 1093 C LEU A 72 0.446 -2.198 -6.940 1.00 0.00 C ATOM 1094 O LEU A 72 -0.782 -2.180 -6.868 1.00 0.00 O ATOM 1095 CB LEU A 72 1.259 -0.833 -5.008 1.00 0.00 C ATOM 1096 CG LEU A 72 2.193 -1.764 -4.233 1.00 0.00 C ATOM 1097 CD1 LEU A 72 3.643 -1.351 -4.433 1.00 0.00 C ATOM 1098 CD2 LEU A 72 1.836 -1.767 -2.754 1.00 0.00 C ATOM 0 H LEU A 72 0.070 0.735 -6.607 1.00 0.00 H new ATOM 0 HA LEU A 72 2.298 -1.134 -6.865 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.519 0.197 -4.762 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.241 -0.997 -4.656 1.00 0.00 H new ATOM 0 HG LEU A 72 2.068 -2.776 -4.618 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.293 -2.024 -3.875 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.893 -1.401 -5.493 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.783 -0.331 -4.075 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.511 -2.435 -2.218 1.00 0.00 H new ATOM 0 HD22 LEU A 72 1.932 -0.757 -2.355 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.809 -2.111 -2.628 1.00 0.00 H new ATOM 1110 N ASN A 73 1.130 -3.254 -7.368 1.00 0.00 N ATOM 1111 CA ASN A 73 0.460 -4.480 -7.788 1.00 0.00 C ATOM 1112 C ASN A 73 1.286 -5.707 -7.414 1.00 0.00 C ATOM 1113 O ASN A 73 2.412 -5.877 -7.881 1.00 0.00 O ATOM 1114 CB ASN A 73 0.213 -4.459 -9.298 1.00 0.00 C ATOM 1115 CG ASN A 73 -0.384 -5.758 -9.804 1.00 0.00 C ATOM 1116 OD1 ASN A 73 -0.290 -6.795 -9.147 1.00 0.00 O ATOM 1117 ND2 ASN A 73 -1.002 -5.707 -10.978 1.00 0.00 N ATOM 0 H ASN A 73 2.147 -3.286 -7.433 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.498 -4.537 -7.270 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -0.457 -3.635 -9.542 1.00 0.00 H new ATOM 0 HB3 ASN A 73 1.154 -4.269 -9.815 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -1.423 -6.549 -11.370 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -1.056 -4.825 -11.488 1.00 0.00 H new ATOM 1124 N VAL A 74 0.718 -6.561 -6.568 1.00 0.00 N ATOM 1125 CA VAL A 74 1.400 -7.773 -6.132 1.00 0.00 C ATOM 1126 C VAL A 74 1.298 -8.871 -7.186 1.00 0.00 C ATOM 1127 O VAL A 74 0.204 -9.214 -7.637 1.00 0.00 O ATOM 1128 CB VAL A 74 0.822 -8.296 -4.804 1.00 0.00 C ATOM 1129 CG1 VAL A 74 -0.603 -8.791 -5.000 1.00 0.00 C ATOM 1130 CG2 VAL A 74 1.704 -9.398 -4.236 1.00 0.00 C ATOM 0 H VAL A 74 -0.213 -6.435 -6.171 1.00 0.00 H new ATOM 0 HA VAL A 74 2.448 -7.511 -5.985 1.00 0.00 H new ATOM 0 HB VAL A 74 0.801 -7.474 -4.089 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.995 -9.157 -4.051 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.227 -7.972 -5.359 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -0.610 -9.599 -5.731 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.280 -9.756 -3.298 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.759 -10.222 -4.947 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.705 -9.006 -4.056 1.00 0.00 H new ATOM 1140 N THR A 75 2.444 -9.420 -7.574 1.00 0.00 N ATOM 1141 CA THR A 75 2.484 -10.478 -8.575 1.00 0.00 C ATOM 1142 C THR A 75 2.900 -11.807 -7.954 1.00 0.00 C ATOM 1143 O THR A 75 3.668 -12.566 -8.546 1.00 0.00 O ATOM 1144 CB THR A 75 3.456 -10.133 -9.720 1.00 0.00 C ATOM 1145 OG1 THR A 75 4.794 -10.049 -9.218 1.00 0.00 O ATOM 1146 CG2 THR A 75 3.071 -8.816 -10.377 1.00 0.00 C ATOM 0 H THR A 75 3.358 -9.149 -7.210 1.00 0.00 H new ATOM 0 HA THR A 75 1.476 -10.568 -8.979 1.00 0.00 H new ATOM 0 HB THR A 75 3.399 -10.924 -10.468 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.875 -9.269 -8.631 1.00 0.00 H new ATOM 0 HG21 THR A 75 3.771 -8.593 -11.182 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.063 -8.893 -10.784 1.00 0.00 H new ATOM 0 HG23 THR A 75 3.103 -8.017 -9.636 1.00 0.00 H new ATOM 1154 N SER A 76 2.389 -12.082 -6.759 1.00 0.00 N ATOM 1155 CA SER A 76 2.710 -13.318 -6.056 1.00 0.00 C ATOM 1156 C SER A 76 1.694 -13.596 -4.952 1.00 0.00 C ATOM 1157 O SER A 76 1.005 -12.688 -4.486 1.00 0.00 O ATOM 1158 CB SER A 76 4.118 -13.241 -5.462 1.00 0.00 C ATOM 1159 OG SER A 76 4.561 -14.517 -5.034 1.00 0.00 O ATOM 0 H SER A 76 1.750 -11.465 -6.257 1.00 0.00 H new ATOM 0 HA SER A 76 2.671 -14.136 -6.775 1.00 0.00 H new ATOM 0 HB2 SER A 76 4.809 -12.843 -6.206 1.00 0.00 H new ATOM 0 HB3 SER A 76 4.123 -12.549 -4.620 1.00 0.00 H new ATOM 0 HG SER A 76 5.464 -14.441 -4.660 1.00 0.00 H new ATOM 1165 N ILE A 77 1.608 -14.855 -4.538 1.00 0.00 N ATOM 1166 CA ILE A 77 0.679 -15.252 -3.488 1.00 0.00 C ATOM 1167 C ILE A 77 1.332 -15.167 -2.114 1.00 0.00 C ATOM 1168 O ILE A 77 2.072 -16.064 -1.708 1.00 0.00 O ATOM 1169 CB ILE A 77 0.159 -16.685 -3.709 1.00 0.00 C ATOM 1170 CG1 ILE A 77 -0.533 -16.797 -5.069 1.00 0.00 C ATOM 1171 CG2 ILE A 77 -0.792 -17.082 -2.590 1.00 0.00 C ATOM 1172 CD1 ILE A 77 -1.633 -15.778 -5.272 1.00 0.00 C ATOM 0 H ILE A 77 2.171 -15.618 -4.914 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.161 -14.558 -3.531 1.00 0.00 H new ATOM 0 HB ILE A 77 1.008 -17.369 -3.698 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.211 -16.679 -5.857 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.952 -17.798 -5.173 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.151 -18.097 -2.760 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.269 -17.038 -1.635 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.639 -16.396 -2.572 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.079 -15.916 -6.257 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.397 -15.910 -4.506 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.216 -14.773 -5.200 1.00 0.00 H new ATOM 1184 N LEU A 78 1.053 -14.082 -1.399 1.00 0.00 N ATOM 1185 CA LEU A 78 1.613 -13.879 -0.067 1.00 0.00 C ATOM 1186 C LEU A 78 1.526 -15.157 0.761 1.00 0.00 C ATOM 1187 O LEU A 78 0.664 -16.004 0.525 1.00 0.00 O ATOM 1188 CB LEU A 78 0.878 -12.744 0.648 1.00 0.00 C ATOM 1189 CG LEU A 78 0.820 -11.409 -0.095 1.00 0.00 C ATOM 1190 CD1 LEU A 78 -0.258 -10.515 0.497 1.00 0.00 C ATOM 1191 CD2 LEU A 78 2.174 -10.715 -0.052 1.00 0.00 C ATOM 0 H LEU A 78 0.443 -13.330 -1.719 1.00 0.00 H new ATOM 0 HA LEU A 78 2.664 -13.611 -0.178 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.143 -13.069 0.850 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.357 -12.579 1.613 1.00 0.00 H new ATOM 0 HG LEU A 78 0.568 -11.606 -1.137 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.284 -9.569 -0.045 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.226 -11.008 0.413 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.037 -10.325 1.547 1.00 0.00 H new ATOM 0 HD21 LEU A 78 2.114 -9.767 -0.586 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.456 -10.531 0.985 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.924 -11.350 -0.524 1.00 0.00 H new ATOM 1203 N ASP A 79 2.422 -15.289 1.733 1.00 0.00 N ATOM 1204 CA ASP A 79 2.445 -16.462 2.598 1.00 0.00 C ATOM 1205 C ASP A 79 2.956 -16.101 3.989 1.00 0.00 C ATOM 1206 O ASP A 79 3.986 -15.441 4.131 1.00 0.00 O ATOM 1207 CB ASP A 79 3.321 -17.556 1.987 1.00 0.00 C ATOM 1208 CG ASP A 79 3.058 -17.749 0.507 1.00 0.00 C ATOM 1209 OD1 ASP A 79 1.971 -18.255 0.158 1.00 0.00 O ATOM 1210 OD2 ASP A 79 3.940 -17.394 -0.303 1.00 0.00 O ATOM 0 H ASP A 79 3.142 -14.597 1.941 1.00 0.00 H new ATOM 0 HA ASP A 79 1.425 -16.835 2.691 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.371 -17.303 2.136 1.00 0.00 H new ATOM 0 HB3 ASP A 79 3.142 -18.495 2.510 1.00 0.00 H new ATOM 1215 N ARG A 80 2.230 -16.537 5.013 1.00 0.00 N ATOM 1216 CA ARG A 80 2.609 -16.258 6.393 1.00 0.00 C ATOM 1217 C ARG A 80 3.825 -17.084 6.800 1.00 0.00 C ATOM 1218 O ARG A 80 4.779 -16.559 7.374 1.00 0.00 O ATOM 1219 CB ARG A 80 1.440 -16.553 7.335 1.00 0.00 C ATOM 1220 CG ARG A 80 1.569 -15.883 8.693 1.00 0.00 C ATOM 1221 CD ARG A 80 0.241 -15.868 9.435 1.00 0.00 C ATOM 1222 NE ARG A 80 0.401 -15.483 10.835 1.00 0.00 N ATOM 1223 CZ ARG A 80 -0.592 -15.022 11.587 1.00 0.00 C ATOM 1224 NH1 ARG A 80 -1.808 -14.889 11.078 1.00 0.00 N ATOM 1225 NH2 ARG A 80 -0.368 -14.692 12.853 1.00 0.00 N ATOM 0 H ARG A 80 1.376 -17.085 4.913 1.00 0.00 H new ATOM 0 HA ARG A 80 2.868 -15.202 6.466 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.513 -16.225 6.864 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.362 -17.631 7.477 1.00 0.00 H new ATOM 0 HG2 ARG A 80 2.315 -16.408 9.290 1.00 0.00 H new ATOM 0 HG3 ARG A 80 1.926 -14.861 8.564 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -0.441 -15.174 8.944 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.216 -16.856 9.381 1.00 0.00 H new ATOM 0 HE ARG A 80 1.325 -15.573 11.258 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -1.984 -15.141 10.105 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -2.568 -14.535 11.659 1.00 0.00 H new ATOM 0 HH21 ARG A 80 0.567 -14.792 13.248 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -1.131 -14.338 13.430 1.00 0.00 H new ATOM 1239 N GLU A 81 3.784 -18.378 6.499 1.00 0.00 N ATOM 1240 CA GLU A 81 4.882 -19.276 6.836 1.00 0.00 C ATOM 1241 C GLU A 81 6.221 -18.680 6.410 1.00 0.00 C ATOM 1242 O GLU A 81 7.162 -18.616 7.200 1.00 0.00 O ATOM 1243 CB GLU A 81 4.681 -20.637 6.166 1.00 0.00 C ATOM 1244 CG GLU A 81 3.595 -21.479 6.814 1.00 0.00 C ATOM 1245 CD GLU A 81 3.748 -22.958 6.516 1.00 0.00 C ATOM 1246 OE1 GLU A 81 3.196 -23.418 5.495 1.00 0.00 O ATOM 1247 OE2 GLU A 81 4.421 -23.655 7.304 1.00 0.00 O ATOM 0 H GLU A 81 3.002 -18.828 6.022 1.00 0.00 H new ATOM 0 HA GLU A 81 4.890 -19.410 7.918 1.00 0.00 H new ATOM 0 HB2 GLU A 81 4.432 -20.483 5.116 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.621 -21.188 6.193 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.617 -21.325 7.893 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.620 -21.140 6.463 1.00 0.00 H new ATOM 1254 N GLU A 82 6.298 -18.246 5.156 1.00 0.00 N ATOM 1255 CA GLU A 82 7.522 -17.657 4.625 1.00 0.00 C ATOM 1256 C GLU A 82 7.780 -16.288 5.246 1.00 0.00 C ATOM 1257 O GLU A 82 8.829 -16.053 5.848 1.00 0.00 O ATOM 1258 CB GLU A 82 7.435 -17.531 3.103 1.00 0.00 C ATOM 1259 CG GLU A 82 8.784 -17.350 2.429 1.00 0.00 C ATOM 1260 CD GLU A 82 9.472 -18.669 2.135 1.00 0.00 C ATOM 1261 OE1 GLU A 82 9.173 -19.661 2.833 1.00 0.00 O ATOM 1262 OE2 GLU A 82 10.308 -18.710 1.209 1.00 0.00 O ATOM 0 H GLU A 82 5.528 -18.291 4.489 1.00 0.00 H new ATOM 0 HA GLU A 82 8.352 -18.315 4.881 1.00 0.00 H new ATOM 0 HB2 GLU A 82 6.954 -18.422 2.700 1.00 0.00 H new ATOM 0 HB3 GLU A 82 6.797 -16.683 2.853 1.00 0.00 H new ATOM 0 HG2 GLU A 82 8.650 -16.799 1.498 1.00 0.00 H new ATOM 0 HG3 GLU A 82 9.427 -16.744 3.068 1.00 0.00 H new ATOM 1269 N THR A 83 6.816 -15.385 5.095 1.00 0.00 N ATOM 1270 CA THR A 83 6.939 -14.038 5.639 1.00 0.00 C ATOM 1271 C THR A 83 5.679 -13.634 6.397 1.00 0.00 C ATOM 1272 O THR A 83 4.562 -13.731 5.888 1.00 0.00 O ATOM 1273 CB THR A 83 7.209 -13.006 4.528 1.00 0.00 C ATOM 1274 OG1 THR A 83 6.268 -13.176 3.462 1.00 0.00 O ATOM 1275 CG2 THR A 83 8.625 -13.149 3.989 1.00 0.00 C ATOM 0 H THR A 83 5.942 -15.562 4.601 1.00 0.00 H new ATOM 0 HA THR A 83 7.785 -14.051 6.326 1.00 0.00 H new ATOM 0 HB THR A 83 7.098 -12.009 4.954 1.00 0.00 H new ATOM 0 HG1 THR A 83 6.129 -12.318 3.008 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.792 -12.410 3.206 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.340 -12.990 4.797 1.00 0.00 H new ATOM 0 HG23 THR A 83 8.759 -14.150 3.578 1.00 0.00 H new ATOM 1283 N PRO A 84 5.860 -13.169 7.642 1.00 0.00 N ATOM 1284 CA PRO A 84 4.749 -12.739 8.495 1.00 0.00 C ATOM 1285 C PRO A 84 4.104 -11.449 8.002 1.00 0.00 C ATOM 1286 O PRO A 84 2.889 -11.275 8.096 1.00 0.00 O ATOM 1287 CB PRO A 84 5.412 -12.519 9.857 1.00 0.00 C ATOM 1288 CG PRO A 84 6.838 -12.224 9.541 1.00 0.00 C ATOM 1289 CD PRO A 84 7.164 -13.026 8.311 1.00 0.00 C ATOM 0 HA PRO A 84 3.942 -13.471 8.512 1.00 0.00 H new ATOM 0 HB2 PRO A 84 4.947 -11.693 10.395 1.00 0.00 H new ATOM 0 HB3 PRO A 84 5.321 -13.402 10.489 1.00 0.00 H new ATOM 0 HG2 PRO A 84 6.986 -11.159 9.363 1.00 0.00 H new ATOM 0 HG3 PRO A 84 7.487 -12.502 10.371 1.00 0.00 H new ATOM 0 HD2 PRO A 84 7.887 -12.513 7.677 1.00 0.00 H new ATOM 0 HD3 PRO A 84 7.594 -13.995 8.565 1.00 0.00 H new ATOM 1297 N PHE A 85 4.925 -10.546 7.475 1.00 0.00 N ATOM 1298 CA PHE A 85 4.434 -9.270 6.967 1.00 0.00 C ATOM 1299 C PHE A 85 5.447 -8.637 6.017 1.00 0.00 C ATOM 1300 O PHE A 85 6.566 -9.129 5.868 1.00 0.00 O ATOM 1301 CB PHE A 85 4.138 -8.316 8.125 1.00 0.00 C ATOM 1302 CG PHE A 85 5.253 -8.226 9.128 1.00 0.00 C ATOM 1303 CD1 PHE A 85 6.386 -7.475 8.859 1.00 0.00 C ATOM 1304 CD2 PHE A 85 5.168 -8.894 10.339 1.00 0.00 C ATOM 1305 CE1 PHE A 85 7.413 -7.390 9.780 1.00 0.00 C ATOM 1306 CE2 PHE A 85 6.192 -8.813 11.264 1.00 0.00 C ATOM 1307 CZ PHE A 85 7.316 -8.061 10.984 1.00 0.00 C ATOM 0 H PHE A 85 5.933 -10.674 7.389 1.00 0.00 H new ATOM 0 HA PHE A 85 3.513 -9.457 6.415 1.00 0.00 H new ATOM 0 HB2 PHE A 85 3.939 -7.322 7.724 1.00 0.00 H new ATOM 0 HB3 PHE A 85 3.230 -8.643 8.632 1.00 0.00 H new ATOM 0 HD1 PHE A 85 6.468 -6.950 7.919 1.00 0.00 H new ATOM 0 HD2 PHE A 85 4.292 -9.485 10.563 1.00 0.00 H new ATOM 0 HE1 PHE A 85 8.290 -6.800 9.559 1.00 0.00 H new ATOM 0 HE2 PHE A 85 6.113 -9.337 12.205 1.00 0.00 H new ATOM 0 HZ PHE A 85 8.118 -7.997 11.705 1.00 0.00 H new ATOM 1317 N PHE A 86 5.046 -7.544 5.377 1.00 0.00 N ATOM 1318 CA PHE A 86 5.917 -6.844 4.441 1.00 0.00 C ATOM 1319 C PHE A 86 6.043 -5.370 4.814 1.00 0.00 C ATOM 1320 O PHE A 86 5.059 -4.630 4.812 1.00 0.00 O ATOM 1321 CB PHE A 86 5.378 -6.976 3.014 1.00 0.00 C ATOM 1322 CG PHE A 86 5.678 -8.304 2.381 1.00 0.00 C ATOM 1323 CD1 PHE A 86 4.795 -9.364 2.511 1.00 0.00 C ATOM 1324 CD2 PHE A 86 6.843 -8.493 1.655 1.00 0.00 C ATOM 1325 CE1 PHE A 86 5.070 -10.587 1.930 1.00 0.00 C ATOM 1326 CE2 PHE A 86 7.123 -9.714 1.071 1.00 0.00 C ATOM 1327 CZ PHE A 86 6.234 -10.762 1.208 1.00 0.00 C ATOM 0 H PHE A 86 4.123 -7.124 5.490 1.00 0.00 H new ATOM 0 HA PHE A 86 6.906 -7.300 4.493 1.00 0.00 H new ATOM 0 HB2 PHE A 86 4.299 -6.824 3.026 1.00 0.00 H new ATOM 0 HB3 PHE A 86 5.805 -6.184 2.398 1.00 0.00 H new ATOM 0 HD1 PHE A 86 3.882 -9.233 3.073 1.00 0.00 H new ATOM 0 HD2 PHE A 86 7.541 -7.676 1.544 1.00 0.00 H new ATOM 0 HE1 PHE A 86 4.375 -11.406 2.041 1.00 0.00 H new ATOM 0 HE2 PHE A 86 8.035 -9.848 0.509 1.00 0.00 H new ATOM 0 HZ PHE A 86 6.449 -11.717 0.751 1.00 0.00 H new ATOM 1337 N LEU A 87 7.262 -4.950 5.135 1.00 0.00 N ATOM 1338 CA LEU A 87 7.520 -3.564 5.511 1.00 0.00 C ATOM 1339 C LEU A 87 8.078 -2.774 4.332 1.00 0.00 C ATOM 1340 O LEU A 87 9.256 -2.897 3.991 1.00 0.00 O ATOM 1341 CB LEU A 87 8.497 -3.507 6.687 1.00 0.00 C ATOM 1342 CG LEU A 87 7.892 -3.732 8.073 1.00 0.00 C ATOM 1343 CD1 LEU A 87 8.982 -3.749 9.134 1.00 0.00 C ATOM 1344 CD2 LEU A 87 6.859 -2.659 8.385 1.00 0.00 C ATOM 0 H LEU A 87 8.087 -5.549 5.142 1.00 0.00 H new ATOM 0 HA LEU A 87 6.574 -3.113 5.811 1.00 0.00 H new ATOM 0 HB2 LEU A 87 9.273 -4.255 6.525 1.00 0.00 H new ATOM 0 HB3 LEU A 87 8.987 -2.533 6.680 1.00 0.00 H new ATOM 0 HG LEU A 87 7.393 -4.701 8.078 1.00 0.00 H new ATOM 0 HD11 LEU A 87 8.533 -3.910 10.114 1.00 0.00 H new ATOM 0 HD12 LEU A 87 9.685 -4.554 8.920 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.510 -2.795 9.129 1.00 0.00 H new ATOM 0 HD21 LEU A 87 6.439 -2.835 9.375 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.334 -1.678 8.362 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.062 -2.694 7.642 1.00 0.00 H new ATOM 1356 N LEU A 88 7.228 -1.961 3.715 1.00 0.00 N ATOM 1357 CA LEU A 88 7.637 -1.149 2.575 1.00 0.00 C ATOM 1358 C LEU A 88 7.678 0.330 2.947 1.00 0.00 C ATOM 1359 O LEU A 88 7.438 0.700 4.097 1.00 0.00 O ATOM 1360 CB LEU A 88 6.681 -1.364 1.400 1.00 0.00 C ATOM 1361 CG LEU A 88 6.413 -2.819 1.012 1.00 0.00 C ATOM 1362 CD1 LEU A 88 5.216 -2.909 0.077 1.00 0.00 C ATOM 1363 CD2 LEU A 88 7.645 -3.434 0.365 1.00 0.00 C ATOM 0 H LEU A 88 6.251 -1.847 3.985 1.00 0.00 H new ATOM 0 HA LEU A 88 8.640 -1.459 2.281 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.729 -0.892 1.641 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.083 -0.845 0.530 1.00 0.00 H new ATOM 0 HG LEU A 88 6.185 -3.381 1.918 1.00 0.00 H new ATOM 0 HD11 LEU A 88 5.040 -3.951 -0.189 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.334 -2.507 0.576 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.416 -2.333 -0.826 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.436 -4.469 0.096 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.905 -2.871 -0.532 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.478 -3.403 1.067 1.00 0.00 H new ATOM 1375 N THR A 89 7.982 1.174 1.965 1.00 0.00 N ATOM 1376 CA THR A 89 8.053 2.612 2.189 1.00 0.00 C ATOM 1377 C THR A 89 7.926 3.380 0.878 1.00 0.00 C ATOM 1378 O THR A 89 8.577 3.047 -0.112 1.00 0.00 O ATOM 1379 CB THR A 89 9.372 3.009 2.878 1.00 0.00 C ATOM 1380 OG1 THR A 89 9.604 2.169 4.014 1.00 0.00 O ATOM 1381 CG2 THR A 89 9.337 4.466 3.317 1.00 0.00 C ATOM 0 H THR A 89 8.183 0.886 1.007 1.00 0.00 H new ATOM 0 HA THR A 89 7.219 2.872 2.841 1.00 0.00 H new ATOM 0 HB THR A 89 10.183 2.882 2.161 1.00 0.00 H new ATOM 0 HG1 THR A 89 8.746 1.859 4.373 1.00 0.00 H new ATOM 0 HG21 THR A 89 10.279 4.723 3.801 1.00 0.00 H new ATOM 0 HG22 THR A 89 9.190 5.105 2.446 1.00 0.00 H new ATOM 0 HG23 THR A 89 8.516 4.615 4.019 1.00 0.00 H new ATOM 1389 N GLY A 90 7.085 4.409 0.878 1.00 0.00 N ATOM 1390 CA GLY A 90 6.889 5.208 -0.318 1.00 0.00 C ATOM 1391 C GLY A 90 7.767 6.444 -0.339 1.00 0.00 C ATOM 1392 O GLY A 90 7.993 7.071 0.696 1.00 0.00 O ATOM 0 H GLY A 90 6.535 4.704 1.685 1.00 0.00 H new ATOM 0 HA2 GLY A 90 7.102 4.600 -1.197 1.00 0.00 H new ATOM 0 HA3 GLY A 90 5.843 5.508 -0.384 1.00 0.00 H new ATOM 1396 N TYR A 91 8.263 6.794 -1.520 1.00 0.00 N ATOM 1397 CA TYR A 91 9.125 7.961 -1.671 1.00 0.00 C ATOM 1398 C TYR A 91 8.693 8.805 -2.866 1.00 0.00 C ATOM 1399 O TYR A 91 8.864 8.405 -4.017 1.00 0.00 O ATOM 1400 CB TYR A 91 10.582 7.527 -1.839 1.00 0.00 C ATOM 1401 CG TYR A 91 11.162 6.865 -0.609 1.00 0.00 C ATOM 1402 CD1 TYR A 91 11.789 7.616 0.377 1.00 0.00 C ATOM 1403 CD2 TYR A 91 11.083 5.489 -0.434 1.00 0.00 C ATOM 1404 CE1 TYR A 91 12.321 7.016 1.502 1.00 0.00 C ATOM 1405 CE2 TYR A 91 11.611 4.881 0.688 1.00 0.00 C ATOM 1406 CZ TYR A 91 12.229 5.648 1.653 1.00 0.00 C ATOM 1407 OH TYR A 91 12.757 5.045 2.771 1.00 0.00 O ATOM 0 H TYR A 91 8.083 6.287 -2.387 1.00 0.00 H new ATOM 0 HA TYR A 91 9.035 8.567 -0.769 1.00 0.00 H new ATOM 0 HB2 TYR A 91 10.652 6.837 -2.680 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.185 8.399 -2.091 1.00 0.00 H new ATOM 0 HD1 TYR A 91 11.862 8.687 0.262 1.00 0.00 H new ATOM 0 HD2 TYR A 91 10.601 4.885 -1.188 1.00 0.00 H new ATOM 0 HE1 TYR A 91 12.806 7.615 2.259 1.00 0.00 H new ATOM 0 HE2 TYR A 91 11.540 3.810 0.809 1.00 0.00 H new ATOM 0 HH TYR A 91 12.607 4.078 2.723 1.00 0.00 H new ATOM 1417 N ALA A 92 8.133 9.977 -2.583 1.00 0.00 N ATOM 1418 CA ALA A 92 7.679 10.880 -3.633 1.00 0.00 C ATOM 1419 C ALA A 92 8.831 11.723 -4.168 1.00 0.00 C ATOM 1420 O ALA A 92 9.013 12.872 -3.763 1.00 0.00 O ATOM 1421 CB ALA A 92 6.563 11.775 -3.114 1.00 0.00 C ATOM 0 H ALA A 92 7.983 10.323 -1.635 1.00 0.00 H new ATOM 0 HA ALA A 92 7.293 10.277 -4.455 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.234 12.444 -3.909 1.00 0.00 H new ATOM 0 HB2 ALA A 92 5.725 11.159 -2.788 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.930 12.364 -2.273 1.00 0.00 H new ATOM 1427 N LEU A 93 9.607 11.147 -5.079 1.00 0.00 N ATOM 1428 CA LEU A 93 10.743 11.846 -5.670 1.00 0.00 C ATOM 1429 C LEU A 93 10.273 12.958 -6.602 1.00 0.00 C ATOM 1430 O LEU A 93 9.316 12.787 -7.357 1.00 0.00 O ATOM 1431 CB LEU A 93 11.629 10.863 -6.437 1.00 0.00 C ATOM 1432 CG LEU A 93 12.230 9.721 -5.617 1.00 0.00 C ATOM 1433 CD1 LEU A 93 13.017 8.777 -6.513 1.00 0.00 C ATOM 1434 CD2 LEU A 93 13.116 10.269 -4.508 1.00 0.00 C ATOM 0 H LEU A 93 9.470 10.197 -5.425 1.00 0.00 H new ATOM 0 HA LEU A 93 11.322 12.294 -4.863 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.042 10.432 -7.248 1.00 0.00 H new ATOM 0 HB3 LEU A 93 12.444 11.422 -6.897 1.00 0.00 H new ATOM 0 HG LEU A 93 11.415 9.160 -5.160 1.00 0.00 H new ATOM 0 HD11 LEU A 93 13.437 7.971 -5.912 1.00 0.00 H new ATOM 0 HD12 LEU A 93 12.355 8.358 -7.270 1.00 0.00 H new ATOM 0 HD13 LEU A 93 13.824 9.325 -7.000 1.00 0.00 H new ATOM 0 HD21 LEU A 93 13.535 9.442 -3.935 1.00 0.00 H new ATOM 0 HD22 LEU A 93 13.925 10.855 -4.945 1.00 0.00 H new ATOM 0 HD23 LEU A 93 12.523 10.904 -3.849 1.00 0.00 H new ATOM 1446 N ASP A 94 10.954 14.098 -6.545 1.00 0.00 N ATOM 1447 CA ASP A 94 10.609 15.238 -7.386 1.00 0.00 C ATOM 1448 C ASP A 94 11.184 15.071 -8.789 1.00 0.00 C ATOM 1449 O ASP A 94 11.944 14.140 -9.053 1.00 0.00 O ATOM 1450 CB ASP A 94 11.125 16.535 -6.761 1.00 0.00 C ATOM 1451 CG ASP A 94 10.455 17.764 -7.342 1.00 0.00 C ATOM 1452 OD1 ASP A 94 9.239 17.703 -7.619 1.00 0.00 O ATOM 1453 OD2 ASP A 94 11.147 18.788 -7.519 1.00 0.00 O ATOM 0 H ASP A 94 11.748 14.257 -5.925 1.00 0.00 H new ATOM 0 HA ASP A 94 9.523 15.287 -7.461 1.00 0.00 H new ATOM 0 HB2 ASP A 94 10.957 16.508 -5.684 1.00 0.00 H new ATOM 0 HB3 ASP A 94 12.202 16.605 -6.914 1.00 0.00 H new ATOM 1458 N ALA A 95 10.813 15.979 -9.686 1.00 0.00 N ATOM 1459 CA ALA A 95 11.292 15.933 -11.062 1.00 0.00 C ATOM 1460 C ALA A 95 12.766 15.543 -11.118 1.00 0.00 C ATOM 1461 O ALA A 95 13.177 14.756 -11.970 1.00 0.00 O ATOM 1462 CB ALA A 95 11.074 17.277 -11.742 1.00 0.00 C ATOM 0 H ALA A 95 10.182 16.755 -9.484 1.00 0.00 H new ATOM 0 HA ALA A 95 10.721 15.172 -11.594 1.00 0.00 H new ATOM 0 HB1 ALA A 95 11.436 17.228 -12.769 1.00 0.00 H new ATOM 0 HB2 ALA A 95 10.010 17.516 -11.743 1.00 0.00 H new ATOM 0 HB3 ALA A 95 11.619 18.051 -11.201 1.00 0.00 H new ATOM 1468 N ARG A 96 13.555 16.099 -10.205 1.00 0.00 N ATOM 1469 CA ARG A 96 14.983 15.811 -10.152 1.00 0.00 C ATOM 1470 C ARG A 96 15.231 14.370 -9.713 1.00 0.00 C ATOM 1471 O ARG A 96 16.082 13.678 -10.270 1.00 0.00 O ATOM 1472 CB ARG A 96 15.685 16.775 -9.194 1.00 0.00 C ATOM 1473 CG ARG A 96 16.182 18.045 -9.864 1.00 0.00 C ATOM 1474 CD ARG A 96 16.690 19.052 -8.843 1.00 0.00 C ATOM 1475 NE ARG A 96 18.072 18.787 -8.454 1.00 0.00 N ATOM 1476 CZ ARG A 96 18.729 19.497 -7.543 1.00 0.00 C ATOM 1477 NH1 ARG A 96 18.131 20.509 -6.930 1.00 0.00 N ATOM 1478 NH2 ARG A 96 19.985 19.195 -7.244 1.00 0.00 N ATOM 0 H ARG A 96 13.230 16.752 -9.492 1.00 0.00 H new ATOM 0 HA ARG A 96 15.392 15.944 -11.154 1.00 0.00 H new ATOM 0 HB2 ARG A 96 14.997 17.043 -8.392 1.00 0.00 H new ATOM 0 HB3 ARG A 96 16.529 16.264 -8.732 1.00 0.00 H new ATOM 0 HG2 ARG A 96 16.981 17.800 -10.563 1.00 0.00 H new ATOM 0 HG3 ARG A 96 15.375 18.491 -10.446 1.00 0.00 H new ATOM 0 HD2 ARG A 96 16.617 20.057 -9.258 1.00 0.00 H new ATOM 0 HD3 ARG A 96 16.053 19.025 -7.959 1.00 0.00 H new ATOM 0 HE ARG A 96 18.560 18.014 -8.907 1.00 0.00 H new ATOM 0 HH11 ARG A 96 17.165 20.744 -7.157 1.00 0.00 H new ATOM 0 HH12 ARG A 96 18.637 21.053 -6.231 1.00 0.00 H new ATOM 0 HH21 ARG A 96 20.448 18.417 -7.714 1.00 0.00 H new ATOM 0 HH22 ARG A 96 20.488 19.741 -6.545 1.00 0.00 H new ATOM 1492 N GLY A 97 14.480 13.925 -8.710 1.00 0.00 N ATOM 1493 CA GLY A 97 14.634 12.571 -8.212 1.00 0.00 C ATOM 1494 C GLY A 97 15.070 12.532 -6.761 1.00 0.00 C ATOM 1495 O GLY A 97 15.728 11.586 -6.329 1.00 0.00 O ATOM 0 H GLY A 97 13.768 14.478 -8.234 1.00 0.00 H new ATOM 0 HA2 GLY A 97 13.689 12.039 -8.318 1.00 0.00 H new ATOM 0 HA3 GLY A 97 15.367 12.044 -8.823 1.00 0.00 H new ATOM 1499 N ASN A 98 14.703 13.563 -6.007 1.00 0.00 N ATOM 1500 CA ASN A 98 15.062 13.643 -4.596 1.00 0.00 C ATOM 1501 C ASN A 98 13.819 13.584 -3.713 1.00 0.00 C ATOM 1502 O ASN A 98 12.807 14.218 -4.006 1.00 0.00 O ATOM 1503 CB ASN A 98 15.837 14.933 -4.318 1.00 0.00 C ATOM 1504 CG ASN A 98 15.300 16.111 -5.108 1.00 0.00 C ATOM 1505 OD1 ASN A 98 14.092 16.244 -5.301 1.00 0.00 O ATOM 1506 ND2 ASN A 98 16.199 16.973 -5.569 1.00 0.00 N ATOM 0 H ASN A 98 14.158 14.354 -6.349 1.00 0.00 H new ATOM 0 HA ASN A 98 15.695 12.788 -4.359 1.00 0.00 H new ATOM 0 HB2 ASN A 98 15.788 15.161 -3.253 1.00 0.00 H new ATOM 0 HB3 ASN A 98 16.888 14.783 -4.564 1.00 0.00 H new ATOM 0 HD21 ASN A 98 15.898 17.785 -6.107 1.00 0.00 H new ATOM 0 HD22 ASN A 98 17.191 16.823 -5.385 1.00 0.00 H new ATOM 1513 N ASN A 99 13.905 12.817 -2.631 1.00 0.00 N ATOM 1514 CA ASN A 99 12.787 12.674 -1.705 1.00 0.00 C ATOM 1515 C ASN A 99 12.561 13.964 -0.922 1.00 0.00 C ATOM 1516 O ASN A 99 12.989 14.089 0.226 1.00 0.00 O ATOM 1517 CB ASN A 99 13.042 11.516 -0.739 1.00 0.00 C ATOM 1518 CG ASN A 99 14.409 11.597 -0.087 1.00 0.00 C ATOM 1519 OD1 ASN A 99 15.436 11.485 -0.756 1.00 0.00 O ATOM 1520 ND2 ASN A 99 14.426 11.792 1.226 1.00 0.00 N ATOM 0 H ASN A 99 14.737 12.285 -2.374 1.00 0.00 H new ATOM 0 HA ASN A 99 11.891 12.461 -2.287 1.00 0.00 H new ATOM 0 HB2 ASN A 99 12.273 11.515 0.034 1.00 0.00 H new ATOM 0 HB3 ASN A 99 12.954 10.572 -1.277 1.00 0.00 H new ATOM 0 HD21 ASN A 99 15.316 11.855 1.721 1.00 0.00 H new ATOM 0 HD22 ASN A 99 13.549 11.879 1.740 1.00 0.00 H new ATOM 1527 N VAL A 100 11.886 14.921 -1.550 1.00 0.00 N ATOM 1528 CA VAL A 100 11.601 16.201 -0.912 1.00 0.00 C ATOM 1529 C VAL A 100 10.573 16.043 0.202 1.00 0.00 C ATOM 1530 O VAL A 100 10.475 16.886 1.093 1.00 0.00 O ATOM 1531 CB VAL A 100 11.084 17.234 -1.931 1.00 0.00 C ATOM 1532 CG1 VAL A 100 12.085 17.417 -3.061 1.00 0.00 C ATOM 1533 CG2 VAL A 100 9.726 16.812 -2.473 1.00 0.00 C ATOM 0 H VAL A 100 11.526 14.834 -2.500 1.00 0.00 H new ATOM 0 HA VAL A 100 12.539 16.559 -0.488 1.00 0.00 H new ATOM 0 HB VAL A 100 10.966 18.192 -1.424 1.00 0.00 H new ATOM 0 HG11 VAL A 100 11.702 18.150 -3.771 1.00 0.00 H new ATOM 0 HG12 VAL A 100 13.034 17.767 -2.654 1.00 0.00 H new ATOM 0 HG13 VAL A 100 12.238 16.465 -3.570 1.00 0.00 H new ATOM 0 HG21 VAL A 100 9.375 17.553 -3.192 1.00 0.00 H new ATOM 0 HG22 VAL A 100 9.816 15.843 -2.965 1.00 0.00 H new ATOM 0 HG23 VAL A 100 9.014 16.737 -1.651 1.00 0.00 H new ATOM 1543 N GLU A 101 9.809 14.957 0.145 1.00 0.00 N ATOM 1544 CA GLU A 101 8.787 14.689 1.150 1.00 0.00 C ATOM 1545 C GLU A 101 9.230 13.574 2.093 1.00 0.00 C ATOM 1546 O GLU A 101 10.070 12.745 1.742 1.00 0.00 O ATOM 1547 CB GLU A 101 7.466 14.308 0.478 1.00 0.00 C ATOM 1548 CG GLU A 101 6.640 15.505 0.038 1.00 0.00 C ATOM 1549 CD GLU A 101 6.541 16.573 1.110 1.00 0.00 C ATOM 1550 OE1 GLU A 101 7.426 17.453 1.153 1.00 0.00 O ATOM 1551 OE2 GLU A 101 5.581 16.527 1.907 1.00 0.00 O ATOM 0 H GLU A 101 9.878 14.249 -0.586 1.00 0.00 H new ATOM 0 HA GLU A 101 8.641 15.598 1.733 1.00 0.00 H new ATOM 0 HB2 GLU A 101 7.677 13.684 -0.390 1.00 0.00 H new ATOM 0 HB3 GLU A 101 6.877 13.705 1.169 1.00 0.00 H new ATOM 0 HG2 GLU A 101 7.083 15.937 -0.860 1.00 0.00 H new ATOM 0 HG3 GLU A 101 5.638 15.171 -0.230 1.00 0.00 H new ATOM 1558 N LYS A 102 8.660 13.560 3.293 1.00 0.00 N ATOM 1559 CA LYS A 102 8.994 12.548 4.288 1.00 0.00 C ATOM 1560 C LYS A 102 8.375 11.202 3.924 1.00 0.00 C ATOM 1561 O LYS A 102 7.175 11.092 3.672 1.00 0.00 O ATOM 1562 CB LYS A 102 8.512 12.986 5.673 1.00 0.00 C ATOM 1563 CG LYS A 102 9.526 13.822 6.434 1.00 0.00 C ATOM 1564 CD LYS A 102 10.454 12.952 7.266 1.00 0.00 C ATOM 1565 CE LYS A 102 11.385 13.794 8.125 1.00 0.00 C ATOM 1566 NZ LYS A 102 10.675 14.395 9.288 1.00 0.00 N ATOM 0 H LYS A 102 7.964 14.239 3.600 1.00 0.00 H new ATOM 0 HA LYS A 102 10.078 12.436 4.306 1.00 0.00 H new ATOM 0 HB2 LYS A 102 7.591 13.558 5.564 1.00 0.00 H new ATOM 0 HB3 LYS A 102 8.269 12.101 6.261 1.00 0.00 H new ATOM 0 HG2 LYS A 102 10.113 14.413 5.731 1.00 0.00 H new ATOM 0 HG3 LYS A 102 9.005 14.525 7.084 1.00 0.00 H new ATOM 0 HD2 LYS A 102 9.863 12.295 7.904 1.00 0.00 H new ATOM 0 HD3 LYS A 102 11.043 12.313 6.608 1.00 0.00 H new ATOM 0 HE2 LYS A 102 12.208 13.175 8.482 1.00 0.00 H new ATOM 0 HE3 LYS A 102 11.822 14.586 7.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 11.362 14.876 9.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 9.973 15.083 8.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 10.194 13.646 9.826 1.00 0.00 H new ATOM 1580 N PRO A 103 9.211 10.153 3.898 1.00 0.00 N ATOM 1581 CA PRO A 103 8.766 8.796 3.568 1.00 0.00 C ATOM 1582 C PRO A 103 7.887 8.193 4.659 1.00 0.00 C ATOM 1583 O PRO A 103 8.306 8.068 5.810 1.00 0.00 O ATOM 1584 CB PRO A 103 10.077 8.014 3.445 1.00 0.00 C ATOM 1585 CG PRO A 103 11.046 8.764 4.291 1.00 0.00 C ATOM 1586 CD PRO A 103 10.653 10.212 4.188 1.00 0.00 C ATOM 0 HA PRO A 103 8.154 8.775 2.666 1.00 0.00 H new ATOM 0 HB2 PRO A 103 9.960 6.988 3.792 1.00 0.00 H new ATOM 0 HB3 PRO A 103 10.412 7.964 2.409 1.00 0.00 H new ATOM 0 HG2 PRO A 103 11.007 8.422 5.325 1.00 0.00 H new ATOM 0 HG3 PRO A 103 12.068 8.611 3.943 1.00 0.00 H new ATOM 0 HD2 PRO A 103 10.855 10.750 5.114 1.00 0.00 H new ATOM 0 HD3 PRO A 103 11.202 10.722 3.396 1.00 0.00 H new ATOM 1594 N LEU A 104 6.667 7.820 4.289 1.00 0.00 N ATOM 1595 CA LEU A 104 5.728 7.229 5.236 1.00 0.00 C ATOM 1596 C LEU A 104 6.068 5.765 5.498 1.00 0.00 C ATOM 1597 O LEU A 104 6.836 5.154 4.756 1.00 0.00 O ATOM 1598 CB LEU A 104 4.298 7.346 4.707 1.00 0.00 C ATOM 1599 CG LEU A 104 4.034 6.715 3.339 1.00 0.00 C ATOM 1600 CD1 LEU A 104 3.994 5.198 3.450 1.00 0.00 C ATOM 1601 CD2 LEU A 104 2.735 7.243 2.750 1.00 0.00 C ATOM 0 H LEU A 104 6.305 7.916 3.340 1.00 0.00 H new ATOM 0 HA LEU A 104 5.806 7.775 6.176 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.625 6.888 5.432 1.00 0.00 H new ATOM 0 HB3 LEU A 104 4.037 8.403 4.654 1.00 0.00 H new ATOM 0 HG LEU A 104 4.850 6.989 2.670 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.805 4.766 2.467 1.00 0.00 H new ATOM 0 HD12 LEU A 104 4.950 4.836 3.828 1.00 0.00 H new ATOM 0 HD13 LEU A 104 3.198 4.904 4.134 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.563 6.783 1.777 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.908 7.000 3.417 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.802 8.325 2.634 1.00 0.00 H new ATOM 1613 N GLU A 105 5.487 5.208 6.556 1.00 0.00 N ATOM 1614 CA GLU A 105 5.728 3.815 6.914 1.00 0.00 C ATOM 1615 C GLU A 105 4.524 2.947 6.562 1.00 0.00 C ATOM 1616 O GLU A 105 3.469 3.044 7.190 1.00 0.00 O ATOM 1617 CB GLU A 105 6.037 3.695 8.408 1.00 0.00 C ATOM 1618 CG GLU A 105 6.610 2.344 8.804 1.00 0.00 C ATOM 1619 CD GLU A 105 7.315 2.381 10.146 1.00 0.00 C ATOM 1620 OE1 GLU A 105 6.784 3.020 11.079 1.00 0.00 O ATOM 1621 OE2 GLU A 105 8.398 1.770 10.264 1.00 0.00 O ATOM 0 H GLU A 105 4.847 5.699 7.180 1.00 0.00 H new ATOM 0 HA GLU A 105 6.587 3.464 6.343 1.00 0.00 H new ATOM 0 HB2 GLU A 105 6.744 4.476 8.688 1.00 0.00 H new ATOM 0 HB3 GLU A 105 5.123 3.873 8.975 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.806 1.609 8.840 1.00 0.00 H new ATOM 0 HG3 GLU A 105 7.311 2.012 8.038 1.00 0.00 H new ATOM 1628 N LEU A 106 4.688 2.099 5.552 1.00 0.00 N ATOM 1629 CA LEU A 106 3.615 1.213 5.114 1.00 0.00 C ATOM 1630 C LEU A 106 3.934 -0.239 5.455 1.00 0.00 C ATOM 1631 O LEU A 106 5.003 -0.746 5.115 1.00 0.00 O ATOM 1632 CB LEU A 106 3.390 1.358 3.608 1.00 0.00 C ATOM 1633 CG LEU A 106 2.582 0.245 2.940 1.00 0.00 C ATOM 1634 CD1 LEU A 106 1.093 0.463 3.156 1.00 0.00 C ATOM 1635 CD2 LEU A 106 2.903 0.171 1.454 1.00 0.00 C ATOM 0 H LEU A 106 5.554 2.006 5.021 1.00 0.00 H new ATOM 0 HA LEU A 106 2.704 1.498 5.640 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.884 2.306 3.426 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.363 1.417 3.120 1.00 0.00 H new ATOM 0 HG LEU A 106 2.859 -0.704 3.398 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.534 -0.339 2.674 1.00 0.00 H new ATOM 0 HD12 LEU A 106 0.877 0.464 4.224 1.00 0.00 H new ATOM 0 HD13 LEU A 106 0.799 1.420 2.725 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.319 -0.627 0.995 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.655 1.121 0.980 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.965 -0.034 1.321 1.00 0.00 H new ATOM 1647 N ARG A 107 3.000 -0.903 6.127 1.00 0.00 N ATOM 1648 CA ARG A 107 3.181 -2.297 6.513 1.00 0.00 C ATOM 1649 C ARG A 107 1.979 -3.138 6.094 1.00 0.00 C ATOM 1650 O ARG A 107 0.832 -2.752 6.315 1.00 0.00 O ATOM 1651 CB ARG A 107 3.392 -2.407 8.024 1.00 0.00 C ATOM 1652 CG ARG A 107 2.242 -1.843 8.842 1.00 0.00 C ATOM 1653 CD ARG A 107 2.602 -1.745 10.316 1.00 0.00 C ATOM 1654 NE ARG A 107 3.770 -0.897 10.539 1.00 0.00 N ATOM 1655 CZ ARG A 107 4.437 -0.852 11.687 1.00 0.00 C ATOM 1656 NH1 ARG A 107 4.053 -1.603 12.711 1.00 0.00 N ATOM 1657 NH2 ARG A 107 5.490 -0.055 11.813 1.00 0.00 N ATOM 0 H ARG A 107 2.110 -0.498 6.416 1.00 0.00 H new ATOM 0 HA ARG A 107 4.065 -2.677 6.001 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.534 -3.455 8.287 1.00 0.00 H new ATOM 0 HB3 ARG A 107 4.309 -1.884 8.293 1.00 0.00 H new ATOM 0 HG2 ARG A 107 1.976 -0.855 8.465 1.00 0.00 H new ATOM 0 HG3 ARG A 107 1.364 -2.477 8.722 1.00 0.00 H new ATOM 0 HD2 ARG A 107 1.753 -1.346 10.871 1.00 0.00 H new ATOM 0 HD3 ARG A 107 2.798 -2.743 10.708 1.00 0.00 H new ATOM 0 HE ARG A 107 4.091 -0.307 9.771 1.00 0.00 H new ATOM 0 HH11 ARG A 107 3.244 -2.217 12.618 1.00 0.00 H new ATOM 0 HH12 ARG A 107 4.567 -1.566 13.591 1.00 0.00 H new ATOM 0 HH21 ARG A 107 5.788 0.524 11.028 1.00 0.00 H new ATOM 0 HH22 ARG A 107 6.001 -0.021 12.695 1.00 0.00 H new ATOM 1671 N ILE A 108 2.252 -4.289 5.487 1.00 0.00 N ATOM 1672 CA ILE A 108 1.193 -5.184 5.037 1.00 0.00 C ATOM 1673 C ILE A 108 1.076 -6.399 5.951 1.00 0.00 C ATOM 1674 O ILE A 108 2.039 -7.144 6.139 1.00 0.00 O ATOM 1675 CB ILE A 108 1.435 -5.662 3.593 1.00 0.00 C ATOM 1676 CG1 ILE A 108 1.573 -4.464 2.652 1.00 0.00 C ATOM 1677 CG2 ILE A 108 0.304 -6.572 3.140 1.00 0.00 C ATOM 1678 CD1 ILE A 108 2.329 -4.778 1.380 1.00 0.00 C ATOM 0 H ILE A 108 3.197 -4.623 5.296 1.00 0.00 H new ATOM 0 HA ILE A 108 0.263 -4.616 5.071 1.00 0.00 H new ATOM 0 HB ILE A 108 2.365 -6.230 3.565 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.579 -4.099 2.393 1.00 0.00 H new ATOM 0 HG13 ILE A 108 2.082 -3.656 3.178 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.489 -6.902 2.118 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.250 -7.440 3.797 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.639 -6.028 3.180 1.00 0.00 H new ATOM 0 HD11 ILE A 108 2.388 -3.883 0.761 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.336 -5.114 1.629 1.00 0.00 H new ATOM 0 HD13 ILE A 108 1.809 -5.564 0.832 1.00 0.00 H new ATOM 1690 N LYS A 109 -0.111 -6.596 6.515 1.00 0.00 N ATOM 1691 CA LYS A 109 -0.357 -7.723 7.407 1.00 0.00 C ATOM 1692 C LYS A 109 -0.868 -8.931 6.629 1.00 0.00 C ATOM 1693 O LYS A 109 -1.874 -8.848 5.924 1.00 0.00 O ATOM 1694 CB LYS A 109 -1.368 -7.334 8.488 1.00 0.00 C ATOM 1695 CG LYS A 109 -1.623 -8.431 9.506 1.00 0.00 C ATOM 1696 CD LYS A 109 -2.748 -8.059 10.457 1.00 0.00 C ATOM 1697 CE LYS A 109 -3.380 -9.293 11.083 1.00 0.00 C ATOM 1698 NZ LYS A 109 -4.802 -9.059 11.457 1.00 0.00 N ATOM 0 H LYS A 109 -0.918 -5.989 6.370 1.00 0.00 H new ATOM 0 HA LYS A 109 0.587 -7.991 7.881 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.009 -6.445 9.007 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.311 -7.066 8.012 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -1.874 -9.357 8.989 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -0.712 -8.620 10.074 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -2.362 -7.409 11.242 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -3.508 -7.493 9.919 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -3.321 -10.126 10.383 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -2.814 -9.581 11.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -5.196 -9.923 11.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -4.857 -8.281 12.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -5.348 -8.809 10.608 1.00 0.00 H new ATOM 1712 N VAL A 110 -0.170 -10.055 6.763 1.00 0.00 N ATOM 1713 CA VAL A 110 -0.555 -11.281 6.074 1.00 0.00 C ATOM 1714 C VAL A 110 -1.608 -12.048 6.866 1.00 0.00 C ATOM 1715 O VAL A 110 -1.304 -12.671 7.883 1.00 0.00 O ATOM 1716 CB VAL A 110 0.661 -12.196 5.837 1.00 0.00 C ATOM 1717 CG1 VAL A 110 0.225 -13.509 5.204 1.00 0.00 C ATOM 1718 CG2 VAL A 110 1.695 -11.494 4.969 1.00 0.00 C ATOM 0 H VAL A 110 0.665 -10.141 7.342 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.972 -10.986 5.111 1.00 0.00 H new ATOM 0 HB VAL A 110 1.120 -12.419 6.800 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.097 -14.143 5.044 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.476 -14.017 5.866 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.259 -13.309 4.248 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.547 -12.155 4.812 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.250 -11.240 4.007 1.00 0.00 H new ATOM 0 HG23 VAL A 110 2.029 -10.583 5.466 1.00 0.00 H new ATOM 1728 N LEU A 111 -2.848 -11.998 6.392 1.00 0.00 N ATOM 1729 CA LEU A 111 -3.949 -12.689 7.055 1.00 0.00 C ATOM 1730 C LEU A 111 -3.921 -14.182 6.743 1.00 0.00 C ATOM 1731 O LEU A 111 -3.692 -14.584 5.602 1.00 0.00 O ATOM 1732 CB LEU A 111 -5.288 -12.091 6.621 1.00 0.00 C ATOM 1733 CG LEU A 111 -5.422 -10.574 6.760 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -6.678 -10.083 6.058 1.00 0.00 C ATOM 1735 CD2 LEU A 111 -5.437 -10.172 8.228 1.00 0.00 C ATOM 0 H LEU A 111 -3.116 -11.486 5.551 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.832 -12.559 8.131 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.461 -12.357 5.578 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.079 -12.561 7.205 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.559 -10.107 6.285 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -6.757 -9.001 6.167 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.626 -10.338 4.999 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.553 -10.557 6.503 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.533 -9.089 8.308 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.281 -10.649 8.727 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -4.508 -10.490 8.702 1.00 0.00 H new ATOM 1747 N ASP A 112 -4.157 -14.999 7.764 1.00 0.00 N ATOM 1748 CA ASP A 112 -4.163 -16.448 7.598 1.00 0.00 C ATOM 1749 C ASP A 112 -5.320 -16.889 6.708 1.00 0.00 C ATOM 1750 O ASP A 112 -6.291 -16.154 6.526 1.00 0.00 O ATOM 1751 CB ASP A 112 -4.259 -17.138 8.960 1.00 0.00 C ATOM 1752 CG ASP A 112 -5.378 -16.577 9.815 1.00 0.00 C ATOM 1753 OD1 ASP A 112 -5.546 -15.340 9.835 1.00 0.00 O ATOM 1754 OD2 ASP A 112 -6.086 -17.375 10.466 1.00 0.00 O ATOM 0 H ASP A 112 -4.347 -14.683 8.715 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.229 -16.738 7.117 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -4.419 -18.206 8.813 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -3.312 -17.027 9.488 1.00 0.00 H new ATOM 1759 N ILE A 113 -5.209 -18.091 6.154 1.00 0.00 N ATOM 1760 CA ILE A 113 -6.246 -18.629 5.282 1.00 0.00 C ATOM 1761 C ILE A 113 -7.568 -18.776 6.027 1.00 0.00 C ATOM 1762 O ILE A 113 -8.641 -18.623 5.444 1.00 0.00 O ATOM 1763 CB ILE A 113 -5.841 -19.998 4.704 1.00 0.00 C ATOM 1764 CG1 ILE A 113 -6.903 -20.495 3.721 1.00 0.00 C ATOM 1765 CG2 ILE A 113 -5.635 -21.007 5.825 1.00 0.00 C ATOM 1766 CD1 ILE A 113 -6.919 -19.734 2.414 1.00 0.00 C ATOM 0 H ILE A 113 -4.411 -18.711 6.293 1.00 0.00 H new ATOM 0 HA ILE A 113 -6.369 -17.920 4.463 1.00 0.00 H new ATOM 0 HB ILE A 113 -4.900 -19.885 4.166 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -6.730 -21.551 3.515 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -7.884 -20.418 4.189 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -5.349 -21.969 5.400 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -4.847 -20.656 6.491 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -6.562 -21.120 6.388 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -7.696 -20.140 1.766 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -7.122 -18.681 2.609 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -5.950 -19.832 1.924 1.00 0.00 H new ATOM 1778 N ASN A 114 -7.484 -19.071 7.320 1.00 0.00 N ATOM 1779 CA ASN A 114 -8.674 -19.237 8.146 1.00 0.00 C ATOM 1780 C ASN A 114 -8.926 -17.993 8.993 1.00 0.00 C ATOM 1781 O ASN A 114 -9.377 -18.089 10.135 1.00 0.00 O ATOM 1782 CB ASN A 114 -8.527 -20.463 9.050 1.00 0.00 C ATOM 1783 CG ASN A 114 -8.441 -21.755 8.261 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -7.383 -22.381 8.187 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -9.557 -22.161 7.667 1.00 0.00 N ATOM 0 H ASN A 114 -6.604 -19.200 7.819 1.00 0.00 H new ATOM 0 HA ASN A 114 -9.528 -19.383 7.484 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -7.632 -20.354 9.663 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -9.376 -20.512 9.732 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -9.560 -23.023 7.122 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -10.411 -21.610 7.755 1.00 0.00 H new ATOM 1792 N ASP A 115 -8.632 -16.829 8.426 1.00 0.00 N ATOM 1793 CA ASP A 115 -8.827 -15.566 9.128 1.00 0.00 C ATOM 1794 C ASP A 115 -10.242 -15.471 9.692 1.00 0.00 C ATOM 1795 O ASP A 115 -10.452 -15.618 10.895 1.00 0.00 O ATOM 1796 CB ASP A 115 -8.560 -14.389 8.189 1.00 0.00 C ATOM 1797 CG ASP A 115 -8.622 -13.052 8.903 1.00 0.00 C ATOM 1798 OD1 ASP A 115 -8.604 -13.046 10.151 1.00 0.00 O ATOM 1799 OD2 ASP A 115 -8.689 -12.013 8.213 1.00 0.00 O ATOM 0 H ASP A 115 -8.258 -16.733 7.482 1.00 0.00 H new ATOM 0 HA ASP A 115 -8.120 -15.527 9.957 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -7.578 -14.508 7.732 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -9.291 -14.400 7.381 1.00 0.00 H new