USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=16 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 Single : A 14 THR OG1 : rot -32:sc= 0.089 USER MOD Single : A 26 SER OG : rot -104:sc= 0.0166 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 29 ASN : amide:sc= -0.564 K(o=-0.56,f=-7!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc= -2.32 K(o=-2.3,f=-1.3) 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+ -174:sc= 0 (180deg=-0.0143) 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+ -179:sc= 0.115 (180deg=0.115) USER MOD Single : A 56 THR OG1 : rot -67:sc= 0.726 USER MOD Single : A 66 ASN : amide:sc= -0.155 K(o=-0.15,f=-0.72) 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 73 ASN : amide:sc= -2.4! C(o=-2.4!,f=-9.9!) USER MOD Single : A 75 THR OG1 : rot 76:sc= 0.39 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 47:sc= 0.33 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.147 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.977 K(o=-0.98,f=-0.091) USER MOD Single : A 99 ASN : amide:sc= 0.551 K(o=0.55,f=-2.9!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 ASN : amide:sc= -0.352 X(o=-0.35,f=-0.49) USER MOD ----------------------------------------------------------------- ATOM 182 N THR A 14 -3.055 7.930 5.284 1.00 0.00 N ATOM 183 CA THR A 14 -2.992 6.588 4.720 1.00 0.00 C ATOM 184 C THR A 14 -3.487 5.548 5.719 1.00 0.00 C ATOM 185 O THR A 14 -3.410 5.752 6.931 1.00 0.00 O ATOM 186 CB THR A 14 -1.559 6.227 4.288 1.00 0.00 C ATOM 187 OG1 THR A 14 -0.664 6.360 5.398 1.00 0.00 O ATOM 188 CG2 THR A 14 -1.096 7.120 3.147 1.00 0.00 C ATOM 0 HA THR A 14 -3.640 6.583 3.843 1.00 0.00 H new ATOM 0 HB THR A 14 -1.557 5.193 3.943 1.00 0.00 H new ATOM 0 HG1 THR A 14 -0.974 7.082 5.983 1.00 0.00 H new ATOM 0 HG21 THR A 14 -0.081 6.846 2.859 1.00 0.00 H new ATOM 0 HG22 THR A 14 -1.762 6.994 2.293 1.00 0.00 H new ATOM 0 HG23 THR A 14 -1.113 8.161 3.470 1.00 0.00 H new ATOM 196 N ALA A 15 -3.994 4.433 5.204 1.00 0.00 N ATOM 197 CA ALA A 15 -4.499 3.360 6.051 1.00 0.00 C ATOM 198 C ALA A 15 -3.677 2.088 5.875 1.00 0.00 C ATOM 199 O ALA A 15 -2.934 1.930 4.905 1.00 0.00 O ATOM 200 CB ALA A 15 -5.965 3.090 5.745 1.00 0.00 C ATOM 0 H ALA A 15 -4.066 4.249 4.203 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.409 3.679 7.090 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.328 2.286 6.385 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -6.547 3.993 5.930 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -6.071 2.798 4.700 1.00 0.00 H new ATOM 206 N PRO A 16 -3.810 1.159 6.832 1.00 0.00 N ATOM 207 CA PRO A 16 -3.087 -0.116 6.805 1.00 0.00 C ATOM 208 C PRO A 16 -3.586 -1.042 5.700 1.00 0.00 C ATOM 209 O PRO A 16 -4.781 -1.089 5.409 1.00 0.00 O ATOM 210 CB PRO A 16 -3.378 -0.719 8.181 1.00 0.00 C ATOM 211 CG PRO A 16 -4.670 -0.107 8.597 1.00 0.00 C ATOM 212 CD PRO A 16 -4.677 1.280 8.016 1.00 0.00 C ATOM 0 HA PRO A 16 -2.025 0.022 6.602 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -3.453 -1.805 8.129 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -2.584 -0.488 8.891 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -5.514 -0.689 8.228 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -4.755 -0.076 9.683 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -5.684 1.597 7.746 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -4.291 2.014 8.723 1.00 0.00 H new ATOM 220 N VAL A 17 -2.663 -1.777 5.088 1.00 0.00 N ATOM 221 CA VAL A 17 -3.009 -2.703 4.017 1.00 0.00 C ATOM 222 C VAL A 17 -2.930 -4.149 4.493 1.00 0.00 C ATOM 223 O VAL A 17 -1.842 -4.685 4.704 1.00 0.00 O ATOM 224 CB VAL A 17 -2.084 -2.523 2.799 1.00 0.00 C ATOM 225 CG1 VAL A 17 -2.446 -3.515 1.703 1.00 0.00 C ATOM 226 CG2 VAL A 17 -2.157 -1.095 2.281 1.00 0.00 C ATOM 0 H VAL A 17 -1.669 -1.749 5.316 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.034 -2.477 3.722 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.058 -2.720 3.111 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.782 -3.373 0.850 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.338 -4.531 2.082 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.478 -3.352 1.391 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.497 -0.986 1.420 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.181 -0.867 1.984 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.845 -0.407 3.067 1.00 0.00 H new ATOM 236 N ALA A 18 -4.089 -4.776 4.660 1.00 0.00 N ATOM 237 CA ALA A 18 -4.151 -6.162 5.109 1.00 0.00 C ATOM 238 C ALA A 18 -4.538 -7.093 3.965 1.00 0.00 C ATOM 239 O ALA A 18 -5.719 -7.362 3.742 1.00 0.00 O ATOM 240 CB ALA A 18 -5.136 -6.300 6.260 1.00 0.00 C ATOM 0 H ALA A 18 -4.999 -4.346 4.491 1.00 0.00 H new ATOM 0 HA ALA A 18 -3.159 -6.450 5.457 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.172 -7.340 6.585 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -4.816 -5.671 7.091 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.127 -5.988 5.930 1.00 0.00 H new ATOM 246 N LEU A 19 -3.536 -7.581 3.242 1.00 0.00 N ATOM 247 CA LEU A 19 -3.772 -8.483 2.119 1.00 0.00 C ATOM 248 C LEU A 19 -3.882 -9.928 2.595 1.00 0.00 C ATOM 249 O LEU A 19 -3.332 -10.293 3.634 1.00 0.00 O ATOM 250 CB LEU A 19 -2.644 -8.356 1.093 1.00 0.00 C ATOM 251 CG LEU A 19 -2.509 -6.996 0.408 1.00 0.00 C ATOM 252 CD1 LEU A 19 -1.135 -6.852 -0.227 1.00 0.00 C ATOM 253 CD2 LEU A 19 -3.603 -6.812 -0.634 1.00 0.00 C ATOM 0 H LEU A 19 -2.553 -7.368 3.413 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.715 -8.202 1.650 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.701 -8.585 1.589 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.792 -9.114 0.324 1.00 0.00 H new ATOM 0 HG LEU A 19 -2.620 -6.218 1.163 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.058 -5.878 -0.710 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -0.368 -6.938 0.542 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -0.993 -7.637 -0.970 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.491 -5.838 -1.111 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.524 -7.596 -1.387 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.579 -6.869 -0.151 1.00 0.00 H new ATOM 265 N ARG A 20 -4.594 -10.745 1.826 1.00 0.00 N ATOM 266 CA ARG A 20 -4.776 -12.151 2.169 1.00 0.00 C ATOM 267 C ARG A 20 -3.932 -13.044 1.264 1.00 0.00 C ATOM 268 O ARG A 20 -3.497 -12.623 0.192 1.00 0.00 O ATOM 269 CB ARG A 20 -6.251 -12.539 2.055 1.00 0.00 C ATOM 270 CG ARG A 20 -7.029 -12.358 3.348 1.00 0.00 C ATOM 271 CD ARG A 20 -8.460 -12.854 3.211 1.00 0.00 C ATOM 272 NE ARG A 20 -9.132 -12.953 4.504 1.00 0.00 N ATOM 273 CZ ARG A 20 -9.717 -11.924 5.108 1.00 0.00 C ATOM 274 NH1 ARG A 20 -9.713 -10.727 4.539 1.00 0.00 N ATOM 275 NH2 ARG A 20 -10.308 -12.093 6.284 1.00 0.00 N ATOM 0 H ARG A 20 -5.054 -10.458 0.962 1.00 0.00 H new ATOM 0 HA ARG A 20 -4.449 -12.294 3.199 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -6.717 -11.939 1.273 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -6.321 -13.581 1.741 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -6.531 -12.899 4.153 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -7.033 -11.304 3.627 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -9.018 -12.177 2.564 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -8.460 -13.831 2.727 1.00 0.00 H new ATOM 0 HE ARG A 20 -9.153 -13.861 4.968 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -9.260 -10.594 3.635 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -10.163 -9.939 5.005 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -10.313 -13.013 6.725 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -10.757 -11.303 6.747 1.00 0.00 H new ATOM 289 N GLU A 21 -3.706 -14.278 1.703 1.00 0.00 N ATOM 290 CA GLU A 21 -2.913 -15.229 0.933 1.00 0.00 C ATOM 291 C GLU A 21 -3.815 -16.180 0.150 1.00 0.00 C ATOM 292 O GLU A 21 -4.618 -16.910 0.729 1.00 0.00 O ATOM 293 CB GLU A 21 -1.993 -16.028 1.858 1.00 0.00 C ATOM 294 CG GLU A 21 -2.739 -16.850 2.896 1.00 0.00 C ATOM 295 CD GLU A 21 -1.817 -17.434 3.949 1.00 0.00 C ATOM 296 OE1 GLU A 21 -0.913 -16.709 4.416 1.00 0.00 O ATOM 297 OE2 GLU A 21 -2.000 -18.617 4.307 1.00 0.00 O ATOM 0 H GLU A 21 -4.061 -14.642 2.587 1.00 0.00 H new ATOM 0 HA GLU A 21 -2.304 -14.666 0.225 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -1.375 -16.694 1.255 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -1.318 -15.340 2.368 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -3.488 -16.223 3.381 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.274 -17.659 2.398 1.00 0.00 H new ATOM 304 N GLY A 22 -3.675 -16.164 -1.172 1.00 0.00 N ATOM 305 CA GLY A 22 -4.483 -17.027 -2.014 1.00 0.00 C ATOM 306 C GLY A 22 -4.907 -16.349 -3.302 1.00 0.00 C ATOM 307 O GLY A 22 -5.309 -15.186 -3.295 1.00 0.00 O ATOM 0 H GLY A 22 -3.017 -15.569 -1.675 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.919 -17.930 -2.251 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -5.370 -17.340 -1.463 1.00 0.00 H new ATOM 311 N GLU A 23 -4.816 -17.077 -4.410 1.00 0.00 N ATOM 312 CA GLU A 23 -5.192 -16.537 -5.712 1.00 0.00 C ATOM 313 C GLU A 23 -4.294 -15.364 -6.093 1.00 0.00 C ATOM 314 O GLU A 23 -4.693 -14.487 -6.860 1.00 0.00 O ATOM 315 CB GLU A 23 -6.656 -16.092 -5.700 1.00 0.00 C ATOM 316 CG GLU A 23 -7.643 -17.245 -5.764 1.00 0.00 C ATOM 317 CD GLU A 23 -8.955 -16.854 -6.418 1.00 0.00 C ATOM 318 OE1 GLU A 23 -9.544 -15.834 -6.002 1.00 0.00 O ATOM 319 OE2 GLU A 23 -9.392 -17.567 -7.345 1.00 0.00 O ATOM 0 H GLU A 23 -4.485 -18.042 -4.433 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.066 -17.324 -6.455 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.844 -15.514 -4.795 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -6.832 -15.427 -6.546 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -7.197 -18.070 -6.319 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -7.838 -17.608 -4.755 1.00 0.00 H new ATOM 326 N ASP A 24 -3.081 -15.354 -5.552 1.00 0.00 N ATOM 327 CA ASP A 24 -2.126 -14.289 -5.835 1.00 0.00 C ATOM 328 C ASP A 24 -2.830 -12.939 -5.932 1.00 0.00 C ATOM 329 O ASP A 24 -2.358 -12.029 -6.614 1.00 0.00 O ATOM 330 CB ASP A 24 -1.375 -14.581 -7.136 1.00 0.00 C ATOM 331 CG ASP A 24 -2.028 -13.931 -8.340 1.00 0.00 C ATOM 332 OD1 ASP A 24 -3.059 -14.456 -8.810 1.00 0.00 O ATOM 333 OD2 ASP A 24 -1.509 -12.898 -8.812 1.00 0.00 O ATOM 0 H ASP A 24 -2.736 -16.072 -4.915 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.411 -14.248 -5.013 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.348 -14.226 -7.047 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -1.327 -15.659 -7.290 1.00 0.00 H new ATOM 338 N LEU A 25 -3.961 -12.818 -5.246 1.00 0.00 N ATOM 339 CA LEU A 25 -4.731 -11.579 -5.254 1.00 0.00 C ATOM 340 C LEU A 25 -4.611 -10.872 -6.601 1.00 0.00 C ATOM 341 O LEU A 25 -4.336 -9.674 -6.662 1.00 0.00 O ATOM 342 CB LEU A 25 -4.255 -10.652 -4.135 1.00 0.00 C ATOM 343 CG LEU A 25 -4.162 -11.274 -2.741 1.00 0.00 C ATOM 344 CD1 LEU A 25 -3.767 -10.226 -1.713 1.00 0.00 C ATOM 345 CD2 LEU A 25 -5.482 -11.928 -2.360 1.00 0.00 C ATOM 0 H LEU A 25 -4.365 -13.562 -4.677 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.779 -11.830 -5.088 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.272 -10.265 -4.405 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.931 -9.798 -4.086 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.390 -12.043 -2.758 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.706 -10.688 -0.728 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -2.797 -9.805 -1.977 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.514 -9.433 -1.696 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.398 -12.365 -1.365 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.273 -11.178 -2.361 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.722 -12.710 -3.081 1.00 0.00 H new ATOM 357 N SER A 26 -4.821 -11.623 -7.678 1.00 0.00 N ATOM 358 CA SER A 26 -4.735 -11.069 -9.024 1.00 0.00 C ATOM 359 C SER A 26 -5.915 -10.143 -9.307 1.00 0.00 C ATOM 360 O SER A 26 -5.737 -9.009 -9.750 1.00 0.00 O ATOM 361 CB SER A 26 -4.695 -12.194 -10.060 1.00 0.00 C ATOM 362 OG SER A 26 -5.693 -13.165 -9.797 1.00 0.00 O ATOM 0 H SER A 26 -5.052 -12.616 -7.644 1.00 0.00 H new ATOM 0 HA SER A 26 -3.815 -10.488 -9.093 1.00 0.00 H new ATOM 0 HB2 SER A 26 -4.840 -11.779 -11.058 1.00 0.00 H new ATOM 0 HB3 SER A 26 -3.713 -12.666 -10.051 1.00 0.00 H new ATOM 0 HG SER A 26 -5.279 -13.961 -9.402 1.00 0.00 H new ATOM 368 N LYS A 27 -7.121 -10.637 -9.048 1.00 0.00 N ATOM 369 CA LYS A 27 -8.332 -9.857 -9.273 1.00 0.00 C ATOM 370 C LYS A 27 -8.615 -8.938 -8.089 1.00 0.00 C ATOM 371 O LYS A 27 -9.769 -8.727 -7.715 1.00 0.00 O ATOM 372 CB LYS A 27 -9.525 -10.785 -9.509 1.00 0.00 C ATOM 373 CG LYS A 27 -10.628 -10.158 -10.344 1.00 0.00 C ATOM 374 CD LYS A 27 -11.668 -11.186 -10.756 1.00 0.00 C ATOM 375 CE LYS A 27 -12.511 -11.632 -9.571 1.00 0.00 C ATOM 376 NZ LYS A 27 -13.660 -12.479 -9.995 1.00 0.00 N ATOM 0 H LYS A 27 -7.286 -11.575 -8.682 1.00 0.00 H new ATOM 0 HA LYS A 27 -8.178 -9.241 -10.159 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -9.177 -11.692 -10.004 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -9.937 -11.086 -8.546 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -11.108 -9.361 -9.775 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.196 -9.699 -11.233 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.314 -10.763 -11.525 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -11.172 -12.051 -11.197 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.888 -12.189 -8.871 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.882 -10.756 -9.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.210 -12.762 -9.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.269 -11.939 -10.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.305 -13.328 -10.480 1.00 0.00 H new ATOM 390 N LYS A 28 -7.555 -8.393 -7.502 1.00 0.00 N ATOM 391 CA LYS A 28 -7.689 -7.495 -6.361 1.00 0.00 C ATOM 392 C LYS A 28 -7.032 -6.148 -6.649 1.00 0.00 C ATOM 393 O LYS A 28 -7.572 -5.098 -6.304 1.00 0.00 O ATOM 394 CB LYS A 28 -7.063 -8.124 -5.114 1.00 0.00 C ATOM 395 CG LYS A 28 -7.672 -9.463 -4.737 1.00 0.00 C ATOM 396 CD LYS A 28 -8.837 -9.294 -3.775 1.00 0.00 C ATOM 397 CE LYS A 28 -9.496 -10.628 -3.460 1.00 0.00 C ATOM 398 NZ LYS A 28 -10.826 -10.450 -2.814 1.00 0.00 N ATOM 0 H LYS A 28 -6.593 -8.558 -7.798 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.752 -7.331 -6.183 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.994 -8.255 -5.281 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -7.173 -7.436 -4.276 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -8.013 -9.975 -5.637 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.910 -10.095 -4.280 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -8.484 -8.834 -2.852 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -9.573 -8.616 -4.208 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.613 -11.202 -4.379 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.848 -11.207 -2.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -11.243 -11.382 -2.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -10.712 -9.925 -1.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -11.453 -9.919 -3.451 1.00 0.00 H new ATOM 412 N ASN A 29 -5.866 -6.188 -7.284 1.00 0.00 N ATOM 413 CA ASN A 29 -5.136 -4.971 -7.619 1.00 0.00 C ATOM 414 C ASN A 29 -5.994 -4.039 -8.470 1.00 0.00 C ATOM 415 O ASN A 29 -6.873 -4.472 -9.216 1.00 0.00 O ATOM 416 CB ASN A 29 -3.844 -5.314 -8.364 1.00 0.00 C ATOM 417 CG ASN A 29 -3.081 -6.447 -7.706 1.00 0.00 C ATOM 418 OD1 ASN A 29 -2.711 -6.364 -6.535 1.00 0.00 O ATOM 419 ND2 ASN A 29 -2.843 -7.515 -8.459 1.00 0.00 N ATOM 0 H ASN A 29 -5.406 -7.050 -7.577 1.00 0.00 H new ATOM 0 HA ASN A 29 -4.887 -4.460 -6.689 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.082 -5.589 -9.392 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -3.208 -4.430 -8.410 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.335 -8.310 -8.071 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -3.169 -7.541 -9.425 1.00 0.00 H new ATOM 426 N PRO A 30 -5.735 -2.728 -8.356 1.00 0.00 N ATOM 427 CA PRO A 30 -4.692 -2.201 -7.471 1.00 0.00 C ATOM 428 C PRO A 30 -5.049 -2.357 -5.997 1.00 0.00 C ATOM 429 O PRO A 30 -6.223 -2.470 -5.642 1.00 0.00 O ATOM 430 CB PRO A 30 -4.620 -0.719 -7.850 1.00 0.00 C ATOM 431 CG PRO A 30 -5.968 -0.404 -8.402 1.00 0.00 C ATOM 432 CD PRO A 30 -6.440 -1.659 -9.083 1.00 0.00 C ATOM 0 HA PRO A 30 -3.748 -2.732 -7.592 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -4.392 -0.099 -6.983 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -3.838 -0.536 -8.587 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -6.655 -0.108 -7.609 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -5.917 0.427 -9.106 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -7.522 -1.772 -9.013 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -6.187 -1.660 -10.143 1.00 0.00 H new ATOM 440 N ILE A 31 -4.031 -2.363 -5.143 1.00 0.00 N ATOM 441 CA ILE A 31 -4.239 -2.504 -3.708 1.00 0.00 C ATOM 442 C ILE A 31 -3.843 -1.231 -2.967 1.00 0.00 C ATOM 443 O ILE A 31 -4.513 -0.817 -2.021 1.00 0.00 O ATOM 444 CB ILE A 31 -3.436 -3.687 -3.136 1.00 0.00 C ATOM 445 CG1 ILE A 31 -1.945 -3.511 -3.433 1.00 0.00 C ATOM 446 CG2 ILE A 31 -3.945 -5.000 -3.712 1.00 0.00 C ATOM 447 CD1 ILE A 31 -1.070 -4.554 -2.772 1.00 0.00 C ATOM 0 H ILE A 31 -3.054 -2.272 -5.421 1.00 0.00 H new ATOM 0 HA ILE A 31 -5.303 -2.692 -3.561 1.00 0.00 H new ATOM 0 HB ILE A 31 -3.571 -3.710 -2.055 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -1.791 -3.549 -4.511 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -1.631 -2.521 -3.101 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -3.368 -5.827 -3.298 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -4.997 -5.127 -3.454 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.836 -4.988 -4.796 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.027 -4.368 -3.026 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -1.195 -4.502 -1.690 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.357 -5.545 -3.123 1.00 0.00 H new ATOM 459 N ALA A 32 -2.751 -0.613 -3.405 1.00 0.00 N ATOM 460 CA ALA A 32 -2.268 0.615 -2.787 1.00 0.00 C ATOM 461 C ALA A 32 -2.277 1.771 -3.781 1.00 0.00 C ATOM 462 O ALA A 32 -2.118 1.569 -4.986 1.00 0.00 O ATOM 463 CB ALA A 32 -0.869 0.409 -2.227 1.00 0.00 C ATOM 0 H ALA A 32 -2.184 -0.943 -4.186 1.00 0.00 H new ATOM 0 HA ALA A 32 -2.941 0.869 -1.969 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -0.521 1.334 -1.768 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.890 -0.382 -1.477 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -0.192 0.127 -3.033 1.00 0.00 H new ATOM 469 N LYS A 33 -2.466 2.983 -3.271 1.00 0.00 N ATOM 470 CA LYS A 33 -2.495 4.173 -4.114 1.00 0.00 C ATOM 471 C LYS A 33 -2.079 5.410 -3.324 1.00 0.00 C ATOM 472 O LYS A 33 -2.421 5.552 -2.150 1.00 0.00 O ATOM 473 CB LYS A 33 -3.895 4.375 -4.697 1.00 0.00 C ATOM 474 CG LYS A 33 -4.955 4.665 -3.649 1.00 0.00 C ATOM 475 CD LYS A 33 -6.297 4.987 -4.286 1.00 0.00 C ATOM 476 CE LYS A 33 -7.417 4.986 -3.257 1.00 0.00 C ATOM 477 NZ LYS A 33 -8.745 4.739 -3.884 1.00 0.00 N ATOM 0 H LYS A 33 -2.602 3.168 -2.277 1.00 0.00 H new ATOM 0 HA LYS A 33 -1.785 4.028 -4.929 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.867 5.199 -5.410 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -4.180 3.482 -5.253 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -5.062 3.803 -2.990 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.635 5.503 -3.029 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -6.247 5.963 -4.770 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.516 4.256 -5.065 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.221 4.219 -2.507 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -7.433 5.944 -2.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -9.482 4.746 -3.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -8.944 5.485 -4.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -8.738 3.814 -4.359 1.00 0.00 H new ATOM 491 N ILE A 34 -1.341 6.301 -3.976 1.00 0.00 N ATOM 492 CA ILE A 34 -0.881 7.527 -3.335 1.00 0.00 C ATOM 493 C ILE A 34 -0.788 8.671 -4.338 1.00 0.00 C ATOM 494 O ILE A 34 -0.362 8.479 -5.478 1.00 0.00 O ATOM 495 CB ILE A 34 0.494 7.332 -2.668 1.00 0.00 C ATOM 496 CG1 ILE A 34 1.526 6.875 -3.700 1.00 0.00 C ATOM 497 CG2 ILE A 34 0.393 6.325 -1.531 1.00 0.00 C ATOM 498 CD1 ILE A 34 2.950 6.924 -3.193 1.00 0.00 C ATOM 0 H ILE A 34 -1.049 6.197 -4.948 1.00 0.00 H new ATOM 0 HA ILE A 34 -1.616 7.777 -2.570 1.00 0.00 H new ATOM 0 HB ILE A 34 0.819 8.287 -2.255 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.293 5.856 -4.008 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.443 7.503 -4.587 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.372 6.198 -1.070 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.315 6.688 -0.786 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.049 5.368 -1.922 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.627 6.586 -3.977 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.201 7.947 -2.912 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.049 6.274 -2.324 1.00 0.00 H new ATOM 510 N HIS A 35 -1.189 9.863 -3.907 1.00 0.00 N ATOM 511 CA HIS A 35 -1.149 11.041 -4.767 1.00 0.00 C ATOM 512 C HIS A 35 -0.934 12.307 -3.945 1.00 0.00 C ATOM 513 O HIS A 35 -1.811 12.725 -3.189 1.00 0.00 O ATOM 514 CB HIS A 35 -2.444 11.154 -5.572 1.00 0.00 C ATOM 515 CG HIS A 35 -2.747 9.940 -6.394 1.00 0.00 C ATOM 516 ND1 HIS A 35 -2.503 9.868 -7.749 1.00 0.00 N ATOM 517 CD2 HIS A 35 -3.275 8.744 -6.044 1.00 0.00 C ATOM 518 CE1 HIS A 35 -2.870 8.681 -8.198 1.00 0.00 C ATOM 519 NE2 HIS A 35 -3.342 7.979 -7.183 1.00 0.00 N ATOM 0 H HIS A 35 -1.545 10.039 -2.968 1.00 0.00 H new ATOM 0 HA HIS A 35 -0.311 10.930 -5.455 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -3.273 11.335 -4.888 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -2.379 12.021 -6.230 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -3.586 8.446 -5.053 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -2.797 8.342 -9.221 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -3.698 7.025 -7.236 1.00 0.00 H new ATOM 528 N SER A 36 0.239 12.914 -4.097 1.00 0.00 N ATOM 529 CA SER A 36 0.570 14.131 -3.364 1.00 0.00 C ATOM 530 C SER A 36 -0.350 15.278 -3.771 1.00 0.00 C ATOM 531 O SER A 36 -0.458 15.613 -4.951 1.00 0.00 O ATOM 532 CB SER A 36 2.029 14.520 -3.614 1.00 0.00 C ATOM 533 OG SER A 36 2.522 15.344 -2.571 1.00 0.00 O ATOM 0 H SER A 36 0.975 12.583 -4.720 1.00 0.00 H new ATOM 0 HA SER A 36 0.429 13.935 -2.301 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.640 13.621 -3.692 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.111 15.044 -4.566 1.00 0.00 H new ATOM 0 HG SER A 36 3.456 15.578 -2.753 1.00 0.00 H new ATOM 539 N ASP A 37 -1.012 15.875 -2.786 1.00 0.00 N ATOM 540 CA ASP A 37 -1.923 16.985 -3.039 1.00 0.00 C ATOM 541 C ASP A 37 -1.305 17.984 -4.013 1.00 0.00 C ATOM 542 O ASP A 37 -1.870 18.268 -5.070 1.00 0.00 O ATOM 543 CB ASP A 37 -2.282 17.687 -1.729 1.00 0.00 C ATOM 544 CG ASP A 37 -2.660 16.709 -0.633 1.00 0.00 C ATOM 545 OD1 ASP A 37 -3.837 16.296 -0.588 1.00 0.00 O ATOM 546 OD2 ASP A 37 -1.778 16.358 0.179 1.00 0.00 O ATOM 0 H ASP A 37 -0.935 15.609 -1.804 1.00 0.00 H new ATOM 0 HA ASP A 37 -2.831 16.582 -3.487 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -1.435 18.289 -1.399 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -3.112 18.372 -1.903 1.00 0.00 H new ATOM 551 N LEU A 38 -0.142 18.514 -3.649 1.00 0.00 N ATOM 552 CA LEU A 38 0.553 19.483 -4.490 1.00 0.00 C ATOM 553 C LEU A 38 0.595 19.013 -5.941 1.00 0.00 C ATOM 554 O LEU A 38 0.352 19.792 -6.863 1.00 0.00 O ATOM 555 CB LEU A 38 1.975 19.708 -3.974 1.00 0.00 C ATOM 556 CG LEU A 38 2.123 20.717 -2.835 1.00 0.00 C ATOM 557 CD1 LEU A 38 3.457 20.531 -2.127 1.00 0.00 C ATOM 558 CD2 LEU A 38 1.990 22.139 -3.360 1.00 0.00 C ATOM 0 H LEU A 38 0.339 18.289 -2.778 1.00 0.00 H new ATOM 0 HA LEU A 38 0.004 20.424 -4.448 1.00 0.00 H new ATOM 0 HB2 LEU A 38 2.374 18.751 -3.639 1.00 0.00 H new ATOM 0 HB3 LEU A 38 2.595 20.038 -4.808 1.00 0.00 H new ATOM 0 HG LEU A 38 1.324 20.541 -2.114 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.545 21.258 -1.319 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.513 19.523 -1.716 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.270 20.679 -2.838 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.098 22.843 -2.535 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.766 22.327 -4.102 1.00 0.00 H new ATOM 0 HD23 LEU A 38 1.010 22.267 -3.820 1.00 0.00 H new ATOM 570 N ALA A 39 0.902 17.735 -6.135 1.00 0.00 N ATOM 571 CA ALA A 39 0.971 17.161 -7.473 1.00 0.00 C ATOM 572 C ALA A 39 -0.220 17.596 -8.320 1.00 0.00 C ATOM 573 O ALA A 39 -0.067 17.946 -9.489 1.00 0.00 O ATOM 574 CB ALA A 39 1.039 15.643 -7.393 1.00 0.00 C ATOM 0 H ALA A 39 1.107 17.077 -5.383 1.00 0.00 H new ATOM 0 HA ALA A 39 1.878 17.529 -7.953 1.00 0.00 H new ATOM 0 HB1 ALA A 39 1.090 15.228 -8.399 1.00 0.00 H new ATOM 0 HB2 ALA A 39 1.926 15.348 -6.833 1.00 0.00 H new ATOM 0 HB3 ALA A 39 0.149 15.265 -6.889 1.00 0.00 H new ATOM 580 N GLU A 40 -1.407 17.570 -7.721 1.00 0.00 N ATOM 581 CA GLU A 40 -2.624 17.960 -8.422 1.00 0.00 C ATOM 582 C GLU A 40 -2.981 19.414 -8.124 1.00 0.00 C ATOM 583 O GLU A 40 -3.077 20.238 -9.033 1.00 0.00 O ATOM 584 CB GLU A 40 -3.785 17.047 -8.022 1.00 0.00 C ATOM 585 CG GLU A 40 -3.824 15.739 -8.795 1.00 0.00 C ATOM 586 CD GLU A 40 -4.653 14.676 -8.100 1.00 0.00 C ATOM 587 OE1 GLU A 40 -4.130 14.031 -7.167 1.00 0.00 O ATOM 588 OE2 GLU A 40 -5.824 14.489 -8.490 1.00 0.00 O ATOM 0 H GLU A 40 -1.551 17.283 -6.753 1.00 0.00 H new ATOM 0 HA GLU A 40 -2.444 17.859 -9.492 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -3.714 16.828 -6.957 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.724 17.579 -8.176 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.232 15.921 -9.789 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -2.807 15.371 -8.930 1.00 0.00 H new ATOM 595 N GLU A 41 -3.177 19.719 -6.845 1.00 0.00 N ATOM 596 CA GLU A 41 -3.524 21.073 -6.428 1.00 0.00 C ATOM 597 C GLU A 41 -2.782 22.108 -7.268 1.00 0.00 C ATOM 598 O GLU A 41 -3.388 23.031 -7.813 1.00 0.00 O ATOM 599 CB GLU A 41 -3.199 21.273 -4.947 1.00 0.00 C ATOM 600 CG GLU A 41 -4.331 20.873 -4.015 1.00 0.00 C ATOM 601 CD GLU A 41 -5.656 21.496 -4.407 1.00 0.00 C ATOM 602 OE1 GLU A 41 -5.662 22.678 -4.809 1.00 0.00 O ATOM 603 OE2 GLU A 41 -6.689 20.800 -4.312 1.00 0.00 O ATOM 0 H GLU A 41 -3.102 19.048 -6.081 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.595 21.209 -6.579 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.311 20.692 -4.697 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -2.952 22.321 -4.776 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.430 19.788 -4.015 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -4.081 21.171 -2.997 1.00 0.00 H new ATOM 610 N ARG A 42 -1.466 21.948 -7.367 1.00 0.00 N ATOM 611 CA ARG A 42 -0.640 22.869 -8.138 1.00 0.00 C ATOM 612 C ARG A 42 -0.427 22.350 -9.557 1.00 0.00 C ATOM 613 O ARG A 42 -0.842 22.980 -10.529 1.00 0.00 O ATOM 614 CB ARG A 42 0.710 23.075 -7.450 1.00 0.00 C ATOM 615 CG ARG A 42 0.652 24.028 -6.267 1.00 0.00 C ATOM 616 CD ARG A 42 0.420 25.462 -6.718 1.00 0.00 C ATOM 617 NE ARG A 42 1.675 26.182 -6.921 1.00 0.00 N ATOM 618 CZ ARG A 42 2.384 26.716 -5.933 1.00 0.00 C ATOM 619 NH1 ARG A 42 1.964 26.612 -4.680 1.00 0.00 N ATOM 620 NH2 ARG A 42 3.516 27.356 -6.198 1.00 0.00 N ATOM 0 H ARG A 42 -0.949 21.189 -6.923 1.00 0.00 H new ATOM 0 HA ARG A 42 -1.161 23.825 -8.194 1.00 0.00 H new ATOM 0 HB2 ARG A 42 1.086 22.110 -7.110 1.00 0.00 H new ATOM 0 HB3 ARG A 42 1.425 23.457 -8.179 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -0.148 23.724 -5.592 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.584 23.969 -5.704 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -0.152 25.462 -7.646 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -0.181 25.984 -5.973 1.00 0.00 H new ATOM 0 HE ARG A 42 2.026 26.280 -7.874 1.00 0.00 H new ATOM 0 HH11 ARG A 42 1.094 26.121 -4.473 1.00 0.00 H new ATOM 0 HH12 ARG A 42 2.510 27.023 -3.923 1.00 0.00 H new ATOM 0 HH21 ARG A 42 3.842 27.438 -7.161 1.00 0.00 H new ATOM 0 HH22 ARG A 42 4.060 27.766 -5.439 1.00 0.00 H new ATOM 634 N GLY A 43 0.226 21.197 -9.668 1.00 0.00 N ATOM 635 CA GLY A 43 0.484 20.613 -10.971 1.00 0.00 C ATOM 636 C GLY A 43 1.943 20.250 -11.165 1.00 0.00 C ATOM 637 O GLY A 43 2.528 20.535 -12.210 1.00 0.00 O ATOM 0 H GLY A 43 0.581 20.657 -8.879 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -0.129 19.720 -11.093 1.00 0.00 H new ATOM 0 HA3 GLY A 43 0.181 21.316 -11.747 1.00 0.00 H new ATOM 641 N LEU A 44 2.534 19.621 -10.155 1.00 0.00 N ATOM 642 CA LEU A 44 3.935 19.220 -10.218 1.00 0.00 C ATOM 643 C LEU A 44 4.065 17.760 -10.640 1.00 0.00 C ATOM 644 O LEU A 44 3.092 17.005 -10.613 1.00 0.00 O ATOM 645 CB LEU A 44 4.608 19.432 -8.860 1.00 0.00 C ATOM 646 CG LEU A 44 4.668 20.876 -8.360 1.00 0.00 C ATOM 647 CD1 LEU A 44 3.355 21.267 -7.700 1.00 0.00 C ATOM 648 CD2 LEU A 44 5.828 21.056 -7.391 1.00 0.00 C ATOM 0 H LEU A 44 2.065 19.378 -9.283 1.00 0.00 H new ATOM 0 HA LEU A 44 4.432 19.840 -10.964 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.080 18.833 -8.118 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.626 19.045 -8.917 1.00 0.00 H new ATOM 0 HG LEU A 44 4.830 21.531 -9.216 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.416 22.298 -7.350 1.00 0.00 H new ATOM 0 HD12 LEU A 44 2.544 21.176 -8.422 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.163 20.608 -6.854 1.00 0.00 H new ATOM 0 HD21 LEU A 44 5.856 22.089 -7.045 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.696 20.391 -6.538 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.764 20.817 -7.896 1.00 0.00 H new ATOM 660 N LYS A 45 5.274 17.367 -11.027 1.00 0.00 N ATOM 661 CA LYS A 45 5.534 15.996 -11.452 1.00 0.00 C ATOM 662 C LYS A 45 6.316 15.236 -10.386 1.00 0.00 C ATOM 663 O LYS A 45 7.527 15.411 -10.249 1.00 0.00 O ATOM 664 CB LYS A 45 6.308 15.988 -12.771 1.00 0.00 C ATOM 665 CG LYS A 45 5.417 16.057 -14.000 1.00 0.00 C ATOM 666 CD LYS A 45 6.182 15.700 -15.264 1.00 0.00 C ATOM 667 CE LYS A 45 5.240 15.424 -16.425 1.00 0.00 C ATOM 668 NZ LYS A 45 4.831 16.677 -17.118 1.00 0.00 N ATOM 0 H LYS A 45 6.090 17.979 -11.055 1.00 0.00 H new ATOM 0 HA LYS A 45 4.575 15.498 -11.598 1.00 0.00 H new ATOM 0 HB2 LYS A 45 6.996 16.833 -12.784 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.913 15.083 -12.822 1.00 0.00 H new ATOM 0 HG2 LYS A 45 4.575 15.376 -13.879 1.00 0.00 H new ATOM 0 HG3 LYS A 45 5.004 17.061 -14.095 1.00 0.00 H new ATOM 0 HD2 LYS A 45 6.855 16.516 -15.526 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.802 14.822 -15.080 1.00 0.00 H new ATOM 0 HE2 LYS A 45 5.727 14.758 -17.137 1.00 0.00 H new ATOM 0 HE3 LYS A 45 4.354 14.906 -16.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 4.189 16.446 -17.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 4.344 17.303 -16.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 5.674 17.159 -17.490 1.00 0.00 H new ATOM 682 N ILE A 46 5.617 14.391 -9.636 1.00 0.00 N ATOM 683 CA ILE A 46 6.248 13.602 -8.585 1.00 0.00 C ATOM 684 C ILE A 46 6.338 12.132 -8.979 1.00 0.00 C ATOM 685 O ILE A 46 5.452 11.602 -9.651 1.00 0.00 O ATOM 686 CB ILE A 46 5.479 13.719 -7.255 1.00 0.00 C ATOM 687 CG1 ILE A 46 5.432 15.177 -6.794 1.00 0.00 C ATOM 688 CG2 ILE A 46 6.124 12.842 -6.192 1.00 0.00 C ATOM 689 CD1 ILE A 46 4.295 15.966 -7.404 1.00 0.00 C ATOM 0 H ILE A 46 4.614 14.235 -9.736 1.00 0.00 H new ATOM 0 HA ILE A 46 7.253 14.002 -8.451 1.00 0.00 H new ATOM 0 HB ILE A 46 4.457 13.375 -7.412 1.00 0.00 H new ATOM 0 HG12 ILE A 46 5.341 15.204 -5.708 1.00 0.00 H new ATOM 0 HG13 ILE A 46 6.376 15.660 -7.047 1.00 0.00 H new ATOM 0 HG21 ILE A 46 5.570 12.935 -5.258 1.00 0.00 H new ATOM 0 HG22 ILE A 46 6.110 11.803 -6.520 1.00 0.00 H new ATOM 0 HG23 ILE A 46 7.155 13.159 -6.035 1.00 0.00 H new ATOM 0 HD11 ILE A 46 4.323 16.991 -7.033 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.396 15.970 -8.489 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.345 15.507 -7.130 1.00 0.00 H new ATOM 701 N THR A 47 7.414 11.476 -8.557 1.00 0.00 N ATOM 702 CA THR A 47 7.621 10.067 -8.865 1.00 0.00 C ATOM 703 C THR A 47 7.447 9.201 -7.623 1.00 0.00 C ATOM 704 O THR A 47 7.955 9.528 -6.550 1.00 0.00 O ATOM 705 CB THR A 47 9.022 9.820 -9.456 1.00 0.00 C ATOM 706 OG1 THR A 47 9.281 10.757 -10.508 1.00 0.00 O ATOM 707 CG2 THR A 47 9.141 8.402 -9.993 1.00 0.00 C ATOM 0 H THR A 47 8.157 11.899 -8.000 1.00 0.00 H new ATOM 0 HA THR A 47 6.869 9.792 -9.605 1.00 0.00 H new ATOM 0 HB THR A 47 9.756 9.953 -8.661 1.00 0.00 H new ATOM 0 HG1 THR A 47 10.174 10.595 -10.878 1.00 0.00 H new ATOM 0 HG21 THR A 47 10.139 8.252 -10.405 1.00 0.00 H new ATOM 0 HG22 THR A 47 8.971 7.691 -9.184 1.00 0.00 H new ATOM 0 HG23 THR A 47 8.398 8.246 -10.775 1.00 0.00 H new ATOM 715 N TYR A 48 6.726 8.095 -7.774 1.00 0.00 N ATOM 716 CA TYR A 48 6.484 7.182 -6.663 1.00 0.00 C ATOM 717 C TYR A 48 7.467 6.016 -6.692 1.00 0.00 C ATOM 718 O TYR A 48 7.589 5.315 -7.697 1.00 0.00 O ATOM 719 CB TYR A 48 5.049 6.655 -6.713 1.00 0.00 C ATOM 720 CG TYR A 48 4.020 7.727 -6.994 1.00 0.00 C ATOM 721 CD1 TYR A 48 3.737 8.710 -6.053 1.00 0.00 C ATOM 722 CD2 TYR A 48 3.330 7.756 -8.200 1.00 0.00 C ATOM 723 CE1 TYR A 48 2.797 9.690 -6.305 1.00 0.00 C ATOM 724 CE2 TYR A 48 2.390 8.734 -8.461 1.00 0.00 C ATOM 725 CZ TYR A 48 2.126 9.699 -7.511 1.00 0.00 C ATOM 726 OH TYR A 48 1.189 10.673 -7.767 1.00 0.00 O ATOM 0 H TYR A 48 6.299 7.809 -8.655 1.00 0.00 H new ATOM 0 HA TYR A 48 6.630 7.733 -5.734 1.00 0.00 H new ATOM 0 HB2 TYR A 48 4.980 5.886 -7.482 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.813 6.177 -5.762 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.261 8.707 -5.109 1.00 0.00 H new ATOM 0 HD2 TYR A 48 3.532 7.001 -8.946 1.00 0.00 H new ATOM 0 HE1 TYR A 48 2.588 10.445 -5.562 1.00 0.00 H new ATOM 0 HE2 TYR A 48 1.864 8.743 -9.404 1.00 0.00 H new ATOM 0 HH TYR A 48 0.811 10.536 -8.661 1.00 0.00 H new ATOM 736 N LYS A 49 8.167 5.813 -5.581 1.00 0.00 N ATOM 737 CA LYS A 49 9.138 4.731 -5.474 1.00 0.00 C ATOM 738 C LYS A 49 8.817 3.826 -4.289 1.00 0.00 C ATOM 739 O LYS A 49 8.615 4.300 -3.171 1.00 0.00 O ATOM 740 CB LYS A 49 10.551 5.300 -5.327 1.00 0.00 C ATOM 741 CG LYS A 49 11.577 4.273 -4.881 1.00 0.00 C ATOM 742 CD LYS A 49 12.837 4.937 -4.352 1.00 0.00 C ATOM 743 CE LYS A 49 13.773 5.337 -5.482 1.00 0.00 C ATOM 744 NZ LYS A 49 14.518 4.168 -6.026 1.00 0.00 N ATOM 0 H LYS A 49 8.080 6.385 -4.741 1.00 0.00 H new ATOM 0 HA LYS A 49 9.085 4.137 -6.386 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.864 5.723 -6.281 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.531 6.118 -4.607 1.00 0.00 H new ATOM 0 HG2 LYS A 49 11.146 3.639 -4.106 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.831 3.624 -5.719 1.00 0.00 H new ATOM 0 HD2 LYS A 49 12.568 5.819 -3.771 1.00 0.00 H new ATOM 0 HD3 LYS A 49 13.352 4.255 -3.676 1.00 0.00 H new ATOM 0 HE2 LYS A 49 13.198 5.805 -6.281 1.00 0.00 H new ATOM 0 HE3 LYS A 49 14.481 6.082 -5.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 15.217 4.496 -6.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 15.006 3.676 -5.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 13.852 3.515 -6.486 1.00 0.00 H new ATOM 758 N TYR A 50 8.774 2.523 -4.541 1.00 0.00 N ATOM 759 CA TYR A 50 8.477 1.551 -3.495 1.00 0.00 C ATOM 760 C TYR A 50 9.686 0.662 -3.219 1.00 0.00 C ATOM 761 O TYR A 50 9.955 -0.287 -3.955 1.00 0.00 O ATOM 762 CB TYR A 50 7.278 0.691 -3.895 1.00 0.00 C ATOM 763 CG TYR A 50 5.947 1.386 -3.715 1.00 0.00 C ATOM 764 CD1 TYR A 50 5.334 1.443 -2.470 1.00 0.00 C ATOM 765 CD2 TYR A 50 5.304 1.986 -4.791 1.00 0.00 C ATOM 766 CE1 TYR A 50 4.117 2.077 -2.301 1.00 0.00 C ATOM 767 CE2 TYR A 50 4.088 2.623 -4.631 1.00 0.00 C ATOM 768 CZ TYR A 50 3.499 2.665 -3.384 1.00 0.00 C ATOM 769 OH TYR A 50 2.288 3.299 -3.220 1.00 0.00 O ATOM 0 H TYR A 50 8.941 2.115 -5.461 1.00 0.00 H new ATOM 0 HA TYR A 50 8.235 2.098 -2.584 1.00 0.00 H new ATOM 0 HB2 TYR A 50 7.386 0.395 -4.939 1.00 0.00 H new ATOM 0 HB3 TYR A 50 7.284 -0.224 -3.302 1.00 0.00 H new ATOM 0 HD1 TYR A 50 5.816 0.984 -1.619 1.00 0.00 H new ATOM 0 HD2 TYR A 50 5.762 1.954 -5.768 1.00 0.00 H new ATOM 0 HE1 TYR A 50 3.653 2.111 -1.326 1.00 0.00 H new ATOM 0 HE2 TYR A 50 3.602 3.085 -5.477 1.00 0.00 H new ATOM 0 HH TYR A 50 1.989 3.661 -4.080 1.00 0.00 H new ATOM 779 N THR A 51 10.411 0.976 -2.150 1.00 0.00 N ATOM 780 CA THR A 51 11.591 0.208 -1.774 1.00 0.00 C ATOM 781 C THR A 51 11.360 -0.553 -0.473 1.00 0.00 C ATOM 782 O THR A 51 10.781 -0.022 0.473 1.00 0.00 O ATOM 783 CB THR A 51 12.825 1.115 -1.613 1.00 0.00 C ATOM 784 OG1 THR A 51 12.723 1.869 -0.400 1.00 0.00 O ATOM 785 CG2 THR A 51 12.957 2.063 -2.795 1.00 0.00 C ATOM 0 H THR A 51 10.201 1.758 -1.529 1.00 0.00 H new ATOM 0 HA THR A 51 11.775 -0.502 -2.580 1.00 0.00 H new ATOM 0 HB THR A 51 13.712 0.482 -1.574 1.00 0.00 H new ATOM 0 HG1 THR A 51 13.512 2.442 -0.304 1.00 0.00 H new ATOM 0 HG21 THR A 51 13.836 2.694 -2.659 1.00 0.00 H new ATOM 0 HG22 THR A 51 13.063 1.486 -3.714 1.00 0.00 H new ATOM 0 HG23 THR A 51 12.067 2.689 -2.860 1.00 0.00 H new ATOM 793 N GLY A 52 11.819 -1.800 -0.433 1.00 0.00 N ATOM 794 CA GLY A 52 11.653 -2.614 0.758 1.00 0.00 C ATOM 795 C GLY A 52 11.745 -4.098 0.464 1.00 0.00 C ATOM 796 O GLY A 52 12.258 -4.501 -0.581 1.00 0.00 O ATOM 0 H GLY A 52 12.303 -2.261 -1.203 1.00 0.00 H new ATOM 0 HA2 GLY A 52 12.416 -2.344 1.488 1.00 0.00 H new ATOM 0 HA3 GLY A 52 10.686 -2.396 1.211 1.00 0.00 H new ATOM 800 N LYS A 53 11.249 -4.914 1.387 1.00 0.00 N ATOM 801 CA LYS A 53 11.277 -6.363 1.223 1.00 0.00 C ATOM 802 C LYS A 53 10.464 -6.788 0.005 1.00 0.00 C ATOM 803 O LYS A 53 9.414 -6.216 -0.284 1.00 0.00 O ATOM 804 CB LYS A 53 10.733 -7.049 2.478 1.00 0.00 C ATOM 805 CG LYS A 53 10.793 -8.566 2.416 1.00 0.00 C ATOM 806 CD LYS A 53 9.830 -9.203 3.403 1.00 0.00 C ATOM 807 CE LYS A 53 10.391 -9.190 4.817 1.00 0.00 C ATOM 808 NZ LYS A 53 9.659 -10.128 5.713 1.00 0.00 N ATOM 0 H LYS A 53 10.822 -4.597 2.257 1.00 0.00 H new ATOM 0 HA LYS A 53 12.313 -6.667 1.070 1.00 0.00 H new ATOM 0 HB2 LYS A 53 11.300 -6.706 3.344 1.00 0.00 H new ATOM 0 HB3 LYS A 53 9.699 -6.741 2.631 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.554 -8.899 1.406 1.00 0.00 H new ATOM 0 HG3 LYS A 53 11.808 -8.900 2.630 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.880 -8.669 3.382 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.625 -10.230 3.101 1.00 0.00 H new ATOM 0 HE2 LYS A 53 11.446 -9.461 4.791 1.00 0.00 H new ATOM 0 HE3 LYS A 53 10.331 -8.180 5.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 10.060 -10.077 6.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 8.653 -9.865 5.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.751 -11.098 5.350 1.00 0.00 H new ATOM 822 N GLY A 54 10.957 -7.798 -0.707 1.00 0.00 N ATOM 823 CA GLY A 54 10.263 -8.283 -1.885 1.00 0.00 C ATOM 824 C GLY A 54 10.692 -7.564 -3.149 1.00 0.00 C ATOM 825 O GLY A 54 10.781 -8.172 -4.216 1.00 0.00 O ATOM 0 H GLY A 54 11.824 -8.288 -0.488 1.00 0.00 H new ATOM 0 HA2 GLY A 54 10.448 -9.351 -1.998 1.00 0.00 H new ATOM 0 HA3 GLY A 54 9.189 -8.159 -1.747 1.00 0.00 H new ATOM 829 N ILE A 55 10.957 -6.268 -3.029 1.00 0.00 N ATOM 830 CA ILE A 55 11.379 -5.466 -4.171 1.00 0.00 C ATOM 831 C ILE A 55 12.896 -5.325 -4.213 1.00 0.00 C ATOM 832 O ILE A 55 13.527 -5.579 -5.240 1.00 0.00 O ATOM 833 CB ILE A 55 10.744 -4.063 -4.139 1.00 0.00 C ATOM 834 CG1 ILE A 55 9.218 -4.170 -4.136 1.00 0.00 C ATOM 835 CG2 ILE A 55 11.221 -3.239 -5.325 1.00 0.00 C ATOM 836 CD1 ILE A 55 8.524 -2.899 -3.699 1.00 0.00 C ATOM 0 H ILE A 55 10.887 -5.751 -2.153 1.00 0.00 H new ATOM 0 HA ILE A 55 11.041 -5.988 -5.066 1.00 0.00 H new ATOM 0 HB ILE A 55 11.055 -3.560 -3.224 1.00 0.00 H new ATOM 0 HG12 ILE A 55 8.878 -4.434 -5.138 1.00 0.00 H new ATOM 0 HG13 ILE A 55 8.920 -4.983 -3.474 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.764 -2.250 -5.289 1.00 0.00 H new ATOM 0 HG22 ILE A 55 12.306 -3.139 -5.286 1.00 0.00 H new ATOM 0 HG23 ILE A 55 10.936 -3.737 -6.252 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.444 -3.048 -3.721 1.00 0.00 H new ATOM 0 HD12 ILE A 55 8.835 -2.645 -2.686 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.792 -2.087 -4.375 1.00 0.00 H new ATOM 848 N THR A 56 13.479 -4.918 -3.089 1.00 0.00 N ATOM 849 CA THR A 56 14.923 -4.743 -2.997 1.00 0.00 C ATOM 850 C THR A 56 15.601 -6.019 -2.510 1.00 0.00 C ATOM 851 O THR A 56 16.643 -6.416 -3.031 1.00 0.00 O ATOM 852 CB THR A 56 15.289 -3.586 -2.048 1.00 0.00 C ATOM 853 OG1 THR A 56 14.647 -3.770 -0.781 1.00 0.00 O ATOM 854 CG2 THR A 56 14.876 -2.248 -2.642 1.00 0.00 C ATOM 0 H THR A 56 12.973 -4.704 -2.230 1.00 0.00 H new ATOM 0 HA THR A 56 15.278 -4.506 -4.000 1.00 0.00 H new ATOM 0 HB THR A 56 16.370 -3.586 -1.910 1.00 0.00 H new ATOM 0 HG1 THR A 56 13.678 -3.674 -0.889 1.00 0.00 H new ATOM 0 HG21 THR A 56 15.145 -1.446 -1.954 1.00 0.00 H new ATOM 0 HG22 THR A 56 15.389 -2.098 -3.592 1.00 0.00 H new ATOM 0 HG23 THR A 56 13.798 -2.240 -2.806 1.00 0.00 H new ATOM 862 N GLU A 57 15.003 -6.656 -1.508 1.00 0.00 N ATOM 863 CA GLU A 57 15.551 -7.888 -0.952 1.00 0.00 C ATOM 864 C GLU A 57 14.714 -9.093 -1.369 1.00 0.00 C ATOM 865 O GLU A 57 13.508 -8.995 -1.595 1.00 0.00 O ATOM 866 CB GLU A 57 15.613 -7.800 0.575 1.00 0.00 C ATOM 867 CG GLU A 57 16.858 -7.101 1.094 1.00 0.00 C ATOM 868 CD GLU A 57 16.922 -5.642 0.683 1.00 0.00 C ATOM 869 OE1 GLU A 57 16.190 -4.825 1.278 1.00 0.00 O ATOM 870 OE2 GLU A 57 17.705 -5.320 -0.235 1.00 0.00 O ATOM 0 H GLU A 57 14.140 -6.340 -1.065 1.00 0.00 H new ATOM 0 HA GLU A 57 16.560 -8.016 -1.343 1.00 0.00 H new ATOM 0 HB2 GLU A 57 14.732 -7.270 0.936 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.572 -8.807 0.991 1.00 0.00 H new ATOM 0 HG2 GLU A 57 16.882 -7.170 2.182 1.00 0.00 H new ATOM 0 HG3 GLU A 57 17.742 -7.619 0.722 1.00 0.00 H new ATOM 877 N PRO A 58 15.368 -10.259 -1.475 1.00 0.00 N ATOM 878 CA PRO A 58 14.705 -11.507 -1.866 1.00 0.00 C ATOM 879 C PRO A 58 13.759 -12.023 -0.787 1.00 0.00 C ATOM 880 O PRO A 58 13.911 -11.728 0.399 1.00 0.00 O ATOM 881 CB PRO A 58 15.869 -12.480 -2.066 1.00 0.00 C ATOM 882 CG PRO A 58 16.962 -11.945 -1.206 1.00 0.00 C ATOM 883 CD PRO A 58 16.806 -10.450 -1.220 1.00 0.00 C ATOM 0 HA PRO A 58 14.083 -11.378 -2.752 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.593 -13.493 -1.772 1.00 0.00 H new ATOM 0 HB3 PRO A 58 16.173 -12.524 -3.112 1.00 0.00 H new ATOM 0 HG2 PRO A 58 16.887 -12.336 -0.191 1.00 0.00 H new ATOM 0 HG3 PRO A 58 17.939 -12.239 -1.589 1.00 0.00 H new ATOM 0 HD2 PRO A 58 17.108 -10.006 -0.272 1.00 0.00 H new ATOM 0 HD3 PRO A 58 17.416 -9.990 -1.997 1.00 0.00 H new ATOM 891 N PRO A 59 12.758 -12.812 -1.204 1.00 0.00 N ATOM 892 CA PRO A 59 12.567 -13.169 -2.613 1.00 0.00 C ATOM 893 C PRO A 59 12.112 -11.982 -3.455 1.00 0.00 C ATOM 894 O PRO A 59 11.397 -11.103 -2.973 1.00 0.00 O ATOM 895 CB PRO A 59 11.472 -14.238 -2.563 1.00 0.00 C ATOM 896 CG PRO A 59 10.724 -13.955 -1.306 1.00 0.00 C ATOM 897 CD PRO A 59 11.736 -13.416 -0.333 1.00 0.00 C ATOM 0 HA PRO A 59 13.493 -13.509 -3.076 1.00 0.00 H new ATOM 0 HB2 PRO A 59 10.820 -14.178 -3.434 1.00 0.00 H new ATOM 0 HB3 PRO A 59 11.898 -15.241 -2.553 1.00 0.00 H new ATOM 0 HG2 PRO A 59 9.927 -13.232 -1.481 1.00 0.00 H new ATOM 0 HG3 PRO A 59 10.254 -14.860 -0.919 1.00 0.00 H new ATOM 0 HD2 PRO A 59 11.295 -12.680 0.339 1.00 0.00 H new ATOM 0 HD3 PRO A 59 12.155 -14.206 0.290 1.00 0.00 H new ATOM 905 N PHE A 60 12.532 -11.961 -4.716 1.00 0.00 N ATOM 906 CA PHE A 60 12.169 -10.881 -5.625 1.00 0.00 C ATOM 907 C PHE A 60 10.930 -11.247 -6.437 1.00 0.00 C ATOM 908 O PHE A 60 10.473 -12.389 -6.413 1.00 0.00 O ATOM 909 CB PHE A 60 13.333 -10.564 -6.566 1.00 0.00 C ATOM 910 CG PHE A 60 14.518 -9.957 -5.870 1.00 0.00 C ATOM 911 CD1 PHE A 60 15.409 -10.753 -5.169 1.00 0.00 C ATOM 912 CD2 PHE A 60 14.740 -8.590 -5.917 1.00 0.00 C ATOM 913 CE1 PHE A 60 16.501 -10.198 -4.528 1.00 0.00 C ATOM 914 CE2 PHE A 60 15.830 -8.029 -5.278 1.00 0.00 C ATOM 915 CZ PHE A 60 16.710 -8.834 -4.582 1.00 0.00 C ATOM 0 H PHE A 60 13.124 -12.680 -5.131 1.00 0.00 H new ATOM 0 HA PHE A 60 11.943 -9.998 -5.027 1.00 0.00 H new ATOM 0 HB2 PHE A 60 13.646 -11.481 -7.066 1.00 0.00 H new ATOM 0 HB3 PHE A 60 12.987 -9.880 -7.341 1.00 0.00 H new ATOM 0 HD1 PHE A 60 15.249 -11.820 -5.123 1.00 0.00 H new ATOM 0 HD2 PHE A 60 14.054 -7.956 -6.459 1.00 0.00 H new ATOM 0 HE1 PHE A 60 17.189 -10.830 -3.986 1.00 0.00 H new ATOM 0 HE2 PHE A 60 15.993 -6.962 -5.323 1.00 0.00 H new ATOM 0 HZ PHE A 60 17.561 -8.397 -4.080 1.00 0.00 H new ATOM 925 N GLY A 61 10.389 -10.267 -7.156 1.00 0.00 N ATOM 926 CA GLY A 61 9.208 -10.505 -7.964 1.00 0.00 C ATOM 927 C GLY A 61 7.956 -10.674 -7.126 1.00 0.00 C ATOM 928 O GLY A 61 7.158 -11.581 -7.366 1.00 0.00 O ATOM 0 H GLY A 61 10.748 -9.313 -7.193 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.070 -9.673 -8.654 1.00 0.00 H new ATOM 0 HA3 GLY A 61 9.360 -11.399 -8.569 1.00 0.00 H new ATOM 932 N ILE A 62 7.784 -9.801 -6.139 1.00 0.00 N ATOM 933 CA ILE A 62 6.621 -9.859 -5.263 1.00 0.00 C ATOM 934 C ILE A 62 5.759 -8.610 -5.410 1.00 0.00 C ATOM 935 O ILE A 62 4.530 -8.682 -5.366 1.00 0.00 O ATOM 936 CB ILE A 62 7.036 -10.011 -3.787 1.00 0.00 C ATOM 937 CG1 ILE A 62 7.839 -11.299 -3.590 1.00 0.00 C ATOM 938 CG2 ILE A 62 5.808 -10.004 -2.889 1.00 0.00 C ATOM 939 CD1 ILE A 62 8.309 -11.506 -2.168 1.00 0.00 C ATOM 0 H ILE A 62 8.435 -9.045 -5.926 1.00 0.00 H new ATOM 0 HA ILE A 62 6.043 -10.734 -5.563 1.00 0.00 H new ATOM 0 HB ILE A 62 7.668 -9.166 -3.513 1.00 0.00 H new ATOM 0 HG12 ILE A 62 7.226 -12.149 -3.889 1.00 0.00 H new ATOM 0 HG13 ILE A 62 8.705 -11.282 -4.252 1.00 0.00 H new ATOM 0 HG21 ILE A 62 6.117 -10.112 -1.849 1.00 0.00 H new ATOM 0 HG22 ILE A 62 5.272 -9.063 -3.012 1.00 0.00 H new ATOM 0 HG23 ILE A 62 5.154 -10.832 -3.161 1.00 0.00 H new ATOM 0 HD11 ILE A 62 8.871 -12.438 -2.103 1.00 0.00 H new ATOM 0 HD12 ILE A 62 8.949 -10.675 -1.872 1.00 0.00 H new ATOM 0 HD13 ILE A 62 7.447 -11.555 -1.503 1.00 0.00 H new ATOM 951 N PHE A 63 6.410 -7.466 -5.588 1.00 0.00 N ATOM 952 CA PHE A 63 5.703 -6.200 -5.744 1.00 0.00 C ATOM 953 C PHE A 63 6.233 -5.425 -6.947 1.00 0.00 C ATOM 954 O PHE A 63 7.444 -5.296 -7.132 1.00 0.00 O ATOM 955 CB PHE A 63 5.842 -5.354 -4.476 1.00 0.00 C ATOM 956 CG PHE A 63 5.216 -5.984 -3.265 1.00 0.00 C ATOM 957 CD1 PHE A 63 3.873 -6.324 -3.259 1.00 0.00 C ATOM 958 CD2 PHE A 63 5.972 -6.236 -2.131 1.00 0.00 C ATOM 959 CE1 PHE A 63 3.295 -6.902 -2.145 1.00 0.00 C ATOM 960 CE2 PHE A 63 5.399 -6.814 -1.014 1.00 0.00 C ATOM 961 CZ PHE A 63 4.059 -7.149 -1.021 1.00 0.00 C ATOM 0 H PHE A 63 7.426 -7.389 -5.628 1.00 0.00 H new ATOM 0 HA PHE A 63 4.649 -6.420 -5.912 1.00 0.00 H new ATOM 0 HB2 PHE A 63 6.900 -5.179 -4.279 1.00 0.00 H new ATOM 0 HB3 PHE A 63 5.384 -4.380 -4.647 1.00 0.00 H new ATOM 0 HD1 PHE A 63 3.271 -6.135 -4.135 1.00 0.00 H new ATOM 0 HD2 PHE A 63 7.021 -5.978 -2.120 1.00 0.00 H new ATOM 0 HE1 PHE A 63 2.246 -7.161 -2.153 1.00 0.00 H new ATOM 0 HE2 PHE A 63 5.999 -7.004 -0.136 1.00 0.00 H new ATOM 0 HZ PHE A 63 3.610 -7.603 -0.150 1.00 0.00 H new ATOM 971 N VAL A 64 5.318 -4.910 -7.762 1.00 0.00 N ATOM 972 CA VAL A 64 5.692 -4.147 -8.947 1.00 0.00 C ATOM 973 C VAL A 64 5.106 -2.741 -8.903 1.00 0.00 C ATOM 974 O VAL A 64 3.908 -2.563 -8.684 1.00 0.00 O ATOM 975 CB VAL A 64 5.223 -4.847 -10.236 1.00 0.00 C ATOM 976 CG1 VAL A 64 5.880 -6.212 -10.373 1.00 0.00 C ATOM 977 CG2 VAL A 64 3.707 -4.971 -10.253 1.00 0.00 C ATOM 0 H VAL A 64 4.312 -5.007 -7.623 1.00 0.00 H new ATOM 0 HA VAL A 64 6.780 -4.084 -8.952 1.00 0.00 H new ATOM 0 HB VAL A 64 5.525 -4.239 -11.089 1.00 0.00 H new ATOM 0 HG11 VAL A 64 5.536 -6.691 -11.290 1.00 0.00 H new ATOM 0 HG12 VAL A 64 6.963 -6.093 -10.410 1.00 0.00 H new ATOM 0 HG13 VAL A 64 5.613 -6.832 -9.517 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.393 -5.468 -11.171 1.00 0.00 H new ATOM 0 HG22 VAL A 64 3.380 -5.556 -9.393 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.260 -3.978 -10.207 1.00 0.00 H new ATOM 987 N PHE A 65 5.959 -1.744 -9.111 1.00 0.00 N ATOM 988 CA PHE A 65 5.526 -0.351 -9.095 1.00 0.00 C ATOM 989 C PHE A 65 6.125 0.419 -10.269 1.00 0.00 C ATOM 990 O PHE A 65 7.203 0.084 -10.759 1.00 0.00 O ATOM 991 CB PHE A 65 5.927 0.314 -7.777 1.00 0.00 C ATOM 992 CG PHE A 65 7.337 0.830 -7.770 1.00 0.00 C ATOM 993 CD1 PHE A 65 7.666 1.996 -8.442 1.00 0.00 C ATOM 994 CD2 PHE A 65 8.335 0.149 -7.091 1.00 0.00 C ATOM 995 CE1 PHE A 65 8.963 2.474 -8.438 1.00 0.00 C ATOM 996 CE2 PHE A 65 9.633 0.622 -7.082 1.00 0.00 C ATOM 997 CZ PHE A 65 9.948 1.785 -7.758 1.00 0.00 C ATOM 0 H PHE A 65 6.954 -1.874 -9.293 1.00 0.00 H new ATOM 0 HA PHE A 65 4.440 -0.333 -9.188 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.245 1.140 -7.574 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.808 -0.404 -6.966 1.00 0.00 H new ATOM 0 HD1 PHE A 65 6.899 2.538 -8.976 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.095 -0.762 -6.563 1.00 0.00 H new ATOM 0 HE1 PHE A 65 9.206 3.385 -8.966 1.00 0.00 H new ATOM 0 HE2 PHE A 65 10.401 0.083 -6.547 1.00 0.00 H new ATOM 0 HZ PHE A 65 10.963 2.155 -7.755 1.00 0.00 H new ATOM 1007 N ASN A 66 5.417 1.451 -10.714 1.00 0.00 N ATOM 1008 CA ASN A 66 5.877 2.269 -11.831 1.00 0.00 C ATOM 1009 C ASN A 66 5.791 3.753 -11.490 1.00 0.00 C ATOM 1010 O ASN A 66 5.257 4.133 -10.448 1.00 0.00 O ATOM 1011 CB ASN A 66 5.048 1.972 -13.082 1.00 0.00 C ATOM 1012 CG ASN A 66 4.723 0.498 -13.225 1.00 0.00 C ATOM 1013 OD1 ASN A 66 5.602 -0.357 -13.112 1.00 0.00 O ATOM 1014 ND2 ASN A 66 3.455 0.193 -13.475 1.00 0.00 N ATOM 0 H ASN A 66 4.523 1.741 -10.319 1.00 0.00 H new ATOM 0 HA ASN A 66 6.920 2.020 -12.027 1.00 0.00 H new ATOM 0 HB2 ASN A 66 4.121 2.543 -13.044 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.593 2.308 -13.964 1.00 0.00 H new ATOM 0 HD21 ASN A 66 3.176 -0.782 -13.581 1.00 0.00 H new ATOM 0 HD22 ASN A 66 2.760 0.934 -13.561 1.00 0.00 H new ATOM 1021 N LYS A 67 6.321 4.589 -12.376 1.00 0.00 N ATOM 1022 CA LYS A 67 6.304 6.033 -12.172 1.00 0.00 C ATOM 1023 C LYS A 67 5.392 6.715 -13.187 1.00 0.00 C ATOM 1024 O LYS A 67 4.910 7.824 -12.956 1.00 0.00 O ATOM 1025 CB LYS A 67 7.721 6.601 -12.282 1.00 0.00 C ATOM 1026 CG LYS A 67 8.265 6.611 -13.700 1.00 0.00 C ATOM 1027 CD LYS A 67 7.916 7.901 -14.423 1.00 0.00 C ATOM 1028 CE LYS A 67 8.812 8.123 -15.631 1.00 0.00 C ATOM 1029 NZ LYS A 67 8.763 9.533 -16.106 1.00 0.00 N ATOM 0 H LYS A 67 6.768 4.291 -13.243 1.00 0.00 H new ATOM 0 HA LYS A 67 5.917 6.229 -11.172 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.726 7.619 -11.893 1.00 0.00 H new ATOM 0 HB3 LYS A 67 8.388 6.015 -11.650 1.00 0.00 H new ATOM 0 HG2 LYS A 67 9.348 6.488 -13.676 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.860 5.763 -14.252 1.00 0.00 H new ATOM 0 HD2 LYS A 67 6.874 7.870 -14.742 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.014 8.742 -13.737 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.839 7.862 -15.375 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.506 7.457 -16.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.387 9.643 -16.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 7.788 9.775 -16.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.080 10.167 -15.345 1.00 0.00 H new ATOM 1043 N ASP A 68 5.157 6.044 -14.309 1.00 0.00 N ATOM 1044 CA ASP A 68 4.300 6.585 -15.358 1.00 0.00 C ATOM 1045 C ASP A 68 2.901 6.872 -14.822 1.00 0.00 C ATOM 1046 O ASP A 68 2.380 7.978 -14.976 1.00 0.00 O ATOM 1047 CB ASP A 68 4.219 5.609 -16.533 1.00 0.00 C ATOM 1048 CG ASP A 68 4.371 4.165 -16.099 1.00 0.00 C ATOM 1049 OD1 ASP A 68 3.384 3.591 -15.592 1.00 0.00 O ATOM 1050 OD2 ASP A 68 5.476 3.609 -16.265 1.00 0.00 O ATOM 0 H ASP A 68 5.548 5.125 -14.516 1.00 0.00 H new ATOM 0 HA ASP A 68 4.737 7.522 -15.703 1.00 0.00 H new ATOM 0 HB2 ASP A 68 3.262 5.734 -17.040 1.00 0.00 H new ATOM 0 HB3 ASP A 68 4.997 5.851 -17.257 1.00 0.00 H new ATOM 1055 N THR A 69 2.296 5.870 -14.193 1.00 0.00 N ATOM 1056 CA THR A 69 0.957 6.013 -13.637 1.00 0.00 C ATOM 1057 C THR A 69 0.986 5.961 -12.114 1.00 0.00 C ATOM 1058 O THR A 69 0.402 6.811 -11.443 1.00 0.00 O ATOM 1059 CB THR A 69 0.011 4.916 -14.159 1.00 0.00 C ATOM 1060 OG1 THR A 69 -1.284 5.062 -13.566 1.00 0.00 O ATOM 1061 CG2 THR A 69 0.563 3.533 -13.847 1.00 0.00 C ATOM 0 H THR A 69 2.713 4.949 -14.056 1.00 0.00 H new ATOM 0 HA THR A 69 0.584 6.986 -13.958 1.00 0.00 H new ATOM 0 HB THR A 69 -0.071 5.023 -15.241 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.880 4.361 -13.905 1.00 0.00 H new ATOM 0 HG21 THR A 69 -0.122 2.774 -14.225 1.00 0.00 H new ATOM 0 HG22 THR A 69 1.536 3.414 -14.324 1.00 0.00 H new ATOM 0 HG23 THR A 69 0.671 3.419 -12.768 1.00 0.00 H new ATOM 1069 N GLY A 70 1.671 4.958 -11.573 1.00 0.00 N ATOM 1070 CA GLY A 70 1.764 4.815 -10.132 1.00 0.00 C ATOM 1071 C GLY A 70 0.736 3.849 -9.578 1.00 0.00 C ATOM 1072 O GLY A 70 -0.390 4.239 -9.271 1.00 0.00 O ATOM 0 H GLY A 70 2.163 4.242 -12.107 1.00 0.00 H new ATOM 0 HA2 GLY A 70 2.763 4.468 -9.868 1.00 0.00 H new ATOM 0 HA3 GLY A 70 1.631 5.790 -9.664 1.00 0.00 H new ATOM 1076 N GLU A 71 1.123 2.583 -9.451 1.00 0.00 N ATOM 1077 CA GLU A 71 0.224 1.558 -8.933 1.00 0.00 C ATOM 1078 C GLU A 71 1.012 0.398 -8.331 1.00 0.00 C ATOM 1079 O GLU A 71 2.063 0.014 -8.845 1.00 0.00 O ATOM 1080 CB GLU A 71 -0.694 1.044 -10.044 1.00 0.00 C ATOM 1081 CG GLU A 71 0.055 0.468 -11.234 1.00 0.00 C ATOM 1082 CD GLU A 71 -0.841 -0.344 -12.149 1.00 0.00 C ATOM 1083 OE1 GLU A 71 -1.093 -1.526 -11.838 1.00 0.00 O ATOM 1084 OE2 GLU A 71 -1.291 0.205 -13.177 1.00 0.00 O ATOM 0 H GLU A 71 2.052 2.243 -9.699 1.00 0.00 H new ATOM 0 HA GLU A 71 -0.385 2.007 -8.148 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.353 0.278 -9.634 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.329 1.861 -10.386 1.00 0.00 H new ATOM 0 HG2 GLU A 71 0.507 1.281 -11.802 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.869 -0.162 -10.876 1.00 0.00 H new ATOM 1091 N LEU A 72 0.497 -0.156 -7.239 1.00 0.00 N ATOM 1092 CA LEU A 72 1.151 -1.272 -6.566 1.00 0.00 C ATOM 1093 C LEU A 72 0.404 -2.577 -6.824 1.00 0.00 C ATOM 1094 O LEU A 72 -0.692 -2.788 -6.308 1.00 0.00 O ATOM 1095 CB LEU A 72 1.234 -1.008 -5.061 1.00 0.00 C ATOM 1096 CG LEU A 72 2.109 -1.971 -4.258 1.00 0.00 C ATOM 1097 CD1 LEU A 72 3.582 -1.712 -4.535 1.00 0.00 C ATOM 1098 CD2 LEU A 72 1.814 -1.845 -2.770 1.00 0.00 C ATOM 0 H LEU A 72 -0.372 0.150 -6.801 1.00 0.00 H new ATOM 0 HA LEU A 72 2.160 -1.366 -6.969 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.609 0.004 -4.910 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.225 -1.038 -4.651 1.00 0.00 H new ATOM 0 HG LEU A 72 1.876 -2.989 -4.570 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.189 -2.407 -3.955 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.783 -1.854 -5.597 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.831 -0.689 -4.252 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.446 -2.538 -2.214 1.00 0.00 H new ATOM 0 HD22 LEU A 72 2.019 -0.825 -2.444 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.766 -2.082 -2.585 1.00 0.00 H new ATOM 1110 N ASN A 73 1.008 -3.449 -7.624 1.00 0.00 N ATOM 1111 CA ASN A 73 0.401 -4.735 -7.950 1.00 0.00 C ATOM 1112 C ASN A 73 1.244 -5.887 -7.412 1.00 0.00 C ATOM 1113 O ASN A 73 2.421 -6.019 -7.749 1.00 0.00 O ATOM 1114 CB ASN A 73 0.233 -4.875 -9.464 1.00 0.00 C ATOM 1115 CG ASN A 73 -0.250 -6.254 -9.868 1.00 0.00 C ATOM 1116 OD1 ASN A 73 0.074 -7.251 -9.222 1.00 0.00 O ATOM 1117 ND2 ASN A 73 -1.029 -6.318 -10.941 1.00 0.00 N ATOM 0 H ASN A 73 1.917 -3.289 -8.059 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.580 -4.775 -7.477 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -0.476 -4.127 -9.819 1.00 0.00 H new ATOM 0 HB3 ASN A 73 1.185 -4.669 -9.953 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -1.384 -7.219 -11.260 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -1.272 -5.466 -11.446 1.00 0.00 H new ATOM 1124 N VAL A 74 0.634 -6.719 -6.573 1.00 0.00 N ATOM 1125 CA VAL A 74 1.328 -7.861 -5.990 1.00 0.00 C ATOM 1126 C VAL A 74 1.448 -9.002 -6.993 1.00 0.00 C ATOM 1127 O VAL A 74 0.446 -9.491 -7.517 1.00 0.00 O ATOM 1128 CB VAL A 74 0.604 -8.372 -4.730 1.00 0.00 C ATOM 1129 CG1 VAL A 74 -0.791 -8.867 -5.079 1.00 0.00 C ATOM 1130 CG2 VAL A 74 1.416 -9.470 -4.059 1.00 0.00 C ATOM 0 H VAL A 74 -0.339 -6.623 -6.282 1.00 0.00 H new ATOM 0 HA VAL A 74 2.326 -7.519 -5.714 1.00 0.00 H new ATOM 0 HB VAL A 74 0.504 -7.544 -4.028 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.287 -9.224 -4.176 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.369 -8.051 -5.512 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -0.718 -9.682 -5.799 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.890 -9.820 -3.171 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.548 -10.300 -4.753 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.392 -9.078 -3.772 1.00 0.00 H new ATOM 1140 N THR A 75 2.680 -9.425 -7.256 1.00 0.00 N ATOM 1141 CA THR A 75 2.932 -10.509 -8.197 1.00 0.00 C ATOM 1142 C THR A 75 3.401 -11.766 -7.474 1.00 0.00 C ATOM 1143 O THR A 75 4.301 -12.464 -7.942 1.00 0.00 O ATOM 1144 CB THR A 75 3.988 -10.109 -9.245 1.00 0.00 C ATOM 1145 OG1 THR A 75 5.210 -9.742 -8.594 1.00 0.00 O ATOM 1146 CG2 THR A 75 3.493 -8.950 -10.097 1.00 0.00 C ATOM 0 H THR A 75 3.520 -9.033 -6.830 1.00 0.00 H new ATOM 0 HA THR A 75 1.989 -10.714 -8.703 1.00 0.00 H new ATOM 0 HB THR A 75 4.166 -10.966 -9.894 1.00 0.00 H new ATOM 0 HG1 THR A 75 5.674 -10.550 -8.289 1.00 0.00 H new ATOM 0 HG21 THR A 75 4.255 -8.685 -10.830 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.579 -9.243 -10.614 1.00 0.00 H new ATOM 0 HG23 THR A 75 3.289 -8.090 -9.459 1.00 0.00 H new ATOM 1154 N SER A 76 2.784 -12.051 -6.332 1.00 0.00 N ATOM 1155 CA SER A 76 3.140 -13.224 -5.542 1.00 0.00 C ATOM 1156 C SER A 76 2.026 -13.578 -4.562 1.00 0.00 C ATOM 1157 O SER A 76 1.173 -12.747 -4.249 1.00 0.00 O ATOM 1158 CB SER A 76 4.445 -12.977 -4.782 1.00 0.00 C ATOM 1159 OG SER A 76 4.985 -14.190 -4.288 1.00 0.00 O ATOM 0 H SER A 76 2.035 -11.486 -5.933 1.00 0.00 H new ATOM 0 HA SER A 76 3.279 -14.062 -6.225 1.00 0.00 H new ATOM 0 HB2 SER A 76 5.168 -12.495 -5.441 1.00 0.00 H new ATOM 0 HB3 SER A 76 4.263 -12.292 -3.954 1.00 0.00 H new ATOM 0 HG SER A 76 5.819 -14.005 -3.808 1.00 0.00 H new ATOM 1165 N ILE A 77 2.041 -14.817 -4.081 1.00 0.00 N ATOM 1166 CA ILE A 77 1.034 -15.281 -3.135 1.00 0.00 C ATOM 1167 C ILE A 77 1.563 -15.244 -1.706 1.00 0.00 C ATOM 1168 O ILE A 77 2.191 -16.196 -1.240 1.00 0.00 O ATOM 1169 CB ILE A 77 0.572 -16.713 -3.463 1.00 0.00 C ATOM 1170 CG1 ILE A 77 -0.040 -16.767 -4.864 1.00 0.00 C ATOM 1171 CG2 ILE A 77 -0.427 -17.198 -2.423 1.00 0.00 C ATOM 1172 CD1 ILE A 77 -0.435 -18.161 -5.298 1.00 0.00 C ATOM 0 H ILE A 77 2.739 -15.517 -4.331 1.00 0.00 H new ATOM 0 HA ILE A 77 0.184 -14.604 -3.222 1.00 0.00 H new ATOM 0 HB ILE A 77 1.439 -17.373 -3.441 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.919 -16.124 -4.892 1.00 0.00 H new ATOM 0 HG13 ILE A 77 0.675 -16.361 -5.580 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.744 -18.212 -2.668 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.041 -17.193 -1.439 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.294 -16.538 -2.416 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.861 -18.123 -6.300 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.445 -18.804 -5.302 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.174 -18.562 -4.604 1.00 0.00 H new ATOM 1184 N LEU A 78 1.304 -14.140 -1.013 1.00 0.00 N ATOM 1185 CA LEU A 78 1.753 -13.979 0.365 1.00 0.00 C ATOM 1186 C LEU A 78 1.704 -15.308 1.113 1.00 0.00 C ATOM 1187 O LEU A 78 0.681 -15.994 1.113 1.00 0.00 O ATOM 1188 CB LEU A 78 0.889 -12.943 1.086 1.00 0.00 C ATOM 1189 CG LEU A 78 0.821 -11.559 0.440 1.00 0.00 C ATOM 1190 CD1 LEU A 78 -0.261 -10.716 1.095 1.00 0.00 C ATOM 1191 CD2 LEU A 78 2.171 -10.862 0.530 1.00 0.00 C ATOM 0 H LEU A 78 0.785 -13.344 -1.383 1.00 0.00 H new ATOM 0 HA LEU A 78 2.786 -13.632 0.346 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.125 -13.336 1.164 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.266 -12.829 2.102 1.00 0.00 H new ATOM 0 HG LEU A 78 0.568 -11.683 -0.613 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.294 -9.735 0.622 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.226 -11.208 0.978 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.039 -10.600 2.156 1.00 0.00 H new ATOM 0 HD21 LEU A 78 2.104 -9.878 0.065 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.454 -10.750 1.577 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.923 -11.457 0.012 1.00 0.00 H new ATOM 1203 N ASP A 79 2.813 -15.663 1.751 1.00 0.00 N ATOM 1204 CA ASP A 79 2.896 -16.908 2.505 1.00 0.00 C ATOM 1205 C ASP A 79 3.264 -16.638 3.961 1.00 0.00 C ATOM 1206 O ASP A 79 4.442 -16.556 4.308 1.00 0.00 O ATOM 1207 CB ASP A 79 3.924 -17.847 1.872 1.00 0.00 C ATOM 1208 CG ASP A 79 3.340 -18.666 0.738 1.00 0.00 C ATOM 1209 OD1 ASP A 79 2.181 -19.114 0.865 1.00 0.00 O ATOM 1210 OD2 ASP A 79 4.040 -18.857 -0.277 1.00 0.00 O ATOM 0 H ASP A 79 3.667 -15.106 1.761 1.00 0.00 H new ATOM 0 HA ASP A 79 1.916 -17.385 2.479 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.764 -17.262 1.498 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.317 -18.518 2.636 1.00 0.00 H new ATOM 1215 N ARG A 80 2.249 -16.500 4.807 1.00 0.00 N ATOM 1216 CA ARG A 80 2.466 -16.236 6.225 1.00 0.00 C ATOM 1217 C ARG A 80 3.601 -17.098 6.770 1.00 0.00 C ATOM 1218 O ARG A 80 4.509 -16.597 7.433 1.00 0.00 O ATOM 1219 CB ARG A 80 1.184 -16.501 7.017 1.00 0.00 C ATOM 1220 CG ARG A 80 0.294 -15.278 7.161 1.00 0.00 C ATOM 1221 CD ARG A 80 -1.121 -15.664 7.564 1.00 0.00 C ATOM 1222 NE ARG A 80 -1.240 -15.882 9.003 1.00 0.00 N ATOM 1223 CZ ARG A 80 -0.977 -17.043 9.594 1.00 0.00 C ATOM 1224 NH1 ARG A 80 -0.582 -18.083 8.873 1.00 0.00 N ATOM 1225 NH2 ARG A 80 -1.108 -17.164 10.909 1.00 0.00 N ATOM 0 H ARG A 80 1.268 -16.567 4.536 1.00 0.00 H new ATOM 0 HA ARG A 80 2.743 -15.188 6.336 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.621 -17.294 6.525 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.449 -16.866 8.009 1.00 0.00 H new ATOM 0 HG2 ARG A 80 0.716 -14.605 7.908 1.00 0.00 H new ATOM 0 HG3 ARG A 80 0.269 -14.732 6.218 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -1.812 -14.879 7.258 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -1.414 -16.571 7.035 1.00 0.00 H new ATOM 0 HE ARG A 80 -1.541 -15.101 9.586 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -0.479 -17.993 7.862 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -0.381 -18.973 9.329 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -1.411 -16.366 11.467 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -0.906 -18.055 11.362 1.00 0.00 H new ATOM 1239 N GLU A 81 3.541 -18.395 6.487 1.00 0.00 N ATOM 1240 CA GLU A 81 4.563 -19.326 6.951 1.00 0.00 C ATOM 1241 C GLU A 81 5.955 -18.711 6.829 1.00 0.00 C ATOM 1242 O GLU A 81 6.700 -18.639 7.805 1.00 0.00 O ATOM 1243 CB GLU A 81 4.498 -20.630 6.152 1.00 0.00 C ATOM 1244 CG GLU A 81 3.377 -21.557 6.591 1.00 0.00 C ATOM 1245 CD GLU A 81 3.434 -22.907 5.903 1.00 0.00 C ATOM 1246 OE1 GLU A 81 3.071 -22.981 4.710 1.00 0.00 O ATOM 1247 OE2 GLU A 81 3.841 -23.889 6.558 1.00 0.00 O ATOM 0 H GLU A 81 2.796 -18.825 5.939 1.00 0.00 H new ATOM 0 HA GLU A 81 4.371 -19.542 8.002 1.00 0.00 H new ATOM 0 HB2 GLU A 81 4.370 -20.393 5.096 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.449 -21.153 6.248 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.431 -21.701 7.670 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.417 -21.086 6.380 1.00 0.00 H new ATOM 1254 N GLU A 82 6.296 -18.270 5.622 1.00 0.00 N ATOM 1255 CA GLU A 82 7.598 -17.662 5.372 1.00 0.00 C ATOM 1256 C GLU A 82 7.569 -16.167 5.676 1.00 0.00 C ATOM 1257 O GLU A 82 8.237 -15.695 6.597 1.00 0.00 O ATOM 1258 CB GLU A 82 8.021 -17.890 3.919 1.00 0.00 C ATOM 1259 CG GLU A 82 9.520 -17.779 3.697 1.00 0.00 C ATOM 1260 CD GLU A 82 10.271 -19.014 4.154 1.00 0.00 C ATOM 1261 OE1 GLU A 82 10.320 -19.259 5.378 1.00 0.00 O ATOM 1262 OE2 GLU A 82 10.809 -19.736 3.289 1.00 0.00 O ATOM 0 H GLU A 82 5.690 -18.322 4.803 1.00 0.00 H new ATOM 0 HA GLU A 82 8.324 -18.135 6.033 1.00 0.00 H new ATOM 0 HB2 GLU A 82 7.688 -18.879 3.603 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.513 -17.164 3.283 1.00 0.00 H new ATOM 0 HG2 GLU A 82 9.715 -17.611 2.638 1.00 0.00 H new ATOM 0 HG3 GLU A 82 9.899 -16.909 4.233 1.00 0.00 H new ATOM 1269 N THR A 83 6.789 -15.426 4.895 1.00 0.00 N ATOM 1270 CA THR A 83 6.673 -13.984 5.079 1.00 0.00 C ATOM 1271 C THR A 83 5.334 -13.617 5.707 1.00 0.00 C ATOM 1272 O THR A 83 4.313 -13.501 5.029 1.00 0.00 O ATOM 1273 CB THR A 83 6.823 -13.234 3.742 1.00 0.00 C ATOM 1274 OG1 THR A 83 5.962 -13.813 2.756 1.00 0.00 O ATOM 1275 CG2 THR A 83 8.263 -13.280 3.255 1.00 0.00 C ATOM 0 H THR A 83 6.228 -15.800 4.129 1.00 0.00 H new ATOM 0 HA THR A 83 7.480 -13.684 5.748 1.00 0.00 H new ATOM 0 HB THR A 83 6.543 -12.193 3.901 1.00 0.00 H new ATOM 0 HG1 THR A 83 5.067 -13.937 3.136 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.345 -12.744 2.309 1.00 0.00 H new ATOM 0 HG22 THR A 83 8.912 -12.812 3.995 1.00 0.00 H new ATOM 0 HG23 THR A 83 8.566 -14.317 3.111 1.00 0.00 H new ATOM 1283 N PRO A 84 5.334 -13.427 7.035 1.00 0.00 N ATOM 1284 CA PRO A 84 4.127 -13.068 7.784 1.00 0.00 C ATOM 1285 C PRO A 84 3.659 -11.648 7.484 1.00 0.00 C ATOM 1286 O PRO A 84 2.489 -11.315 7.677 1.00 0.00 O ATOM 1287 CB PRO A 84 4.567 -13.188 9.246 1.00 0.00 C ATOM 1288 CG PRO A 84 6.041 -12.977 9.216 1.00 0.00 C ATOM 1289 CD PRO A 84 6.515 -13.548 7.908 1.00 0.00 C ATOM 0 HA PRO A 84 3.282 -13.706 7.525 1.00 0.00 H new ATOM 0 HB2 PRO A 84 4.073 -12.444 9.871 1.00 0.00 H new ATOM 0 HB3 PRO A 84 4.315 -14.166 9.656 1.00 0.00 H new ATOM 0 HG2 PRO A 84 6.285 -11.917 9.290 1.00 0.00 H new ATOM 0 HG3 PRO A 84 6.524 -13.475 10.057 1.00 0.00 H new ATOM 0 HD2 PRO A 84 7.366 -12.993 7.512 1.00 0.00 H new ATOM 0 HD3 PRO A 84 6.832 -14.586 8.014 1.00 0.00 H new ATOM 1297 N PHE A 85 4.578 -10.815 7.008 1.00 0.00 N ATOM 1298 CA PHE A 85 4.260 -9.430 6.681 1.00 0.00 C ATOM 1299 C PHE A 85 5.401 -8.778 5.906 1.00 0.00 C ATOM 1300 O PHE A 85 6.499 -9.327 5.817 1.00 0.00 O ATOM 1301 CB PHE A 85 3.975 -8.635 7.957 1.00 0.00 C ATOM 1302 CG PHE A 85 5.178 -8.467 8.840 1.00 0.00 C ATOM 1303 CD1 PHE A 85 5.479 -9.410 9.810 1.00 0.00 C ATOM 1304 CD2 PHE A 85 6.009 -7.368 8.699 1.00 0.00 C ATOM 1305 CE1 PHE A 85 6.585 -9.258 10.624 1.00 0.00 C ATOM 1306 CE2 PHE A 85 7.117 -7.210 9.511 1.00 0.00 C ATOM 1307 CZ PHE A 85 7.406 -8.157 10.474 1.00 0.00 C ATOM 0 H PHE A 85 5.550 -11.075 6.840 1.00 0.00 H new ATOM 0 HA PHE A 85 3.369 -9.427 6.053 1.00 0.00 H new ATOM 0 HB2 PHE A 85 3.594 -7.651 7.685 1.00 0.00 H new ATOM 0 HB3 PHE A 85 3.188 -9.137 8.520 1.00 0.00 H new ATOM 0 HD1 PHE A 85 4.842 -10.274 9.931 1.00 0.00 H new ATOM 0 HD2 PHE A 85 5.789 -6.626 7.946 1.00 0.00 H new ATOM 0 HE1 PHE A 85 6.808 -9.999 11.377 1.00 0.00 H new ATOM 0 HE2 PHE A 85 7.756 -6.347 9.392 1.00 0.00 H new ATOM 0 HZ PHE A 85 8.272 -8.037 11.108 1.00 0.00 H new ATOM 1317 N PHE A 86 5.132 -7.604 5.345 1.00 0.00 N ATOM 1318 CA PHE A 86 6.135 -6.876 4.576 1.00 0.00 C ATOM 1319 C PHE A 86 6.222 -5.423 5.033 1.00 0.00 C ATOM 1320 O PHE A 86 5.255 -4.864 5.551 1.00 0.00 O ATOM 1321 CB PHE A 86 5.803 -6.934 3.083 1.00 0.00 C ATOM 1322 CG PHE A 86 6.042 -8.283 2.468 1.00 0.00 C ATOM 1323 CD1 PHE A 86 5.100 -9.292 2.592 1.00 0.00 C ATOM 1324 CD2 PHE A 86 7.207 -8.543 1.765 1.00 0.00 C ATOM 1325 CE1 PHE A 86 5.317 -10.535 2.027 1.00 0.00 C ATOM 1326 CE2 PHE A 86 7.430 -9.784 1.198 1.00 0.00 C ATOM 1327 CZ PHE A 86 6.483 -10.780 1.328 1.00 0.00 C ATOM 0 H PHE A 86 4.228 -7.136 5.408 1.00 0.00 H new ATOM 0 HA PHE A 86 7.102 -7.350 4.746 1.00 0.00 H new ATOM 0 HB2 PHE A 86 4.758 -6.658 2.940 1.00 0.00 H new ATOM 0 HB3 PHE A 86 6.403 -6.192 2.556 1.00 0.00 H new ATOM 0 HD1 PHE A 86 4.186 -9.105 3.136 1.00 0.00 H new ATOM 0 HD2 PHE A 86 7.950 -7.767 1.659 1.00 0.00 H new ATOM 0 HE1 PHE A 86 4.576 -11.313 2.132 1.00 0.00 H new ATOM 0 HE2 PHE A 86 8.344 -9.974 0.654 1.00 0.00 H new ATOM 0 HZ PHE A 86 6.654 -11.750 0.884 1.00 0.00 H new ATOM 1337 N LEU A 87 7.388 -4.818 4.838 1.00 0.00 N ATOM 1338 CA LEU A 87 7.605 -3.429 5.230 1.00 0.00 C ATOM 1339 C LEU A 87 8.128 -2.607 4.057 1.00 0.00 C ATOM 1340 O LEU A 87 9.285 -2.743 3.656 1.00 0.00 O ATOM 1341 CB LEU A 87 8.589 -3.356 6.398 1.00 0.00 C ATOM 1342 CG LEU A 87 7.976 -3.412 7.798 1.00 0.00 C ATOM 1343 CD1 LEU A 87 9.055 -3.641 8.845 1.00 0.00 C ATOM 1344 CD2 LEU A 87 7.206 -2.133 8.094 1.00 0.00 C ATOM 0 H LEU A 87 8.198 -5.267 4.411 1.00 0.00 H new ATOM 0 HA LEU A 87 6.648 -3.012 5.543 1.00 0.00 H new ATOM 0 HB2 LEU A 87 9.298 -4.178 6.301 1.00 0.00 H new ATOM 0 HB3 LEU A 87 9.159 -2.431 6.310 1.00 0.00 H new ATOM 0 HG LEU A 87 7.279 -4.249 7.835 1.00 0.00 H new ATOM 0 HD11 LEU A 87 8.600 -3.678 9.835 1.00 0.00 H new ATOM 0 HD12 LEU A 87 9.563 -4.584 8.644 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.777 -2.825 8.808 1.00 0.00 H new ATOM 0 HD21 LEU A 87 6.777 -2.190 9.094 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.882 -1.280 8.038 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.407 -2.012 7.362 1.00 0.00 H new ATOM 1356 N LEU A 88 7.270 -1.752 3.511 1.00 0.00 N ATOM 1357 CA LEU A 88 7.646 -0.905 2.384 1.00 0.00 C ATOM 1358 C LEU A 88 7.752 0.555 2.812 1.00 0.00 C ATOM 1359 O LEU A 88 7.438 0.905 3.951 1.00 0.00 O ATOM 1360 CB LEU A 88 6.625 -1.044 1.253 1.00 0.00 C ATOM 1361 CG LEU A 88 6.379 -2.464 0.742 1.00 0.00 C ATOM 1362 CD1 LEU A 88 5.187 -2.492 -0.202 1.00 0.00 C ATOM 1363 CD2 LEU A 88 7.622 -3.004 0.049 1.00 0.00 C ATOM 0 H LEU A 88 6.309 -1.627 3.830 1.00 0.00 H new ATOM 0 HA LEU A 88 8.622 -1.231 2.026 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.675 -0.633 1.595 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.955 -0.430 0.415 1.00 0.00 H new ATOM 0 HG LEU A 88 6.156 -3.104 1.596 1.00 0.00 H new ATOM 0 HD11 LEU A 88 5.027 -3.510 -0.556 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.297 -2.147 0.325 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.381 -1.839 -1.053 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.429 -4.016 -0.308 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.875 -2.363 -0.795 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.453 -3.021 0.754 1.00 0.00 H new ATOM 1375 N THR A 89 8.196 1.406 1.892 1.00 0.00 N ATOM 1376 CA THR A 89 8.342 2.828 2.173 1.00 0.00 C ATOM 1377 C THR A 89 8.207 3.657 0.901 1.00 0.00 C ATOM 1378 O THR A 89 9.063 3.602 0.019 1.00 0.00 O ATOM 1379 CB THR A 89 9.702 3.134 2.829 1.00 0.00 C ATOM 1380 OG1 THR A 89 9.921 2.252 3.937 1.00 0.00 O ATOM 1381 CG2 THR A 89 9.761 4.578 3.305 1.00 0.00 C ATOM 0 H THR A 89 8.461 1.134 0.945 1.00 0.00 H new ATOM 0 HA THR A 89 7.544 3.097 2.865 1.00 0.00 H new ATOM 0 HB THR A 89 10.482 2.982 2.083 1.00 0.00 H new ATOM 0 HG1 THR A 89 10.788 2.452 4.348 1.00 0.00 H new ATOM 0 HG21 THR A 89 10.730 4.770 3.765 1.00 0.00 H new ATOM 0 HG22 THR A 89 9.623 5.247 2.456 1.00 0.00 H new ATOM 0 HG23 THR A 89 8.972 4.753 4.036 1.00 0.00 H new ATOM 1389 N GLY A 90 7.126 4.426 0.813 1.00 0.00 N ATOM 1390 CA GLY A 90 6.900 5.257 -0.355 1.00 0.00 C ATOM 1391 C GLY A 90 7.784 6.488 -0.372 1.00 0.00 C ATOM 1392 O GLY A 90 7.950 7.155 0.649 1.00 0.00 O ATOM 0 H GLY A 90 6.403 4.488 1.530 1.00 0.00 H new ATOM 0 HA2 GLY A 90 7.083 4.670 -1.255 1.00 0.00 H new ATOM 0 HA3 GLY A 90 5.855 5.564 -0.381 1.00 0.00 H new ATOM 1396 N TYR A 91 8.353 6.789 -1.533 1.00 0.00 N ATOM 1397 CA TYR A 91 9.229 7.946 -1.678 1.00 0.00 C ATOM 1398 C TYR A 91 8.752 8.852 -2.809 1.00 0.00 C ATOM 1399 O TYR A 91 8.887 8.518 -3.985 1.00 0.00 O ATOM 1400 CB TYR A 91 10.666 7.495 -1.942 1.00 0.00 C ATOM 1401 CG TYR A 91 11.363 6.944 -0.719 1.00 0.00 C ATOM 1402 CD1 TYR A 91 11.870 7.793 0.257 1.00 0.00 C ATOM 1403 CD2 TYR A 91 11.515 5.574 -0.540 1.00 0.00 C ATOM 1404 CE1 TYR A 91 12.508 7.294 1.377 1.00 0.00 C ATOM 1405 CE2 TYR A 91 12.150 5.067 0.577 1.00 0.00 C ATOM 1406 CZ TYR A 91 12.645 5.930 1.532 1.00 0.00 C ATOM 1407 OH TYR A 91 13.280 5.428 2.645 1.00 0.00 O ATOM 0 H TYR A 91 8.224 6.248 -2.388 1.00 0.00 H new ATOM 0 HA TYR A 91 9.199 8.511 -0.747 1.00 0.00 H new ATOM 0 HB2 TYR A 91 10.661 6.733 -2.721 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.238 8.340 -2.326 1.00 0.00 H new ATOM 0 HD1 TYR A 91 11.764 8.861 0.138 1.00 0.00 H new ATOM 0 HD2 TYR A 91 11.130 4.895 -1.286 1.00 0.00 H new ATOM 0 HE1 TYR A 91 12.897 7.968 2.126 1.00 0.00 H new ATOM 0 HE2 TYR A 91 12.258 4.000 0.702 1.00 0.00 H new ATOM 0 HH TYR A 91 13.291 4.449 2.601 1.00 0.00 H new ATOM 1417 N ALA A 92 8.194 10.002 -2.442 1.00 0.00 N ATOM 1418 CA ALA A 92 7.699 10.958 -3.424 1.00 0.00 C ATOM 1419 C ALA A 92 8.802 11.917 -3.861 1.00 0.00 C ATOM 1420 O ALA A 92 8.819 13.082 -3.461 1.00 0.00 O ATOM 1421 CB ALA A 92 6.518 11.732 -2.858 1.00 0.00 C ATOM 0 H ALA A 92 8.074 10.293 -1.472 1.00 0.00 H new ATOM 0 HA ALA A 92 7.368 10.402 -4.301 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.158 12.443 -3.602 1.00 0.00 H new ATOM 0 HB2 ALA A 92 5.717 11.038 -2.602 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.831 12.271 -1.964 1.00 0.00 H new ATOM 1427 N LEU A 93 9.721 11.420 -4.681 1.00 0.00 N ATOM 1428 CA LEU A 93 10.828 12.233 -5.172 1.00 0.00 C ATOM 1429 C LEU A 93 10.319 13.381 -6.038 1.00 0.00 C ATOM 1430 O LEU A 93 9.455 13.190 -6.894 1.00 0.00 O ATOM 1431 CB LEU A 93 11.805 11.370 -5.972 1.00 0.00 C ATOM 1432 CG LEU A 93 12.361 10.141 -5.250 1.00 0.00 C ATOM 1433 CD1 LEU A 93 13.034 9.201 -6.238 1.00 0.00 C ATOM 1434 CD2 LEU A 93 13.338 10.560 -4.160 1.00 0.00 C ATOM 0 H LEU A 93 9.722 10.458 -5.020 1.00 0.00 H new ATOM 0 HA LEU A 93 11.346 12.654 -4.311 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.304 11.037 -6.881 1.00 0.00 H new ATOM 0 HB3 LEU A 93 12.643 11.995 -6.280 1.00 0.00 H new ATOM 0 HG LEU A 93 11.531 9.611 -4.783 1.00 0.00 H new ATOM 0 HD11 LEU A 93 13.423 8.333 -5.707 1.00 0.00 H new ATOM 0 HD12 LEU A 93 12.308 8.875 -6.983 1.00 0.00 H new ATOM 0 HD13 LEU A 93 13.854 9.721 -6.734 1.00 0.00 H new ATOM 0 HD21 LEU A 93 13.724 9.673 -3.657 1.00 0.00 H new ATOM 0 HD22 LEU A 93 14.165 11.113 -4.606 1.00 0.00 H new ATOM 0 HD23 LEU A 93 12.826 11.194 -3.436 1.00 0.00 H new ATOM 1446 N ASP A 94 10.862 14.572 -5.811 1.00 0.00 N ATOM 1447 CA ASP A 94 10.466 15.750 -6.573 1.00 0.00 C ATOM 1448 C ASP A 94 10.967 15.662 -8.011 1.00 0.00 C ATOM 1449 O ASP A 94 11.643 14.704 -8.385 1.00 0.00 O ATOM 1450 CB ASP A 94 11.005 17.018 -5.909 1.00 0.00 C ATOM 1451 CG ASP A 94 10.074 17.551 -4.837 1.00 0.00 C ATOM 1452 OD1 ASP A 94 9.312 16.747 -4.260 1.00 0.00 O ATOM 1453 OD2 ASP A 94 10.109 18.771 -4.574 1.00 0.00 O ATOM 0 H ASP A 94 11.578 14.747 -5.105 1.00 0.00 H new ATOM 0 HA ASP A 94 9.377 15.792 -6.589 1.00 0.00 H new ATOM 0 HB2 ASP A 94 11.979 16.808 -5.468 1.00 0.00 H new ATOM 0 HB3 ASP A 94 11.158 17.785 -6.668 1.00 0.00 H new ATOM 1458 N ALA A 95 10.631 16.667 -8.812 1.00 0.00 N ATOM 1459 CA ALA A 95 11.048 16.703 -10.209 1.00 0.00 C ATOM 1460 C ALA A 95 12.540 16.418 -10.344 1.00 0.00 C ATOM 1461 O ALA A 95 12.980 15.817 -11.324 1.00 0.00 O ATOM 1462 CB ALA A 95 10.708 18.052 -10.826 1.00 0.00 C ATOM 0 H ALA A 95 10.071 17.467 -8.518 1.00 0.00 H new ATOM 0 HA ALA A 95 10.506 15.924 -10.745 1.00 0.00 H new ATOM 0 HB1 ALA A 95 11.025 18.065 -11.869 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.632 18.216 -10.771 1.00 0.00 H new ATOM 0 HB3 ALA A 95 11.224 18.842 -10.280 1.00 0.00 H new ATOM 1468 N ARG A 96 13.313 16.854 -9.354 1.00 0.00 N ATOM 1469 CA ARG A 96 14.756 16.647 -9.364 1.00 0.00 C ATOM 1470 C ARG A 96 15.098 15.190 -9.067 1.00 0.00 C ATOM 1471 O ARG A 96 15.968 14.603 -9.708 1.00 0.00 O ATOM 1472 CB ARG A 96 15.430 17.560 -8.339 1.00 0.00 C ATOM 1473 CG ARG A 96 15.725 18.955 -8.866 1.00 0.00 C ATOM 1474 CD ARG A 96 16.559 19.758 -7.880 1.00 0.00 C ATOM 1475 NE ARG A 96 16.309 21.193 -7.994 1.00 0.00 N ATOM 1476 CZ ARG A 96 17.048 22.117 -7.390 1.00 0.00 C ATOM 1477 NH1 ARG A 96 18.076 21.759 -6.634 1.00 0.00 N ATOM 1478 NH2 ARG A 96 16.757 23.403 -7.542 1.00 0.00 N ATOM 0 H ARG A 96 12.964 17.352 -8.535 1.00 0.00 H new ATOM 0 HA ARG A 96 15.127 16.893 -10.359 1.00 0.00 H new ATOM 0 HB2 ARG A 96 14.790 17.641 -7.461 1.00 0.00 H new ATOM 0 HB3 ARG A 96 16.362 17.099 -8.013 1.00 0.00 H new ATOM 0 HG2 ARG A 96 16.254 18.882 -9.816 1.00 0.00 H new ATOM 0 HG3 ARG A 96 14.788 19.477 -9.062 1.00 0.00 H new ATOM 0 HD2 ARG A 96 16.335 19.430 -6.865 1.00 0.00 H new ATOM 0 HD3 ARG A 96 17.617 19.559 -8.053 1.00 0.00 H new ATOM 0 HE ARG A 96 15.525 21.502 -8.568 1.00 0.00 H new ATOM 0 HH11 ARG A 96 18.302 20.771 -6.515 1.00 0.00 H new ATOM 0 HH12 ARG A 96 18.641 22.471 -6.172 1.00 0.00 H new ATOM 0 HH21 ARG A 96 15.966 23.682 -8.123 1.00 0.00 H new ATOM 0 HH22 ARG A 96 17.324 24.113 -7.078 1.00 0.00 H new ATOM 1492 N GLY A 97 14.407 14.613 -8.089 1.00 0.00 N ATOM 1493 CA GLY A 97 14.652 13.230 -7.724 1.00 0.00 C ATOM 1494 C GLY A 97 15.121 13.084 -6.290 1.00 0.00 C ATOM 1495 O GLY A 97 15.968 12.243 -5.989 1.00 0.00 O ATOM 0 H GLY A 97 13.682 15.078 -7.543 1.00 0.00 H new ATOM 0 HA2 GLY A 97 13.738 12.653 -7.865 1.00 0.00 H new ATOM 0 HA3 GLY A 97 15.402 12.808 -8.393 1.00 0.00 H new ATOM 1499 N ASN A 98 14.572 13.906 -5.402 1.00 0.00 N ATOM 1500 CA ASN A 98 14.941 13.866 -3.992 1.00 0.00 C ATOM 1501 C ASN A 98 13.700 13.842 -3.105 1.00 0.00 C ATOM 1502 O ASN A 98 12.747 14.587 -3.333 1.00 0.00 O ATOM 1503 CB ASN A 98 15.812 15.073 -3.637 1.00 0.00 C ATOM 1504 CG ASN A 98 16.898 15.324 -4.664 1.00 0.00 C ATOM 1505 OD1 ASN A 98 18.056 14.955 -4.463 1.00 0.00 O ATOM 1506 ND2 ASN A 98 16.530 15.955 -5.773 1.00 0.00 N ATOM 0 H ASN A 98 13.870 14.608 -5.634 1.00 0.00 H new ATOM 0 HA ASN A 98 15.509 12.952 -3.817 1.00 0.00 H new ATOM 0 HB2 ASN A 98 15.183 15.959 -3.553 1.00 0.00 H new ATOM 0 HB3 ASN A 98 16.269 14.913 -2.661 1.00 0.00 H new ATOM 0 HD21 ASN A 98 17.218 16.152 -6.500 1.00 0.00 H new ATOM 0 HD22 ASN A 98 15.559 16.243 -5.898 1.00 0.00 H new ATOM 1513 N ASN A 99 13.719 12.981 -2.093 1.00 0.00 N ATOM 1514 CA ASN A 99 12.595 12.859 -1.171 1.00 0.00 C ATOM 1515 C ASN A 99 12.570 14.025 -0.187 1.00 0.00 C ATOM 1516 O ASN A 99 13.015 13.898 0.954 1.00 0.00 O ATOM 1517 CB ASN A 99 12.675 11.535 -0.409 1.00 0.00 C ATOM 1518 CG ASN A 99 14.088 11.205 0.030 1.00 0.00 C ATOM 1519 OD1 ASN A 99 14.945 10.879 -0.791 1.00 0.00 O ATOM 1520 ND2 ASN A 99 14.338 11.287 1.332 1.00 0.00 N ATOM 0 H ASN A 99 14.500 12.357 -1.890 1.00 0.00 H new ATOM 0 HA ASN A 99 11.674 12.879 -1.754 1.00 0.00 H new ATOM 0 HB2 ASN A 99 12.027 11.583 0.466 1.00 0.00 H new ATOM 0 HB3 ASN A 99 12.297 10.732 -1.041 1.00 0.00 H new ATOM 0 HD21 ASN A 99 15.271 11.076 1.687 1.00 0.00 H new ATOM 0 HD22 ASN A 99 13.597 11.561 1.977 1.00 0.00 H new ATOM 1527 N VAL A 100 12.047 15.161 -0.637 1.00 0.00 N ATOM 1528 CA VAL A 100 11.962 16.349 0.204 1.00 0.00 C ATOM 1529 C VAL A 100 10.861 16.206 1.249 1.00 0.00 C ATOM 1530 O VAL A 100 10.840 16.928 2.245 1.00 0.00 O ATOM 1531 CB VAL A 100 11.695 17.613 -0.636 1.00 0.00 C ATOM 1532 CG1 VAL A 100 12.822 17.840 -1.632 1.00 0.00 C ATOM 1533 CG2 VAL A 100 10.356 17.506 -1.349 1.00 0.00 C ATOM 0 H VAL A 100 11.676 15.284 -1.579 1.00 0.00 H new ATOM 0 HA VAL A 100 12.924 16.451 0.706 1.00 0.00 H new ATOM 0 HB VAL A 100 11.656 18.472 0.034 1.00 0.00 H new ATOM 0 HG11 VAL A 100 12.616 18.737 -2.216 1.00 0.00 H new ATOM 0 HG12 VAL A 100 13.762 17.965 -1.095 1.00 0.00 H new ATOM 0 HG13 VAL A 100 12.896 16.981 -2.299 1.00 0.00 H new ATOM 0 HG21 VAL A 100 10.184 18.407 -1.937 1.00 0.00 H new ATOM 0 HG22 VAL A 100 10.363 16.638 -2.008 1.00 0.00 H new ATOM 0 HG23 VAL A 100 9.560 17.396 -0.613 1.00 0.00 H new ATOM 1543 N GLU A 101 9.949 15.267 1.015 1.00 0.00 N ATOM 1544 CA GLU A 101 8.844 15.030 1.937 1.00 0.00 C ATOM 1545 C GLU A 101 9.172 13.888 2.895 1.00 0.00 C ATOM 1546 O GLU A 101 10.173 13.191 2.729 1.00 0.00 O ATOM 1547 CB GLU A 101 7.564 14.709 1.162 1.00 0.00 C ATOM 1548 CG GLU A 101 7.461 13.255 0.732 1.00 0.00 C ATOM 1549 CD GLU A 101 8.700 12.773 0.002 1.00 0.00 C ATOM 1550 OE1 GLU A 101 9.032 13.355 -1.052 1.00 0.00 O ATOM 1551 OE2 GLU A 101 9.337 11.814 0.486 1.00 0.00 O ATOM 0 H GLU A 101 9.954 14.659 0.196 1.00 0.00 H new ATOM 0 HA GLU A 101 8.689 15.938 2.520 1.00 0.00 H new ATOM 0 HB2 GLU A 101 6.702 14.958 1.781 1.00 0.00 H new ATOM 0 HB3 GLU A 101 7.515 15.345 0.278 1.00 0.00 H new ATOM 0 HG2 GLU A 101 7.296 12.631 1.610 1.00 0.00 H new ATOM 0 HG3 GLU A 101 6.592 13.132 0.086 1.00 0.00 H new ATOM 1558 N LYS A 102 8.321 13.703 3.898 1.00 0.00 N ATOM 1559 CA LYS A 102 8.517 12.647 4.884 1.00 0.00 C ATOM 1560 C LYS A 102 7.889 11.339 4.412 1.00 0.00 C ATOM 1561 O LYS A 102 6.669 11.213 4.302 1.00 0.00 O ATOM 1562 CB LYS A 102 7.915 13.058 6.229 1.00 0.00 C ATOM 1563 CG LYS A 102 8.878 13.827 7.117 1.00 0.00 C ATOM 1564 CD LYS A 102 8.511 13.695 8.585 1.00 0.00 C ATOM 1565 CE LYS A 102 9.033 12.394 9.175 1.00 0.00 C ATOM 1566 NZ LYS A 102 8.524 12.167 10.556 1.00 0.00 N ATOM 0 H LYS A 102 7.488 14.271 4.050 1.00 0.00 H new ATOM 0 HA LYS A 102 9.589 12.492 5.005 1.00 0.00 H new ATOM 0 HB2 LYS A 102 7.031 13.670 6.050 1.00 0.00 H new ATOM 0 HB3 LYS A 102 7.582 12.164 6.757 1.00 0.00 H new ATOM 0 HG2 LYS A 102 9.892 13.459 6.960 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.874 14.879 6.833 1.00 0.00 H new ATOM 0 HD2 LYS A 102 8.921 14.538 9.141 1.00 0.00 H new ATOM 0 HD3 LYS A 102 7.427 13.737 8.695 1.00 0.00 H new ATOM 0 HE2 LYS A 102 8.736 11.561 8.537 1.00 0.00 H new ATOM 0 HE3 LYS A 102 10.123 12.413 9.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 8.903 11.270 10.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 8.828 12.949 11.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 7.485 12.123 10.540 1.00 0.00 H new ATOM 1580 N PRO A 103 8.739 10.341 4.129 1.00 0.00 N ATOM 1581 CA PRO A 103 8.289 9.025 3.667 1.00 0.00 C ATOM 1582 C PRO A 103 7.577 8.238 4.762 1.00 0.00 C ATOM 1583 O PRO A 103 7.885 8.385 5.946 1.00 0.00 O ATOM 1584 CB PRO A 103 9.591 8.326 3.266 1.00 0.00 C ATOM 1585 CG PRO A 103 10.645 8.992 4.080 1.00 0.00 C ATOM 1586 CD PRO A 103 10.206 10.421 4.238 1.00 0.00 C ATOM 0 HA PRO A 103 7.564 9.103 2.857 1.00 0.00 H new ATOM 0 HB2 PRO A 103 9.547 7.257 3.474 1.00 0.00 H new ATOM 0 HB3 PRO A 103 9.787 8.435 2.199 1.00 0.00 H new ATOM 0 HG2 PRO A 103 10.753 8.507 5.050 1.00 0.00 H new ATOM 0 HG3 PRO A 103 11.615 8.934 3.585 1.00 0.00 H new ATOM 0 HD2 PRO A 103 10.516 10.833 5.199 1.00 0.00 H new ATOM 0 HD3 PRO A 103 10.632 11.060 3.465 1.00 0.00 H new ATOM 1594 N LEU A 104 6.625 7.403 4.361 1.00 0.00 N ATOM 1595 CA LEU A 104 5.870 6.592 5.309 1.00 0.00 C ATOM 1596 C LEU A 104 6.277 5.125 5.216 1.00 0.00 C ATOM 1597 O LEU A 104 6.478 4.596 4.124 1.00 0.00 O ATOM 1598 CB LEU A 104 4.369 6.734 5.049 1.00 0.00 C ATOM 1599 CG LEU A 104 3.886 6.321 3.658 1.00 0.00 C ATOM 1600 CD1 LEU A 104 2.446 5.837 3.715 1.00 0.00 C ATOM 1601 CD2 LEU A 104 4.025 7.478 2.680 1.00 0.00 C ATOM 0 H LEU A 104 6.358 7.270 3.386 1.00 0.00 H new ATOM 0 HA LEU A 104 6.094 6.949 6.314 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.835 6.138 5.789 1.00 0.00 H new ATOM 0 HB3 LEU A 104 4.089 7.774 5.215 1.00 0.00 H new ATOM 0 HG LEU A 104 4.509 5.499 3.307 1.00 0.00 H new ATOM 0 HD11 LEU A 104 2.120 5.547 2.716 1.00 0.00 H new ATOM 0 HD12 LEU A 104 2.377 4.978 4.382 1.00 0.00 H new ATOM 0 HD13 LEU A 104 1.807 6.638 4.087 1.00 0.00 H new ATOM 0 HD21 LEU A 104 3.677 7.166 1.695 1.00 0.00 H new ATOM 0 HD22 LEU A 104 3.427 8.321 3.026 1.00 0.00 H new ATOM 0 HD23 LEU A 104 5.071 7.777 2.617 1.00 0.00 H new ATOM 1613 N GLU A 105 6.393 4.474 6.369 1.00 0.00 N ATOM 1614 CA GLU A 105 6.775 3.068 6.417 1.00 0.00 C ATOM 1615 C GLU A 105 5.570 2.168 6.157 1.00 0.00 C ATOM 1616 O GLU A 105 5.250 1.292 6.962 1.00 0.00 O ATOM 1617 CB GLU A 105 7.394 2.730 7.775 1.00 0.00 C ATOM 1618 CG GLU A 105 6.457 2.967 8.947 1.00 0.00 C ATOM 1619 CD GLU A 105 7.161 2.864 10.286 1.00 0.00 C ATOM 1620 OE1 GLU A 105 7.507 1.734 10.688 1.00 0.00 O ATOM 1621 OE2 GLU A 105 7.365 3.913 10.932 1.00 0.00 O ATOM 0 H GLU A 105 6.228 4.898 7.282 1.00 0.00 H new ATOM 0 HA GLU A 105 7.514 2.892 5.635 1.00 0.00 H new ATOM 0 HB2 GLU A 105 7.703 1.685 7.774 1.00 0.00 H new ATOM 0 HB3 GLU A 105 8.294 3.329 7.914 1.00 0.00 H new ATOM 0 HG2 GLU A 105 6.006 3.955 8.853 1.00 0.00 H new ATOM 0 HG3 GLU A 105 5.645 2.241 8.911 1.00 0.00 H new ATOM 1628 N LEU A 106 4.905 2.392 5.030 1.00 0.00 N ATOM 1629 CA LEU A 106 3.734 1.602 4.663 1.00 0.00 C ATOM 1630 C LEU A 106 3.900 0.149 5.095 1.00 0.00 C ATOM 1631 O LEU A 106 4.847 -0.525 4.691 1.00 0.00 O ATOM 1632 CB LEU A 106 3.499 1.673 3.153 1.00 0.00 C ATOM 1633 CG LEU A 106 2.558 0.619 2.570 1.00 0.00 C ATOM 1634 CD1 LEU A 106 1.108 1.041 2.748 1.00 0.00 C ATOM 1635 CD2 LEU A 106 2.869 0.381 1.099 1.00 0.00 C ATOM 0 H LEU A 106 5.156 3.114 4.354 1.00 0.00 H new ATOM 0 HA LEU A 106 2.869 2.019 5.179 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.101 2.659 2.913 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.463 1.588 2.651 1.00 0.00 H new ATOM 0 HG LEU A 106 2.712 -0.316 3.109 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.453 0.278 2.327 1.00 0.00 H new ATOM 0 HD12 LEU A 106 0.891 1.160 3.810 1.00 0.00 H new ATOM 0 HD13 LEU A 106 0.939 1.988 2.235 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.189 -0.372 0.701 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.744 1.312 0.545 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.897 0.033 0.996 1.00 0.00 H new ATOM 1647 N ARG A 107 2.971 -0.328 5.918 1.00 0.00 N ATOM 1648 CA ARG A 107 3.014 -1.702 6.405 1.00 0.00 C ATOM 1649 C ARG A 107 1.968 -2.561 5.700 1.00 0.00 C ATOM 1650 O ARG A 107 0.915 -2.067 5.297 1.00 0.00 O ATOM 1651 CB ARG A 107 2.785 -1.737 7.917 1.00 0.00 C ATOM 1652 CG ARG A 107 3.692 -0.796 8.692 1.00 0.00 C ATOM 1653 CD ARG A 107 3.213 -0.615 10.124 1.00 0.00 C ATOM 1654 NE ARG A 107 3.733 0.611 10.724 1.00 0.00 N ATOM 1655 CZ ARG A 107 3.758 0.835 12.033 1.00 0.00 C ATOM 1656 NH1 ARG A 107 3.296 -0.079 12.875 1.00 0.00 N ATOM 1657 NH2 ARG A 107 4.247 1.976 12.503 1.00 0.00 N ATOM 0 H ARG A 107 2.180 0.217 6.261 1.00 0.00 H new ATOM 0 HA ARG A 107 4.001 -2.109 6.185 1.00 0.00 H new ATOM 0 HB2 ARG A 107 1.746 -1.480 8.125 1.00 0.00 H new ATOM 0 HB3 ARG A 107 2.939 -2.755 8.276 1.00 0.00 H new ATOM 0 HG2 ARG A 107 4.709 -1.188 8.694 1.00 0.00 H new ATOM 0 HG3 ARG A 107 3.725 0.172 8.193 1.00 0.00 H new ATOM 0 HD2 ARG A 107 2.123 -0.593 10.142 1.00 0.00 H new ATOM 0 HD3 ARG A 107 3.525 -1.472 10.722 1.00 0.00 H new ATOM 0 HE ARG A 107 4.097 1.335 10.104 1.00 0.00 H new ATOM 0 HH11 ARG A 107 2.920 -0.957 12.518 1.00 0.00 H new ATOM 0 HH12 ARG A 107 3.317 0.096 13.880 1.00 0.00 H new ATOM 0 HH21 ARG A 107 4.604 2.682 11.859 1.00 0.00 H new ATOM 0 HH22 ARG A 107 4.266 2.147 13.508 1.00 0.00 H new ATOM 1671 N ILE A 108 2.266 -3.847 5.556 1.00 0.00 N ATOM 1672 CA ILE A 108 1.351 -4.774 4.902 1.00 0.00 C ATOM 1673 C ILE A 108 1.279 -6.099 5.654 1.00 0.00 C ATOM 1674 O ILE A 108 2.252 -6.852 5.704 1.00 0.00 O ATOM 1675 CB ILE A 108 1.772 -5.046 3.445 1.00 0.00 C ATOM 1676 CG1 ILE A 108 1.759 -3.747 2.637 1.00 0.00 C ATOM 1677 CG2 ILE A 108 0.853 -6.080 2.813 1.00 0.00 C ATOM 1678 CD1 ILE A 108 2.502 -3.846 1.323 1.00 0.00 C ATOM 0 H ILE A 108 3.134 -4.271 5.883 1.00 0.00 H new ATOM 0 HA ILE A 108 0.368 -4.303 4.906 1.00 0.00 H new ATOM 0 HB ILE A 108 2.787 -5.442 3.443 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.726 -3.461 2.440 1.00 0.00 H new ATOM 0 HG13 ILE A 108 2.201 -2.951 3.236 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.163 -6.262 1.784 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.909 -7.010 3.378 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.172 -5.710 2.823 1.00 0.00 H new ATOM 0 HD11 ILE A 108 2.452 -2.889 0.803 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.545 -4.101 1.513 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.046 -4.619 0.705 1.00 0.00 H new ATOM 1690 N LYS A 109 0.119 -6.379 6.238 1.00 0.00 N ATOM 1691 CA LYS A 109 -0.083 -7.614 6.986 1.00 0.00 C ATOM 1692 C LYS A 109 -0.667 -8.703 6.091 1.00 0.00 C ATOM 1693 O LYS A 109 -1.416 -8.416 5.156 1.00 0.00 O ATOM 1694 CB LYS A 109 -1.011 -7.367 8.177 1.00 0.00 C ATOM 1695 CG LYS A 109 -1.001 -8.491 9.199 1.00 0.00 C ATOM 1696 CD LYS A 109 -2.306 -8.550 9.976 1.00 0.00 C ATOM 1697 CE LYS A 109 -2.360 -7.481 11.057 1.00 0.00 C ATOM 1698 NZ LYS A 109 -1.778 -7.961 12.341 1.00 0.00 N ATOM 0 H LYS A 109 -0.696 -5.767 6.208 1.00 0.00 H new ATOM 0 HA LYS A 109 0.887 -7.950 7.352 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.719 -6.438 8.668 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.029 -7.228 7.812 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -0.834 -9.442 8.693 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -0.171 -8.348 9.891 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -3.144 -8.420 9.292 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -2.416 -9.535 10.431 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -1.818 -6.597 10.721 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -3.395 -7.179 11.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -1.834 -7.204 13.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -2.310 -8.789 12.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -0.783 -8.225 12.194 1.00 0.00 H new ATOM 1712 N VAL A 110 -0.321 -9.952 6.384 1.00 0.00 N ATOM 1713 CA VAL A 110 -0.813 -11.084 5.607 1.00 0.00 C ATOM 1714 C VAL A 110 -1.854 -11.877 6.390 1.00 0.00 C ATOM 1715 O VAL A 110 -1.554 -12.446 7.441 1.00 0.00 O ATOM 1716 CB VAL A 110 0.335 -12.026 5.199 1.00 0.00 C ATOM 1717 CG1 VAL A 110 -0.192 -13.171 4.347 1.00 0.00 C ATOM 1718 CG2 VAL A 110 1.419 -11.256 4.460 1.00 0.00 C ATOM 0 H VAL A 110 0.298 -10.206 7.154 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.274 -10.675 4.708 1.00 0.00 H new ATOM 0 HB VAL A 110 0.774 -12.449 6.103 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.633 -13.826 4.068 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.930 -13.738 4.915 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.658 -12.770 3.447 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.222 -11.937 4.179 1.00 0.00 H new ATOM 0 HG22 VAL A 110 0.997 -10.804 3.563 1.00 0.00 H new ATOM 0 HG23 VAL A 110 1.816 -10.474 5.108 1.00 0.00 H new ATOM 1728 N LEU A 111 -3.076 -11.911 5.872 1.00 0.00 N ATOM 1729 CA LEU A 111 -4.163 -12.635 6.523 1.00 0.00 C ATOM 1730 C LEU A 111 -4.430 -13.962 5.819 1.00 0.00 C ATOM 1731 O LEU A 111 -4.005 -14.170 4.683 1.00 0.00 O ATOM 1732 CB LEU A 111 -5.434 -11.785 6.533 1.00 0.00 C ATOM 1733 CG LEU A 111 -5.296 -10.377 7.113 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -6.544 -9.557 6.828 1.00 0.00 C ATOM 1735 CD2 LEU A 111 -5.027 -10.440 8.609 1.00 0.00 C ATOM 0 H LEU A 111 -3.340 -11.446 5.003 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.865 -12.843 7.551 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.798 -11.700 5.509 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.198 -12.317 7.100 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.448 -9.889 6.632 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -6.427 -8.558 7.248 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.692 -9.482 5.751 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.409 -10.042 7.280 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -4.932 -9.429 9.004 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -5.854 -10.948 9.106 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -4.103 -10.989 8.790 1.00 0.00 H new ATOM 1747 N ASP A 112 -5.139 -14.855 6.501 1.00 0.00 N ATOM 1748 CA ASP A 112 -5.467 -16.160 5.940 1.00 0.00 C ATOM 1749 C ASP A 112 -6.818 -16.125 5.233 1.00 0.00 C ATOM 1750 O ASP A 112 -7.757 -15.478 5.700 1.00 0.00 O ATOM 1751 CB ASP A 112 -5.481 -17.223 7.041 1.00 0.00 C ATOM 1752 CG ASP A 112 -4.102 -17.787 7.318 1.00 0.00 C ATOM 1753 OD1 ASP A 112 -3.305 -17.102 7.995 1.00 0.00 O ATOM 1754 OD2 ASP A 112 -3.819 -18.913 6.860 1.00 0.00 O ATOM 0 H ASP A 112 -5.497 -14.699 7.443 1.00 0.00 H new ATOM 0 HA ASP A 112 -4.701 -16.416 5.208 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -5.883 -16.789 7.956 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -6.150 -18.033 6.751 1.00 0.00 H new ATOM 1759 N ILE A 113 -6.909 -16.822 4.106 1.00 0.00 N ATOM 1760 CA ILE A 113 -8.145 -16.870 3.335 1.00 0.00 C ATOM 1761 C ILE A 113 -9.311 -17.345 4.195 1.00 0.00 C ATOM 1762 O ILE A 113 -10.442 -16.888 4.033 1.00 0.00 O ATOM 1763 CB ILE A 113 -8.012 -17.797 2.113 1.00 0.00 C ATOM 1764 CG1 ILE A 113 -9.210 -17.622 1.179 1.00 0.00 C ATOM 1765 CG2 ILE A 113 -7.888 -19.246 2.559 1.00 0.00 C ATOM 1766 CD1 ILE A 113 -8.866 -17.789 -0.285 1.00 0.00 C ATOM 0 H ILE A 113 -6.141 -17.362 3.706 1.00 0.00 H new ATOM 0 HA ILE A 113 -8.341 -15.855 2.990 1.00 0.00 H new ATOM 0 HB ILE A 113 -7.108 -17.526 1.567 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -9.979 -18.347 1.448 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -9.638 -16.631 1.332 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -7.795 -19.889 1.684 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.005 -19.359 3.188 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -8.775 -19.530 3.125 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -9.764 -17.651 -0.888 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -8.120 -17.047 -0.570 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -8.466 -18.789 -0.453 1.00 0.00 H new ATOM 1778 N ASN A 114 -9.027 -18.265 5.111 1.00 0.00 N ATOM 1779 CA ASN A 114 -10.052 -18.802 5.999 1.00 0.00 C ATOM 1780 C ASN A 114 -9.923 -18.212 7.400 1.00 0.00 C ATOM 1781 O ASN A 114 -10.097 -18.912 8.398 1.00 0.00 O ATOM 1782 CB ASN A 114 -9.951 -20.328 6.064 1.00 0.00 C ATOM 1783 CG ASN A 114 -10.351 -20.990 4.760 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -9.569 -21.731 4.162 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -11.572 -20.725 4.312 1.00 0.00 N ATOM 0 H ASN A 114 -8.096 -18.654 5.258 1.00 0.00 H new ATOM 0 HA ASN A 114 -11.027 -18.526 5.597 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -8.928 -20.611 6.313 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -10.589 -20.698 6.867 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -11.896 -21.141 3.439 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -12.186 -20.105 4.841 1.00 0.00 H new ATOM 1792 N ASP A 115 -9.616 -16.921 7.466 1.00 0.00 N ATOM 1793 CA ASP A 115 -9.465 -16.236 8.744 1.00 0.00 C ATOM 1794 C ASP A 115 -10.826 -15.887 9.338 1.00 0.00 C ATOM 1795 O ASP A 115 -11.773 -15.587 8.612 1.00 0.00 O ATOM 1796 CB ASP A 115 -8.630 -14.966 8.571 1.00 0.00 C ATOM 1797 CG ASP A 115 -8.331 -14.285 9.892 1.00 0.00 C ATOM 1798 OD1 ASP A 115 -9.196 -13.525 10.376 1.00 0.00 O ATOM 1799 OD2 ASP A 115 -7.233 -14.512 10.441 1.00 0.00 O ATOM 0 H ASP A 115 -9.467 -16.328 6.649 1.00 0.00 H new ATOM 0 HA ASP A 115 -8.951 -16.909 9.430 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -7.693 -15.216 8.074 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -9.161 -14.272 7.920 1.00 0.00 H new