USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=18 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 -27:sc= 0.169 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 29 ASN : amide:sc= -3.69! C(o=-3.7!,f=-10!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc= -3.98! K(o=-4!,f=-2.4) 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+ -145:sc= -1.7 (180deg=-3.8!) USER MOD Single : A 50 TYR OH : rot 180:sc= -1.06 USER MOD Single : A 51 THR OG1 : rot 30:sc= 0.459 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot -42:sc= 0.446 USER MOD Single : A 66 ASN : amide:sc= -0.217 X(o=-0.22,f=-0.31) USER MOD Single : A 67 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0246) USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.371 USER MOD Single : A 73 ASN : amide:sc= -1.56 K(o=-1.6,f=-6.3!) USER MOD Single : A 75 THR OG1 : rot -13:sc= 0.28 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 155:sc= 1.02 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.0641 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 ASN : amide:sc= -1.29 K(o=-1.3,f=-4.8!) USER MOD Single : A 102 LYS NZ :NH3+ 161:sc= -0.0528 (180deg=-0.453) USER MOD Single : A 109 LYS NZ :NH3+ -117:sc= -0.244 (180deg=-1.38!) USER MOD Single : A 114 ASN : amide:sc= -0.0278 X(o=-0.028,f=-0.37) USER MOD ----------------------------------------------------------------- ATOM 182 N THR A 14 -1.418 6.556 4.914 1.00 0.00 N ATOM 183 CA THR A 14 -2.195 5.541 4.213 1.00 0.00 C ATOM 184 C THR A 14 -2.740 4.499 5.183 1.00 0.00 C ATOM 185 O THR A 14 -2.290 4.404 6.325 1.00 0.00 O ATOM 186 CB THR A 14 -1.353 4.833 3.136 1.00 0.00 C ATOM 187 OG1 THR A 14 -0.127 4.360 3.705 1.00 0.00 O ATOM 188 CG2 THR A 14 -1.051 5.773 1.979 1.00 0.00 C ATOM 0 HA THR A 14 -3.027 6.056 3.732 1.00 0.00 H new ATOM 0 HB THR A 14 -1.927 3.988 2.756 1.00 0.00 H new ATOM 0 HG1 THR A 14 0.120 4.926 4.466 1.00 0.00 H new ATOM 0 HG21 THR A 14 -0.455 5.250 1.231 1.00 0.00 H new ATOM 0 HG22 THR A 14 -1.986 6.108 1.529 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.496 6.636 2.347 1.00 0.00 H new ATOM 196 N ALA A 15 -3.711 3.718 4.721 1.00 0.00 N ATOM 197 CA ALA A 15 -4.316 2.680 5.548 1.00 0.00 C ATOM 198 C ALA A 15 -3.495 1.396 5.503 1.00 0.00 C ATOM 199 O ALA A 15 -2.807 1.104 4.524 1.00 0.00 O ATOM 200 CB ALA A 15 -5.744 2.413 5.098 1.00 0.00 C ATOM 0 H ALA A 15 -4.096 3.784 3.779 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.333 3.034 6.579 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.183 1.636 5.724 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -6.331 3.327 5.188 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.743 2.084 4.059 1.00 0.00 H new ATOM 206 N PRO A 16 -3.567 0.609 6.586 1.00 0.00 N ATOM 207 CA PRO A 16 -2.837 -0.658 6.695 1.00 0.00 C ATOM 208 C PRO A 16 -3.390 -1.728 5.760 1.00 0.00 C ATOM 209 O PRO A 16 -4.466 -2.277 5.996 1.00 0.00 O ATOM 210 CB PRO A 16 -3.046 -1.064 8.156 1.00 0.00 C ATOM 211 CG PRO A 16 -4.317 -0.399 8.555 1.00 0.00 C ATOM 212 CD PRO A 16 -4.367 0.894 7.789 1.00 0.00 C ATOM 0 HA PRO A 16 -1.789 -0.550 6.415 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -3.116 -2.147 8.260 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -2.215 -0.737 8.781 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -5.176 -1.026 8.318 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -4.342 -0.217 9.629 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -5.390 1.171 7.535 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -3.947 1.719 8.365 1.00 0.00 H new ATOM 220 N VAL A 17 -2.647 -2.020 4.697 1.00 0.00 N ATOM 221 CA VAL A 17 -3.063 -3.026 3.727 1.00 0.00 C ATOM 222 C VAL A 17 -2.975 -4.429 4.317 1.00 0.00 C ATOM 223 O VAL A 17 -1.893 -5.009 4.405 1.00 0.00 O ATOM 224 CB VAL A 17 -2.204 -2.963 2.450 1.00 0.00 C ATOM 225 CG1 VAL A 17 -2.742 -3.920 1.397 1.00 0.00 C ATOM 226 CG2 VAL A 17 -2.152 -1.541 1.913 1.00 0.00 C ATOM 0 H VAL A 17 -1.754 -1.574 4.486 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.100 -2.808 3.470 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.188 -3.270 2.700 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.123 -3.862 0.502 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.722 -4.938 1.786 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.767 -3.647 1.147 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.541 -1.515 1.011 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.161 -1.204 1.678 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.716 -0.884 2.665 1.00 0.00 H new ATOM 236 N ALA A 18 -4.120 -4.969 4.721 1.00 0.00 N ATOM 237 CA ALA A 18 -4.172 -6.305 5.301 1.00 0.00 C ATOM 238 C ALA A 18 -4.633 -7.332 4.272 1.00 0.00 C ATOM 239 O ALA A 18 -5.832 -7.548 4.089 1.00 0.00 O ATOM 240 CB ALA A 18 -5.093 -6.319 6.512 1.00 0.00 C ATOM 0 H ALA A 18 -5.024 -4.501 4.657 1.00 0.00 H new ATOM 0 HA ALA A 18 -3.166 -6.575 5.620 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.122 -7.323 6.935 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -4.720 -5.620 7.261 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.097 -6.024 6.209 1.00 0.00 H new ATOM 246 N LEU A 19 -3.674 -7.962 3.602 1.00 0.00 N ATOM 247 CA LEU A 19 -3.982 -8.967 2.591 1.00 0.00 C ATOM 248 C LEU A 19 -3.993 -10.366 3.199 1.00 0.00 C ATOM 249 O LEU A 19 -3.514 -10.573 4.314 1.00 0.00 O ATOM 250 CB LEU A 19 -2.962 -8.902 1.452 1.00 0.00 C ATOM 251 CG LEU A 19 -2.832 -7.553 0.745 1.00 0.00 C ATOM 252 CD1 LEU A 19 -1.697 -7.588 -0.268 1.00 0.00 C ATOM 253 CD2 LEU A 19 -4.142 -7.177 0.067 1.00 0.00 C ATOM 0 H LEU A 19 -2.677 -7.795 3.741 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.975 -8.755 2.195 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.985 -9.177 1.850 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.227 -9.655 0.710 1.00 0.00 H new ATOM 0 HG LEU A 19 -2.602 -6.794 1.493 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.620 -6.619 -0.761 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -0.760 -7.811 0.243 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.897 -8.359 -1.012 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.031 -6.214 -0.431 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.402 -7.938 -0.669 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.932 -7.110 0.815 1.00 0.00 H new ATOM 265 N ARG A 20 -4.541 -11.323 2.457 1.00 0.00 N ATOM 266 CA ARG A 20 -4.614 -12.703 2.923 1.00 0.00 C ATOM 267 C ARG A 20 -3.659 -13.594 2.133 1.00 0.00 C ATOM 268 O ARG A 20 -3.368 -13.328 0.968 1.00 0.00 O ATOM 269 CB ARG A 20 -6.044 -13.232 2.798 1.00 0.00 C ATOM 270 CG ARG A 20 -6.168 -14.722 3.068 1.00 0.00 C ATOM 271 CD ARG A 20 -7.607 -15.117 3.361 1.00 0.00 C ATOM 272 NE ARG A 20 -8.421 -15.158 2.149 1.00 0.00 N ATOM 273 CZ ARG A 20 -9.747 -15.077 2.150 1.00 0.00 C ATOM 274 NH1 ARG A 20 -10.405 -14.951 3.294 1.00 0.00 N ATOM 275 NH2 ARG A 20 -10.417 -15.122 1.006 1.00 0.00 N ATOM 0 H ARG A 20 -4.941 -11.168 1.531 1.00 0.00 H new ATOM 0 HA ARG A 20 -4.318 -12.722 3.972 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -6.685 -12.691 3.494 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -6.414 -13.021 1.795 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -5.805 -15.281 2.205 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -5.536 -14.994 3.913 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -7.624 -16.095 3.842 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -8.041 -14.408 4.066 1.00 0.00 H new ATOM 0 HE ARG A 20 -7.945 -15.254 1.252 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -9.893 -14.916 4.176 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -11.423 -14.889 3.293 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -9.914 -15.219 0.124 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -11.435 -15.060 1.008 1.00 0.00 H new ATOM 289 N GLU A 21 -3.176 -14.652 2.777 1.00 0.00 N ATOM 290 CA GLU A 21 -2.254 -15.581 2.135 1.00 0.00 C ATOM 291 C GLU A 21 -2.968 -16.871 1.740 1.00 0.00 C ATOM 292 O GLU A 21 -3.621 -17.509 2.564 1.00 0.00 O ATOM 293 CB GLU A 21 -1.083 -15.899 3.067 1.00 0.00 C ATOM 294 CG GLU A 21 -1.476 -16.729 4.278 1.00 0.00 C ATOM 295 CD GLU A 21 -1.371 -18.220 4.022 1.00 0.00 C ATOM 296 OE1 GLU A 21 -1.430 -18.625 2.843 1.00 0.00 O ATOM 297 OE2 GLU A 21 -1.230 -18.981 5.002 1.00 0.00 O ATOM 0 H GLU A 21 -3.408 -14.887 3.742 1.00 0.00 H new ATOM 0 HA GLU A 21 -1.871 -15.106 1.232 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.317 -16.433 2.505 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -0.636 -14.965 3.407 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -0.836 -16.463 5.119 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.499 -16.485 4.565 1.00 0.00 H new ATOM 304 N GLY A 22 -2.839 -17.247 0.471 1.00 0.00 N ATOM 305 CA GLY A 22 -3.477 -18.457 -0.012 1.00 0.00 C ATOM 306 C GLY A 22 -3.730 -18.422 -1.506 1.00 0.00 C ATOM 307 O GLY A 22 -3.079 -19.136 -2.269 1.00 0.00 O ATOM 0 H GLY A 22 -2.304 -16.735 -0.231 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.849 -19.315 0.227 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.423 -18.599 0.510 1.00 0.00 H new ATOM 311 N GLU A 23 -4.680 -17.592 -1.925 1.00 0.00 N ATOM 312 CA GLU A 23 -5.019 -17.469 -3.338 1.00 0.00 C ATOM 313 C GLU A 23 -4.368 -16.231 -3.948 1.00 0.00 C ATOM 314 O GLU A 23 -3.769 -15.420 -3.242 1.00 0.00 O ATOM 315 CB GLU A 23 -6.537 -17.402 -3.517 1.00 0.00 C ATOM 316 CG GLU A 23 -7.274 -18.586 -2.916 1.00 0.00 C ATOM 317 CD GLU A 23 -8.721 -18.662 -3.364 1.00 0.00 C ATOM 318 OE1 GLU A 23 -9.583 -18.061 -2.690 1.00 0.00 O ATOM 319 OE2 GLU A 23 -8.991 -19.323 -4.389 1.00 0.00 O ATOM 0 H GLU A 23 -5.228 -16.995 -1.306 1.00 0.00 H new ATOM 0 HA GLU A 23 -4.638 -18.350 -3.855 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.908 -16.484 -3.060 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -6.767 -17.344 -4.581 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -6.762 -19.507 -3.195 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -7.237 -18.518 -1.829 1.00 0.00 H new ATOM 326 N ASP A 24 -4.490 -16.094 -5.264 1.00 0.00 N ATOM 327 CA ASP A 24 -3.915 -14.956 -5.971 1.00 0.00 C ATOM 328 C ASP A 24 -4.789 -13.716 -5.807 1.00 0.00 C ATOM 329 O ASP A 24 -5.947 -13.700 -6.228 1.00 0.00 O ATOM 330 CB ASP A 24 -3.744 -15.283 -7.455 1.00 0.00 C ATOM 331 CG ASP A 24 -2.934 -14.232 -8.190 1.00 0.00 C ATOM 332 OD1 ASP A 24 -3.077 -13.036 -7.861 1.00 0.00 O ATOM 333 OD2 ASP A 24 -2.159 -14.606 -9.094 1.00 0.00 O ATOM 0 H ASP A 24 -4.982 -16.757 -5.863 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.936 -14.748 -5.538 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.254 -16.252 -7.557 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.726 -15.372 -7.920 1.00 0.00 H new ATOM 338 N LEU A 25 -4.229 -12.680 -5.193 1.00 0.00 N ATOM 339 CA LEU A 25 -4.958 -11.436 -4.973 1.00 0.00 C ATOM 340 C LEU A 25 -4.777 -10.483 -6.150 1.00 0.00 C ATOM 341 O LEU A 25 -4.537 -9.290 -5.965 1.00 0.00 O ATOM 342 CB LEU A 25 -4.483 -10.766 -3.682 1.00 0.00 C ATOM 343 CG LEU A 25 -4.484 -11.644 -2.430 1.00 0.00 C ATOM 344 CD1 LEU A 25 -3.839 -10.912 -1.264 1.00 0.00 C ATOM 345 CD2 LEU A 25 -5.902 -12.068 -2.077 1.00 0.00 C ATOM 0 H LEU A 25 -3.273 -12.677 -4.839 1.00 0.00 H new ATOM 0 HA LEU A 25 -6.018 -11.675 -4.883 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.470 -10.395 -3.840 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -5.115 -9.898 -3.493 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.899 -12.540 -2.638 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.849 -11.552 -0.382 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -2.809 -10.660 -1.518 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.396 -9.998 -1.055 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.883 -12.692 -1.184 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.510 -11.183 -1.889 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -6.330 -12.633 -2.905 1.00 0.00 H new ATOM 357 N SER A 26 -4.895 -11.018 -7.361 1.00 0.00 N ATOM 358 CA SER A 26 -4.743 -10.215 -8.569 1.00 0.00 C ATOM 359 C SER A 26 -5.908 -9.243 -8.726 1.00 0.00 C ATOM 360 O SER A 26 -5.711 -8.053 -8.972 1.00 0.00 O ATOM 361 CB SER A 26 -4.651 -11.120 -9.799 1.00 0.00 C ATOM 362 OG SER A 26 -4.334 -10.372 -10.960 1.00 0.00 O ATOM 0 H SER A 26 -5.095 -12.003 -7.532 1.00 0.00 H new ATOM 0 HA SER A 26 -3.822 -9.639 -8.479 1.00 0.00 H new ATOM 0 HB2 SER A 26 -3.891 -11.884 -9.636 1.00 0.00 H new ATOM 0 HB3 SER A 26 -5.599 -11.639 -9.944 1.00 0.00 H new ATOM 0 HG SER A 26 -4.279 -10.973 -11.732 1.00 0.00 H new ATOM 368 N LYS A 27 -7.124 -9.758 -8.580 1.00 0.00 N ATOM 369 CA LYS A 27 -8.323 -8.938 -8.704 1.00 0.00 C ATOM 370 C LYS A 27 -8.358 -7.860 -7.625 1.00 0.00 C ATOM 371 O LYS A 27 -8.603 -6.688 -7.912 1.00 0.00 O ATOM 372 CB LYS A 27 -9.576 -9.811 -8.607 1.00 0.00 C ATOM 373 CG LYS A 27 -10.009 -10.403 -9.938 1.00 0.00 C ATOM 374 CD LYS A 27 -10.924 -9.457 -10.697 1.00 0.00 C ATOM 375 CE LYS A 27 -12.361 -9.560 -10.209 1.00 0.00 C ATOM 376 NZ LYS A 27 -13.250 -8.579 -10.892 1.00 0.00 N ATOM 0 H LYS A 27 -7.305 -10.741 -8.375 1.00 0.00 H new ATOM 0 HA LYS A 27 -8.301 -8.452 -9.679 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -9.391 -10.621 -7.902 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -10.393 -9.215 -8.201 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -9.129 -10.623 -10.543 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.523 -11.349 -9.767 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -10.570 -8.433 -10.577 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -10.883 -9.686 -11.762 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -12.732 -10.570 -10.384 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.392 -9.391 -9.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.220 -8.681 -10.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -12.911 -7.614 -10.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.240 -8.757 -11.917 1.00 0.00 H new ATOM 390 N LYS A 28 -8.111 -8.263 -6.384 1.00 0.00 N ATOM 391 CA LYS A 28 -8.111 -7.332 -5.262 1.00 0.00 C ATOM 392 C LYS A 28 -7.475 -6.003 -5.658 1.00 0.00 C ATOM 393 O LYS A 28 -8.006 -4.936 -5.353 1.00 0.00 O ATOM 394 CB LYS A 28 -7.359 -7.934 -4.072 1.00 0.00 C ATOM 395 CG LYS A 28 -8.119 -9.049 -3.375 1.00 0.00 C ATOM 396 CD LYS A 28 -7.711 -9.174 -1.916 1.00 0.00 C ATOM 397 CE LYS A 28 -8.611 -10.145 -1.167 1.00 0.00 C ATOM 398 NZ LYS A 28 -8.504 -9.974 0.308 1.00 0.00 N ATOM 0 H LYS A 28 -7.908 -9.230 -6.129 1.00 0.00 H new ATOM 0 HA LYS A 28 -9.146 -7.149 -4.975 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.399 -8.320 -4.416 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -7.145 -7.145 -3.351 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -9.190 -8.856 -3.439 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -7.934 -9.993 -3.888 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -6.677 -9.513 -1.854 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -7.754 -8.195 -1.440 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.645 -9.994 -1.476 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.344 -11.168 -1.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -9.132 -10.653 0.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -7.522 -10.143 0.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -8.783 -9.006 0.566 1.00 0.00 H new ATOM 412 N ASN A 29 -6.337 -6.076 -6.339 1.00 0.00 N ATOM 413 CA ASN A 29 -5.630 -4.878 -6.778 1.00 0.00 C ATOM 414 C ASN A 29 -6.603 -3.852 -7.352 1.00 0.00 C ATOM 415 O ASN A 29 -7.675 -4.190 -7.854 1.00 0.00 O ATOM 416 CB ASN A 29 -4.574 -5.238 -7.825 1.00 0.00 C ATOM 417 CG ASN A 29 -3.450 -6.076 -7.248 1.00 0.00 C ATOM 418 OD1 ASN A 29 -2.793 -5.675 -6.287 1.00 0.00 O ATOM 419 ND2 ASN A 29 -3.222 -7.245 -7.835 1.00 0.00 N ATOM 0 H ASN A 29 -5.884 -6.952 -6.599 1.00 0.00 H new ATOM 0 HA ASN A 29 -5.137 -4.439 -5.911 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -5.047 -5.783 -8.642 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -4.160 -4.323 -8.249 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.477 -7.851 -7.492 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -3.792 -7.537 -8.629 1.00 0.00 H new ATOM 426 N PRO A 30 -6.221 -2.568 -7.276 1.00 0.00 N ATOM 427 CA PRO A 30 -4.948 -2.155 -6.680 1.00 0.00 C ATOM 428 C PRO A 30 -4.924 -2.353 -5.168 1.00 0.00 C ATOM 429 O PRO A 30 -5.940 -2.178 -4.494 1.00 0.00 O ATOM 430 CB PRO A 30 -4.861 -0.666 -7.026 1.00 0.00 C ATOM 431 CG PRO A 30 -6.276 -0.235 -7.200 1.00 0.00 C ATOM 432 CD PRO A 30 -7.004 -1.422 -7.767 1.00 0.00 C ATOM 0 HA PRO A 30 -4.112 -2.744 -7.057 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -4.370 -0.103 -6.232 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -4.283 -0.504 -7.936 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -6.710 0.071 -6.248 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -6.343 0.621 -7.871 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -8.037 -1.463 -7.421 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -7.034 -1.393 -8.856 1.00 0.00 H new ATOM 440 N ILE A 31 -3.760 -2.717 -4.641 1.00 0.00 N ATOM 441 CA ILE A 31 -3.605 -2.936 -3.209 1.00 0.00 C ATOM 442 C ILE A 31 -3.082 -1.684 -2.514 1.00 0.00 C ATOM 443 O ILE A 31 -3.269 -1.505 -1.311 1.00 0.00 O ATOM 444 CB ILE A 31 -2.649 -4.108 -2.919 1.00 0.00 C ATOM 445 CG1 ILE A 31 -1.277 -3.842 -3.543 1.00 0.00 C ATOM 446 CG2 ILE A 31 -3.233 -5.411 -3.445 1.00 0.00 C ATOM 447 CD1 ILE A 31 -0.192 -4.764 -3.032 1.00 0.00 C ATOM 0 H ILE A 31 -2.910 -2.866 -5.185 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.593 -3.179 -2.819 1.00 0.00 H new ATOM 0 HB ILE A 31 -2.525 -4.198 -1.840 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -1.352 -3.948 -4.625 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.990 -2.810 -3.343 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -2.546 -6.230 -3.232 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -4.189 -5.604 -2.958 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.383 -5.334 -4.522 1.00 0.00 H new ATOM 0 HD11 ILE A 31 0.753 -4.518 -3.517 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -0.089 -4.642 -1.954 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -0.457 -5.797 -3.256 1.00 0.00 H new ATOM 459 N ALA A 32 -2.428 -0.818 -3.281 1.00 0.00 N ATOM 460 CA ALA A 32 -1.881 0.420 -2.740 1.00 0.00 C ATOM 461 C ALA A 32 -1.773 1.491 -3.821 1.00 0.00 C ATOM 462 O ALA A 32 -1.619 1.182 -5.003 1.00 0.00 O ATOM 463 CB ALA A 32 -0.519 0.165 -2.110 1.00 0.00 C ATOM 0 H ALA A 32 -2.264 -0.951 -4.279 1.00 0.00 H new ATOM 0 HA ALA A 32 -2.563 0.784 -1.971 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -0.123 1.098 -1.710 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.621 -0.561 -1.303 1.00 0.00 H new ATOM 0 HB3 ALA A 32 0.164 -0.225 -2.865 1.00 0.00 H new ATOM 469 N LYS A 33 -1.856 2.751 -3.409 1.00 0.00 N ATOM 470 CA LYS A 33 -1.768 3.869 -4.341 1.00 0.00 C ATOM 471 C LYS A 33 -1.353 5.147 -3.620 1.00 0.00 C ATOM 472 O LYS A 33 -1.934 5.510 -2.597 1.00 0.00 O ATOM 473 CB LYS A 33 -3.110 4.080 -5.045 1.00 0.00 C ATOM 474 CG LYS A 33 -4.216 4.550 -4.116 1.00 0.00 C ATOM 475 CD LYS A 33 -5.591 4.277 -4.703 1.00 0.00 C ATOM 476 CE LYS A 33 -6.698 4.672 -3.738 1.00 0.00 C ATOM 477 NZ LYS A 33 -7.053 6.113 -3.862 1.00 0.00 N ATOM 0 H LYS A 33 -1.984 3.024 -2.435 1.00 0.00 H new ATOM 0 HA LYS A 33 -1.008 3.630 -5.085 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -2.981 4.812 -5.843 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.415 3.145 -5.516 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.123 4.046 -3.154 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.105 5.618 -3.928 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -5.706 4.829 -5.636 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -5.680 3.218 -4.947 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.581 4.063 -3.929 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -6.381 4.462 -2.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -7.811 6.343 -3.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -6.217 6.696 -3.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -7.380 6.308 -4.830 1.00 0.00 H new ATOM 491 N ILE A 34 -0.347 5.826 -4.160 1.00 0.00 N ATOM 492 CA ILE A 34 0.143 7.065 -3.569 1.00 0.00 C ATOM 493 C ILE A 34 0.262 8.165 -4.618 1.00 0.00 C ATOM 494 O ILE A 34 0.727 7.927 -5.733 1.00 0.00 O ATOM 495 CB ILE A 34 1.513 6.864 -2.894 1.00 0.00 C ATOM 496 CG1 ILE A 34 2.519 6.290 -3.894 1.00 0.00 C ATOM 497 CG2 ILE A 34 1.379 5.951 -1.685 1.00 0.00 C ATOM 498 CD1 ILE A 34 3.952 6.359 -3.416 1.00 0.00 C ATOM 0 H ILE A 34 0.145 5.539 -5.006 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.584 7.363 -2.814 1.00 0.00 H new ATOM 0 HB ILE A 34 1.880 7.832 -2.554 1.00 0.00 H new ATOM 0 HG12 ILE A 34 2.263 5.251 -4.099 1.00 0.00 H new ATOM 0 HG13 ILE A 34 2.432 6.832 -4.836 1.00 0.00 H new ATOM 0 HG21 ILE A 34 2.355 5.819 -1.219 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.691 6.397 -0.967 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.994 4.982 -2.002 1.00 0.00 H new ATOM 0 HD11 ILE A 34 4.609 5.935 -4.175 1.00 0.00 H new ATOM 0 HD12 ILE A 34 4.227 7.399 -3.238 1.00 0.00 H new ATOM 0 HD13 ILE A 34 4.054 5.793 -2.490 1.00 0.00 H new ATOM 510 N HIS A 35 -0.160 9.372 -4.253 1.00 0.00 N ATOM 511 CA HIS A 35 -0.099 10.511 -5.162 1.00 0.00 C ATOM 512 C HIS A 35 -0.042 11.823 -4.386 1.00 0.00 C ATOM 513 O HIS A 35 -0.937 12.128 -3.597 1.00 0.00 O ATOM 514 CB HIS A 35 -1.309 10.510 -6.097 1.00 0.00 C ATOM 515 CG HIS A 35 -1.311 9.373 -7.072 1.00 0.00 C ATOM 516 ND1 HIS A 35 -0.951 9.516 -8.395 1.00 0.00 N ATOM 517 CD2 HIS A 35 -1.631 8.068 -6.909 1.00 0.00 C ATOM 518 CE1 HIS A 35 -1.051 8.348 -9.005 1.00 0.00 C ATOM 519 NE2 HIS A 35 -1.461 7.452 -8.125 1.00 0.00 N ATOM 0 H HIS A 35 -0.548 9.586 -3.334 1.00 0.00 H new ATOM 0 HA HIS A 35 0.810 10.421 -5.757 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -2.220 10.467 -5.499 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -1.333 11.450 -6.648 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -1.959 7.598 -5.993 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -0.834 8.158 -10.046 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -1.625 6.464 -8.317 1.00 0.00 H new ATOM 528 N SER A 36 1.016 12.595 -4.614 1.00 0.00 N ATOM 529 CA SER A 36 1.192 13.872 -3.933 1.00 0.00 C ATOM 530 C SER A 36 0.144 14.882 -4.392 1.00 0.00 C ATOM 531 O SER A 36 -0.170 14.969 -5.579 1.00 0.00 O ATOM 532 CB SER A 36 2.595 14.423 -4.190 1.00 0.00 C ATOM 533 OG SER A 36 2.881 14.462 -5.578 1.00 0.00 O ATOM 0 H SER A 36 1.764 12.358 -5.265 1.00 0.00 H new ATOM 0 HA SER A 36 1.066 13.705 -2.863 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.678 15.425 -3.770 1.00 0.00 H new ATOM 0 HB3 SER A 36 3.332 13.802 -3.681 1.00 0.00 H new ATOM 0 HG SER A 36 3.783 14.820 -5.716 1.00 0.00 H new ATOM 539 N ASP A 37 -0.392 15.642 -3.444 1.00 0.00 N ATOM 540 CA ASP A 37 -1.403 16.647 -3.750 1.00 0.00 C ATOM 541 C ASP A 37 -0.866 17.673 -4.743 1.00 0.00 C ATOM 542 O ASP A 37 -1.494 17.952 -5.765 1.00 0.00 O ATOM 543 CB ASP A 37 -1.860 17.348 -2.470 1.00 0.00 C ATOM 544 CG ASP A 37 -2.696 16.446 -1.583 1.00 0.00 C ATOM 545 OD1 ASP A 37 -3.869 16.194 -1.931 1.00 0.00 O ATOM 546 OD2 ASP A 37 -2.178 15.992 -0.541 1.00 0.00 O ATOM 0 H ASP A 37 -0.143 15.581 -2.457 1.00 0.00 H new ATOM 0 HA ASP A 37 -2.256 16.142 -4.203 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -0.987 17.690 -1.915 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -2.439 18.234 -2.731 1.00 0.00 H new ATOM 551 N LEU A 38 0.298 18.234 -4.435 1.00 0.00 N ATOM 552 CA LEU A 38 0.920 19.231 -5.299 1.00 0.00 C ATOM 553 C LEU A 38 0.807 18.827 -6.765 1.00 0.00 C ATOM 554 O LEU A 38 0.308 19.589 -7.593 1.00 0.00 O ATOM 555 CB LEU A 38 2.391 19.416 -4.921 1.00 0.00 C ATOM 556 CG LEU A 38 2.684 20.487 -3.871 1.00 0.00 C ATOM 557 CD1 LEU A 38 4.036 20.240 -3.219 1.00 0.00 C ATOM 558 CD2 LEU A 38 2.638 21.874 -4.496 1.00 0.00 C ATOM 0 H LEU A 38 0.830 18.015 -3.593 1.00 0.00 H new ATOM 0 HA LEU A 38 0.394 20.175 -5.160 1.00 0.00 H new ATOM 0 HB2 LEU A 38 2.774 18.463 -4.556 1.00 0.00 H new ATOM 0 HB3 LEU A 38 2.950 19.659 -5.825 1.00 0.00 H new ATOM 0 HG LEU A 38 1.916 20.432 -3.100 1.00 0.00 H new ATOM 0 HD11 LEU A 38 4.227 21.013 -2.474 1.00 0.00 H new ATOM 0 HD12 LEU A 38 4.034 19.263 -2.736 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.817 20.267 -3.979 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.849 22.624 -3.734 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.384 21.941 -5.288 1.00 0.00 H new ATOM 0 HD23 LEU A 38 1.648 22.052 -4.915 1.00 0.00 H new ATOM 570 N ALA A 39 1.271 17.622 -7.080 1.00 0.00 N ATOM 571 CA ALA A 39 1.218 17.115 -8.445 1.00 0.00 C ATOM 572 C ALA A 39 -0.032 17.609 -9.166 1.00 0.00 C ATOM 573 O ALA A 39 0.054 18.387 -10.115 1.00 0.00 O ATOM 574 CB ALA A 39 1.264 15.594 -8.446 1.00 0.00 C ATOM 0 H ALA A 39 1.688 16.979 -6.407 1.00 0.00 H new ATOM 0 HA ALA A 39 2.088 17.494 -8.981 1.00 0.00 H new ATOM 0 HB1 ALA A 39 1.224 15.229 -9.472 1.00 0.00 H new ATOM 0 HB2 ALA A 39 2.189 15.258 -7.978 1.00 0.00 H new ATOM 0 HB3 ALA A 39 0.412 15.204 -7.889 1.00 0.00 H new ATOM 580 N GLU A 40 -1.193 17.150 -8.709 1.00 0.00 N ATOM 581 CA GLU A 40 -2.461 17.545 -9.312 1.00 0.00 C ATOM 582 C GLU A 40 -2.769 19.010 -9.020 1.00 0.00 C ATOM 583 O GLU A 40 -3.053 19.788 -9.929 1.00 0.00 O ATOM 584 CB GLU A 40 -3.596 16.659 -8.793 1.00 0.00 C ATOM 585 CG GLU A 40 -3.723 16.658 -7.279 1.00 0.00 C ATOM 586 CD GLU A 40 -4.700 15.613 -6.776 1.00 0.00 C ATOM 587 OE1 GLU A 40 -5.907 15.922 -6.692 1.00 0.00 O ATOM 588 OE2 GLU A 40 -4.258 14.487 -6.468 1.00 0.00 O ATOM 0 H GLU A 40 -1.282 16.505 -7.924 1.00 0.00 H new ATOM 0 HA GLU A 40 -2.376 17.418 -10.391 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.537 16.996 -9.228 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -3.434 15.637 -9.136 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -2.744 16.477 -6.836 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -4.047 17.644 -6.945 1.00 0.00 H new ATOM 595 N GLU A 41 -2.712 19.378 -7.743 1.00 0.00 N ATOM 596 CA GLU A 41 -2.987 20.749 -7.331 1.00 0.00 C ATOM 597 C GLU A 41 -2.386 21.745 -8.318 1.00 0.00 C ATOM 598 O GLU A 41 -3.108 22.456 -9.017 1.00 0.00 O ATOM 599 CB GLU A 41 -2.430 21.005 -5.929 1.00 0.00 C ATOM 600 CG GLU A 41 -3.420 20.703 -4.816 1.00 0.00 C ATOM 601 CD GLU A 41 -4.437 21.811 -4.624 1.00 0.00 C ATOM 602 OE1 GLU A 41 -5.360 21.921 -5.458 1.00 0.00 O ATOM 603 OE2 GLU A 41 -4.310 22.569 -3.639 1.00 0.00 O ATOM 0 H GLU A 41 -2.478 18.746 -6.977 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.068 20.886 -7.316 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -1.538 20.396 -5.785 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -2.120 22.047 -5.855 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -3.940 19.772 -5.040 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -2.877 20.548 -3.884 1.00 0.00 H new ATOM 610 N ARG A 42 -1.058 21.791 -8.369 1.00 0.00 N ATOM 611 CA ARG A 42 -0.359 22.700 -9.269 1.00 0.00 C ATOM 612 C ARG A 42 -0.286 22.121 -10.678 1.00 0.00 C ATOM 613 O ARG A 42 -0.744 22.739 -11.639 1.00 0.00 O ATOM 614 CB ARG A 42 1.052 22.982 -8.748 1.00 0.00 C ATOM 615 CG ARG A 42 1.082 23.489 -7.315 1.00 0.00 C ATOM 616 CD ARG A 42 1.021 25.008 -7.260 1.00 0.00 C ATOM 617 NE ARG A 42 -0.354 25.500 -7.256 1.00 0.00 N ATOM 618 CZ ARG A 42 -0.705 26.695 -6.793 1.00 0.00 C ATOM 619 NH1 ARG A 42 0.213 27.515 -6.301 1.00 0.00 N ATOM 620 NH2 ARG A 42 -1.977 27.071 -6.823 1.00 0.00 N ATOM 0 H ARG A 42 -0.445 21.209 -7.798 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.919 23.635 -9.308 1.00 0.00 H new ATOM 0 HB2 ARG A 42 1.644 22.069 -8.814 1.00 0.00 H new ATOM 0 HB3 ARG A 42 1.529 23.718 -9.395 1.00 0.00 H new ATOM 0 HG2 ARG A 42 0.242 23.070 -6.762 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.991 23.142 -6.824 1.00 0.00 H new ATOM 0 HD2 ARG A 42 1.534 25.359 -6.365 1.00 0.00 H new ATOM 0 HD3 ARG A 42 1.552 25.424 -8.116 1.00 0.00 H new ATOM 0 HE ARG A 42 -1.084 24.893 -7.629 1.00 0.00 H new ATOM 0 HH11 ARG A 42 1.192 27.229 -6.277 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -0.060 28.432 -5.946 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -2.686 26.443 -7.202 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -2.246 27.988 -6.467 1.00 0.00 H new ATOM 634 N GLY A 43 0.294 20.930 -10.795 1.00 0.00 N ATOM 635 CA GLY A 43 0.417 20.288 -12.090 1.00 0.00 C ATOM 636 C GLY A 43 1.839 19.856 -12.390 1.00 0.00 C ATOM 637 O GLY A 43 2.278 19.895 -13.540 1.00 0.00 O ATOM 0 H GLY A 43 0.681 20.398 -10.015 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -0.239 19.418 -12.125 1.00 0.00 H new ATOM 0 HA3 GLY A 43 0.078 20.974 -12.866 1.00 0.00 H new ATOM 641 N LEU A 44 2.561 19.443 -11.354 1.00 0.00 N ATOM 642 CA LEU A 44 3.942 19.002 -11.512 1.00 0.00 C ATOM 643 C LEU A 44 4.030 17.479 -11.526 1.00 0.00 C ATOM 644 O LEU A 44 3.132 16.790 -11.043 1.00 0.00 O ATOM 645 CB LEU A 44 4.809 19.564 -10.384 1.00 0.00 C ATOM 646 CG LEU A 44 4.786 21.083 -10.212 1.00 0.00 C ATOM 647 CD1 LEU A 44 5.162 21.465 -8.789 1.00 0.00 C ATOM 648 CD2 LEU A 44 5.724 21.747 -11.209 1.00 0.00 C ATOM 0 H LEU A 44 2.213 19.404 -10.396 1.00 0.00 H new ATOM 0 HA LEU A 44 4.310 19.377 -12.467 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.491 19.108 -9.447 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.840 19.254 -10.556 1.00 0.00 H new ATOM 0 HG LEU A 44 3.773 21.436 -10.406 1.00 0.00 H new ATOM 0 HD11 LEU A 44 5.140 22.550 -8.686 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.451 21.020 -8.093 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.165 21.099 -8.567 1.00 0.00 H new ATOM 0 HD21 LEU A 44 5.695 22.828 -11.072 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.740 21.388 -11.047 1.00 0.00 H new ATOM 0 HD23 LEU A 44 5.410 21.501 -12.223 1.00 0.00 H new ATOM 660 N LYS A 45 5.120 16.960 -12.082 1.00 0.00 N ATOM 661 CA LYS A 45 5.328 15.519 -12.156 1.00 0.00 C ATOM 662 C LYS A 45 6.291 15.051 -11.069 1.00 0.00 C ATOM 663 O LYS A 45 7.371 15.616 -10.899 1.00 0.00 O ATOM 664 CB LYS A 45 5.871 15.132 -13.534 1.00 0.00 C ATOM 665 CG LYS A 45 7.172 15.829 -13.893 1.00 0.00 C ATOM 666 CD LYS A 45 7.959 15.043 -14.928 1.00 0.00 C ATOM 667 CE LYS A 45 9.454 15.294 -14.800 1.00 0.00 C ATOM 668 NZ LYS A 45 10.181 14.966 -16.057 1.00 0.00 N ATOM 0 H LYS A 45 5.873 17.516 -12.488 1.00 0.00 H new ATOM 0 HA LYS A 45 4.367 15.030 -12.000 1.00 0.00 H new ATOM 0 HB2 LYS A 45 6.026 14.054 -13.564 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.122 15.368 -14.290 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.957 16.826 -14.278 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.777 15.957 -12.995 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.756 13.979 -14.810 1.00 0.00 H new ATOM 0 HD3 LYS A 45 7.627 15.321 -15.928 1.00 0.00 H new ATOM 0 HE2 LYS A 45 9.626 16.339 -14.543 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.854 14.695 -13.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 11.196 15.151 -15.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 10.038 13.962 -16.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.817 15.556 -16.832 1.00 0.00 H new ATOM 682 N ILE A 46 5.892 14.016 -10.338 1.00 0.00 N ATOM 683 CA ILE A 46 6.721 13.472 -9.269 1.00 0.00 C ATOM 684 C ILE A 46 6.949 11.976 -9.459 1.00 0.00 C ATOM 685 O ILE A 46 6.015 11.224 -9.735 1.00 0.00 O ATOM 686 CB ILE A 46 6.087 13.712 -7.887 1.00 0.00 C ATOM 687 CG1 ILE A 46 5.862 15.208 -7.657 1.00 0.00 C ATOM 688 CG2 ILE A 46 6.967 13.128 -6.791 1.00 0.00 C ATOM 689 CD1 ILE A 46 4.674 15.763 -8.410 1.00 0.00 C ATOM 0 H ILE A 46 5.000 13.537 -10.466 1.00 0.00 H new ATOM 0 HA ILE A 46 7.678 13.992 -9.315 1.00 0.00 H new ATOM 0 HB ILE A 46 5.120 13.210 -7.856 1.00 0.00 H new ATOM 0 HG12 ILE A 46 5.722 15.386 -6.591 1.00 0.00 H new ATOM 0 HG13 ILE A 46 6.758 15.752 -7.956 1.00 0.00 H new ATOM 0 HG21 ILE A 46 6.505 13.306 -5.820 1.00 0.00 H new ATOM 0 HG22 ILE A 46 7.080 12.055 -6.948 1.00 0.00 H new ATOM 0 HG23 ILE A 46 7.947 13.604 -6.819 1.00 0.00 H new ATOM 0 HD11 ILE A 46 4.575 16.828 -8.200 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.821 15.617 -9.480 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.769 15.245 -8.094 1.00 0.00 H new ATOM 701 N THR A 47 8.200 11.550 -9.306 1.00 0.00 N ATOM 702 CA THR A 47 8.552 10.144 -9.459 1.00 0.00 C ATOM 703 C THR A 47 8.381 9.388 -8.147 1.00 0.00 C ATOM 704 O THR A 47 8.817 9.849 -7.092 1.00 0.00 O ATOM 705 CB THR A 47 10.003 9.979 -9.948 1.00 0.00 C ATOM 706 OG1 THR A 47 10.255 10.864 -11.045 1.00 0.00 O ATOM 707 CG2 THR A 47 10.270 8.544 -10.376 1.00 0.00 C ATOM 0 H THR A 47 8.985 12.159 -9.076 1.00 0.00 H new ATOM 0 HA THR A 47 7.875 9.728 -10.205 1.00 0.00 H new ATOM 0 HB THR A 47 10.671 10.226 -9.123 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.180 10.754 -11.348 1.00 0.00 H new ATOM 0 HG21 THR A 47 11.301 8.452 -10.717 1.00 0.00 H new ATOM 0 HG22 THR A 47 10.107 7.876 -9.530 1.00 0.00 H new ATOM 0 HG23 THR A 47 9.594 8.274 -11.187 1.00 0.00 H new ATOM 715 N TYR A 48 7.743 8.225 -8.219 1.00 0.00 N ATOM 716 CA TYR A 48 7.512 7.406 -7.035 1.00 0.00 C ATOM 717 C TYR A 48 8.419 6.178 -7.037 1.00 0.00 C ATOM 718 O TYR A 48 8.465 5.427 -8.011 1.00 0.00 O ATOM 719 CB TYR A 48 6.047 6.972 -6.967 1.00 0.00 C ATOM 720 CG TYR A 48 5.070 8.089 -7.257 1.00 0.00 C ATOM 721 CD1 TYR A 48 4.752 9.029 -6.284 1.00 0.00 C ATOM 722 CD2 TYR A 48 4.466 8.204 -8.502 1.00 0.00 C ATOM 723 CE1 TYR A 48 3.860 10.051 -6.544 1.00 0.00 C ATOM 724 CE2 TYR A 48 3.573 9.223 -8.771 1.00 0.00 C ATOM 725 CZ TYR A 48 3.273 10.144 -7.789 1.00 0.00 C ATOM 726 OH TYR A 48 2.384 11.161 -8.053 1.00 0.00 O ATOM 0 H TYR A 48 7.377 7.828 -9.084 1.00 0.00 H new ATOM 0 HA TYR A 48 7.747 8.007 -6.157 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.883 6.163 -7.679 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.842 6.570 -5.975 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.210 8.959 -5.308 1.00 0.00 H new ATOM 0 HD2 TYR A 48 4.698 7.484 -9.273 1.00 0.00 H new ATOM 0 HE1 TYR A 48 3.623 10.773 -5.777 1.00 0.00 H new ATOM 0 HE2 TYR A 48 3.112 9.298 -9.745 1.00 0.00 H new ATOM 0 HH TYR A 48 2.063 11.083 -8.976 1.00 0.00 H new ATOM 736 N LYS A 49 9.138 5.980 -5.937 1.00 0.00 N ATOM 737 CA LYS A 49 10.042 4.844 -5.809 1.00 0.00 C ATOM 738 C LYS A 49 9.705 4.018 -4.571 1.00 0.00 C ATOM 739 O LYS A 49 9.270 4.556 -3.553 1.00 0.00 O ATOM 740 CB LYS A 49 11.493 5.326 -5.733 1.00 0.00 C ATOM 741 CG LYS A 49 12.506 4.273 -6.147 1.00 0.00 C ATOM 742 CD LYS A 49 13.917 4.837 -6.173 1.00 0.00 C ATOM 743 CE LYS A 49 14.522 4.889 -4.778 1.00 0.00 C ATOM 744 NZ LYS A 49 13.859 5.912 -3.923 1.00 0.00 N ATOM 0 H LYS A 49 9.112 6.592 -5.121 1.00 0.00 H new ATOM 0 HA LYS A 49 9.920 4.214 -6.690 1.00 0.00 H new ATOM 0 HB2 LYS A 49 11.610 6.202 -6.371 1.00 0.00 H new ATOM 0 HB3 LYS A 49 11.708 5.644 -4.713 1.00 0.00 H new ATOM 0 HG2 LYS A 49 12.462 3.432 -5.455 1.00 0.00 H new ATOM 0 HG3 LYS A 49 12.249 3.887 -7.134 1.00 0.00 H new ATOM 0 HD2 LYS A 49 14.544 4.223 -6.820 1.00 0.00 H new ATOM 0 HD3 LYS A 49 13.902 5.839 -6.602 1.00 0.00 H new ATOM 0 HE2 LYS A 49 14.434 3.910 -4.307 1.00 0.00 H new ATOM 0 HE3 LYS A 49 15.586 5.112 -4.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 14.562 6.344 -3.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 13.437 6.647 -4.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 13.114 5.460 -3.355 1.00 0.00 H new ATOM 758 N TYR A 50 9.911 2.709 -4.666 1.00 0.00 N ATOM 759 CA TYR A 50 9.628 1.809 -3.555 1.00 0.00 C ATOM 760 C TYR A 50 10.846 0.953 -3.222 1.00 0.00 C ATOM 761 O TYR A 50 11.429 0.314 -4.099 1.00 0.00 O ATOM 762 CB TYR A 50 8.436 0.910 -3.890 1.00 0.00 C ATOM 763 CG TYR A 50 7.097 1.593 -3.723 1.00 0.00 C ATOM 764 CD1 TYR A 50 6.630 2.491 -4.675 1.00 0.00 C ATOM 765 CD2 TYR A 50 6.300 1.341 -2.613 1.00 0.00 C ATOM 766 CE1 TYR A 50 5.408 3.118 -4.526 1.00 0.00 C ATOM 767 CE2 TYR A 50 5.076 1.962 -2.458 1.00 0.00 C ATOM 768 CZ TYR A 50 4.634 2.850 -3.417 1.00 0.00 C ATOM 769 OH TYR A 50 3.416 3.471 -3.264 1.00 0.00 O ATOM 0 H TYR A 50 10.273 2.248 -5.501 1.00 0.00 H new ATOM 0 HA TYR A 50 9.384 2.416 -2.683 1.00 0.00 H new ATOM 0 HB2 TYR A 50 8.531 0.563 -4.919 1.00 0.00 H new ATOM 0 HB3 TYR A 50 8.466 0.027 -3.251 1.00 0.00 H new ATOM 0 HD1 TYR A 50 7.232 2.702 -5.546 1.00 0.00 H new ATOM 0 HD2 TYR A 50 6.643 0.648 -1.859 1.00 0.00 H new ATOM 0 HE1 TYR A 50 5.061 3.815 -5.275 1.00 0.00 H new ATOM 0 HE2 TYR A 50 4.468 1.753 -1.590 1.00 0.00 H new ATOM 0 HH TYR A 50 2.998 3.171 -2.430 1.00 0.00 H new ATOM 779 N THR A 51 11.226 0.945 -1.948 1.00 0.00 N ATOM 780 CA THR A 51 12.375 0.170 -1.498 1.00 0.00 C ATOM 781 C THR A 51 12.053 -0.600 -0.223 1.00 0.00 C ATOM 782 O THR A 51 11.752 -0.008 0.813 1.00 0.00 O ATOM 783 CB THR A 51 13.598 1.072 -1.245 1.00 0.00 C ATOM 784 OG1 THR A 51 13.299 2.024 -0.217 1.00 0.00 O ATOM 785 CG2 THR A 51 14.005 1.801 -2.516 1.00 0.00 C ATOM 0 H THR A 51 10.754 1.467 -1.210 1.00 0.00 H new ATOM 0 HA THR A 51 12.612 -0.535 -2.295 1.00 0.00 H new ATOM 0 HB THR A 51 14.428 0.441 -0.926 1.00 0.00 H new ATOM 0 HG1 THR A 51 12.650 1.638 0.408 1.00 0.00 H new ATOM 0 HG21 THR A 51 14.870 2.432 -2.312 1.00 0.00 H new ATOM 0 HG22 THR A 51 14.259 1.074 -3.287 1.00 0.00 H new ATOM 0 HG23 THR A 51 13.177 2.421 -2.861 1.00 0.00 H new ATOM 793 N GLY A 52 12.119 -1.926 -0.304 1.00 0.00 N ATOM 794 CA GLY A 52 11.832 -2.755 0.851 1.00 0.00 C ATOM 795 C GLY A 52 11.881 -4.235 0.529 1.00 0.00 C ATOM 796 O GLY A 52 12.508 -4.646 -0.448 1.00 0.00 O ATOM 0 H GLY A 52 12.366 -2.440 -1.150 1.00 0.00 H new ATOM 0 HA2 GLY A 52 12.550 -2.534 1.640 1.00 0.00 H new ATOM 0 HA3 GLY A 52 10.845 -2.503 1.239 1.00 0.00 H new ATOM 800 N LYS A 53 11.220 -5.041 1.353 1.00 0.00 N ATOM 801 CA LYS A 53 11.191 -6.485 1.153 1.00 0.00 C ATOM 802 C LYS A 53 10.173 -6.865 0.081 1.00 0.00 C ATOM 803 O LYS A 53 9.009 -6.473 0.151 1.00 0.00 O ATOM 804 CB LYS A 53 10.855 -7.196 2.465 1.00 0.00 C ATOM 805 CG LYS A 53 10.695 -8.700 2.319 1.00 0.00 C ATOM 806 CD LYS A 53 10.281 -9.347 3.630 1.00 0.00 C ATOM 807 CE LYS A 53 11.468 -9.526 4.563 1.00 0.00 C ATOM 808 NZ LYS A 53 12.221 -10.776 4.269 1.00 0.00 N ATOM 0 H LYS A 53 10.697 -4.718 2.167 1.00 0.00 H new ATOM 0 HA LYS A 53 12.180 -6.800 0.819 1.00 0.00 H new ATOM 0 HB2 LYS A 53 11.642 -6.992 3.191 1.00 0.00 H new ATOM 0 HB3 LYS A 53 9.933 -6.779 2.869 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.948 -8.915 1.555 1.00 0.00 H new ATOM 0 HG3 LYS A 53 11.634 -9.135 1.978 1.00 0.00 H new ATOM 0 HD2 LYS A 53 9.524 -8.732 4.117 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.825 -10.316 3.430 1.00 0.00 H new ATOM 0 HE2 LYS A 53 12.136 -8.669 4.470 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.119 -9.547 5.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.022 -10.861 4.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 11.591 -11.596 4.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 12.577 -10.745 3.292 1.00 0.00 H new ATOM 822 N GLY A 54 10.621 -7.632 -0.908 1.00 0.00 N ATOM 823 CA GLY A 54 9.736 -8.053 -1.979 1.00 0.00 C ATOM 824 C GLY A 54 10.094 -7.420 -3.309 1.00 0.00 C ATOM 825 O GLY A 54 10.019 -8.070 -4.353 1.00 0.00 O ATOM 0 H GLY A 54 11.580 -7.969 -0.987 1.00 0.00 H new ATOM 0 HA2 GLY A 54 9.776 -9.138 -2.074 1.00 0.00 H new ATOM 0 HA3 GLY A 54 8.709 -7.793 -1.721 1.00 0.00 H new ATOM 829 N ILE A 55 10.482 -6.150 -3.273 1.00 0.00 N ATOM 830 CA ILE A 55 10.851 -5.430 -4.486 1.00 0.00 C ATOM 831 C ILE A 55 12.358 -5.475 -4.713 1.00 0.00 C ATOM 832 O ILE A 55 12.823 -5.765 -5.817 1.00 0.00 O ATOM 833 CB ILE A 55 10.396 -3.960 -4.428 1.00 0.00 C ATOM 834 CG1 ILE A 55 8.885 -3.880 -4.199 1.00 0.00 C ATOM 835 CG2 ILE A 55 10.781 -3.236 -5.710 1.00 0.00 C ATOM 836 CD1 ILE A 55 8.446 -2.612 -3.502 1.00 0.00 C ATOM 0 H ILE A 55 10.549 -5.598 -2.418 1.00 0.00 H new ATOM 0 HA ILE A 55 10.345 -5.926 -5.315 1.00 0.00 H new ATOM 0 HB ILE A 55 10.898 -3.472 -3.593 1.00 0.00 H new ATOM 0 HG12 ILE A 55 8.376 -3.952 -5.160 1.00 0.00 H new ATOM 0 HG13 ILE A 55 8.570 -4.739 -3.606 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.453 -2.198 -5.654 1.00 0.00 H new ATOM 0 HG22 ILE A 55 11.863 -3.268 -5.835 1.00 0.00 H new ATOM 0 HG23 ILE A 55 10.303 -3.723 -6.560 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.364 -2.624 -3.373 1.00 0.00 H new ATOM 0 HD12 ILE A 55 8.927 -2.548 -2.526 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.730 -1.749 -4.104 1.00 0.00 H new ATOM 848 N THR A 56 13.119 -5.187 -3.662 1.00 0.00 N ATOM 849 CA THR A 56 14.574 -5.195 -3.746 1.00 0.00 C ATOM 850 C THR A 56 15.157 -6.434 -3.077 1.00 0.00 C ATOM 851 O THR A 56 15.961 -7.151 -3.671 1.00 0.00 O ATOM 852 CB THR A 56 15.182 -3.939 -3.094 1.00 0.00 C ATOM 853 OG1 THR A 56 14.830 -3.888 -1.707 1.00 0.00 O ATOM 854 CG2 THR A 56 14.696 -2.677 -3.792 1.00 0.00 C ATOM 0 H THR A 56 12.751 -4.945 -2.742 1.00 0.00 H new ATOM 0 HA THR A 56 14.829 -5.204 -4.806 1.00 0.00 H new ATOM 0 HB THR A 56 16.266 -3.995 -3.192 1.00 0.00 H new ATOM 0 HG1 THR A 56 13.890 -4.144 -1.598 1.00 0.00 H new ATOM 0 HG21 THR A 56 15.139 -1.803 -3.314 1.00 0.00 H new ATOM 0 HG22 THR A 56 14.991 -2.705 -4.841 1.00 0.00 H new ATOM 0 HG23 THR A 56 13.610 -2.618 -3.722 1.00 0.00 H new ATOM 862 N GLU A 57 14.746 -6.680 -1.837 1.00 0.00 N ATOM 863 CA GLU A 57 15.229 -7.833 -1.087 1.00 0.00 C ATOM 864 C GLU A 57 14.410 -9.078 -1.417 1.00 0.00 C ATOM 865 O GLU A 57 13.266 -8.999 -1.864 1.00 0.00 O ATOM 866 CB GLU A 57 15.170 -7.554 0.416 1.00 0.00 C ATOM 867 CG GLU A 57 16.381 -6.803 0.944 1.00 0.00 C ATOM 868 CD GLU A 57 17.668 -7.589 0.788 1.00 0.00 C ATOM 869 OE1 GLU A 57 18.220 -7.609 -0.331 1.00 0.00 O ATOM 870 OE2 GLU A 57 18.123 -8.185 1.788 1.00 0.00 O ATOM 0 H GLU A 57 14.080 -6.096 -1.331 1.00 0.00 H new ATOM 0 HA GLU A 57 16.265 -8.013 -1.375 1.00 0.00 H new ATOM 0 HB2 GLU A 57 14.271 -6.977 0.635 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.079 -8.500 0.949 1.00 0.00 H new ATOM 0 HG2 GLU A 57 16.473 -5.853 0.417 1.00 0.00 H new ATOM 0 HG3 GLU A 57 16.228 -6.569 1.998 1.00 0.00 H new ATOM 877 N PRO A 58 15.009 -10.257 -1.191 1.00 0.00 N ATOM 878 CA PRO A 58 14.354 -11.541 -1.457 1.00 0.00 C ATOM 879 C PRO A 58 13.214 -11.823 -0.484 1.00 0.00 C ATOM 880 O PRO A 58 13.229 -11.391 0.669 1.00 0.00 O ATOM 881 CB PRO A 58 15.481 -12.560 -1.270 1.00 0.00 C ATOM 882 CG PRO A 58 16.442 -11.895 -0.345 1.00 0.00 C ATOM 883 CD PRO A 58 16.371 -10.427 -0.659 1.00 0.00 C ATOM 0 HA PRO A 58 13.897 -11.568 -2.446 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.106 -13.492 -0.848 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.953 -12.807 -2.221 1.00 0.00 H new ATOM 0 HG2 PRO A 58 16.177 -12.085 0.695 1.00 0.00 H new ATOM 0 HG3 PRO A 58 17.452 -12.277 -0.491 1.00 0.00 H new ATOM 0 HD2 PRO A 58 16.534 -9.818 0.230 1.00 0.00 H new ATOM 0 HD3 PRO A 58 17.127 -10.135 -1.388 1.00 0.00 H new ATOM 891 N PRO A 59 12.202 -12.566 -0.956 1.00 0.00 N ATOM 892 CA PRO A 59 12.173 -13.085 -2.327 1.00 0.00 C ATOM 893 C PRO A 59 11.976 -11.981 -3.361 1.00 0.00 C ATOM 894 O PRO A 59 11.282 -10.996 -3.107 1.00 0.00 O ATOM 895 CB PRO A 59 10.972 -14.034 -2.322 1.00 0.00 C ATOM 896 CG PRO A 59 10.089 -13.521 -1.237 1.00 0.00 C ATOM 897 CD PRO A 59 11.007 -12.955 -0.189 1.00 0.00 C ATOM 0 HA PRO A 59 13.112 -13.566 -2.601 1.00 0.00 H new ATOM 0 HB2 PRO A 59 10.460 -14.030 -3.284 1.00 0.00 H new ATOM 0 HB3 PRO A 59 11.280 -15.062 -2.129 1.00 0.00 H new ATOM 0 HG2 PRO A 59 9.410 -12.757 -1.615 1.00 0.00 H new ATOM 0 HG3 PRO A 59 9.472 -14.320 -0.825 1.00 0.00 H new ATOM 0 HD2 PRO A 59 10.559 -12.100 0.318 1.00 0.00 H new ATOM 0 HD3 PRO A 59 11.244 -13.692 0.578 1.00 0.00 H new ATOM 905 N PHE A 60 12.589 -12.153 -4.527 1.00 0.00 N ATOM 906 CA PHE A 60 12.481 -11.171 -5.599 1.00 0.00 C ATOM 907 C PHE A 60 11.262 -11.452 -6.473 1.00 0.00 C ATOM 908 O PHE A 60 10.807 -12.590 -6.575 1.00 0.00 O ATOM 909 CB PHE A 60 13.749 -11.177 -6.456 1.00 0.00 C ATOM 910 CG PHE A 60 14.942 -10.579 -5.765 1.00 0.00 C ATOM 911 CD1 PHE A 60 15.520 -11.214 -4.678 1.00 0.00 C ATOM 912 CD2 PHE A 60 15.484 -9.382 -6.204 1.00 0.00 C ATOM 913 CE1 PHE A 60 16.617 -10.667 -4.041 1.00 0.00 C ATOM 914 CE2 PHE A 60 16.582 -8.830 -5.571 1.00 0.00 C ATOM 915 CZ PHE A 60 17.148 -9.473 -4.487 1.00 0.00 C ATOM 0 H PHE A 60 13.166 -12.963 -4.754 1.00 0.00 H new ATOM 0 HA PHE A 60 12.362 -10.187 -5.145 1.00 0.00 H new ATOM 0 HB2 PHE A 60 13.981 -12.203 -6.741 1.00 0.00 H new ATOM 0 HB3 PHE A 60 13.558 -10.626 -7.377 1.00 0.00 H new ATOM 0 HD1 PHE A 60 15.108 -12.148 -4.324 1.00 0.00 H new ATOM 0 HD2 PHE A 60 15.044 -8.875 -7.050 1.00 0.00 H new ATOM 0 HE1 PHE A 60 17.059 -11.173 -3.195 1.00 0.00 H new ATOM 0 HE2 PHE A 60 16.997 -7.897 -5.923 1.00 0.00 H new ATOM 0 HZ PHE A 60 18.004 -9.042 -3.989 1.00 0.00 H new ATOM 925 N GLY A 61 10.738 -10.404 -7.103 1.00 0.00 N ATOM 926 CA GLY A 61 9.577 -10.558 -7.959 1.00 0.00 C ATOM 927 C GLY A 61 8.299 -10.766 -7.172 1.00 0.00 C ATOM 928 O GLY A 61 7.571 -11.733 -7.401 1.00 0.00 O ATOM 0 H GLY A 61 11.097 -9.452 -7.035 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.473 -9.673 -8.587 1.00 0.00 H new ATOM 0 HA3 GLY A 61 9.731 -11.406 -8.626 1.00 0.00 H new ATOM 932 N ILE A 62 8.026 -9.860 -6.240 1.00 0.00 N ATOM 933 CA ILE A 62 6.827 -9.949 -5.415 1.00 0.00 C ATOM 934 C ILE A 62 5.851 -8.824 -5.740 1.00 0.00 C ATOM 935 O ILE A 62 4.678 -9.067 -6.024 1.00 0.00 O ATOM 936 CB ILE A 62 7.171 -9.899 -3.914 1.00 0.00 C ATOM 937 CG1 ILE A 62 8.202 -10.975 -3.568 1.00 0.00 C ATOM 938 CG2 ILE A 62 5.913 -10.072 -3.077 1.00 0.00 C ATOM 939 CD1 ILE A 62 7.649 -12.382 -3.629 1.00 0.00 C ATOM 0 H ILE A 62 8.619 -9.055 -6.037 1.00 0.00 H new ATOM 0 HA ILE A 62 6.360 -10.908 -5.640 1.00 0.00 H new ATOM 0 HB ILE A 62 7.603 -8.924 -3.687 1.00 0.00 H new ATOM 0 HG12 ILE A 62 9.044 -10.894 -4.255 1.00 0.00 H new ATOM 0 HG13 ILE A 62 8.588 -10.788 -2.566 1.00 0.00 H new ATOM 0 HG21 ILE A 62 6.172 -10.034 -2.019 1.00 0.00 H new ATOM 0 HG22 ILE A 62 5.210 -9.271 -3.307 1.00 0.00 H new ATOM 0 HG23 ILE A 62 5.454 -11.034 -3.304 1.00 0.00 H new ATOM 0 HD11 ILE A 62 8.434 -13.093 -3.372 1.00 0.00 H new ATOM 0 HD12 ILE A 62 6.825 -12.480 -2.922 1.00 0.00 H new ATOM 0 HD13 ILE A 62 7.288 -12.588 -4.637 1.00 0.00 H new ATOM 951 N PHE A 63 6.344 -7.590 -5.697 1.00 0.00 N ATOM 952 CA PHE A 63 5.515 -6.426 -5.987 1.00 0.00 C ATOM 953 C PHE A 63 6.058 -5.658 -7.189 1.00 0.00 C ATOM 954 O PHE A 63 7.268 -5.477 -7.330 1.00 0.00 O ATOM 955 CB PHE A 63 5.447 -5.505 -4.768 1.00 0.00 C ATOM 956 CG PHE A 63 4.772 -6.130 -3.581 1.00 0.00 C ATOM 957 CD1 PHE A 63 3.390 -6.155 -3.487 1.00 0.00 C ATOM 958 CD2 PHE A 63 5.520 -6.693 -2.559 1.00 0.00 C ATOM 959 CE1 PHE A 63 2.766 -6.729 -2.395 1.00 0.00 C ATOM 960 CE2 PHE A 63 4.901 -7.269 -1.465 1.00 0.00 C ATOM 961 CZ PHE A 63 3.523 -7.288 -1.384 1.00 0.00 C ATOM 0 H PHE A 63 7.313 -7.371 -5.464 1.00 0.00 H new ATOM 0 HA PHE A 63 4.511 -6.777 -6.225 1.00 0.00 H new ATOM 0 HB2 PHE A 63 6.459 -5.211 -4.488 1.00 0.00 H new ATOM 0 HB3 PHE A 63 4.915 -4.594 -5.040 1.00 0.00 H new ATOM 0 HD1 PHE A 63 2.793 -5.721 -4.276 1.00 0.00 H new ATOM 0 HD2 PHE A 63 6.598 -6.682 -2.618 1.00 0.00 H new ATOM 0 HE1 PHE A 63 1.688 -6.740 -2.333 1.00 0.00 H new ATOM 0 HE2 PHE A 63 5.495 -7.704 -0.675 1.00 0.00 H new ATOM 0 HZ PHE A 63 3.038 -7.739 -0.531 1.00 0.00 H new ATOM 971 N VAL A 64 5.154 -5.209 -8.055 1.00 0.00 N ATOM 972 CA VAL A 64 5.541 -4.461 -9.244 1.00 0.00 C ATOM 973 C VAL A 64 4.995 -3.038 -9.201 1.00 0.00 C ATOM 974 O VAL A 64 3.933 -2.787 -8.630 1.00 0.00 O ATOM 975 CB VAL A 64 5.043 -5.151 -10.528 1.00 0.00 C ATOM 976 CG1 VAL A 64 5.531 -6.591 -10.584 1.00 0.00 C ATOM 977 CG2 VAL A 64 3.526 -5.090 -10.611 1.00 0.00 C ATOM 0 H VAL A 64 4.149 -5.351 -7.954 1.00 0.00 H new ATOM 0 HA VAL A 64 6.630 -4.429 -9.256 1.00 0.00 H new ATOM 0 HB VAL A 64 5.453 -4.620 -11.387 1.00 0.00 H new ATOM 0 HG11 VAL A 64 5.169 -7.062 -11.498 1.00 0.00 H new ATOM 0 HG12 VAL A 64 6.621 -6.606 -10.574 1.00 0.00 H new ATOM 0 HG13 VAL A 64 5.153 -7.137 -9.720 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.191 -5.582 -11.524 1.00 0.00 H new ATOM 0 HG22 VAL A 64 3.094 -5.595 -9.747 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.204 -4.049 -10.621 1.00 0.00 H new ATOM 987 N PHE A 65 5.727 -2.110 -9.807 1.00 0.00 N ATOM 988 CA PHE A 65 5.316 -0.711 -9.838 1.00 0.00 C ATOM 989 C PHE A 65 6.048 0.047 -10.941 1.00 0.00 C ATOM 990 O PHE A 65 6.921 -0.502 -11.612 1.00 0.00 O ATOM 991 CB PHE A 65 5.583 -0.050 -8.484 1.00 0.00 C ATOM 992 CG PHE A 65 7.011 0.378 -8.298 1.00 0.00 C ATOM 993 CD1 PHE A 65 7.978 -0.538 -7.916 1.00 0.00 C ATOM 994 CD2 PHE A 65 7.386 1.696 -8.505 1.00 0.00 C ATOM 995 CE1 PHE A 65 9.292 -0.146 -7.743 1.00 0.00 C ATOM 996 CE2 PHE A 65 8.699 2.093 -8.334 1.00 0.00 C ATOM 997 CZ PHE A 65 9.653 1.170 -7.953 1.00 0.00 C ATOM 0 H PHE A 65 6.608 -2.301 -10.284 1.00 0.00 H new ATOM 0 HA PHE A 65 4.247 -0.676 -10.047 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.935 0.820 -8.379 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.314 -0.746 -7.689 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.702 -1.569 -7.752 1.00 0.00 H new ATOM 0 HD2 PHE A 65 6.644 2.421 -8.803 1.00 0.00 H new ATOM 0 HE1 PHE A 65 10.036 -0.869 -7.444 1.00 0.00 H new ATOM 0 HE2 PHE A 65 8.978 3.123 -8.498 1.00 0.00 H new ATOM 0 HZ PHE A 65 10.680 1.477 -7.820 1.00 0.00 H new ATOM 1007 N ASN A 66 5.686 1.313 -11.121 1.00 0.00 N ATOM 1008 CA ASN A 66 6.307 2.147 -12.143 1.00 0.00 C ATOM 1009 C ASN A 66 6.268 3.619 -11.742 1.00 0.00 C ATOM 1010 O ASN A 66 5.826 3.964 -10.646 1.00 0.00 O ATOM 1011 CB ASN A 66 5.602 1.955 -13.487 1.00 0.00 C ATOM 1012 CG ASN A 66 6.050 0.693 -14.200 1.00 0.00 C ATOM 1013 OD1 ASN A 66 7.238 0.503 -14.460 1.00 0.00 O ATOM 1014 ND2 ASN A 66 5.098 -0.176 -14.520 1.00 0.00 N ATOM 0 H ASN A 66 4.966 1.783 -10.573 1.00 0.00 H new ATOM 0 HA ASN A 66 7.349 1.842 -12.240 1.00 0.00 H new ATOM 0 HB2 ASN A 66 4.525 1.915 -13.327 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.798 2.818 -14.124 1.00 0.00 H new ATOM 0 HD21 ASN A 66 5.339 -1.042 -15.001 1.00 0.00 H new ATOM 0 HD22 ASN A 66 4.126 0.023 -14.285 1.00 0.00 H new ATOM 1021 N LYS A 67 6.732 4.483 -12.638 1.00 0.00 N ATOM 1022 CA LYS A 67 6.749 5.918 -12.380 1.00 0.00 C ATOM 1023 C LYS A 67 5.743 6.643 -13.269 1.00 0.00 C ATOM 1024 O LYS A 67 5.200 7.680 -12.889 1.00 0.00 O ATOM 1025 CB LYS A 67 8.152 6.483 -12.615 1.00 0.00 C ATOM 1026 CG LYS A 67 8.659 6.283 -14.033 1.00 0.00 C ATOM 1027 CD LYS A 67 9.951 7.045 -14.276 1.00 0.00 C ATOM 1028 CE LYS A 67 11.140 6.345 -13.637 1.00 0.00 C ATOM 1029 NZ LYS A 67 11.569 5.153 -14.420 1.00 0.00 N ATOM 0 H LYS A 67 7.102 4.214 -13.550 1.00 0.00 H new ATOM 0 HA LYS A 67 6.469 6.077 -11.339 1.00 0.00 H new ATOM 0 HB2 LYS A 67 8.148 7.549 -12.386 1.00 0.00 H new ATOM 0 HB3 LYS A 67 8.846 6.010 -11.920 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.822 5.221 -14.216 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.901 6.615 -14.742 1.00 0.00 H new ATOM 0 HD2 LYS A 67 10.120 7.145 -15.348 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.861 8.053 -13.872 1.00 0.00 H new ATOM 0 HE2 LYS A 67 11.972 7.044 -13.555 1.00 0.00 H new ATOM 0 HE3 LYS A 67 10.880 6.039 -12.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 12.460 4.784 -14.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.835 4.418 -14.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 11.712 5.424 -15.414 1.00 0.00 H new ATOM 1043 N ASP A 68 5.499 6.089 -14.451 1.00 0.00 N ATOM 1044 CA ASP A 68 4.555 6.681 -15.392 1.00 0.00 C ATOM 1045 C ASP A 68 3.117 6.432 -14.949 1.00 0.00 C ATOM 1046 O ASP A 68 2.290 7.345 -14.944 1.00 0.00 O ATOM 1047 CB ASP A 68 4.776 6.111 -16.795 1.00 0.00 C ATOM 1048 CG ASP A 68 5.104 4.631 -16.773 1.00 0.00 C ATOM 1049 OD1 ASP A 68 6.209 4.276 -16.315 1.00 0.00 O ATOM 1050 OD2 ASP A 68 4.255 3.829 -17.216 1.00 0.00 O ATOM 0 H ASP A 68 5.941 5.231 -14.781 1.00 0.00 H new ATOM 0 HA ASP A 68 4.728 7.757 -15.414 1.00 0.00 H new ATOM 0 HB2 ASP A 68 3.881 6.273 -17.395 1.00 0.00 H new ATOM 0 HB3 ASP A 68 5.588 6.653 -17.281 1.00 0.00 H new ATOM 1055 N THR A 69 2.823 5.190 -14.579 1.00 0.00 N ATOM 1056 CA THR A 69 1.485 4.820 -14.136 1.00 0.00 C ATOM 1057 C THR A 69 1.263 5.201 -12.677 1.00 0.00 C ATOM 1058 O THR A 69 0.171 5.617 -12.293 1.00 0.00 O ATOM 1059 CB THR A 69 1.235 3.309 -14.304 1.00 0.00 C ATOM 1060 OG1 THR A 69 2.023 2.574 -13.361 1.00 0.00 O ATOM 1061 CG2 THR A 69 1.575 2.858 -15.717 1.00 0.00 C ATOM 0 H THR A 69 3.495 4.422 -14.577 1.00 0.00 H new ATOM 0 HA THR A 69 0.782 5.369 -14.763 1.00 0.00 H new ATOM 0 HB THR A 69 0.178 3.116 -14.122 1.00 0.00 H new ATOM 0 HG1 THR A 69 1.857 1.615 -13.473 1.00 0.00 H new ATOM 0 HG21 THR A 69 1.391 1.788 -15.812 1.00 0.00 H new ATOM 0 HG22 THR A 69 0.953 3.398 -16.431 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.625 3.065 -15.922 1.00 0.00 H new ATOM 1069 N GLY A 70 2.308 5.056 -11.867 1.00 0.00 N ATOM 1070 CA GLY A 70 2.206 5.390 -10.458 1.00 0.00 C ATOM 1071 C GLY A 70 1.193 4.529 -9.730 1.00 0.00 C ATOM 1072 O GLY A 70 0.136 5.012 -9.326 1.00 0.00 O ATOM 0 H GLY A 70 3.223 4.713 -12.161 1.00 0.00 H new ATOM 0 HA2 GLY A 70 3.183 5.272 -9.988 1.00 0.00 H new ATOM 0 HA3 GLY A 70 1.927 6.439 -10.356 1.00 0.00 H new ATOM 1076 N GLU A 71 1.516 3.251 -9.563 1.00 0.00 N ATOM 1077 CA GLU A 71 0.624 2.321 -8.881 1.00 0.00 C ATOM 1078 C GLU A 71 1.385 1.087 -8.405 1.00 0.00 C ATOM 1079 O GLU A 71 2.493 0.811 -8.866 1.00 0.00 O ATOM 1080 CB GLU A 71 -0.519 1.902 -9.808 1.00 0.00 C ATOM 1081 CG GLU A 71 -0.052 1.196 -11.070 1.00 0.00 C ATOM 1082 CD GLU A 71 -1.189 0.537 -11.825 1.00 0.00 C ATOM 1083 OE1 GLU A 71 -2.240 1.189 -12.002 1.00 0.00 O ATOM 1084 OE2 GLU A 71 -1.030 -0.630 -12.239 1.00 0.00 O ATOM 0 H GLU A 71 2.388 2.836 -9.890 1.00 0.00 H new ATOM 0 HA GLU A 71 0.209 2.829 -8.011 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.195 1.244 -9.263 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.092 2.786 -10.087 1.00 0.00 H new ATOM 0 HG2 GLU A 71 0.443 1.916 -11.722 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.689 0.442 -10.807 1.00 0.00 H new ATOM 1091 N LEU A 72 0.783 0.349 -7.479 1.00 0.00 N ATOM 1092 CA LEU A 72 1.403 -0.856 -6.939 1.00 0.00 C ATOM 1093 C LEU A 72 0.409 -2.013 -6.908 1.00 0.00 C ATOM 1094 O LEU A 72 -0.694 -1.883 -6.380 1.00 0.00 O ATOM 1095 CB LEU A 72 1.938 -0.591 -5.530 1.00 0.00 C ATOM 1096 CG LEU A 72 2.678 -1.751 -4.864 1.00 0.00 C ATOM 1097 CD1 LEU A 72 4.127 -1.794 -5.324 1.00 0.00 C ATOM 1098 CD2 LEU A 72 2.602 -1.632 -3.349 1.00 0.00 C ATOM 0 H LEU A 72 -0.134 0.564 -7.086 1.00 0.00 H new ATOM 0 HA LEU A 72 2.233 -1.131 -7.590 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.611 0.266 -5.574 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.101 -0.307 -4.893 1.00 0.00 H new ATOM 0 HG LEU A 72 2.196 -2.682 -5.161 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.638 -2.626 -4.840 1.00 0.00 H new ATOM 0 HD12 LEU A 72 4.162 -1.927 -6.405 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.621 -0.860 -5.057 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.134 -2.466 -2.891 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.059 -0.694 -3.034 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.559 -1.651 -3.034 1.00 0.00 H new ATOM 1110 N ASN A 73 0.810 -3.146 -7.475 1.00 0.00 N ATOM 1111 CA ASN A 73 -0.044 -4.327 -7.512 1.00 0.00 C ATOM 1112 C ASN A 73 0.758 -5.589 -7.210 1.00 0.00 C ATOM 1113 O ASN A 73 1.823 -5.813 -7.785 1.00 0.00 O ATOM 1114 CB ASN A 73 -0.718 -4.453 -8.880 1.00 0.00 C ATOM 1115 CG ASN A 73 -1.413 -3.173 -9.301 1.00 0.00 C ATOM 1116 OD1 ASN A 73 -2.603 -2.986 -9.046 1.00 0.00 O ATOM 1117 ND2 ASN A 73 -0.672 -2.284 -9.952 1.00 0.00 N ATOM 0 H ASN A 73 1.722 -3.271 -7.915 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.811 -4.213 -6.746 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.029 -4.720 -9.627 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -1.444 -5.265 -8.851 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -1.085 -1.405 -10.262 1.00 0.00 H new ATOM 0 HD22 ASN A 73 0.311 -2.480 -10.142 1.00 0.00 H new ATOM 1124 N VAL A 74 0.239 -6.411 -6.303 1.00 0.00 N ATOM 1125 CA VAL A 74 0.906 -7.652 -5.926 1.00 0.00 C ATOM 1126 C VAL A 74 0.863 -8.667 -7.062 1.00 0.00 C ATOM 1127 O VAL A 74 -0.177 -8.868 -7.692 1.00 0.00 O ATOM 1128 CB VAL A 74 0.264 -8.274 -4.671 1.00 0.00 C ATOM 1129 CG1 VAL A 74 -1.181 -8.661 -4.946 1.00 0.00 C ATOM 1130 CG2 VAL A 74 1.068 -9.479 -4.205 1.00 0.00 C ATOM 0 H VAL A 74 -0.641 -6.240 -5.816 1.00 0.00 H new ATOM 0 HA VAL A 74 1.944 -7.400 -5.708 1.00 0.00 H new ATOM 0 HB VAL A 74 0.270 -7.531 -3.874 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.618 -9.099 -4.048 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.747 -7.774 -5.230 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.215 -9.388 -5.757 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.601 -9.907 -3.318 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.095 -10.227 -4.997 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.085 -9.168 -3.966 1.00 0.00 H new ATOM 1140 N THR A 75 1.999 -9.306 -7.321 1.00 0.00 N ATOM 1141 CA THR A 75 2.092 -10.301 -8.382 1.00 0.00 C ATOM 1142 C THR A 75 2.558 -11.646 -7.836 1.00 0.00 C ATOM 1143 O THR A 75 3.299 -12.372 -8.498 1.00 0.00 O ATOM 1144 CB THR A 75 3.059 -9.849 -9.493 1.00 0.00 C ATOM 1145 OG1 THR A 75 4.366 -9.635 -8.948 1.00 0.00 O ATOM 1146 CG2 THR A 75 2.564 -8.570 -10.153 1.00 0.00 C ATOM 0 H THR A 75 2.868 -9.152 -6.810 1.00 0.00 H new ATOM 0 HA THR A 75 1.092 -10.409 -8.802 1.00 0.00 H new ATOM 0 HB THR A 75 3.104 -10.635 -10.247 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.314 -9.621 -7.969 1.00 0.00 H new ATOM 0 HG21 THR A 75 3.262 -8.270 -10.934 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.582 -8.744 -10.592 1.00 0.00 H new ATOM 0 HG23 THR A 75 2.493 -7.779 -9.406 1.00 0.00 H new ATOM 1154 N SER A 76 2.117 -11.972 -6.625 1.00 0.00 N ATOM 1155 CA SER A 76 2.492 -13.230 -5.989 1.00 0.00 C ATOM 1156 C SER A 76 1.636 -13.489 -4.752 1.00 0.00 C ATOM 1157 O SER A 76 1.105 -12.558 -4.146 1.00 0.00 O ATOM 1158 CB SER A 76 3.972 -13.210 -5.603 1.00 0.00 C ATOM 1159 OG SER A 76 4.433 -14.510 -5.282 1.00 0.00 O ATOM 0 H SER A 76 1.500 -11.383 -6.065 1.00 0.00 H new ATOM 0 HA SER A 76 2.321 -14.035 -6.704 1.00 0.00 H new ATOM 0 HB2 SER A 76 4.560 -12.805 -6.427 1.00 0.00 H new ATOM 0 HB3 SER A 76 4.120 -12.548 -4.750 1.00 0.00 H new ATOM 0 HG SER A 76 5.382 -14.470 -5.040 1.00 0.00 H new ATOM 1165 N ILE A 77 1.507 -14.759 -4.385 1.00 0.00 N ATOM 1166 CA ILE A 77 0.718 -15.141 -3.221 1.00 0.00 C ATOM 1167 C ILE A 77 1.550 -15.072 -1.945 1.00 0.00 C ATOM 1168 O ILE A 77 2.525 -15.808 -1.787 1.00 0.00 O ATOM 1169 CB ILE A 77 0.145 -16.563 -3.371 1.00 0.00 C ATOM 1170 CG1 ILE A 77 -0.747 -16.649 -4.611 1.00 0.00 C ATOM 1171 CG2 ILE A 77 -0.632 -16.956 -2.124 1.00 0.00 C ATOM 1172 CD1 ILE A 77 -0.824 -18.038 -5.205 1.00 0.00 C ATOM 0 H ILE A 77 1.939 -15.541 -4.877 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.106 -14.431 -3.153 1.00 0.00 H new ATOM 0 HB ILE A 77 0.973 -17.261 -3.493 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.752 -16.318 -4.349 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.372 -15.960 -5.367 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.030 -17.963 -2.246 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.031 -16.930 -1.259 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.454 -16.257 -1.972 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.473 -18.024 -6.080 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.174 -18.364 -5.498 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.228 -18.728 -4.465 1.00 0.00 H new ATOM 1184 N LEU A 78 1.159 -14.185 -1.037 1.00 0.00 N ATOM 1185 CA LEU A 78 1.868 -14.021 0.227 1.00 0.00 C ATOM 1186 C LEU A 78 1.956 -15.346 0.978 1.00 0.00 C ATOM 1187 O LEU A 78 1.089 -16.208 0.839 1.00 0.00 O ATOM 1188 CB LEU A 78 1.166 -12.976 1.096 1.00 0.00 C ATOM 1189 CG LEU A 78 0.931 -11.611 0.446 1.00 0.00 C ATOM 1190 CD1 LEU A 78 0.061 -10.739 1.338 1.00 0.00 C ATOM 1191 CD2 LEU A 78 2.258 -10.924 0.155 1.00 0.00 C ATOM 0 H LEU A 78 0.355 -13.568 -1.152 1.00 0.00 H new ATOM 0 HA LEU A 78 2.880 -13.681 0.006 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.202 -13.379 1.407 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.756 -12.829 2.000 1.00 0.00 H new ATOM 0 HG LEU A 78 0.409 -11.764 -0.499 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.096 -9.772 0.860 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.901 -11.226 1.496 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.556 -10.593 2.298 1.00 0.00 H new ATOM 0 HD21 LEU A 78 2.072 -9.954 -0.307 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.807 -10.783 1.086 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.847 -11.542 -0.523 1.00 0.00 H new ATOM 1203 N ASP A 79 3.009 -15.500 1.773 1.00 0.00 N ATOM 1204 CA ASP A 79 3.210 -16.718 2.549 1.00 0.00 C ATOM 1205 C ASP A 79 3.557 -16.389 3.997 1.00 0.00 C ATOM 1206 O ASP A 79 4.714 -16.123 4.324 1.00 0.00 O ATOM 1207 CB ASP A 79 4.318 -17.568 1.926 1.00 0.00 C ATOM 1208 CG ASP A 79 3.871 -18.261 0.654 1.00 0.00 C ATOM 1209 OD1 ASP A 79 3.458 -17.558 -0.291 1.00 0.00 O ATOM 1210 OD2 ASP A 79 3.934 -19.508 0.604 1.00 0.00 O ATOM 0 H ASP A 79 3.737 -14.796 1.897 1.00 0.00 H new ATOM 0 HA ASP A 79 2.279 -17.284 2.538 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.178 -16.935 1.708 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.647 -18.316 2.647 1.00 0.00 H new ATOM 1215 N ARG A 80 2.547 -16.409 4.862 1.00 0.00 N ATOM 1216 CA ARG A 80 2.745 -16.111 6.275 1.00 0.00 C ATOM 1217 C ARG A 80 3.938 -16.883 6.832 1.00 0.00 C ATOM 1218 O ARG A 80 4.818 -16.307 7.470 1.00 0.00 O ATOM 1219 CB ARG A 80 1.485 -16.453 7.072 1.00 0.00 C ATOM 1220 CG ARG A 80 1.386 -15.718 8.399 1.00 0.00 C ATOM 1221 CD ARG A 80 -0.032 -15.749 8.948 1.00 0.00 C ATOM 1222 NE ARG A 80 -0.266 -16.916 9.794 1.00 0.00 N ATOM 1223 CZ ARG A 80 0.092 -16.982 11.071 1.00 0.00 C ATOM 1224 NH1 ARG A 80 0.697 -15.952 11.647 1.00 0.00 N ATOM 1225 NH2 ARG A 80 -0.156 -18.079 11.776 1.00 0.00 N ATOM 0 H ARG A 80 1.584 -16.629 4.608 1.00 0.00 H new ATOM 0 HA ARG A 80 2.948 -15.044 6.370 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.608 -16.216 6.469 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.463 -17.527 7.258 1.00 0.00 H new ATOM 0 HG2 ARG A 80 2.066 -16.172 9.119 1.00 0.00 H new ATOM 0 HG3 ARG A 80 1.704 -14.684 8.268 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -0.218 -14.842 9.523 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.741 -15.753 8.120 1.00 0.00 H new ATOM 0 HE ARG A 80 -0.730 -17.725 9.381 1.00 0.00 H new ATOM 0 HH11 ARG A 80 0.888 -15.107 11.109 1.00 0.00 H new ATOM 0 HH12 ARG A 80 0.971 -16.005 12.628 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -0.622 -18.873 11.337 1.00 0.00 H new ATOM 0 HH22 ARG A 80 0.120 -18.128 12.757 1.00 0.00 H new ATOM 1239 N GLU A 81 3.958 -18.189 6.585 1.00 0.00 N ATOM 1240 CA GLU A 81 5.042 -19.039 7.063 1.00 0.00 C ATOM 1241 C GLU A 81 6.400 -18.426 6.736 1.00 0.00 C ATOM 1242 O GLU A 81 7.173 -18.090 7.632 1.00 0.00 O ATOM 1243 CB GLU A 81 4.937 -20.434 6.443 1.00 0.00 C ATOM 1244 CG GLU A 81 3.781 -21.257 6.986 1.00 0.00 C ATOM 1245 CD GLU A 81 2.429 -20.713 6.566 1.00 0.00 C ATOM 1246 OE1 GLU A 81 1.944 -21.103 5.483 1.00 0.00 O ATOM 1247 OE2 GLU A 81 1.857 -19.897 7.319 1.00 0.00 O ATOM 0 H GLU A 81 3.237 -18.681 6.057 1.00 0.00 H new ATOM 0 HA GLU A 81 4.953 -19.123 8.146 1.00 0.00 H new ATOM 0 HB2 GLU A 81 4.825 -20.335 5.363 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.869 -20.972 6.619 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.878 -22.286 6.639 1.00 0.00 H new ATOM 0 HG3 GLU A 81 3.837 -21.281 8.074 1.00 0.00 H new ATOM 1254 N GLU A 82 6.682 -18.284 5.444 1.00 0.00 N ATOM 1255 CA GLU A 82 7.948 -17.712 4.999 1.00 0.00 C ATOM 1256 C GLU A 82 8.099 -16.275 5.490 1.00 0.00 C ATOM 1257 O GLU A 82 9.007 -15.962 6.260 1.00 0.00 O ATOM 1258 CB GLU A 82 8.042 -17.753 3.472 1.00 0.00 C ATOM 1259 CG GLU A 82 9.263 -17.039 2.918 1.00 0.00 C ATOM 1260 CD GLU A 82 9.742 -17.634 1.608 1.00 0.00 C ATOM 1261 OE1 GLU A 82 9.099 -17.377 0.569 1.00 0.00 O ATOM 1262 OE2 GLU A 82 10.761 -18.356 1.622 1.00 0.00 O ATOM 0 H GLU A 82 6.053 -18.556 4.689 1.00 0.00 H new ATOM 0 HA GLU A 82 8.756 -18.309 5.423 1.00 0.00 H new ATOM 0 HB2 GLU A 82 8.060 -18.793 3.145 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.145 -17.302 3.049 1.00 0.00 H new ATOM 0 HG2 GLU A 82 9.027 -15.985 2.769 1.00 0.00 H new ATOM 0 HG3 GLU A 82 10.069 -17.085 3.650 1.00 0.00 H new ATOM 1269 N THR A 83 7.202 -15.404 5.037 1.00 0.00 N ATOM 1270 CA THR A 83 7.235 -14.000 5.428 1.00 0.00 C ATOM 1271 C THR A 83 5.991 -13.621 6.223 1.00 0.00 C ATOM 1272 O THR A 83 4.861 -13.755 5.754 1.00 0.00 O ATOM 1273 CB THR A 83 7.347 -13.078 4.200 1.00 0.00 C ATOM 1274 OG1 THR A 83 6.368 -13.444 3.221 1.00 0.00 O ATOM 1275 CG2 THR A 83 8.737 -13.157 3.588 1.00 0.00 C ATOM 0 H THR A 83 6.444 -15.646 4.399 1.00 0.00 H new ATOM 0 HA THR A 83 8.117 -13.867 6.055 1.00 0.00 H new ATOM 0 HB THR A 83 7.169 -12.053 4.526 1.00 0.00 H new ATOM 0 HG1 THR A 83 6.159 -12.667 2.661 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.791 -12.497 2.722 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.478 -12.849 4.326 1.00 0.00 H new ATOM 0 HG23 THR A 83 8.940 -14.182 3.276 1.00 0.00 H new ATOM 1283 N PRO A 84 6.201 -13.136 7.456 1.00 0.00 N ATOM 1284 CA PRO A 84 5.107 -12.726 8.342 1.00 0.00 C ATOM 1285 C PRO A 84 4.411 -11.460 7.855 1.00 0.00 C ATOM 1286 O PRO A 84 3.188 -11.341 7.937 1.00 0.00 O ATOM 1287 CB PRO A 84 5.809 -12.471 9.678 1.00 0.00 C ATOM 1288 CG PRO A 84 7.214 -12.142 9.310 1.00 0.00 C ATOM 1289 CD PRO A 84 7.521 -12.950 8.080 1.00 0.00 C ATOM 0 HA PRO A 84 4.321 -13.479 8.395 1.00 0.00 H new ATOM 0 HB2 PRO A 84 5.340 -11.651 10.222 1.00 0.00 H new ATOM 0 HB3 PRO A 84 5.764 -13.349 10.323 1.00 0.00 H new ATOM 0 HG2 PRO A 84 7.326 -11.076 9.114 1.00 0.00 H new ATOM 0 HG3 PRO A 84 7.898 -12.391 10.121 1.00 0.00 H new ATOM 0 HD2 PRO A 84 8.209 -12.426 7.416 1.00 0.00 H new ATOM 0 HD3 PRO A 84 7.985 -13.904 8.331 1.00 0.00 H new ATOM 1297 N PHE A 85 5.197 -10.515 7.349 1.00 0.00 N ATOM 1298 CA PHE A 85 4.655 -9.257 6.850 1.00 0.00 C ATOM 1299 C PHE A 85 5.597 -8.627 5.828 1.00 0.00 C ATOM 1300 O PHE A 85 6.696 -9.128 5.589 1.00 0.00 O ATOM 1301 CB PHE A 85 4.417 -8.285 8.007 1.00 0.00 C ATOM 1302 CG PHE A 85 5.636 -8.048 8.852 1.00 0.00 C ATOM 1303 CD1 PHE A 85 6.651 -7.216 8.409 1.00 0.00 C ATOM 1304 CD2 PHE A 85 5.767 -8.658 10.089 1.00 0.00 C ATOM 1305 CE1 PHE A 85 7.774 -6.995 9.184 1.00 0.00 C ATOM 1306 CE2 PHE A 85 6.887 -8.442 10.869 1.00 0.00 C ATOM 1307 CZ PHE A 85 7.893 -7.610 10.415 1.00 0.00 C ATOM 0 H PHE A 85 6.211 -10.597 7.274 1.00 0.00 H new ATOM 0 HA PHE A 85 3.704 -9.468 6.361 1.00 0.00 H new ATOM 0 HB2 PHE A 85 4.072 -7.332 7.605 1.00 0.00 H new ATOM 0 HB3 PHE A 85 3.617 -8.673 8.638 1.00 0.00 H new ATOM 0 HD1 PHE A 85 6.564 -6.734 7.446 1.00 0.00 H new ATOM 0 HD2 PHE A 85 4.984 -9.310 10.448 1.00 0.00 H new ATOM 0 HE1 PHE A 85 8.557 -6.342 8.828 1.00 0.00 H new ATOM 0 HE2 PHE A 85 6.976 -8.923 11.832 1.00 0.00 H new ATOM 0 HZ PHE A 85 8.770 -7.441 11.022 1.00 0.00 H new ATOM 1317 N PHE A 86 5.158 -7.525 5.228 1.00 0.00 N ATOM 1318 CA PHE A 86 5.960 -6.827 4.230 1.00 0.00 C ATOM 1319 C PHE A 86 5.993 -5.327 4.511 1.00 0.00 C ATOM 1320 O PHE A 86 5.201 -4.563 3.958 1.00 0.00 O ATOM 1321 CB PHE A 86 5.404 -7.083 2.828 1.00 0.00 C ATOM 1322 CG PHE A 86 5.819 -8.406 2.251 1.00 0.00 C ATOM 1323 CD1 PHE A 86 7.066 -8.562 1.667 1.00 0.00 C ATOM 1324 CD2 PHE A 86 4.962 -9.494 2.292 1.00 0.00 C ATOM 1325 CE1 PHE A 86 7.451 -9.778 1.136 1.00 0.00 C ATOM 1326 CE2 PHE A 86 5.342 -10.713 1.762 1.00 0.00 C ATOM 1327 CZ PHE A 86 6.587 -10.855 1.182 1.00 0.00 C ATOM 0 H PHE A 86 4.252 -7.096 5.416 1.00 0.00 H new ATOM 0 HA PHE A 86 6.978 -7.211 4.285 1.00 0.00 H new ATOM 0 HB2 PHE A 86 4.316 -7.036 2.863 1.00 0.00 H new ATOM 0 HB3 PHE A 86 5.736 -6.286 2.163 1.00 0.00 H new ATOM 0 HD1 PHE A 86 7.745 -7.723 1.626 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.986 -9.389 2.743 1.00 0.00 H new ATOM 0 HE1 PHE A 86 8.426 -9.886 0.685 1.00 0.00 H new ATOM 0 HE2 PHE A 86 4.665 -11.554 1.802 1.00 0.00 H new ATOM 0 HZ PHE A 86 6.885 -11.806 0.765 1.00 0.00 H new ATOM 1337 N LEU A 87 6.913 -4.913 5.375 1.00 0.00 N ATOM 1338 CA LEU A 87 7.050 -3.505 5.731 1.00 0.00 C ATOM 1339 C LEU A 87 7.767 -2.732 4.629 1.00 0.00 C ATOM 1340 O LEU A 87 8.987 -2.820 4.487 1.00 0.00 O ATOM 1341 CB LEU A 87 7.813 -3.363 7.048 1.00 0.00 C ATOM 1342 CG LEU A 87 6.995 -3.567 8.324 1.00 0.00 C ATOM 1343 CD1 LEU A 87 7.900 -3.565 9.545 1.00 0.00 C ATOM 1344 CD2 LEU A 87 5.925 -2.492 8.448 1.00 0.00 C ATOM 0 H LEU A 87 7.575 -5.532 5.842 1.00 0.00 H new ATOM 0 HA LEU A 87 6.050 -3.088 5.851 1.00 0.00 H new ATOM 0 HB2 LEU A 87 8.634 -4.080 7.048 1.00 0.00 H new ATOM 0 HB3 LEU A 87 8.258 -2.369 7.081 1.00 0.00 H new ATOM 0 HG LEU A 87 6.502 -4.537 8.266 1.00 0.00 H new ATOM 0 HD11 LEU A 87 7.300 -3.711 10.443 1.00 0.00 H new ATOM 0 HD12 LEU A 87 8.628 -4.372 9.460 1.00 0.00 H new ATOM 0 HD13 LEU A 87 8.422 -2.610 9.609 1.00 0.00 H new ATOM 0 HD21 LEU A 87 5.352 -2.652 9.361 1.00 0.00 H new ATOM 0 HD22 LEU A 87 6.398 -1.510 8.484 1.00 0.00 H new ATOM 0 HD23 LEU A 87 5.257 -2.542 7.588 1.00 0.00 H new ATOM 1356 N LEU A 88 7.002 -1.972 3.852 1.00 0.00 N ATOM 1357 CA LEU A 88 7.565 -1.181 2.764 1.00 0.00 C ATOM 1358 C LEU A 88 7.518 0.308 3.092 1.00 0.00 C ATOM 1359 O LEU A 88 6.995 0.710 4.132 1.00 0.00 O ATOM 1360 CB LEU A 88 6.805 -1.452 1.464 1.00 0.00 C ATOM 1361 CG LEU A 88 6.681 -2.919 1.052 1.00 0.00 C ATOM 1362 CD1 LEU A 88 5.639 -3.080 -0.044 1.00 0.00 C ATOM 1363 CD2 LEU A 88 8.028 -3.460 0.594 1.00 0.00 C ATOM 0 H LEU A 88 5.991 -1.887 3.956 1.00 0.00 H new ATOM 0 HA LEU A 88 8.607 -1.474 2.637 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.802 -1.036 1.560 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.299 -0.910 0.658 1.00 0.00 H new ATOM 0 HG LEU A 88 6.357 -3.494 1.920 1.00 0.00 H new ATOM 0 HD11 LEU A 88 5.565 -4.131 -0.324 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.672 -2.732 0.319 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.932 -2.492 -0.914 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.921 -4.505 0.305 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.381 -2.881 -0.260 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.748 -3.381 1.409 1.00 0.00 H new ATOM 1375 N THR A 89 8.066 1.124 2.197 1.00 0.00 N ATOM 1376 CA THR A 89 8.086 2.568 2.391 1.00 0.00 C ATOM 1377 C THR A 89 8.046 3.303 1.056 1.00 0.00 C ATOM 1378 O THR A 89 8.765 2.951 0.121 1.00 0.00 O ATOM 1379 CB THR A 89 9.337 3.013 3.172 1.00 0.00 C ATOM 1380 OG1 THR A 89 9.471 2.235 4.366 1.00 0.00 O ATOM 1381 CG2 THR A 89 9.256 4.490 3.529 1.00 0.00 C ATOM 0 H THR A 89 8.502 0.809 1.330 1.00 0.00 H new ATOM 0 HA THR A 89 7.197 2.821 2.969 1.00 0.00 H new ATOM 0 HB THR A 89 10.209 2.857 2.537 1.00 0.00 H new ATOM 0 HG1 THR A 89 10.269 2.523 4.856 1.00 0.00 H new ATOM 0 HG21 THR A 89 10.150 4.781 4.080 1.00 0.00 H new ATOM 0 HG22 THR A 89 9.184 5.081 2.616 1.00 0.00 H new ATOM 0 HG23 THR A 89 8.376 4.667 4.147 1.00 0.00 H new ATOM 1389 N GLY A 90 7.202 4.327 0.973 1.00 0.00 N ATOM 1390 CA GLY A 90 7.085 5.095 -0.252 1.00 0.00 C ATOM 1391 C GLY A 90 7.580 6.519 -0.093 1.00 0.00 C ATOM 1392 O GLY A 90 7.172 7.226 0.829 1.00 0.00 O ATOM 0 H GLY A 90 6.597 4.638 1.733 1.00 0.00 H new ATOM 0 HA2 GLY A 90 7.652 4.602 -1.042 1.00 0.00 H new ATOM 0 HA3 GLY A 90 6.043 5.109 -0.570 1.00 0.00 H new ATOM 1396 N TYR A 91 8.462 6.941 -0.992 1.00 0.00 N ATOM 1397 CA TYR A 91 9.016 8.289 -0.944 1.00 0.00 C ATOM 1398 C TYR A 91 8.598 9.093 -2.172 1.00 0.00 C ATOM 1399 O TYR A 91 8.043 8.549 -3.125 1.00 0.00 O ATOM 1400 CB TYR A 91 10.542 8.233 -0.853 1.00 0.00 C ATOM 1401 CG TYR A 91 11.053 7.171 0.094 1.00 0.00 C ATOM 1402 CD1 TYR A 91 11.061 7.384 1.468 1.00 0.00 C ATOM 1403 CD2 TYR A 91 11.528 5.956 -0.383 1.00 0.00 C ATOM 1404 CE1 TYR A 91 11.528 6.417 2.337 1.00 0.00 C ATOM 1405 CE2 TYR A 91 11.996 4.983 0.479 1.00 0.00 C ATOM 1406 CZ TYR A 91 11.993 5.218 1.838 1.00 0.00 C ATOM 1407 OH TYR A 91 12.459 4.252 2.700 1.00 0.00 O ATOM 0 H TYR A 91 8.809 6.369 -1.762 1.00 0.00 H new ATOM 0 HA TYR A 91 8.624 8.785 -0.056 1.00 0.00 H new ATOM 0 HB2 TYR A 91 10.950 8.049 -1.847 1.00 0.00 H new ATOM 0 HB3 TYR A 91 10.914 9.205 -0.530 1.00 0.00 H new ATOM 0 HD1 TYR A 91 10.696 8.321 1.862 1.00 0.00 H new ATOM 0 HD2 TYR A 91 11.532 5.769 -1.447 1.00 0.00 H new ATOM 0 HE1 TYR A 91 11.529 6.599 3.402 1.00 0.00 H new ATOM 0 HE2 TYR A 91 12.362 4.044 0.091 1.00 0.00 H new ATOM 0 HH TYR A 91 12.748 3.468 2.188 1.00 0.00 H new ATOM 1417 N ALA A 92 8.870 10.394 -2.139 1.00 0.00 N ATOM 1418 CA ALA A 92 8.526 11.274 -3.249 1.00 0.00 C ATOM 1419 C ALA A 92 9.767 11.959 -3.812 1.00 0.00 C ATOM 1420 O ALA A 92 10.375 12.803 -3.154 1.00 0.00 O ATOM 1421 CB ALA A 92 7.505 12.311 -2.803 1.00 0.00 C ATOM 0 H ALA A 92 9.327 10.861 -1.356 1.00 0.00 H new ATOM 0 HA ALA A 92 8.088 10.666 -4.041 1.00 0.00 H new ATOM 0 HB1 ALA A 92 7.257 12.962 -3.642 1.00 0.00 H new ATOM 0 HB2 ALA A 92 6.603 11.807 -2.455 1.00 0.00 H new ATOM 0 HB3 ALA A 92 7.923 12.908 -1.992 1.00 0.00 H new ATOM 1427 N LEU A 93 10.137 11.589 -5.033 1.00 0.00 N ATOM 1428 CA LEU A 93 11.307 12.167 -5.686 1.00 0.00 C ATOM 1429 C LEU A 93 10.915 13.368 -6.541 1.00 0.00 C ATOM 1430 O LEU A 93 9.910 13.337 -7.250 1.00 0.00 O ATOM 1431 CB LEU A 93 12.004 11.116 -6.551 1.00 0.00 C ATOM 1432 CG LEU A 93 12.146 9.725 -5.934 1.00 0.00 C ATOM 1433 CD1 LEU A 93 12.853 8.783 -6.896 1.00 0.00 C ATOM 1434 CD2 LEU A 93 12.896 9.802 -4.612 1.00 0.00 C ATOM 0 H LEU A 93 9.644 10.892 -5.591 1.00 0.00 H new ATOM 0 HA LEU A 93 11.995 12.505 -4.911 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.453 11.022 -7.487 1.00 0.00 H new ATOM 0 HB3 LEU A 93 12.999 11.483 -6.802 1.00 0.00 H new ATOM 0 HG LEU A 93 11.148 9.331 -5.741 1.00 0.00 H new ATOM 0 HD11 LEU A 93 12.945 7.798 -6.439 1.00 0.00 H new ATOM 0 HD12 LEU A 93 12.276 8.703 -7.817 1.00 0.00 H new ATOM 0 HD13 LEU A 93 13.846 9.172 -7.122 1.00 0.00 H new ATOM 0 HD21 LEU A 93 12.988 8.802 -4.187 1.00 0.00 H new ATOM 0 HD22 LEU A 93 13.890 10.217 -4.781 1.00 0.00 H new ATOM 0 HD23 LEU A 93 12.349 10.442 -3.920 1.00 0.00 H new ATOM 1446 N ASP A 94 11.717 14.425 -6.470 1.00 0.00 N ATOM 1447 CA ASP A 94 11.457 15.636 -7.240 1.00 0.00 C ATOM 1448 C ASP A 94 12.322 15.677 -8.496 1.00 0.00 C ATOM 1449 O ASP A 94 11.826 15.506 -9.609 1.00 0.00 O ATOM 1450 CB ASP A 94 11.719 16.876 -6.384 1.00 0.00 C ATOM 1451 CG ASP A 94 11.335 18.160 -7.093 1.00 0.00 C ATOM 1452 OD1 ASP A 94 10.124 18.449 -7.184 1.00 0.00 O ATOM 1453 OD2 ASP A 94 12.247 18.877 -7.556 1.00 0.00 O ATOM 0 H ASP A 94 12.553 14.468 -5.887 1.00 0.00 H new ATOM 0 HA ASP A 94 10.410 15.628 -7.542 1.00 0.00 H new ATOM 0 HB2 ASP A 94 11.158 16.797 -5.453 1.00 0.00 H new ATOM 0 HB3 ASP A 94 12.775 16.913 -6.117 1.00 0.00 H new ATOM 1458 N ALA A 95 13.617 15.908 -8.308 1.00 0.00 N ATOM 1459 CA ALA A 95 14.551 15.971 -9.426 1.00 0.00 C ATOM 1460 C ALA A 95 15.772 15.094 -9.172 1.00 0.00 C ATOM 1461 O ALA A 95 15.958 14.068 -9.827 1.00 0.00 O ATOM 1462 CB ALA A 95 14.976 17.410 -9.677 1.00 0.00 C ATOM 0 H ALA A 95 14.043 16.055 -7.393 1.00 0.00 H new ATOM 0 HA ALA A 95 14.043 15.593 -10.313 1.00 0.00 H new ATOM 0 HB1 ALA A 95 15.673 17.443 -10.514 1.00 0.00 H new ATOM 0 HB2 ALA A 95 14.099 18.013 -9.912 1.00 0.00 H new ATOM 0 HB3 ALA A 95 15.461 17.807 -8.785 1.00 0.00 H new ATOM 1468 N ARG A 96 16.601 15.503 -8.217 1.00 0.00 N ATOM 1469 CA ARG A 96 17.805 14.755 -7.878 1.00 0.00 C ATOM 1470 C ARG A 96 17.452 13.363 -7.360 1.00 0.00 C ATOM 1471 O ARG A 96 18.135 12.386 -7.663 1.00 0.00 O ATOM 1472 CB ARG A 96 18.622 15.510 -6.828 1.00 0.00 C ATOM 1473 CG ARG A 96 19.628 16.481 -7.422 1.00 0.00 C ATOM 1474 CD ARG A 96 19.907 17.641 -6.478 1.00 0.00 C ATOM 1475 NE ARG A 96 20.538 18.765 -7.164 1.00 0.00 N ATOM 1476 CZ ARG A 96 20.535 20.008 -6.694 1.00 0.00 C ATOM 1477 NH1 ARG A 96 19.938 20.284 -5.543 1.00 0.00 N ATOM 1478 NH2 ARG A 96 21.132 20.977 -7.376 1.00 0.00 N ATOM 0 H ARG A 96 16.460 16.349 -7.664 1.00 0.00 H new ATOM 0 HA ARG A 96 18.402 14.647 -8.783 1.00 0.00 H new ATOM 0 HB2 ARG A 96 17.942 16.058 -6.176 1.00 0.00 H new ATOM 0 HB3 ARG A 96 19.150 14.789 -6.204 1.00 0.00 H new ATOM 0 HG2 ARG A 96 20.558 15.956 -7.639 1.00 0.00 H new ATOM 0 HG3 ARG A 96 19.250 16.864 -8.370 1.00 0.00 H new ATOM 0 HD2 ARG A 96 18.973 17.972 -6.024 1.00 0.00 H new ATOM 0 HD3 ARG A 96 20.553 17.302 -5.668 1.00 0.00 H new ATOM 0 HE ARG A 96 21.007 18.586 -8.052 1.00 0.00 H new ATOM 0 HH11 ARG A 96 19.479 19.541 -5.015 1.00 0.00 H new ATOM 0 HH12 ARG A 96 19.937 21.239 -5.185 1.00 0.00 H new ATOM 0 HH21 ARG A 96 21.593 20.768 -8.261 1.00 0.00 H new ATOM 0 HH22 ARG A 96 21.129 21.931 -7.015 1.00 0.00 H new ATOM 1492 N GLY A 97 16.381 13.283 -6.576 1.00 0.00 N ATOM 1493 CA GLY A 97 15.957 12.007 -6.028 1.00 0.00 C ATOM 1494 C GLY A 97 15.981 11.991 -4.513 1.00 0.00 C ATOM 1495 O GLY A 97 16.200 10.947 -3.900 1.00 0.00 O ATOM 0 H GLY A 97 15.800 14.078 -6.311 1.00 0.00 H new ATOM 0 HA2 GLY A 97 14.948 11.783 -6.375 1.00 0.00 H new ATOM 0 HA3 GLY A 97 16.607 11.218 -6.407 1.00 0.00 H new ATOM 1499 N ASN A 98 15.757 13.152 -3.906 1.00 0.00 N ATOM 1500 CA ASN A 98 15.756 13.267 -2.452 1.00 0.00 C ATOM 1501 C ASN A 98 14.331 13.369 -1.916 1.00 0.00 C ATOM 1502 O ASN A 98 13.559 14.229 -2.336 1.00 0.00 O ATOM 1503 CB ASN A 98 16.565 14.490 -2.017 1.00 0.00 C ATOM 1504 CG ASN A 98 17.993 14.451 -2.527 1.00 0.00 C ATOM 1505 OD1 ASN A 98 18.783 13.595 -2.128 1.00 0.00 O ATOM 1506 ND2 ASN A 98 18.330 15.380 -3.414 1.00 0.00 N ATOM 0 H ASN A 98 15.574 14.026 -4.398 1.00 0.00 H new ATOM 0 HA ASN A 98 16.217 12.369 -2.040 1.00 0.00 H new ATOM 0 HB2 ASN A 98 16.077 15.394 -2.382 1.00 0.00 H new ATOM 0 HB3 ASN A 98 16.572 14.549 -0.929 1.00 0.00 H new ATOM 0 HD21 ASN A 98 19.277 15.404 -3.793 1.00 0.00 H new ATOM 0 HD22 ASN A 98 17.642 16.070 -3.716 1.00 0.00 H new ATOM 1513 N ASN A 99 13.992 12.484 -0.984 1.00 0.00 N ATOM 1514 CA ASN A 99 12.660 12.474 -0.389 1.00 0.00 C ATOM 1515 C ASN A 99 12.298 13.851 0.158 1.00 0.00 C ATOM 1516 O ASN A 99 12.697 14.216 1.263 1.00 0.00 O ATOM 1517 CB ASN A 99 12.587 11.433 0.730 1.00 0.00 C ATOM 1518 CG ASN A 99 13.532 11.746 1.874 1.00 0.00 C ATOM 1519 OD1 ASN A 99 14.510 12.474 1.704 1.00 0.00 O ATOM 1520 ND2 ASN A 99 13.242 11.196 3.048 1.00 0.00 N ATOM 0 H ASN A 99 14.620 11.765 -0.625 1.00 0.00 H new ATOM 0 HA ASN A 99 11.943 12.212 -1.167 1.00 0.00 H new ATOM 0 HB2 ASN A 99 11.566 11.382 1.109 1.00 0.00 H new ATOM 0 HB3 ASN A 99 12.826 10.450 0.324 1.00 0.00 H new ATOM 0 HD21 ASN A 99 13.841 11.371 3.855 1.00 0.00 H new ATOM 0 HD22 ASN A 99 12.420 10.599 3.142 1.00 0.00 H new ATOM 1527 N VAL A 100 11.538 14.611 -0.624 1.00 0.00 N ATOM 1528 CA VAL A 100 11.120 15.948 -0.218 1.00 0.00 C ATOM 1529 C VAL A 100 9.948 15.885 0.755 1.00 0.00 C ATOM 1530 O VAL A 100 9.658 16.855 1.454 1.00 0.00 O ATOM 1531 CB VAL A 100 10.718 16.804 -1.434 1.00 0.00 C ATOM 1532 CG1 VAL A 100 11.921 17.058 -2.330 1.00 0.00 C ATOM 1533 CG2 VAL A 100 9.597 16.131 -2.212 1.00 0.00 C ATOM 0 H VAL A 100 11.199 14.324 -1.542 1.00 0.00 H new ATOM 0 HA VAL A 100 11.974 16.411 0.276 1.00 0.00 H new ATOM 0 HB VAL A 100 10.353 17.766 -1.074 1.00 0.00 H new ATOM 0 HG11 VAL A 100 11.617 17.664 -3.184 1.00 0.00 H new ATOM 0 HG12 VAL A 100 12.690 17.585 -1.766 1.00 0.00 H new ATOM 0 HG13 VAL A 100 12.319 16.107 -2.684 1.00 0.00 H new ATOM 0 HG21 VAL A 100 9.326 16.749 -3.068 1.00 0.00 H new ATOM 0 HG22 VAL A 100 9.932 15.155 -2.562 1.00 0.00 H new ATOM 0 HG23 VAL A 100 8.729 16.006 -1.565 1.00 0.00 H new ATOM 1543 N GLU A 101 9.279 14.737 0.794 1.00 0.00 N ATOM 1544 CA GLU A 101 8.138 14.548 1.683 1.00 0.00 C ATOM 1545 C GLU A 101 8.313 13.294 2.534 1.00 0.00 C ATOM 1546 O GLU A 101 8.673 12.231 2.027 1.00 0.00 O ATOM 1547 CB GLU A 101 6.844 14.452 0.873 1.00 0.00 C ATOM 1548 CG GLU A 101 6.325 15.797 0.392 1.00 0.00 C ATOM 1549 CD GLU A 101 6.320 16.846 1.488 1.00 0.00 C ATOM 1550 OE1 GLU A 101 6.013 16.493 2.645 1.00 0.00 O ATOM 1551 OE2 GLU A 101 6.623 18.019 1.186 1.00 0.00 O ATOM 0 H GLU A 101 9.507 13.924 0.221 1.00 0.00 H new ATOM 0 HA GLU A 101 8.080 15.411 2.347 1.00 0.00 H new ATOM 0 HB2 GLU A 101 7.012 13.808 0.010 1.00 0.00 H new ATOM 0 HB3 GLU A 101 6.078 13.974 1.483 1.00 0.00 H new ATOM 0 HG2 GLU A 101 6.942 16.145 -0.436 1.00 0.00 H new ATOM 0 HG3 GLU A 101 5.313 15.675 0.006 1.00 0.00 H new ATOM 1558 N LYS A 102 8.055 13.425 3.830 1.00 0.00 N ATOM 1559 CA LYS A 102 8.182 12.304 4.754 1.00 0.00 C ATOM 1560 C LYS A 102 7.654 11.019 4.125 1.00 0.00 C ATOM 1561 O LYS A 102 6.714 11.029 3.331 1.00 0.00 O ATOM 1562 CB LYS A 102 7.426 12.598 6.052 1.00 0.00 C ATOM 1563 CG LYS A 102 5.943 12.280 5.977 1.00 0.00 C ATOM 1564 CD LYS A 102 5.210 12.744 7.224 1.00 0.00 C ATOM 1565 CE LYS A 102 3.812 12.149 7.302 1.00 0.00 C ATOM 1566 NZ LYS A 102 3.847 10.667 7.447 1.00 0.00 N ATOM 0 H LYS A 102 7.756 14.298 4.265 1.00 0.00 H new ATOM 0 HA LYS A 102 9.240 12.169 4.980 1.00 0.00 H new ATOM 0 HB2 LYS A 102 7.872 12.020 6.861 1.00 0.00 H new ATOM 0 HB3 LYS A 102 7.551 13.651 6.305 1.00 0.00 H new ATOM 0 HG2 LYS A 102 5.511 12.761 5.100 1.00 0.00 H new ATOM 0 HG3 LYS A 102 5.806 11.206 5.852 1.00 0.00 H new ATOM 0 HD2 LYS A 102 5.778 12.458 8.109 1.00 0.00 H new ATOM 0 HD3 LYS A 102 5.144 13.832 7.225 1.00 0.00 H new ATOM 0 HE2 LYS A 102 3.279 12.584 8.147 1.00 0.00 H new ATOM 0 HE3 LYS A 102 3.254 12.413 6.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 2.933 10.332 7.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 4.029 10.232 6.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 4.604 10.401 8.109 1.00 0.00 H new ATOM 1580 N PRO A 103 8.271 9.885 4.488 1.00 0.00 N ATOM 1581 CA PRO A 103 7.878 8.570 3.972 1.00 0.00 C ATOM 1582 C PRO A 103 6.523 8.119 4.506 1.00 0.00 C ATOM 1583 O PRO A 103 5.924 8.786 5.352 1.00 0.00 O ATOM 1584 CB PRO A 103 8.987 7.644 4.479 1.00 0.00 C ATOM 1585 CG PRO A 103 9.522 8.322 5.693 1.00 0.00 C ATOM 1586 CD PRO A 103 9.399 9.798 5.431 1.00 0.00 C ATOM 0 HA PRO A 103 7.769 8.574 2.887 1.00 0.00 H new ATOM 0 HB2 PRO A 103 8.598 6.654 4.718 1.00 0.00 H new ATOM 0 HB3 PRO A 103 9.764 7.508 3.727 1.00 0.00 H new ATOM 0 HG2 PRO A 103 8.958 8.035 6.581 1.00 0.00 H new ATOM 0 HG3 PRO A 103 10.560 8.042 5.871 1.00 0.00 H new ATOM 0 HD2 PRO A 103 9.200 10.353 6.348 1.00 0.00 H new ATOM 0 HD3 PRO A 103 10.314 10.207 5.002 1.00 0.00 H new ATOM 1594 N LEU A 104 6.044 6.984 4.009 1.00 0.00 N ATOM 1595 CA LEU A 104 4.758 6.444 4.437 1.00 0.00 C ATOM 1596 C LEU A 104 4.934 5.083 5.104 1.00 0.00 C ATOM 1597 O LEU A 104 5.436 4.142 4.491 1.00 0.00 O ATOM 1598 CB LEU A 104 3.812 6.319 3.241 1.00 0.00 C ATOM 1599 CG LEU A 104 3.128 7.610 2.790 1.00 0.00 C ATOM 1600 CD1 LEU A 104 2.530 7.440 1.402 1.00 0.00 C ATOM 1601 CD2 LEU A 104 2.055 8.023 3.788 1.00 0.00 C ATOM 0 H LEU A 104 6.526 6.420 3.309 1.00 0.00 H new ATOM 0 HA LEU A 104 4.327 7.132 5.164 1.00 0.00 H new ATOM 0 HB2 LEU A 104 4.374 5.916 2.399 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.041 5.590 3.488 1.00 0.00 H new ATOM 0 HG LEU A 104 3.878 8.400 2.746 1.00 0.00 H new ATOM 0 HD11 LEU A 104 2.047 8.369 1.098 1.00 0.00 H new ATOM 0 HD12 LEU A 104 3.320 7.192 0.693 1.00 0.00 H new ATOM 0 HD13 LEU A 104 1.793 6.637 1.419 1.00 0.00 H new ATOM 0 HD21 LEU A 104 1.579 8.944 3.450 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.306 7.234 3.864 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.510 8.187 4.765 1.00 0.00 H new ATOM 1613 N GLU A 105 4.517 4.989 6.362 1.00 0.00 N ATOM 1614 CA GLU A 105 4.627 3.743 7.112 1.00 0.00 C ATOM 1615 C GLU A 105 3.640 2.704 6.588 1.00 0.00 C ATOM 1616 O GLU A 105 2.575 2.494 7.170 1.00 0.00 O ATOM 1617 CB GLU A 105 4.379 3.993 8.601 1.00 0.00 C ATOM 1618 CG GLU A 105 4.742 2.812 9.485 1.00 0.00 C ATOM 1619 CD GLU A 105 4.405 3.051 10.944 1.00 0.00 C ATOM 1620 OE1 GLU A 105 4.715 4.150 11.452 1.00 0.00 O ATOM 1621 OE2 GLU A 105 3.832 2.141 11.578 1.00 0.00 O ATOM 0 H GLU A 105 4.100 5.760 6.884 1.00 0.00 H new ATOM 0 HA GLU A 105 5.638 3.358 6.980 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.956 4.863 8.916 1.00 0.00 H new ATOM 0 HB3 GLU A 105 3.327 4.237 8.750 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.214 1.925 9.135 1.00 0.00 H new ATOM 0 HG3 GLU A 105 5.808 2.607 9.391 1.00 0.00 H new ATOM 1628 N LEU A 106 4.001 2.055 5.487 1.00 0.00 N ATOM 1629 CA LEU A 106 3.148 1.038 4.883 1.00 0.00 C ATOM 1630 C LEU A 106 3.503 -0.350 5.407 1.00 0.00 C ATOM 1631 O LEU A 106 4.590 -0.865 5.144 1.00 0.00 O ATOM 1632 CB LEU A 106 3.282 1.070 3.359 1.00 0.00 C ATOM 1633 CG LEU A 106 2.536 -0.025 2.597 1.00 0.00 C ATOM 1634 CD1 LEU A 106 1.075 0.355 2.409 1.00 0.00 C ATOM 1635 CD2 LEU A 106 3.198 -0.285 1.252 1.00 0.00 C ATOM 0 H LEU A 106 4.879 2.215 4.994 1.00 0.00 H new ATOM 0 HA LEU A 106 2.115 1.257 5.155 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.928 2.038 3.003 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.340 1.005 3.106 1.00 0.00 H new ATOM 0 HG LEU A 106 2.579 -0.942 3.184 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.560 -0.437 1.865 1.00 0.00 H new ATOM 0 HD12 LEU A 106 0.606 0.489 3.384 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.011 1.285 1.844 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.653 -1.067 0.724 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.187 0.629 0.658 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.229 -0.603 1.409 1.00 0.00 H new ATOM 1647 N ARG A 107 2.577 -0.952 6.147 1.00 0.00 N ATOM 1648 CA ARG A 107 2.791 -2.281 6.706 1.00 0.00 C ATOM 1649 C ARG A 107 1.759 -3.269 6.171 1.00 0.00 C ATOM 1650 O ARG A 107 0.602 -3.262 6.592 1.00 0.00 O ATOM 1651 CB ARG A 107 2.722 -2.232 8.234 1.00 0.00 C ATOM 1652 CG ARG A 107 1.385 -1.742 8.767 1.00 0.00 C ATOM 1653 CD ARG A 107 1.484 -1.337 10.229 1.00 0.00 C ATOM 1654 NE ARG A 107 1.591 -2.495 11.112 1.00 0.00 N ATOM 1655 CZ ARG A 107 1.772 -2.404 12.425 1.00 0.00 C ATOM 1656 NH1 ARG A 107 1.866 -1.215 13.004 1.00 0.00 N ATOM 1657 NH2 ARG A 107 1.859 -3.505 13.162 1.00 0.00 N ATOM 0 H ARG A 107 1.672 -0.540 6.373 1.00 0.00 H new ATOM 0 HA ARG A 107 3.782 -2.619 6.404 1.00 0.00 H new ATOM 0 HB2 ARG A 107 2.919 -3.228 8.630 1.00 0.00 H new ATOM 0 HB3 ARG A 107 3.513 -1.580 8.604 1.00 0.00 H new ATOM 0 HG2 ARG A 107 1.045 -0.892 8.175 1.00 0.00 H new ATOM 0 HG3 ARG A 107 0.637 -2.527 8.656 1.00 0.00 H new ATOM 0 HD2 ARG A 107 2.352 -0.693 10.369 1.00 0.00 H new ATOM 0 HD3 ARG A 107 0.606 -0.752 10.503 1.00 0.00 H new ATOM 0 HE ARG A 107 1.523 -3.425 10.698 1.00 0.00 H new ATOM 0 HH11 ARG A 107 1.799 -0.367 12.441 1.00 0.00 H new ATOM 0 HH12 ARG A 107 2.005 -1.148 14.012 1.00 0.00 H new ATOM 0 HH21 ARG A 107 1.787 -4.421 12.720 1.00 0.00 H new ATOM 0 HH22 ARG A 107 1.998 -3.434 14.170 1.00 0.00 H new ATOM 1671 N ILE A 108 2.186 -4.117 5.241 1.00 0.00 N ATOM 1672 CA ILE A 108 1.299 -5.111 4.649 1.00 0.00 C ATOM 1673 C ILE A 108 1.272 -6.388 5.481 1.00 0.00 C ATOM 1674 O ILE A 108 1.994 -7.344 5.195 1.00 0.00 O ATOM 1675 CB ILE A 108 1.724 -5.458 3.210 1.00 0.00 C ATOM 1676 CG1 ILE A 108 1.728 -4.200 2.339 1.00 0.00 C ATOM 1677 CG2 ILE A 108 0.796 -6.511 2.623 1.00 0.00 C ATOM 1678 CD1 ILE A 108 2.644 -4.298 1.139 1.00 0.00 C ATOM 0 H ILE A 108 3.140 -4.136 4.881 1.00 0.00 H new ATOM 0 HA ILE A 108 0.301 -4.672 4.629 1.00 0.00 H new ATOM 0 HB ILE A 108 2.735 -5.865 3.234 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.713 -4.003 1.995 1.00 0.00 H new ATOM 0 HG13 ILE A 108 2.030 -3.348 2.948 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.109 -6.746 1.606 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.838 -7.413 3.233 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.225 -6.129 2.609 1.00 0.00 H new ATOM 0 HD11 ILE A 108 2.596 -3.371 0.568 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.667 -4.464 1.475 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.330 -5.129 0.508 1.00 0.00 H new ATOM 1690 N LYS A 109 0.434 -6.399 6.512 1.00 0.00 N ATOM 1691 CA LYS A 109 0.309 -7.560 7.385 1.00 0.00 C ATOM 1692 C LYS A 109 -0.282 -8.747 6.631 1.00 0.00 C ATOM 1693 O LYS A 109 -1.342 -8.637 6.013 1.00 0.00 O ATOM 1694 CB LYS A 109 -0.567 -7.222 8.594 1.00 0.00 C ATOM 1695 CG LYS A 109 -0.281 -8.084 9.811 1.00 0.00 C ATOM 1696 CD LYS A 109 -1.470 -8.126 10.757 1.00 0.00 C ATOM 1697 CE LYS A 109 -2.544 -9.082 10.260 1.00 0.00 C ATOM 1698 NZ LYS A 109 -2.275 -10.485 10.681 1.00 0.00 N ATOM 0 H LYS A 109 -0.169 -5.616 6.764 1.00 0.00 H new ATOM 0 HA LYS A 109 1.306 -7.833 7.731 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.419 -6.175 8.858 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.615 -7.336 8.316 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -0.034 -9.096 9.491 1.00 0.00 H new ATOM 0 HG3 LYS A 109 0.590 -7.694 10.337 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -1.137 -8.434 11.748 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -1.891 -7.126 10.859 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -3.515 -8.768 10.642 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -2.599 -9.033 9.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -2.126 -11.078 9.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -1.424 -10.511 11.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -3.087 -10.847 11.220 1.00 0.00 H new ATOM 1712 N VAL A 110 0.408 -9.881 6.687 1.00 0.00 N ATOM 1713 CA VAL A 110 -0.050 -11.089 6.011 1.00 0.00 C ATOM 1714 C VAL A 110 -1.002 -11.886 6.896 1.00 0.00 C ATOM 1715 O VAL A 110 -0.579 -12.541 7.850 1.00 0.00 O ATOM 1716 CB VAL A 110 1.132 -11.989 5.607 1.00 0.00 C ATOM 1717 CG1 VAL A 110 0.632 -13.266 4.950 1.00 0.00 C ATOM 1718 CG2 VAL A 110 2.080 -11.240 4.682 1.00 0.00 C ATOM 0 H VAL A 110 1.287 -9.989 7.194 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.576 -10.768 5.112 1.00 0.00 H new ATOM 0 HB VAL A 110 1.681 -12.264 6.508 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.482 -13.889 4.672 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.003 -13.810 5.649 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.058 -13.016 4.058 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.910 -11.891 4.406 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.545 -10.934 3.783 1.00 0.00 H new ATOM 0 HG23 VAL A 110 2.466 -10.358 5.193 1.00 0.00 H new ATOM 1728 N LEU A 111 -2.289 -11.827 6.575 1.00 0.00 N ATOM 1729 CA LEU A 111 -3.303 -12.545 7.340 1.00 0.00 C ATOM 1730 C LEU A 111 -3.171 -14.051 7.141 1.00 0.00 C ATOM 1731 O LEU A 111 -2.601 -14.509 6.151 1.00 0.00 O ATOM 1732 CB LEU A 111 -4.702 -12.084 6.928 1.00 0.00 C ATOM 1733 CG LEU A 111 -5.067 -10.643 7.284 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -6.287 -10.191 6.497 1.00 0.00 C ATOM 1735 CD2 LEU A 111 -5.314 -10.508 8.779 1.00 0.00 C ATOM 0 H LEU A 111 -2.656 -11.289 5.790 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.151 -12.323 8.396 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.800 -12.206 5.849 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -5.432 -12.747 7.391 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.229 -10.000 7.016 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -6.532 -9.163 6.764 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.073 -10.248 5.430 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.132 -10.838 6.733 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.573 -9.475 9.013 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.134 -11.163 9.073 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -4.412 -10.789 9.324 1.00 0.00 H new ATOM 1747 N ASP A 112 -3.704 -14.816 8.087 1.00 0.00 N ATOM 1748 CA ASP A 112 -3.649 -16.272 8.014 1.00 0.00 C ATOM 1749 C ASP A 112 -4.386 -16.782 6.779 1.00 0.00 C ATOM 1750 O ASP A 112 -5.083 -16.025 6.104 1.00 0.00 O ATOM 1751 CB ASP A 112 -4.253 -16.890 9.276 1.00 0.00 C ATOM 1752 CG ASP A 112 -3.791 -16.194 10.540 1.00 0.00 C ATOM 1753 OD1 ASP A 112 -3.890 -14.950 10.603 1.00 0.00 O ATOM 1754 OD2 ASP A 112 -3.332 -16.892 11.468 1.00 0.00 O ATOM 0 H ASP A 112 -4.179 -14.453 8.913 1.00 0.00 H new ATOM 0 HA ASP A 112 -2.603 -16.569 7.939 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -5.340 -16.843 9.215 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -3.982 -17.945 9.326 1.00 0.00 H new ATOM 1759 N ILE A 113 -4.225 -18.069 6.491 1.00 0.00 N ATOM 1760 CA ILE A 113 -4.875 -18.680 5.338 1.00 0.00 C ATOM 1761 C ILE A 113 -6.383 -18.779 5.545 1.00 0.00 C ATOM 1762 O ILE A 113 -7.165 -18.455 4.652 1.00 0.00 O ATOM 1763 CB ILE A 113 -4.314 -20.086 5.054 1.00 0.00 C ATOM 1764 CG1 ILE A 113 -4.758 -20.567 3.671 1.00 0.00 C ATOM 1765 CG2 ILE A 113 -4.763 -21.062 6.131 1.00 0.00 C ATOM 1766 CD1 ILE A 113 -6.074 -21.313 3.685 1.00 0.00 C ATOM 0 H ILE A 113 -3.650 -18.709 7.040 1.00 0.00 H new ATOM 0 HA ILE A 113 -4.669 -18.036 4.483 1.00 0.00 H new ATOM 0 HB ILE A 113 -3.225 -20.037 5.067 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -4.844 -19.707 3.006 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -3.986 -21.215 3.256 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -4.359 -22.051 5.917 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -4.401 -20.724 7.102 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -5.852 -21.111 6.147 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -6.327 -21.624 2.671 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -5.987 -22.192 4.323 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -6.858 -20.661 4.070 1.00 0.00 H new ATOM 1778 N ASN A 114 -6.783 -19.227 6.730 1.00 0.00 N ATOM 1779 CA ASN A 114 -8.198 -19.368 7.056 1.00 0.00 C ATOM 1780 C ASN A 114 -8.714 -18.131 7.786 1.00 0.00 C ATOM 1781 O ASN A 114 -9.541 -18.232 8.692 1.00 0.00 O ATOM 1782 CB ASN A 114 -8.423 -20.612 7.917 1.00 0.00 C ATOM 1783 CG ASN A 114 -8.399 -21.891 7.101 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -9.027 -21.980 6.046 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -7.671 -22.889 7.589 1.00 0.00 N ATOM 0 H ASN A 114 -6.148 -19.499 7.481 1.00 0.00 H new ATOM 0 HA ASN A 114 -8.751 -19.475 6.123 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -7.654 -20.661 8.688 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -9.382 -20.528 8.428 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -7.616 -23.774 7.085 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -7.167 -22.770 8.468 1.00 0.00 H new ATOM 1792 N ASP A 115 -8.220 -16.965 7.384 1.00 0.00 N ATOM 1793 CA ASP A 115 -8.632 -15.708 7.998 1.00 0.00 C ATOM 1794 C ASP A 115 -9.622 -14.966 7.106 1.00 0.00 C ATOM 1795 O ASP A 115 -9.237 -14.348 6.115 1.00 0.00 O ATOM 1796 CB ASP A 115 -7.412 -14.826 8.271 1.00 0.00 C ATOM 1797 CG ASP A 115 -7.763 -13.585 9.069 1.00 0.00 C ATOM 1798 OD1 ASP A 115 -8.922 -13.128 8.978 1.00 0.00 O ATOM 1799 OD2 ASP A 115 -6.878 -13.071 9.785 1.00 0.00 O ATOM 0 H ASP A 115 -7.534 -16.864 6.636 1.00 0.00 H new ATOM 0 HA ASP A 115 -9.124 -15.938 8.943 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -6.663 -15.404 8.813 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -6.962 -14.530 7.324 1.00 0.00 H new