USER MOD reduce.3.24.130724 H: found=0, std=0, add=414, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 416 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 28 THR OG1 : rot 180:sc= -2.57! USER MOD Set 1.2: A 64 TYR OH : rot 180:sc= -1.12 USER MOD Single : A 10 SER OG : rot 39:sc= 0.154 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot -110:sc= 0.332 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.711 USER MOD Single : A 40 LYS NZ :NH3+ -128:sc= 0 (180deg=-0.201) USER MOD Single : A 43 SER OG : rot 29:sc= 0.328! USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 161 N SER A 10 64.358 4.144 7.895 1.00 15.00 N ATOM 162 CA SER A 10 63.530 2.918 8.135 1.00 15.00 C ATOM 163 C SER A 10 63.715 1.914 6.990 1.00 15.00 C ATOM 164 O SER A 10 64.134 2.269 5.905 1.00 15.00 O ATOM 165 CB SER A 10 62.083 3.411 8.183 1.00 15.00 C ATOM 166 OG SER A 10 61.937 4.333 9.256 1.00 15.00 O ATOM 0 HA SER A 10 63.817 2.408 9.054 1.00 15.00 H new ATOM 0 HB2 SER A 10 61.818 3.888 7.240 1.00 15.00 H new ATOM 0 HB3 SER A 10 61.404 2.569 8.317 1.00 15.00 H new ATOM 0 HG SER A 10 62.737 4.896 9.315 1.00 15.00 H new ATOM 172 N LYS A 11 63.403 0.663 7.235 1.00 15.00 N ATOM 173 CA LYS A 11 63.558 -0.388 6.176 1.00 15.00 C ATOM 174 C LYS A 11 62.321 -0.420 5.272 1.00 15.00 C ATOM 175 O LYS A 11 61.199 -0.443 5.746 1.00 15.00 O ATOM 176 CB LYS A 11 63.688 -1.713 6.937 1.00 15.00 C ATOM 177 CG LYS A 11 64.964 -1.707 7.782 1.00 15.00 C ATOM 178 CD LYS A 11 65.079 -3.029 8.543 1.00 15.00 C ATOM 179 CE LYS A 11 66.302 -2.986 9.460 1.00 15.00 C ATOM 180 NZ LYS A 11 66.386 -4.349 10.054 1.00 15.00 N ATOM 0 H LYS A 11 63.046 0.322 8.128 1.00 15.00 H new ATOM 0 HA LYS A 11 64.420 -0.196 5.537 1.00 15.00 H new ATOM 0 HB2 LYS A 11 62.818 -1.861 7.577 1.00 15.00 H new ATOM 0 HB3 LYS A 11 63.711 -2.545 6.234 1.00 15.00 H new ATOM 0 HG2 LYS A 11 65.835 -1.566 7.143 1.00 15.00 H new ATOM 0 HG3 LYS A 11 64.945 -0.872 8.483 1.00 15.00 H new ATOM 0 HD2 LYS A 11 64.177 -3.202 9.130 1.00 15.00 H new ATOM 0 HD3 LYS A 11 65.167 -3.858 7.841 1.00 15.00 H new ATOM 0 HE2 LYS A 11 67.206 -2.742 8.901 1.00 15.00 H new ATOM 0 HE3 LYS A 11 66.190 -2.225 10.232 1.00 15.00 H new ATOM 0 HZ1 LYS A 11 67.202 -4.398 10.696 1.00 15.00 H new ATOM 0 HZ2 LYS A 11 65.515 -4.550 10.585 1.00 15.00 H new ATOM 0 HZ3 LYS A 11 66.499 -5.052 9.296 1.00 15.00 H new ATOM 194 N ILE A 12 62.518 -0.423 3.974 1.00 15.00 N ATOM 195 CA ILE A 12 61.357 -0.465 3.032 1.00 15.00 C ATOM 196 C ILE A 12 61.612 -1.505 1.934 1.00 15.00 C ATOM 197 O ILE A 12 62.739 -1.728 1.526 1.00 15.00 O ATOM 198 CB ILE A 12 61.253 0.951 2.436 1.00 15.00 C ATOM 199 CG1 ILE A 12 60.977 1.963 3.558 1.00 15.00 C ATOM 200 CG2 ILE A 12 60.103 1.002 1.418 1.00 15.00 C ATOM 201 CD1 ILE A 12 61.035 3.388 3.000 1.00 15.00 C ATOM 0 H ILE A 12 63.435 -0.398 3.527 1.00 15.00 H new ATOM 0 HA ILE A 12 60.432 -0.750 3.532 1.00 15.00 H new ATOM 0 HB ILE A 12 62.191 1.199 1.940 1.00 15.00 H new ATOM 0 HG12 ILE A 12 59.997 1.774 3.997 1.00 15.00 H new ATOM 0 HG13 ILE A 12 61.711 1.845 4.355 1.00 15.00 H new ATOM 0 HG21 ILE A 12 60.033 2.006 0.999 1.00 15.00 H new ATOM 0 HG22 ILE A 12 60.293 0.287 0.618 1.00 15.00 H new ATOM 0 HG23 ILE A 12 59.166 0.750 1.915 1.00 15.00 H new ATOM 0 HD11 ILE A 12 60.838 4.101 3.801 1.00 15.00 H new ATOM 0 HD12 ILE A 12 62.024 3.575 2.582 1.00 15.00 H new ATOM 0 HD13 ILE A 12 60.284 3.504 2.219 1.00 15.00 H new ATOM 213 N SER A 13 60.565 -2.137 1.463 1.00 15.00 N ATOM 214 CA SER A 13 60.699 -3.098 0.329 1.00 15.00 C ATOM 215 C SER A 13 59.895 -2.589 -0.870 1.00 15.00 C ATOM 216 O SER A 13 58.738 -2.235 -0.744 1.00 15.00 O ATOM 217 CB SER A 13 60.116 -4.411 0.849 1.00 15.00 C ATOM 218 OG SER A 13 60.289 -5.424 -0.133 1.00 15.00 O ATOM 0 H SER A 13 59.616 -2.026 1.820 1.00 15.00 H new ATOM 0 HA SER A 13 61.731 -3.219 0.001 1.00 15.00 H new ATOM 0 HB2 SER A 13 60.610 -4.700 1.777 1.00 15.00 H new ATOM 0 HB3 SER A 13 59.057 -4.287 1.077 1.00 15.00 H new ATOM 0 HG SER A 13 59.418 -5.663 -0.514 1.00 15.00 H new ATOM 224 N LEU A 14 60.505 -2.550 -2.028 1.00 15.00 N ATOM 225 CA LEU A 14 59.821 -1.987 -3.230 1.00 15.00 C ATOM 226 C LEU A 14 59.694 -3.055 -4.318 1.00 15.00 C ATOM 227 O LEU A 14 60.630 -3.784 -4.591 1.00 15.00 O ATOM 228 CB LEU A 14 60.731 -0.851 -3.698 1.00 15.00 C ATOM 229 CG LEU A 14 59.928 0.132 -4.549 1.00 15.00 C ATOM 230 CD1 LEU A 14 59.009 0.955 -3.644 1.00 15.00 C ATOM 231 CD2 LEU A 14 60.889 1.069 -5.286 1.00 15.00 C ATOM 0 H LEU A 14 61.454 -2.887 -2.192 1.00 15.00 H new ATOM 0 HA LEU A 14 58.811 -1.641 -3.009 1.00 15.00 H new ATOM 0 HB2 LEU A 14 61.160 -0.337 -2.838 1.00 15.00 H new ATOM 0 HB3 LEU A 14 61.563 -1.253 -4.276 1.00 15.00 H new ATOM 0 HG LEU A 14 59.328 -0.418 -5.274 1.00 15.00 H new ATOM 0 HD11 LEU A 14 58.435 1.657 -4.250 1.00 15.00 H new ATOM 0 HD12 LEU A 14 58.326 0.289 -3.116 1.00 15.00 H new ATOM 0 HD13 LEU A 14 59.610 1.506 -2.921 1.00 15.00 H new ATOM 0 HD21 LEU A 14 60.318 1.771 -5.894 1.00 15.00 H new ATOM 0 HD22 LEU A 14 61.488 1.620 -4.561 1.00 15.00 H new ATOM 0 HD23 LEU A 14 61.546 0.484 -5.929 1.00 15.00 H new ATOM 243 N ILE A 15 58.544 -3.150 -4.937 1.00 15.00 N ATOM 244 CA ILE A 15 58.357 -4.129 -6.053 1.00 15.00 C ATOM 245 C ILE A 15 58.278 -3.364 -7.378 1.00 15.00 C ATOM 246 O ILE A 15 57.400 -2.539 -7.570 1.00 15.00 O ATOM 247 CB ILE A 15 57.033 -4.850 -5.750 1.00 15.00 C ATOM 248 CG1 ILE A 15 57.132 -5.571 -4.398 1.00 15.00 C ATOM 249 CG2 ILE A 15 56.742 -5.883 -6.845 1.00 15.00 C ATOM 250 CD1 ILE A 15 55.740 -6.024 -3.954 1.00 15.00 C ATOM 0 H ILE A 15 57.722 -2.588 -4.716 1.00 15.00 H new ATOM 0 HA ILE A 15 59.177 -4.842 -6.134 1.00 15.00 H new ATOM 0 HB ILE A 15 56.230 -4.114 -5.717 1.00 15.00 H new ATOM 0 HG12 ILE A 15 57.796 -6.431 -4.481 1.00 15.00 H new ATOM 0 HG13 ILE A 15 57.564 -4.906 -3.651 1.00 15.00 H new ATOM 0 HG21 ILE A 15 55.803 -6.391 -6.626 1.00 15.00 H new ATOM 0 HG22 ILE A 15 56.666 -5.380 -7.809 1.00 15.00 H new ATOM 0 HG23 ILE A 15 57.550 -6.614 -6.880 1.00 15.00 H new ATOM 0 HD11 ILE A 15 55.813 -6.535 -2.994 1.00 15.00 H new ATOM 0 HD12 ILE A 15 55.089 -5.155 -3.854 1.00 15.00 H new ATOM 0 HD13 ILE A 15 55.325 -6.705 -4.697 1.00 15.00 H new ATOM 262 N SER A 16 59.184 -3.638 -8.285 1.00 15.00 N ATOM 263 CA SER A 16 59.289 -2.812 -9.529 1.00 15.00 C ATOM 264 C SER A 16 58.420 -3.396 -10.648 1.00 15.00 C ATOM 265 O SER A 16 57.869 -4.473 -10.523 1.00 15.00 O ATOM 266 CB SER A 16 60.768 -2.863 -9.918 1.00 15.00 C ATOM 267 OG SER A 16 61.483 -1.886 -9.172 1.00 15.00 O ATOM 0 H SER A 16 59.858 -4.401 -8.217 1.00 15.00 H new ATOM 0 HA SER A 16 58.941 -1.792 -9.367 1.00 15.00 H new ATOM 0 HB2 SER A 16 61.174 -3.856 -9.722 1.00 15.00 H new ATOM 0 HB3 SER A 16 60.882 -2.677 -10.986 1.00 15.00 H new ATOM 0 HG SER A 16 62.431 -1.917 -9.417 1.00 15.00 H new ATOM 273 N LYS A 17 58.303 -2.687 -11.746 1.00 15.00 N ATOM 274 CA LYS A 17 57.433 -3.158 -12.878 1.00 15.00 C ATOM 275 C LYS A 17 57.905 -4.518 -13.421 1.00 15.00 C ATOM 276 O LYS A 17 57.156 -5.215 -14.080 1.00 15.00 O ATOM 277 CB LYS A 17 57.561 -2.082 -13.961 1.00 15.00 C ATOM 278 CG LYS A 17 56.508 -2.320 -15.046 1.00 15.00 C ATOM 279 CD LYS A 17 56.673 -1.279 -16.155 1.00 15.00 C ATOM 280 CE LYS A 17 55.529 -1.418 -17.161 1.00 15.00 C ATOM 281 NZ LYS A 17 55.878 -0.490 -18.272 1.00 15.00 N ATOM 0 H LYS A 17 58.774 -1.797 -11.910 1.00 15.00 H new ATOM 0 HA LYS A 17 56.402 -3.298 -12.552 1.00 15.00 H new ATOM 0 HB2 LYS A 17 57.429 -1.093 -13.523 1.00 15.00 H new ATOM 0 HB3 LYS A 17 58.560 -2.107 -14.397 1.00 15.00 H new ATOM 0 HG2 LYS A 17 56.614 -3.324 -15.457 1.00 15.00 H new ATOM 0 HG3 LYS A 17 55.508 -2.255 -14.617 1.00 15.00 H new ATOM 0 HD2 LYS A 17 56.677 -0.276 -15.729 1.00 15.00 H new ATOM 0 HD3 LYS A 17 57.631 -1.416 -16.657 1.00 15.00 H new ATOM 0 HE2 LYS A 17 55.439 -2.444 -17.517 1.00 15.00 H new ATOM 0 HE3 LYS A 17 54.573 -1.152 -16.710 1.00 15.00 H new ATOM 0 HZ1 LYS A 17 55.139 -0.530 -19.003 1.00 15.00 H new ATOM 0 HZ2 LYS A 17 55.950 0.480 -17.904 1.00 15.00 H new ATOM 0 HZ3 LYS A 17 56.789 -0.772 -18.686 1.00 15.00 H new ATOM 295 N ALA A 18 59.135 -4.899 -13.153 1.00 15.00 N ATOM 296 CA ALA A 18 59.654 -6.203 -13.677 1.00 15.00 C ATOM 297 C ALA A 18 59.382 -7.351 -12.689 1.00 15.00 C ATOM 298 O ALA A 18 59.969 -8.410 -12.797 1.00 15.00 O ATOM 299 CB ALA A 18 61.161 -5.993 -13.841 1.00 15.00 C ATOM 0 H ALA A 18 59.799 -4.363 -12.595 1.00 15.00 H new ATOM 0 HA ALA A 18 59.166 -6.479 -14.612 1.00 15.00 H new ATOM 0 HB1 ALA A 18 61.616 -6.907 -14.223 1.00 15.00 H new ATOM 0 HB2 ALA A 18 61.341 -5.178 -14.542 1.00 15.00 H new ATOM 0 HB3 ALA A 18 61.601 -5.744 -12.875 1.00 15.00 H new ATOM 305 N GLU A 19 58.499 -7.151 -11.727 1.00 15.00 N ATOM 306 CA GLU A 19 58.148 -8.235 -10.745 1.00 15.00 C ATOM 307 C GLU A 19 59.398 -8.721 -10.001 1.00 15.00 C ATOM 308 O GLU A 19 59.481 -9.863 -9.588 1.00 15.00 O ATOM 309 CB GLU A 19 57.522 -9.376 -11.564 1.00 15.00 C ATOM 310 CG GLU A 19 56.238 -8.884 -12.237 1.00 15.00 C ATOM 311 CD GLU A 19 55.606 -10.025 -13.037 1.00 15.00 C ATOM 312 OE1 GLU A 19 55.177 -9.775 -14.151 1.00 15.00 O ATOM 313 OE2 GLU A 19 55.561 -11.131 -12.521 1.00 15.00 O ATOM 0 H GLU A 19 58.003 -6.272 -11.581 1.00 15.00 H new ATOM 0 HA GLU A 19 57.455 -7.869 -9.988 1.00 15.00 H new ATOM 0 HB2 GLU A 19 58.228 -9.726 -12.317 1.00 15.00 H new ATOM 0 HB3 GLU A 19 57.302 -10.224 -10.915 1.00 15.00 H new ATOM 0 HG2 GLU A 19 55.537 -8.523 -11.485 1.00 15.00 H new ATOM 0 HG3 GLU A 19 56.460 -8.044 -12.896 1.00 15.00 H new ATOM 320 N ILE A 20 60.370 -7.856 -9.829 1.00 15.00 N ATOM 321 CA ILE A 20 61.552 -8.197 -8.979 1.00 15.00 C ATOM 322 C ILE A 20 61.437 -7.454 -7.642 1.00 15.00 C ATOM 323 O ILE A 20 60.928 -6.349 -7.584 1.00 15.00 O ATOM 324 CB ILE A 20 62.781 -7.720 -9.768 1.00 15.00 C ATOM 325 CG1 ILE A 20 62.855 -8.460 -11.109 1.00 15.00 C ATOM 326 CG2 ILE A 20 64.057 -8.013 -8.968 1.00 15.00 C ATOM 327 CD1 ILE A 20 63.875 -7.770 -12.018 1.00 15.00 C ATOM 0 H ILE A 20 60.394 -6.924 -10.244 1.00 15.00 H new ATOM 0 HA ILE A 20 61.620 -9.263 -8.760 1.00 15.00 H new ATOM 0 HB ILE A 20 62.694 -6.648 -9.943 1.00 15.00 H new ATOM 0 HG12 ILE A 20 63.141 -9.499 -10.947 1.00 15.00 H new ATOM 0 HG13 ILE A 20 61.875 -8.469 -11.586 1.00 15.00 H new ATOM 0 HG21 ILE A 20 64.926 -7.673 -9.532 1.00 15.00 H new ATOM 0 HG22 ILE A 20 64.016 -7.489 -8.013 1.00 15.00 H new ATOM 0 HG23 ILE A 20 64.137 -9.085 -8.790 1.00 15.00 H new ATOM 0 HD11 ILE A 20 63.927 -8.296 -12.971 1.00 15.00 H new ATOM 0 HD12 ILE A 20 63.570 -6.738 -12.190 1.00 15.00 H new ATOM 0 HD13 ILE A 20 64.855 -7.784 -11.541 1.00 15.00 H new ATOM 339 N ARG A 21 61.908 -8.054 -6.575 1.00 15.00 N ATOM 340 CA ARG A 21 61.777 -7.417 -5.231 1.00 15.00 C ATOM 341 C ARG A 21 63.125 -6.845 -4.775 1.00 15.00 C ATOM 342 O ARG A 21 64.101 -7.562 -4.650 1.00 15.00 O ATOM 343 CB ARG A 21 61.331 -8.546 -4.301 1.00 15.00 C ATOM 344 CG ARG A 21 60.936 -7.965 -2.941 1.00 15.00 C ATOM 345 CD ARG A 21 60.577 -9.105 -1.982 1.00 15.00 C ATOM 346 NE ARG A 21 60.118 -8.434 -0.722 1.00 15.00 N ATOM 347 CZ ARG A 21 59.429 -9.089 0.192 1.00 15.00 C ATOM 348 NH1 ARG A 21 59.119 -10.357 0.047 1.00 15.00 N ATOM 349 NH2 ARG A 21 59.048 -8.461 1.272 1.00 15.00 N ATOM 0 H ARG A 21 62.378 -8.959 -6.579 1.00 15.00 H new ATOM 0 HA ARG A 21 61.070 -6.587 -5.237 1.00 15.00 H new ATOM 0 HB2 ARG A 21 60.487 -9.080 -4.739 1.00 15.00 H new ATOM 0 HB3 ARG A 21 62.137 -9.270 -4.178 1.00 15.00 H new ATOM 0 HG2 ARG A 21 61.758 -7.377 -2.532 1.00 15.00 H new ATOM 0 HG3 ARG A 21 60.087 -7.290 -3.055 1.00 15.00 H new ATOM 0 HD2 ARG A 21 59.793 -9.737 -2.399 1.00 15.00 H new ATOM 0 HD3 ARG A 21 61.438 -9.747 -1.794 1.00 15.00 H new ATOM 0 HE ARG A 21 60.343 -7.451 -0.569 1.00 15.00 H new ATOM 0 HH11 ARG A 21 59.412 -10.861 -0.790 1.00 15.00 H new ATOM 0 HH12 ARG A 21 58.585 -10.837 0.771 1.00 15.00 H new ATOM 0 HH21 ARG A 21 59.284 -7.477 1.400 1.00 15.00 H new ATOM 0 HH22 ARG A 21 58.514 -8.955 1.988 1.00 15.00 H new ATOM 363 N TYR A 22 63.176 -5.559 -4.528 1.00 15.00 N ATOM 364 CA TYR A 22 64.427 -4.930 -4.004 1.00 15.00 C ATOM 365 C TYR A 22 64.203 -4.455 -2.567 1.00 15.00 C ATOM 366 O TYR A 22 63.201 -3.837 -2.266 1.00 15.00 O ATOM 367 CB TYR A 22 64.680 -3.727 -4.914 1.00 15.00 C ATOM 368 CG TYR A 22 65.086 -4.092 -6.323 1.00 15.00 C ATOM 369 CD1 TYR A 22 66.456 -4.237 -6.648 1.00 15.00 C ATOM 370 CD2 TYR A 22 64.097 -4.276 -7.321 1.00 15.00 C ATOM 371 CE1 TYR A 22 66.837 -4.569 -7.973 1.00 15.00 C ATOM 372 CE2 TYR A 22 64.478 -4.607 -8.643 1.00 15.00 C ATOM 373 CZ TYR A 22 65.848 -4.753 -8.970 1.00 15.00 C ATOM 374 OH TYR A 22 66.220 -5.075 -10.260 1.00 15.00 O ATOM 0 H TYR A 22 62.398 -4.914 -4.668 1.00 15.00 H new ATOM 0 HA TYR A 22 65.267 -5.625 -3.998 1.00 15.00 H new ATOM 0 HB2 TYR A 22 63.776 -3.119 -4.954 1.00 15.00 H new ATOM 0 HB3 TYR A 22 65.461 -3.108 -4.471 1.00 15.00 H new ATOM 0 HD1 TYR A 22 67.210 -4.095 -5.888 1.00 15.00 H new ATOM 0 HD2 TYR A 22 63.052 -4.164 -7.073 1.00 15.00 H new ATOM 0 HE1 TYR A 22 67.882 -4.682 -8.222 1.00 15.00 H new ATOM 0 HE2 TYR A 22 63.724 -4.748 -9.403 1.00 15.00 H new ATOM 0 HH TYR A 22 65.420 -5.167 -10.818 1.00 15.00 H new ATOM 384 N GLU A 23 65.125 -4.737 -1.680 1.00 15.00 N ATOM 385 CA GLU A 23 65.013 -4.211 -0.283 1.00 15.00 C ATOM 386 C GLU A 23 66.175 -3.260 0.008 1.00 15.00 C ATOM 387 O GLU A 23 67.296 -3.501 -0.394 1.00 15.00 O ATOM 388 CB GLU A 23 65.091 -5.447 0.614 1.00 15.00 C ATOM 389 CG GLU A 23 64.775 -5.052 2.059 1.00 15.00 C ATOM 390 CD GLU A 23 64.981 -6.260 2.978 1.00 15.00 C ATOM 391 OE1 GLU A 23 64.133 -6.485 3.824 1.00 15.00 O ATOM 392 OE2 GLU A 23 65.984 -6.937 2.818 1.00 15.00 O ATOM 0 H GLU A 23 65.950 -5.308 -1.862 1.00 15.00 H new ATOM 0 HA GLU A 23 64.092 -3.651 -0.120 1.00 15.00 H new ATOM 0 HB2 GLU A 23 64.386 -6.204 0.270 1.00 15.00 H new ATOM 0 HB3 GLU A 23 66.086 -5.889 0.556 1.00 15.00 H new ATOM 0 HG2 GLU A 23 65.420 -4.230 2.371 1.00 15.00 H new ATOM 0 HG3 GLU A 23 63.747 -4.697 2.133 1.00 15.00 H new ATOM 399 N GLY A 24 65.908 -2.185 0.707 1.00 15.00 N ATOM 400 CA GLY A 24 66.984 -1.203 1.035 1.00 15.00 C ATOM 401 C GLY A 24 66.482 -0.264 2.131 1.00 15.00 C ATOM 402 O GLY A 24 65.371 -0.403 2.607 1.00 15.00 O ATOM 0 H GLY A 24 64.984 -1.945 1.066 1.00 15.00 H new ATOM 0 HA2 GLY A 24 67.881 -1.725 1.368 1.00 15.00 H new ATOM 0 HA3 GLY A 24 67.257 -0.633 0.147 1.00 15.00 H new ATOM 406 N ILE A 25 67.286 0.688 2.537 1.00 15.00 N ATOM 407 CA ILE A 25 66.842 1.634 3.611 1.00 15.00 C ATOM 408 C ILE A 25 66.552 3.007 3.000 1.00 15.00 C ATOM 409 O ILE A 25 67.248 3.456 2.108 1.00 15.00 O ATOM 410 CB ILE A 25 68.002 1.731 4.620 1.00 15.00 C ATOM 411 CG1 ILE A 25 68.571 0.334 4.955 1.00 15.00 C ATOM 412 CG2 ILE A 25 67.490 2.391 5.907 1.00 15.00 C ATOM 413 CD1 ILE A 25 67.468 -0.587 5.495 1.00 15.00 C ATOM 0 H ILE A 25 68.225 0.852 2.175 1.00 15.00 H new ATOM 0 HA ILE A 25 65.932 1.286 4.099 1.00 15.00 H new ATOM 0 HB ILE A 25 68.799 2.327 4.175 1.00 15.00 H new ATOM 0 HG12 ILE A 25 69.015 -0.107 4.062 1.00 15.00 H new ATOM 0 HG13 ILE A 25 69.367 0.428 5.694 1.00 15.00 H new ATOM 0 HG21 ILE A 25 68.305 2.464 6.627 1.00 15.00 H new ATOM 0 HG22 ILE A 25 67.116 3.389 5.680 1.00 15.00 H new ATOM 0 HG23 ILE A 25 66.685 1.789 6.329 1.00 15.00 H new ATOM 0 HD11 ILE A 25 67.891 -1.565 5.724 1.00 15.00 H new ATOM 0 HD12 ILE A 25 67.043 -0.154 6.401 1.00 15.00 H new ATOM 0 HD13 ILE A 25 66.686 -0.697 4.744 1.00 15.00 H new ATOM 425 N LEU A 26 65.528 3.672 3.477 1.00 15.00 N ATOM 426 CA LEU A 26 65.153 5.006 2.904 1.00 15.00 C ATOM 427 C LEU A 26 66.250 6.033 3.194 1.00 15.00 C ATOM 428 O LEU A 26 66.427 6.451 4.322 1.00 15.00 O ATOM 429 CB LEU A 26 63.855 5.399 3.616 1.00 15.00 C ATOM 430 CG LEU A 26 63.177 6.542 2.859 1.00 15.00 C ATOM 431 CD1 LEU A 26 62.487 5.993 1.608 1.00 15.00 C ATOM 432 CD2 LEU A 26 62.136 7.201 3.767 1.00 15.00 C ATOM 0 H LEU A 26 64.933 3.349 4.240 1.00 15.00 H new ATOM 0 HA LEU A 26 65.028 4.966 1.822 1.00 15.00 H new ATOM 0 HB2 LEU A 26 63.186 4.540 3.673 1.00 15.00 H new ATOM 0 HB3 LEU A 26 64.069 5.705 4.640 1.00 15.00 H new ATOM 0 HG LEU A 26 63.926 7.277 2.564 1.00 15.00 H new ATOM 0 HD11 LEU A 26 62.005 6.809 1.071 1.00 15.00 H new ATOM 0 HD12 LEU A 26 63.227 5.520 0.962 1.00 15.00 H new ATOM 0 HD13 LEU A 26 61.737 5.257 1.899 1.00 15.00 H new ATOM 0 HD21 LEU A 26 61.650 8.017 3.231 1.00 15.00 H new ATOM 0 HD22 LEU A 26 61.389 6.463 4.059 1.00 15.00 H new ATOM 0 HD23 LEU A 26 62.626 7.593 4.658 1.00 15.00 H new ATOM 444 N TYR A 27 66.982 6.438 2.184 1.00 15.00 N ATOM 445 CA TYR A 27 68.103 7.401 2.403 1.00 15.00 C ATOM 446 C TYR A 27 67.615 8.841 2.224 1.00 15.00 C ATOM 447 O TYR A 27 67.820 9.681 3.082 1.00 15.00 O ATOM 448 CB TYR A 27 69.145 7.053 1.337 1.00 15.00 C ATOM 449 CG TYR A 27 70.419 7.854 1.461 1.00 15.00 C ATOM 450 CD1 TYR A 27 71.179 7.792 2.655 1.00 15.00 C ATOM 451 CD2 TYR A 27 70.853 8.667 0.386 1.00 15.00 C ATOM 452 CE1 TYR A 27 72.373 8.545 2.773 1.00 15.00 C ATOM 453 CE2 TYR A 27 72.046 9.420 0.505 1.00 15.00 C ATOM 454 CZ TYR A 27 72.807 9.358 1.699 1.00 15.00 C ATOM 455 OH TYR A 27 73.970 10.092 1.816 1.00 15.00 O ATOM 0 H TYR A 27 66.850 6.142 1.217 1.00 15.00 H new ATOM 0 HA TYR A 27 68.511 7.329 3.411 1.00 15.00 H new ATOM 0 HB2 TYR A 27 69.384 5.992 1.405 1.00 15.00 H new ATOM 0 HB3 TYR A 27 68.714 7.220 0.350 1.00 15.00 H new ATOM 0 HD1 TYR A 27 70.848 7.171 3.475 1.00 15.00 H new ATOM 0 HD2 TYR A 27 70.274 8.713 -0.525 1.00 15.00 H new ATOM 0 HE1 TYR A 27 72.953 8.499 3.683 1.00 15.00 H new ATOM 0 HE2 TYR A 27 72.376 10.042 -0.314 1.00 15.00 H new ATOM 0 HH TYR A 27 74.124 10.594 0.989 1.00 15.00 H new ATOM 465 N THR A 28 66.971 9.128 1.119 1.00 15.00 N ATOM 466 CA THR A 28 66.486 10.522 0.871 1.00 15.00 C ATOM 467 C THR A 28 65.133 10.499 0.156 1.00 15.00 C ATOM 468 O THR A 28 64.887 9.665 -0.696 1.00 15.00 O ATOM 469 CB THR A 28 67.552 11.165 -0.020 1.00 15.00 C ATOM 470 OG1 THR A 28 67.864 10.289 -1.092 1.00 15.00 O ATOM 471 CG2 THR A 28 68.812 11.436 0.804 1.00 15.00 C ATOM 0 H THR A 28 66.760 8.458 0.379 1.00 15.00 H new ATOM 0 HA THR A 28 66.343 11.075 1.799 1.00 15.00 H new ATOM 0 HB THR A 28 67.172 12.105 -0.419 1.00 15.00 H new ATOM 0 HG1 THR A 28 68.545 10.701 -1.663 1.00 15.00 H new ATOM 0 HG21 THR A 28 69.571 11.894 0.169 1.00 15.00 H new ATOM 0 HG22 THR A 28 68.571 12.111 1.626 1.00 15.00 H new ATOM 0 HG23 THR A 28 69.193 10.497 1.205 1.00 15.00 H new ATOM 479 N ILE A 29 64.258 11.413 0.499 1.00 15.00 N ATOM 480 CA ILE A 29 62.902 11.446 -0.134 1.00 15.00 C ATOM 481 C ILE A 29 62.738 12.744 -0.938 1.00 15.00 C ATOM 482 O ILE A 29 62.898 13.829 -0.410 1.00 15.00 O ATOM 483 CB ILE A 29 61.903 11.410 1.039 1.00 15.00 C ATOM 484 CG1 ILE A 29 62.128 10.152 1.891 1.00 15.00 C ATOM 485 CG2 ILE A 29 60.470 11.391 0.497 1.00 15.00 C ATOM 486 CD1 ILE A 29 61.360 10.282 3.209 1.00 15.00 C ATOM 0 H ILE A 29 64.426 12.141 1.193 1.00 15.00 H new ATOM 0 HA ILE A 29 62.745 10.614 -0.821 1.00 15.00 H new ATOM 0 HB ILE A 29 62.057 12.297 1.654 1.00 15.00 H new ATOM 0 HG12 ILE A 29 61.793 9.268 1.348 1.00 15.00 H new ATOM 0 HG13 ILE A 29 63.192 10.020 2.089 1.00 15.00 H new ATOM 0 HG21 ILE A 29 59.767 11.366 1.329 1.00 15.00 H new ATOM 0 HG22 ILE A 29 60.295 12.287 -0.099 1.00 15.00 H new ATOM 0 HG23 ILE A 29 60.328 10.507 -0.125 1.00 15.00 H new ATOM 0 HD11 ILE A 29 61.520 9.389 3.813 1.00 15.00 H new ATOM 0 HD12 ILE A 29 61.716 11.157 3.753 1.00 15.00 H new ATOM 0 HD13 ILE A 29 60.296 10.393 3.001 1.00 15.00 H new ATOM 498 N ASP A 30 62.423 12.636 -2.207 1.00 15.00 N ATOM 499 CA ASP A 30 62.202 13.857 -3.039 1.00 15.00 C ATOM 500 C ASP A 30 60.726 13.956 -3.436 1.00 15.00 C ATOM 501 O ASP A 30 60.290 13.327 -4.381 1.00 15.00 O ATOM 502 CB ASP A 30 63.080 13.660 -4.275 1.00 15.00 C ATOM 503 CG ASP A 30 63.131 14.961 -5.078 1.00 15.00 C ATOM 504 OD1 ASP A 30 64.014 15.761 -4.818 1.00 15.00 O ATOM 505 OD2 ASP A 30 62.285 15.136 -5.938 1.00 15.00 O ATOM 0 H ASP A 30 62.310 11.751 -2.702 1.00 15.00 H new ATOM 0 HA ASP A 30 62.453 14.775 -2.507 1.00 15.00 H new ATOM 0 HB2 ASP A 30 64.086 13.365 -3.976 1.00 15.00 H new ATOM 0 HB3 ASP A 30 62.682 12.855 -4.892 1.00 15.00 H new ATOM 510 N THR A 31 59.962 14.742 -2.719 1.00 15.00 N ATOM 511 CA THR A 31 58.495 14.838 -3.004 1.00 15.00 C ATOM 512 C THR A 31 58.252 15.604 -4.308 1.00 15.00 C ATOM 513 O THR A 31 57.354 15.285 -5.064 1.00 15.00 O ATOM 514 CB THR A 31 57.898 15.601 -1.817 1.00 15.00 C ATOM 515 OG1 THR A 31 58.342 15.008 -0.604 1.00 15.00 O ATOM 516 CG2 THR A 31 56.371 15.543 -1.885 1.00 15.00 C ATOM 0 H THR A 31 60.290 15.323 -1.947 1.00 15.00 H new ATOM 0 HA THR A 31 58.041 13.854 -3.124 1.00 15.00 H new ATOM 0 HB THR A 31 58.221 16.641 -1.854 1.00 15.00 H new ATOM 0 HG1 THR A 31 57.963 15.496 0.157 1.00 15.00 H new ATOM 0 HG21 THR A 31 55.948 16.086 -1.040 1.00 15.00 H new ATOM 0 HG22 THR A 31 56.031 15.998 -2.815 1.00 15.00 H new ATOM 0 HG23 THR A 31 56.044 14.504 -1.848 1.00 15.00 H new ATOM 524 N GLU A 32 59.053 16.606 -4.580 1.00 15.00 N ATOM 525 CA GLU A 32 58.768 17.524 -5.736 1.00 15.00 C ATOM 526 C GLU A 32 58.708 16.746 -7.058 1.00 15.00 C ATOM 527 O GLU A 32 58.007 17.130 -7.976 1.00 15.00 O ATOM 528 CB GLU A 32 59.932 18.521 -5.759 1.00 15.00 C ATOM 529 CG GLU A 32 59.611 19.659 -6.731 1.00 15.00 C ATOM 530 CD GLU A 32 58.530 20.561 -6.132 1.00 15.00 C ATOM 531 OE1 GLU A 32 58.603 20.837 -4.945 1.00 15.00 O ATOM 532 OE2 GLU A 32 57.645 20.961 -6.870 1.00 15.00 O ATOM 0 H GLU A 32 59.896 16.831 -4.051 1.00 15.00 H new ATOM 0 HA GLU A 32 57.804 18.019 -5.622 1.00 15.00 H new ATOM 0 HB2 GLU A 32 60.103 18.920 -4.759 1.00 15.00 H new ATOM 0 HB3 GLU A 32 60.850 18.018 -6.062 1.00 15.00 H new ATOM 0 HG2 GLU A 32 60.510 20.240 -6.935 1.00 15.00 H new ATOM 0 HG3 GLU A 32 59.271 19.252 -7.683 1.00 15.00 H new ATOM 539 N ASN A 33 59.437 15.659 -7.157 1.00 15.00 N ATOM 540 CA ASN A 33 59.474 14.890 -8.444 1.00 15.00 C ATOM 541 C ASN A 33 58.892 13.477 -8.273 1.00 15.00 C ATOM 542 O ASN A 33 59.066 12.630 -9.130 1.00 15.00 O ATOM 543 CB ASN A 33 60.958 14.811 -8.811 1.00 15.00 C ATOM 544 CG ASN A 33 61.485 16.209 -9.151 1.00 15.00 C ATOM 545 OD1 ASN A 33 60.753 17.050 -9.636 1.00 15.00 O ATOM 546 ND2 ASN A 33 62.737 16.494 -8.919 1.00 15.00 N ATOM 0 H ASN A 33 60.007 15.271 -6.405 1.00 15.00 H new ATOM 0 HA ASN A 33 58.875 15.374 -9.216 1.00 15.00 H new ATOM 0 HB2 ASN A 33 61.525 14.391 -7.981 1.00 15.00 H new ATOM 0 HB3 ASN A 33 61.096 14.144 -9.662 1.00 15.00 H new ATOM 0 HD21 ASN A 33 63.099 17.420 -9.144 1.00 15.00 H new ATOM 0 HD22 ASN A 33 63.353 15.790 -8.512 1.00 15.00 H new ATOM 553 N SER A 34 58.199 13.212 -7.181 1.00 15.00 N ATOM 554 CA SER A 34 57.665 11.829 -6.912 1.00 15.00 C ATOM 555 C SER A 34 58.767 10.765 -7.080 1.00 15.00 C ATOM 556 O SER A 34 58.582 9.766 -7.755 1.00 15.00 O ATOM 557 CB SER A 34 56.547 11.623 -7.939 1.00 15.00 C ATOM 558 OG SER A 34 55.361 12.254 -7.474 1.00 15.00 O ATOM 0 H SER A 34 57.980 13.900 -6.461 1.00 15.00 H new ATOM 0 HA SER A 34 57.302 11.730 -5.889 1.00 15.00 H new ATOM 0 HB2 SER A 34 56.841 12.040 -8.902 1.00 15.00 H new ATOM 0 HB3 SER A 34 56.370 10.558 -8.093 1.00 15.00 H new ATOM 0 HG SER A 34 54.644 12.126 -8.129 1.00 15.00 H new ATOM 564 N THR A 35 59.907 10.976 -6.465 1.00 15.00 N ATOM 565 CA THR A 35 61.038 10.008 -6.612 1.00 15.00 C ATOM 566 C THR A 35 61.638 9.671 -5.244 1.00 15.00 C ATOM 567 O THR A 35 61.662 10.493 -4.347 1.00 15.00 O ATOM 568 CB THR A 35 62.070 10.727 -7.487 1.00 15.00 C ATOM 569 OG1 THR A 35 62.278 12.040 -6.988 1.00 15.00 O ATOM 570 CG2 THR A 35 61.571 10.804 -8.934 1.00 15.00 C ATOM 0 H THR A 35 60.102 11.779 -5.867 1.00 15.00 H new ATOM 0 HA THR A 35 60.713 9.066 -7.054 1.00 15.00 H new ATOM 0 HB THR A 35 63.007 10.171 -7.463 1.00 15.00 H new ATOM 0 HG1 THR A 35 62.939 12.501 -7.546 1.00 15.00 H new ATOM 0 HG21 THR A 35 62.312 11.317 -9.548 1.00 15.00 H new ATOM 0 HG22 THR A 35 61.415 9.796 -9.319 1.00 15.00 H new ATOM 0 HG23 THR A 35 60.630 11.354 -8.966 1.00 15.00 H new ATOM 578 N VAL A 36 62.126 8.466 -5.085 1.00 15.00 N ATOM 579 CA VAL A 36 62.738 8.057 -3.782 1.00 15.00 C ATOM 580 C VAL A 36 64.117 7.437 -4.035 1.00 15.00 C ATOM 581 O VAL A 36 64.295 6.664 -4.960 1.00 15.00 O ATOM 582 CB VAL A 36 61.771 7.022 -3.186 1.00 15.00 C ATOM 583 CG1 VAL A 36 62.295 6.539 -1.830 1.00 15.00 C ATOM 584 CG2 VAL A 36 60.390 7.656 -2.986 1.00 15.00 C ATOM 0 H VAL A 36 62.127 7.744 -5.805 1.00 15.00 H new ATOM 0 HA VAL A 36 62.883 8.898 -3.104 1.00 15.00 H new ATOM 0 HB VAL A 36 61.694 6.179 -3.872 1.00 15.00 H new ATOM 0 HG11 VAL A 36 61.605 5.806 -1.413 1.00 15.00 H new ATOM 0 HG12 VAL A 36 63.275 6.081 -1.961 1.00 15.00 H new ATOM 0 HG13 VAL A 36 62.378 7.386 -1.149 1.00 15.00 H new ATOM 0 HG21 VAL A 36 59.709 6.918 -2.563 1.00 15.00 H new ATOM 0 HG22 VAL A 36 60.474 8.504 -2.306 1.00 15.00 H new ATOM 0 HG23 VAL A 36 60.004 7.998 -3.946 1.00 15.00 H new ATOM 594 N ALA A 37 65.089 7.771 -3.220 1.00 15.00 N ATOM 595 CA ALA A 37 66.451 7.175 -3.383 1.00 15.00 C ATOM 596 C ALA A 37 66.753 6.238 -2.211 1.00 15.00 C ATOM 597 O ALA A 37 66.629 6.617 -1.060 1.00 15.00 O ATOM 598 CB ALA A 37 67.420 8.364 -3.390 1.00 15.00 C ATOM 0 H ALA A 37 64.997 8.432 -2.448 1.00 15.00 H new ATOM 0 HA ALA A 37 66.537 6.586 -4.296 1.00 15.00 H new ATOM 0 HB1 ALA A 37 68.441 8.001 -3.507 1.00 15.00 H new ATOM 0 HB2 ALA A 37 67.175 9.029 -4.218 1.00 15.00 H new ATOM 0 HB3 ALA A 37 67.334 8.909 -2.450 1.00 15.00 H new ATOM 604 N LEU A 38 67.152 5.022 -2.502 1.00 15.00 N ATOM 605 CA LEU A 38 67.430 4.032 -1.417 1.00 15.00 C ATOM 606 C LEU A 38 68.907 3.636 -1.444 1.00 15.00 C ATOM 607 O LEU A 38 69.469 3.391 -2.496 1.00 15.00 O ATOM 608 CB LEU A 38 66.553 2.813 -1.735 1.00 15.00 C ATOM 609 CG LEU A 38 65.068 3.201 -1.729 1.00 15.00 C ATOM 610 CD1 LEU A 38 64.231 1.999 -2.172 1.00 15.00 C ATOM 611 CD2 LEU A 38 64.645 3.618 -0.316 1.00 15.00 C ATOM 0 H LEU A 38 67.297 4.673 -3.449 1.00 15.00 H new ATOM 0 HA LEU A 38 67.213 4.438 -0.429 1.00 15.00 H new ATOM 0 HB2 LEU A 38 66.825 2.407 -2.709 1.00 15.00 H new ATOM 0 HB3 LEU A 38 66.732 2.027 -1.001 1.00 15.00 H new ATOM 0 HG LEU A 38 64.911 4.035 -2.413 1.00 15.00 H new ATOM 0 HD11 LEU A 38 63.175 2.270 -2.169 1.00 15.00 H new ATOM 0 HD12 LEU A 38 64.526 1.701 -3.178 1.00 15.00 H new ATOM 0 HD13 LEU A 38 64.394 1.169 -1.485 1.00 15.00 H new ATOM 0 HD21 LEU A 38 63.590 3.892 -0.318 1.00 15.00 H new ATOM 0 HD22 LEU A 38 64.802 2.787 0.371 1.00 15.00 H new ATOM 0 HD23 LEU A 38 65.241 4.472 0.005 1.00 15.00 H new ATOM 623 N ALA A 39 69.534 3.571 -0.296 1.00 15.00 N ATOM 624 CA ALA A 39 70.976 3.180 -0.243 1.00 15.00 C ATOM 625 C ALA A 39 71.122 1.821 0.443 1.00 15.00 C ATOM 626 O ALA A 39 70.216 1.358 1.116 1.00 15.00 O ATOM 627 CB ALA A 39 71.655 4.276 0.581 1.00 15.00 C ATOM 0 H ALA A 39 69.108 3.772 0.609 1.00 15.00 H new ATOM 0 HA ALA A 39 71.419 3.087 -1.235 1.00 15.00 H new ATOM 0 HB1 ALA A 39 72.720 4.060 0.666 1.00 15.00 H new ATOM 0 HB2 ALA A 39 71.518 5.239 0.089 1.00 15.00 H new ATOM 0 HB3 ALA A 39 71.211 4.311 1.576 1.00 15.00 H new ATOM 633 N LYS A 40 72.259 1.175 0.275 1.00 15.00 N ATOM 634 CA LYS A 40 72.477 -0.191 0.869 1.00 15.00 C ATOM 635 C LYS A 40 71.325 -1.134 0.486 1.00 15.00 C ATOM 636 O LYS A 40 70.607 -1.636 1.334 1.00 15.00 O ATOM 637 CB LYS A 40 72.534 0.025 2.388 1.00 15.00 C ATOM 638 CG LYS A 40 73.772 0.852 2.742 1.00 15.00 C ATOM 639 CD LYS A 40 73.896 0.960 4.264 1.00 15.00 C ATOM 640 CE LYS A 40 75.033 1.922 4.618 1.00 15.00 C ATOM 641 NZ LYS A 40 76.281 1.146 4.376 1.00 15.00 N ATOM 0 H LYS A 40 73.052 1.540 -0.253 1.00 15.00 H new ATOM 0 HA LYS A 40 73.392 -0.655 0.500 1.00 15.00 H new ATOM 0 HB2 LYS A 40 71.633 0.537 2.727 1.00 15.00 H new ATOM 0 HB3 LYS A 40 72.567 -0.936 2.901 1.00 15.00 H new ATOM 0 HG2 LYS A 40 74.665 0.386 2.326 1.00 15.00 H new ATOM 0 HG3 LYS A 40 73.697 1.846 2.301 1.00 15.00 H new ATOM 0 HD2 LYS A 40 72.958 1.316 4.691 1.00 15.00 H new ATOM 0 HD3 LYS A 40 74.090 -0.023 4.694 1.00 15.00 H new ATOM 0 HE2 LYS A 40 74.999 2.819 3.999 1.00 15.00 H new ATOM 0 HE3 LYS A 40 74.966 2.248 5.656 1.00 15.00 H new ATOM 0 HZ1 LYS A 40 76.886 1.190 5.221 1.00 15.00 H new ATOM 0 HZ2 LYS A 40 76.040 0.155 4.174 1.00 15.00 H new ATOM 0 HZ3 LYS A 40 76.790 1.551 3.564 1.00 15.00 H new ATOM 655 N VAL A 41 71.150 -1.375 -0.791 1.00 15.00 N ATOM 656 CA VAL A 41 69.969 -2.162 -1.259 1.00 15.00 C ATOM 657 C VAL A 41 70.428 -3.397 -2.049 1.00 15.00 C ATOM 658 O VAL A 41 71.431 -3.367 -2.736 1.00 15.00 O ATOM 659 CB VAL A 41 69.166 -1.188 -2.143 1.00 15.00 C ATOM 660 CG1 VAL A 41 69.982 -0.780 -3.375 1.00 15.00 C ATOM 661 CG2 VAL A 41 67.862 -1.855 -2.596 1.00 15.00 C ATOM 0 H VAL A 41 71.777 -1.059 -1.531 1.00 15.00 H new ATOM 0 HA VAL A 41 69.364 -2.540 -0.434 1.00 15.00 H new ATOM 0 HB VAL A 41 68.940 -0.296 -1.558 1.00 15.00 H new ATOM 0 HG11 VAL A 41 69.398 -0.092 -3.987 1.00 15.00 H new ATOM 0 HG12 VAL A 41 70.902 -0.290 -3.056 1.00 15.00 H new ATOM 0 HG13 VAL A 41 70.227 -1.667 -3.959 1.00 15.00 H new ATOM 0 HG21 VAL A 41 67.297 -1.163 -3.221 1.00 15.00 H new ATOM 0 HG22 VAL A 41 68.093 -2.754 -3.167 1.00 15.00 H new ATOM 0 HG23 VAL A 41 67.268 -2.123 -1.722 1.00 15.00 H new ATOM 671 N ARG A 42 69.692 -4.475 -1.948 1.00 15.00 N ATOM 672 CA ARG A 42 70.053 -5.718 -2.693 1.00 15.00 C ATOM 673 C ARG A 42 68.805 -6.317 -3.348 1.00 15.00 C ATOM 674 O ARG A 42 67.708 -6.194 -2.833 1.00 15.00 O ATOM 675 CB ARG A 42 70.611 -6.667 -1.630 1.00 15.00 C ATOM 676 CG ARG A 42 71.223 -7.894 -2.309 1.00 15.00 C ATOM 677 CD ARG A 42 71.689 -8.889 -1.243 1.00 15.00 C ATOM 678 NE ARG A 42 72.343 -9.999 -2.005 1.00 15.00 N ATOM 679 CZ ARG A 42 71.636 -10.907 -2.652 1.00 15.00 C ATOM 680 NH1 ARG A 42 70.322 -10.872 -2.672 1.00 15.00 N ATOM 681 NH2 ARG A 42 72.257 -11.859 -3.292 1.00 15.00 N ATOM 0 H ARG A 42 68.850 -4.547 -1.377 1.00 15.00 H new ATOM 0 HA ARG A 42 70.773 -5.532 -3.490 1.00 15.00 H new ATOM 0 HB2 ARG A 42 71.365 -6.156 -1.031 1.00 15.00 H new ATOM 0 HB3 ARG A 42 69.817 -6.974 -0.949 1.00 15.00 H new ATOM 0 HG2 ARG A 42 70.489 -8.364 -2.964 1.00 15.00 H new ATOM 0 HG3 ARG A 42 72.064 -7.595 -2.935 1.00 15.00 H new ATOM 0 HD2 ARG A 42 72.387 -8.423 -0.548 1.00 15.00 H new ATOM 0 HD3 ARG A 42 70.849 -9.257 -0.653 1.00 15.00 H new ATOM 0 HE ARG A 42 73.361 -10.055 -2.025 1.00 15.00 H new ATOM 0 HH11 ARG A 42 69.824 -10.130 -2.180 1.00 15.00 H new ATOM 0 HH12 ARG A 42 69.800 -11.586 -3.180 1.00 15.00 H new ATOM 0 HH21 ARG A 42 73.276 -11.895 -3.288 1.00 15.00 H new ATOM 0 HH22 ARG A 42 71.723 -12.567 -3.796 1.00 15.00 H new ATOM 695 N SER A 43 68.968 -6.961 -4.477 1.00 15.00 N ATOM 696 CA SER A 43 67.805 -7.612 -5.153 1.00 15.00 C ATOM 697 C SER A 43 67.749 -9.097 -4.774 1.00 15.00 C ATOM 698 O SER A 43 68.737 -9.802 -4.863 1.00 15.00 O ATOM 699 CB SER A 43 68.070 -7.436 -6.651 1.00 15.00 C ATOM 700 OG SER A 43 69.114 -8.312 -7.057 1.00 15.00 O ATOM 0 H SER A 43 69.860 -7.064 -4.961 1.00 15.00 H new ATOM 0 HA SER A 43 66.850 -7.176 -4.862 1.00 15.00 H new ATOM 0 HB2 SER A 43 67.163 -7.647 -7.218 1.00 15.00 H new ATOM 0 HB3 SER A 43 68.345 -6.403 -6.863 1.00 15.00 H new ATOM 0 HG SER A 43 69.117 -9.106 -6.482 1.00 15.00 H new ATOM 706 N PHE A 44 66.600 -9.571 -4.354 1.00 15.00 N ATOM 707 CA PHE A 44 66.509 -10.978 -3.844 1.00 15.00 C ATOM 708 C PHE A 44 66.655 -11.978 -4.994 1.00 15.00 C ATOM 709 O PHE A 44 67.304 -12.999 -4.856 1.00 15.00 O ATOM 710 CB PHE A 44 65.120 -11.095 -3.213 1.00 15.00 C ATOM 711 CG PHE A 44 64.981 -10.347 -1.909 1.00 15.00 C ATOM 712 CD1 PHE A 44 65.741 -10.743 -0.781 1.00 15.00 C ATOM 713 CD2 PHE A 44 64.090 -9.250 -1.813 1.00 15.00 C ATOM 714 CE1 PHE A 44 65.609 -10.043 0.443 1.00 15.00 C ATOM 715 CE2 PHE A 44 63.959 -8.550 -0.589 1.00 15.00 C ATOM 716 CZ PHE A 44 64.718 -8.946 0.539 1.00 15.00 C ATOM 0 H PHE A 44 65.724 -9.048 -4.342 1.00 15.00 H new ATOM 0 HA PHE A 44 67.301 -11.198 -3.128 1.00 15.00 H new ATOM 0 HB2 PHE A 44 64.378 -10.720 -3.918 1.00 15.00 H new ATOM 0 HB3 PHE A 44 64.895 -12.148 -3.043 1.00 15.00 H new ATOM 0 HD1 PHE A 44 66.421 -11.579 -0.854 1.00 15.00 H new ATOM 0 HD2 PHE A 44 63.511 -8.948 -2.673 1.00 15.00 H new ATOM 0 HE1 PHE A 44 66.188 -10.346 1.303 1.00 15.00 H new ATOM 0 HE2 PHE A 44 63.280 -7.714 -0.516 1.00 15.00 H new ATOM 0 HZ PHE A 44 64.618 -8.412 1.472 1.00 15.00 H new ATOM 984 N PHE A 62 74.269 -2.885 -4.016 1.00 15.00 N ATOM 985 CA PHE A 62 74.448 -1.557 -4.678 1.00 15.00 C ATOM 986 C PHE A 62 74.393 -0.437 -3.636 1.00 15.00 C ATOM 987 O PHE A 62 73.521 -0.413 -2.786 1.00 15.00 O ATOM 988 CB PHE A 62 73.280 -1.441 -5.655 1.00 15.00 C ATOM 989 CG PHE A 62 73.315 -2.472 -6.759 1.00 15.00 C ATOM 990 CD1 PHE A 62 74.166 -2.284 -7.876 1.00 15.00 C ATOM 991 CD2 PHE A 62 72.496 -3.624 -6.678 1.00 15.00 C ATOM 992 CE1 PHE A 62 74.198 -3.251 -8.911 1.00 15.00 C ATOM 993 CE2 PHE A 62 72.529 -4.590 -7.713 1.00 15.00 C ATOM 994 CZ PHE A 62 73.379 -4.403 -8.829 1.00 15.00 C ATOM 0 HA PHE A 62 75.410 -1.472 -5.184 1.00 15.00 H new ATOM 0 HB2 PHE A 62 72.345 -1.541 -5.105 1.00 15.00 H new ATOM 0 HB3 PHE A 62 73.284 -0.445 -6.098 1.00 15.00 H new ATOM 0 HD1 PHE A 62 74.790 -1.404 -7.938 1.00 15.00 H new ATOM 0 HD2 PHE A 62 71.846 -3.766 -5.827 1.00 15.00 H new ATOM 0 HE1 PHE A 62 74.847 -3.109 -9.762 1.00 15.00 H new ATOM 0 HE2 PHE A 62 71.905 -5.470 -7.651 1.00 15.00 H new ATOM 0 HZ PHE A 62 73.403 -5.139 -9.619 1.00 15.00 H new ATOM 1004 N GLU A 63 75.321 0.487 -3.701 1.00 15.00 N ATOM 1005 CA GLU A 63 75.371 1.587 -2.684 1.00 15.00 C ATOM 1006 C GLU A 63 74.162 2.518 -2.830 1.00 15.00 C ATOM 1007 O GLU A 63 73.596 2.960 -1.847 1.00 15.00 O ATOM 1008 CB GLU A 63 76.668 2.348 -2.973 1.00 15.00 C ATOM 1009 CG GLU A 63 76.945 3.338 -1.838 1.00 15.00 C ATOM 1010 CD GLU A 63 78.177 4.178 -2.180 1.00 15.00 C ATOM 1011 OE1 GLU A 63 78.120 5.382 -1.991 1.00 15.00 O ATOM 1012 OE2 GLU A 63 79.157 3.604 -2.625 1.00 15.00 O ATOM 0 H GLU A 63 76.048 0.528 -4.415 1.00 15.00 H new ATOM 0 HA GLU A 63 75.345 1.196 -1.667 1.00 15.00 H new ATOM 0 HB2 GLU A 63 77.498 1.648 -3.070 1.00 15.00 H new ATOM 0 HB3 GLU A 63 76.586 2.879 -3.921 1.00 15.00 H new ATOM 0 HG2 GLU A 63 76.081 3.985 -1.687 1.00 15.00 H new ATOM 0 HG3 GLU A 63 77.107 2.800 -0.904 1.00 15.00 H new ATOM 1019 N TYR A 64 73.763 2.818 -4.044 1.00 15.00 N ATOM 1020 CA TYR A 64 72.660 3.806 -4.252 1.00 15.00 C ATOM 1021 C TYR A 64 71.902 3.511 -5.550 1.00 15.00 C ATOM 1022 O TYR A 64 72.480 3.478 -6.621 1.00 15.00 O ATOM 1023 CB TYR A 64 73.366 5.159 -4.342 1.00 15.00 C ATOM 1024 CG TYR A 64 72.449 6.343 -4.137 1.00 15.00 C ATOM 1025 CD1 TYR A 64 71.408 6.604 -5.062 1.00 15.00 C ATOM 1026 CD2 TYR A 64 72.636 7.198 -3.024 1.00 15.00 C ATOM 1027 CE1 TYR A 64 70.556 7.718 -4.871 1.00 15.00 C ATOM 1028 CE2 TYR A 64 71.783 8.311 -2.834 1.00 15.00 C ATOM 1029 CZ TYR A 64 70.743 8.571 -3.758 1.00 15.00 C ATOM 1030 OH TYR A 64 69.912 9.658 -3.573 1.00 15.00 O ATOM 0 H TYR A 64 74.154 2.421 -4.898 1.00 15.00 H new ATOM 0 HA TYR A 64 71.923 3.773 -3.450 1.00 15.00 H new ATOM 0 HB2 TYR A 64 74.160 5.194 -3.596 1.00 15.00 H new ATOM 0 HB3 TYR A 64 73.842 5.245 -5.319 1.00 15.00 H new ATOM 0 HD1 TYR A 64 71.265 5.953 -5.912 1.00 15.00 H new ATOM 0 HD2 TYR A 64 73.430 7.001 -2.319 1.00 15.00 H new ATOM 0 HE1 TYR A 64 69.762 7.917 -5.576 1.00 15.00 H new ATOM 0 HE2 TYR A 64 71.926 8.962 -1.984 1.00 15.00 H new ATOM 0 HH TYR A 64 70.177 10.138 -2.761 1.00 15.00 H new ATOM 1040 N ILE A 65 70.611 3.296 -5.458 1.00 15.00 N ATOM 1041 CA ILE A 65 69.767 3.172 -6.691 1.00 15.00 C ATOM 1042 C ILE A 65 68.551 4.102 -6.578 1.00 15.00 C ATOM 1043 O ILE A 65 68.035 4.333 -5.500 1.00 15.00 O ATOM 1044 CB ILE A 65 69.335 1.697 -6.755 1.00 15.00 C ATOM 1045 CG1 ILE A 65 70.577 0.806 -6.905 1.00 15.00 C ATOM 1046 CG2 ILE A 65 68.406 1.475 -7.960 1.00 15.00 C ATOM 1047 CD1 ILE A 65 70.174 -0.672 -6.837 1.00 15.00 C ATOM 0 H ILE A 65 70.103 3.201 -4.579 1.00 15.00 H new ATOM 0 HA ILE A 65 70.306 3.458 -7.594 1.00 15.00 H new ATOM 0 HB ILE A 65 68.805 1.441 -5.838 1.00 15.00 H new ATOM 0 HG12 ILE A 65 71.071 1.013 -7.854 1.00 15.00 H new ATOM 0 HG13 ILE A 65 71.294 1.032 -6.116 1.00 15.00 H new ATOM 0 HG21 ILE A 65 68.104 0.428 -7.999 1.00 15.00 H new ATOM 0 HG22 ILE A 65 67.522 2.104 -7.858 1.00 15.00 H new ATOM 0 HG23 ILE A 65 68.933 1.735 -8.878 1.00 15.00 H new ATOM 0 HD11 ILE A 65 71.061 -1.296 -6.944 1.00 15.00 H new ATOM 0 HD12 ILE A 65 69.701 -0.876 -5.877 1.00 15.00 H new ATOM 0 HD13 ILE A 65 69.474 -0.896 -7.642 1.00 15.00 H new ATOM 1059 N ILE A 66 68.095 4.633 -7.689 1.00 15.00 N ATOM 1060 CA ILE A 66 66.927 5.570 -7.662 1.00 15.00 C ATOM 1061 C ILE A 66 65.708 4.902 -8.312 1.00 15.00 C ATOM 1062 O ILE A 66 65.815 4.273 -9.349 1.00 15.00 O ATOM 1063 CB ILE A 66 67.375 6.798 -8.473 1.00 15.00 C ATOM 1064 CG1 ILE A 66 68.588 7.449 -7.802 1.00 15.00 C ATOM 1065 CG2 ILE A 66 66.239 7.825 -8.541 1.00 15.00 C ATOM 1066 CD1 ILE A 66 69.248 8.427 -8.777 1.00 15.00 C ATOM 0 H ILE A 66 68.483 4.457 -8.616 1.00 15.00 H new ATOM 0 HA ILE A 66 66.637 5.845 -6.648 1.00 15.00 H new ATOM 0 HB ILE A 66 67.638 6.474 -9.480 1.00 15.00 H new ATOM 0 HG12 ILE A 66 68.279 7.974 -6.898 1.00 15.00 H new ATOM 0 HG13 ILE A 66 69.303 6.684 -7.498 1.00 15.00 H new ATOM 0 HG21 ILE A 66 66.565 8.691 -9.117 1.00 15.00 H new ATOM 0 HG22 ILE A 66 65.370 7.375 -9.022 1.00 15.00 H new ATOM 0 HG23 ILE A 66 65.972 8.140 -7.532 1.00 15.00 H new ATOM 0 HD11 ILE A 66 70.111 8.890 -8.299 1.00 15.00 H new ATOM 0 HD12 ILE A 66 69.572 7.889 -9.668 1.00 15.00 H new ATOM 0 HD13 ILE A 66 68.532 9.199 -9.059 1.00 15.00 H new ATOM 1078 N PHE A 67 64.555 5.039 -7.704 1.00 15.00 N ATOM 1079 CA PHE A 67 63.304 4.494 -8.315 1.00 15.00 C ATOM 1080 C PHE A 67 62.242 5.593 -8.397 1.00 15.00 C ATOM 1081 O PHE A 67 62.105 6.399 -7.494 1.00 15.00 O ATOM 1082 CB PHE A 67 62.852 3.380 -7.371 1.00 15.00 C ATOM 1083 CG PHE A 67 63.776 2.186 -7.360 1.00 15.00 C ATOM 1084 CD1 PHE A 67 63.836 1.328 -8.485 1.00 15.00 C ATOM 1085 CD2 PHE A 67 64.581 1.924 -6.225 1.00 15.00 C ATOM 1086 CE1 PHE A 67 64.703 0.207 -8.474 1.00 15.00 C ATOM 1087 CE2 PHE A 67 65.447 0.803 -6.214 1.00 15.00 C ATOM 1088 CZ PHE A 67 65.508 -0.055 -7.339 1.00 15.00 C ATOM 0 H PHE A 67 64.427 5.507 -6.807 1.00 15.00 H new ATOM 0 HA PHE A 67 63.463 4.125 -9.328 1.00 15.00 H new ATOM 0 HB2 PHE A 67 62.777 3.780 -6.360 1.00 15.00 H new ATOM 0 HB3 PHE A 67 61.853 3.053 -7.660 1.00 15.00 H new ATOM 0 HD1 PHE A 67 63.222 1.528 -9.351 1.00 15.00 H new ATOM 0 HD2 PHE A 67 64.535 2.579 -5.367 1.00 15.00 H new ATOM 0 HE1 PHE A 67 64.750 -0.448 -9.332 1.00 15.00 H new ATOM 0 HE2 PHE A 67 66.060 0.603 -5.348 1.00 15.00 H new ATOM 0 HZ PHE A 67 66.169 -0.909 -7.331 1.00 15.00 H new ATOM 1098 N ARG A 68 61.494 5.632 -9.472 1.00 15.00 N ATOM 1099 CA ARG A 68 60.435 6.677 -9.622 1.00 15.00 C ATOM 1100 C ARG A 68 59.049 6.045 -9.465 1.00 15.00 C ATOM 1101 O ARG A 68 58.853 4.880 -9.756 1.00 15.00 O ATOM 1102 CB ARG A 68 60.615 7.232 -11.037 1.00 15.00 C ATOM 1103 CG ARG A 68 61.957 7.960 -11.138 1.00 15.00 C ATOM 1104 CD ARG A 68 62.127 8.528 -12.551 1.00 15.00 C ATOM 1105 NE ARG A 68 61.104 9.617 -12.669 1.00 15.00 N ATOM 1106 CZ ARG A 68 60.746 10.099 -13.844 1.00 15.00 C ATOM 1107 NH1 ARG A 68 61.271 9.654 -14.962 1.00 15.00 N ATOM 1108 NH2 ARG A 68 59.848 11.044 -13.896 1.00 15.00 N ATOM 0 H ARG A 68 61.572 4.983 -10.255 1.00 15.00 H new ATOM 0 HA ARG A 68 60.518 7.460 -8.868 1.00 15.00 H new ATOM 0 HB2 ARG A 68 60.575 6.421 -11.764 1.00 15.00 H new ATOM 0 HB3 ARG A 68 59.800 7.916 -11.276 1.00 15.00 H new ATOM 0 HG2 ARG A 68 62.002 8.764 -10.404 1.00 15.00 H new ATOM 0 HG3 ARG A 68 62.773 7.274 -10.910 1.00 15.00 H new ATOM 0 HD2 ARG A 68 63.134 8.918 -12.699 1.00 15.00 H new ATOM 0 HD3 ARG A 68 61.969 7.757 -13.306 1.00 15.00 H new ATOM 0 HE ARG A 68 60.676 9.993 -11.823 1.00 15.00 H new ATOM 0 HH11 ARG A 68 61.975 8.917 -14.937 1.00 15.00 H new ATOM 0 HH12 ARG A 68 60.975 10.046 -15.856 1.00 15.00 H new ATOM 0 HH21 ARG A 68 59.432 11.401 -13.035 1.00 15.00 H new ATOM 0 HH22 ARG A 68 59.561 11.426 -14.797 1.00 15.00 H new ATOM 1122 N GLY A 69 58.085 6.810 -9.006 1.00 15.00 N ATOM 1123 CA GLY A 69 56.704 6.262 -8.796 1.00 15.00 C ATOM 1124 C GLY A 69 56.157 5.651 -10.096 1.00 15.00 C ATOM 1125 O GLY A 69 55.315 4.772 -10.065 1.00 15.00 O ATOM 0 H GLY A 69 58.196 7.795 -8.767 1.00 15.00 H new ATOM 0 HA2 GLY A 69 56.724 5.504 -8.013 1.00 15.00 H new ATOM 0 HA3 GLY A 69 56.040 7.056 -8.455 1.00 15.00 H new ATOM 1129 N SER A 70 56.628 6.110 -11.233 1.00 15.00 N ATOM 1130 CA SER A 70 56.104 5.586 -12.538 1.00 15.00 C ATOM 1131 C SER A 70 56.483 4.111 -12.722 1.00 15.00 C ATOM 1132 O SER A 70 55.658 3.298 -13.099 1.00 15.00 O ATOM 1133 CB SER A 70 56.769 6.443 -13.617 1.00 15.00 C ATOM 1134 OG SER A 70 56.200 6.131 -14.881 1.00 15.00 O ATOM 0 H SER A 70 57.352 6.824 -11.314 1.00 15.00 H new ATOM 0 HA SER A 70 55.016 5.641 -12.585 1.00 15.00 H new ATOM 0 HB2 SER A 70 56.630 7.501 -13.394 1.00 15.00 H new ATOM 0 HB3 SER A 70 57.843 6.259 -13.633 1.00 15.00 H new ATOM 0 HG SER A 70 56.623 6.679 -15.574 1.00 15.00 H new ATOM 1140 N ASP A 71 57.720 3.764 -12.457 1.00 15.00 N ATOM 1141 CA ASP A 71 58.175 2.355 -12.691 1.00 15.00 C ATOM 1142 C ASP A 71 57.779 1.453 -11.513 1.00 15.00 C ATOM 1143 O ASP A 71 57.511 0.278 -11.688 1.00 15.00 O ATOM 1144 CB ASP A 71 59.705 2.430 -12.839 1.00 15.00 C ATOM 1145 CG ASP A 71 60.346 2.965 -11.552 1.00 15.00 C ATOM 1146 OD1 ASP A 71 60.577 2.171 -10.654 1.00 15.00 O ATOM 1147 OD2 ASP A 71 60.594 4.157 -11.488 1.00 15.00 O ATOM 0 H ASP A 71 58.433 4.394 -12.090 1.00 15.00 H new ATOM 0 HA ASP A 71 57.711 1.924 -13.578 1.00 15.00 H new ATOM 0 HB2 ASP A 71 60.103 1.441 -13.066 1.00 15.00 H new ATOM 0 HB3 ASP A 71 59.964 3.077 -13.677 1.00 15.00 H new ATOM 1152 N ILE A 72 57.740 1.998 -10.321 1.00 15.00 N ATOM 1153 CA ILE A 72 57.385 1.171 -9.118 1.00 15.00 C ATOM 1154 C ILE A 72 55.927 0.701 -9.220 1.00 15.00 C ATOM 1155 O ILE A 72 55.061 1.433 -9.662 1.00 15.00 O ATOM 1156 CB ILE A 72 57.575 2.097 -7.902 1.00 15.00 C ATOM 1157 CG1 ILE A 72 59.036 2.556 -7.820 1.00 15.00 C ATOM 1158 CG2 ILE A 72 57.220 1.346 -6.613 1.00 15.00 C ATOM 1159 CD1 ILE A 72 59.138 3.764 -6.887 1.00 15.00 C ATOM 0 H ILE A 72 57.938 2.979 -10.126 1.00 15.00 H new ATOM 0 HA ILE A 72 58.007 0.280 -9.036 1.00 15.00 H new ATOM 0 HB ILE A 72 56.922 2.962 -8.016 1.00 15.00 H new ATOM 0 HG12 ILE A 72 59.663 1.744 -7.452 1.00 15.00 H new ATOM 0 HG13 ILE A 72 59.403 2.817 -8.813 1.00 15.00 H new ATOM 0 HG21 ILE A 72 57.357 2.007 -5.757 1.00 15.00 H new ATOM 0 HG22 ILE A 72 56.181 1.019 -6.657 1.00 15.00 H new ATOM 0 HG23 ILE A 72 57.870 0.477 -6.508 1.00 15.00 H new ATOM 0 HD11 ILE A 72 60.176 4.091 -6.828 1.00 15.00 H new ATOM 0 HD12 ILE A 72 58.523 4.576 -7.275 1.00 15.00 H new ATOM 0 HD13 ILE A 72 58.788 3.486 -5.893 1.00 15.00 H new ATOM 1171 N LYS A 73 55.660 -0.517 -8.813 1.00 15.00 N ATOM 1172 CA LYS A 73 54.267 -1.050 -8.880 1.00 15.00 C ATOM 1173 C LYS A 73 53.641 -1.074 -7.483 1.00 15.00 C ATOM 1174 O LYS A 73 52.494 -0.709 -7.304 1.00 15.00 O ATOM 1175 CB LYS A 73 54.412 -2.469 -9.429 1.00 15.00 C ATOM 1176 CG LYS A 73 53.030 -3.026 -9.777 1.00 15.00 C ATOM 1177 CD LYS A 73 53.170 -4.464 -10.278 1.00 15.00 C ATOM 1178 CE LYS A 73 51.821 -4.954 -10.810 1.00 15.00 C ATOM 1179 NZ LYS A 73 51.914 -6.440 -10.781 1.00 15.00 N ATOM 0 H LYS A 73 56.351 -1.165 -8.436 1.00 15.00 H new ATOM 0 HA LYS A 73 53.619 -0.436 -9.506 1.00 15.00 H new ATOM 0 HB2 LYS A 73 55.047 -2.464 -10.315 1.00 15.00 H new ATOM 0 HB3 LYS A 73 54.898 -3.108 -8.691 1.00 15.00 H new ATOM 0 HG2 LYS A 73 52.383 -2.997 -8.900 1.00 15.00 H new ATOM 0 HG3 LYS A 73 52.559 -2.408 -10.541 1.00 15.00 H new ATOM 0 HD2 LYS A 73 53.923 -4.514 -11.065 1.00 15.00 H new ATOM 0 HD3 LYS A 73 53.510 -5.111 -9.469 1.00 15.00 H new ATOM 0 HE2 LYS A 73 50.999 -4.598 -10.190 1.00 15.00 H new ATOM 0 HE3 LYS A 73 51.639 -4.589 -11.821 1.00 15.00 H new ATOM 0 HZ1 LYS A 73 51.025 -6.850 -11.132 1.00 15.00 H new ATOM 0 HZ2 LYS A 73 52.701 -6.750 -11.386 1.00 15.00 H new ATOM 0 HZ3 LYS A 73 52.081 -6.758 -9.805 1.00 15.00 H new ATOM 1193 N ASP A 74 54.388 -1.504 -6.494 1.00 15.00 N ATOM 1194 CA ASP A 74 53.831 -1.587 -5.107 1.00 15.00 C ATOM 1195 C ASP A 74 54.901 -1.221 -4.072 1.00 15.00 C ATOM 1196 O ASP A 74 56.072 -1.480 -4.264 1.00 15.00 O ATOM 1197 CB ASP A 74 53.403 -3.046 -4.942 1.00 15.00 C ATOM 1198 CG ASP A 74 52.589 -3.199 -3.655 1.00 15.00 C ATOM 1199 OD1 ASP A 74 53.170 -3.571 -2.650 1.00 15.00 O ATOM 1200 OD2 ASP A 74 51.397 -2.940 -3.698 1.00 15.00 O ATOM 0 H ASP A 74 55.359 -1.801 -6.588 1.00 15.00 H new ATOM 0 HA ASP A 74 53.002 -0.895 -4.957 1.00 15.00 H new ATOM 0 HB2 ASP A 74 52.809 -3.361 -5.800 1.00 15.00 H new ATOM 0 HB3 ASP A 74 54.281 -3.692 -4.908 1.00 15.00 H new ATOM 1205 N LEU A 75 54.498 -0.620 -2.977 1.00 15.00 N ATOM 1206 CA LEU A 75 55.478 -0.238 -1.913 1.00 15.00 C ATOM 1207 C LEU A 75 54.981 -0.708 -0.540 1.00 15.00 C ATOM 1208 O LEU A 75 53.844 -0.474 -0.173 1.00 15.00 O ATOM 1209 CB LEU A 75 55.539 1.290 -1.965 1.00 15.00 C ATOM 1210 CG LEU A 75 56.756 1.785 -1.178 1.00 15.00 C ATOM 1211 CD1 LEU A 75 57.161 3.172 -1.681 1.00 15.00 C ATOM 1212 CD2 LEU A 75 56.403 1.868 0.310 1.00 15.00 C ATOM 0 H LEU A 75 53.528 -0.377 -2.775 1.00 15.00 H new ATOM 0 HA LEU A 75 56.456 -0.693 -2.069 1.00 15.00 H new ATOM 0 HB2 LEU A 75 55.602 1.626 -3.000 1.00 15.00 H new ATOM 0 HB3 LEU A 75 54.626 1.714 -1.547 1.00 15.00 H new ATOM 0 HG LEU A 75 57.584 1.091 -1.318 1.00 15.00 H new ATOM 0 HD11 LEU A 75 58.027 3.524 -1.120 1.00 15.00 H new ATOM 0 HD12 LEU A 75 57.413 3.116 -2.740 1.00 15.00 H new ATOM 0 HD13 LEU A 75 56.332 3.866 -1.541 1.00 15.00 H new ATOM 0 HD21 LEU A 75 57.269 2.220 0.870 1.00 15.00 H new ATOM 0 HD22 LEU A 75 55.574 2.562 0.449 1.00 15.00 H new ATOM 0 HD23 LEU A 75 56.114 0.881 0.671 1.00 15.00 H new ATOM 1224 N THR A 76 55.827 -1.370 0.214 1.00 15.00 N ATOM 1225 CA THR A 76 55.424 -1.838 1.578 1.00 15.00 C ATOM 1226 C THR A 76 56.474 -1.422 2.615 1.00 15.00 C ATOM 1227 O THR A 76 57.662 -1.475 2.358 1.00 15.00 O ATOM 1228 CB THR A 76 55.354 -3.362 1.467 1.00 15.00 C ATOM 1229 OG1 THR A 76 54.563 -3.717 0.340 1.00 15.00 O ATOM 1230 CG2 THR A 76 54.725 -3.941 2.735 1.00 15.00 C ATOM 0 H THR A 76 56.781 -1.607 -0.058 1.00 15.00 H new ATOM 0 HA THR A 76 54.476 -1.407 1.899 1.00 15.00 H new ATOM 0 HB THR A 76 56.360 -3.764 1.348 1.00 15.00 H new ATOM 0 HG1 THR A 76 54.518 -4.693 0.266 1.00 15.00 H new ATOM 0 HG21 THR A 76 54.676 -5.027 2.654 1.00 15.00 H new ATOM 0 HG22 THR A 76 55.331 -3.669 3.599 1.00 15.00 H new ATOM 0 HG23 THR A 76 53.719 -3.541 2.857 1.00 15.00 H new