USER MOD reduce.3.24.130724 H: found=0, std=0, add=414, rem=0, adj=15 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 170:sc= -2.1! USER MOD Set 1.2: A 64 TYR OH : rot 180:sc= -0.99 USER MOD Single : A 10 SER OG : rot 37:sc= 0.194 USER MOD Single : A 11 LYS NZ :NH3+ 173:sc= -1.24 (180deg=-1.44) USER MOD Single : A 13 SER OG : rot 110:sc= -1.64 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= 0.00204 USER MOD Single : A 33 ASN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.458 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot -0:sc= 0.377 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00278) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 161 N SER A 10 64.064 4.140 7.941 1.00 15.00 N ATOM 162 CA SER A 10 63.270 2.885 8.120 1.00 15.00 C ATOM 163 C SER A 10 63.565 1.894 6.988 1.00 15.00 C ATOM 164 O SER A 10 63.918 2.283 5.890 1.00 15.00 O ATOM 165 CB SER A 10 61.809 3.332 8.069 1.00 15.00 C ATOM 166 OG SER A 10 61.570 4.274 9.108 1.00 15.00 O ATOM 0 HA SER A 10 63.513 2.377 9.053 1.00 15.00 H new ATOM 0 HB2 SER A 10 61.587 3.778 7.100 1.00 15.00 H new ATOM 0 HB3 SER A 10 61.149 2.472 8.183 1.00 15.00 H new ATOM 0 HG SER A 10 62.357 4.849 9.216 1.00 15.00 H new ATOM 172 N LYS A 11 63.424 0.618 7.256 1.00 15.00 N ATOM 173 CA LYS A 11 63.665 -0.417 6.201 1.00 15.00 C ATOM 174 C LYS A 11 62.400 -0.619 5.359 1.00 15.00 C ATOM 175 O LYS A 11 61.324 -0.847 5.886 1.00 15.00 O ATOM 176 CB LYS A 11 64.009 -1.696 6.970 1.00 15.00 C ATOM 177 CG LYS A 11 64.558 -2.749 6.008 1.00 15.00 C ATOM 178 CD LYS A 11 64.881 -4.028 6.786 1.00 15.00 C ATOM 179 CE LYS A 11 65.669 -4.990 5.893 1.00 15.00 C ATOM 180 NZ LYS A 11 64.633 -5.767 5.157 1.00 15.00 N ATOM 0 H LYS A 11 63.151 0.247 8.166 1.00 15.00 H new ATOM 0 HA LYS A 11 64.461 -0.129 5.514 1.00 15.00 H new ATOM 0 HB2 LYS A 11 64.745 -1.479 7.744 1.00 15.00 H new ATOM 0 HB3 LYS A 11 63.121 -2.078 7.473 1.00 15.00 H new ATOM 0 HG2 LYS A 11 63.828 -2.960 5.227 1.00 15.00 H new ATOM 0 HG3 LYS A 11 65.454 -2.374 5.514 1.00 15.00 H new ATOM 0 HD2 LYS A 11 65.460 -3.787 7.677 1.00 15.00 H new ATOM 0 HD3 LYS A 11 63.960 -4.502 7.124 1.00 15.00 H new ATOM 0 HE2 LYS A 11 66.319 -4.448 5.206 1.00 15.00 H new ATOM 0 HE3 LYS A 11 66.307 -5.645 6.485 1.00 15.00 H new ATOM 0 HZ1 LYS A 11 65.091 -6.364 4.439 1.00 15.00 H new ATOM 0 HZ2 LYS A 11 64.110 -6.369 5.825 1.00 15.00 H new ATOM 0 HZ3 LYS A 11 63.973 -5.112 4.692 1.00 15.00 H new ATOM 194 N ILE A 12 62.523 -0.541 4.054 1.00 15.00 N ATOM 195 CA ILE A 12 61.317 -0.633 3.173 1.00 15.00 C ATOM 196 C ILE A 12 61.576 -1.623 2.032 1.00 15.00 C ATOM 197 O ILE A 12 62.698 -1.799 1.591 1.00 15.00 O ATOM 198 CB ILE A 12 61.096 0.789 2.626 1.00 15.00 C ATOM 199 CG1 ILE A 12 60.841 1.758 3.791 1.00 15.00 C ATOM 200 CG2 ILE A 12 59.879 0.802 1.690 1.00 15.00 C ATOM 201 CD1 ILE A 12 60.838 3.199 3.275 1.00 15.00 C ATOM 0 H ILE A 12 63.408 -0.417 3.562 1.00 15.00 H new ATOM 0 HA ILE A 12 60.440 -0.991 3.712 1.00 15.00 H new ATOM 0 HB ILE A 12 61.985 1.099 2.077 1.00 15.00 H new ATOM 0 HG12 ILE A 12 59.886 1.529 4.264 1.00 15.00 H new ATOM 0 HG13 ILE A 12 61.611 1.636 4.553 1.00 15.00 H new ATOM 0 HG21 ILE A 12 59.727 1.810 1.305 1.00 15.00 H new ATOM 0 HG22 ILE A 12 60.052 0.119 0.859 1.00 15.00 H new ATOM 0 HG23 ILE A 12 58.993 0.486 2.241 1.00 15.00 H new ATOM 0 HD11 ILE A 12 60.657 3.882 4.105 1.00 15.00 H new ATOM 0 HD12 ILE A 12 61.803 3.426 2.823 1.00 15.00 H new ATOM 0 HD13 ILE A 12 60.052 3.317 2.530 1.00 15.00 H new ATOM 213 N SER A 13 60.537 -2.266 1.558 1.00 15.00 N ATOM 214 CA SER A 13 60.669 -3.170 0.379 1.00 15.00 C ATOM 215 C SER A 13 59.851 -2.611 -0.789 1.00 15.00 C ATOM 216 O SER A 13 58.697 -2.257 -0.632 1.00 15.00 O ATOM 217 CB SER A 13 60.101 -4.511 0.840 1.00 15.00 C ATOM 218 OG SER A 13 60.364 -5.496 -0.150 1.00 15.00 O ATOM 0 H SER A 13 59.595 -2.201 1.943 1.00 15.00 H new ATOM 0 HA SER A 13 61.700 -3.267 0.037 1.00 15.00 H new ATOM 0 HB2 SER A 13 60.551 -4.803 1.789 1.00 15.00 H new ATOM 0 HB3 SER A 13 59.028 -4.426 1.009 1.00 15.00 H new ATOM 0 HG SER A 13 61.036 -6.126 0.186 1.00 15.00 H new ATOM 224 N LEU A 14 60.444 -2.532 -1.953 1.00 15.00 N ATOM 225 CA LEU A 14 59.746 -1.926 -3.125 1.00 15.00 C ATOM 226 C LEU A 14 59.596 -2.958 -4.245 1.00 15.00 C ATOM 227 O LEU A 14 60.526 -3.673 -4.565 1.00 15.00 O ATOM 228 CB LEU A 14 60.657 -0.781 -3.569 1.00 15.00 C ATOM 229 CG LEU A 14 59.851 0.231 -4.382 1.00 15.00 C ATOM 230 CD1 LEU A 14 58.929 1.018 -3.450 1.00 15.00 C ATOM 231 CD2 LEU A 14 60.810 1.196 -5.084 1.00 15.00 C ATOM 0 H LEU A 14 61.390 -2.864 -2.142 1.00 15.00 H new ATOM 0 HA LEU A 14 58.742 -1.581 -2.878 1.00 15.00 H new ATOM 0 HB2 LEU A 14 61.097 -0.295 -2.698 1.00 15.00 H new ATOM 0 HB3 LEU A 14 61.481 -1.170 -4.168 1.00 15.00 H new ATOM 0 HG LEU A 14 59.251 -0.294 -5.125 1.00 15.00 H new ATOM 0 HD11 LEU A 14 58.354 1.740 -4.031 1.00 15.00 H new ATOM 0 HD12 LEU A 14 58.247 0.332 -2.948 1.00 15.00 H new ATOM 0 HD13 LEU A 14 59.527 1.545 -2.706 1.00 15.00 H new ATOM 0 HD21 LEU A 14 60.238 1.919 -5.665 1.00 15.00 H new ATOM 0 HD22 LEU A 14 61.408 1.721 -4.339 1.00 15.00 H new ATOM 0 HD23 LEU A 14 61.468 0.636 -5.749 1.00 15.00 H new ATOM 243 N ILE A 15 58.431 -3.036 -4.838 1.00 15.00 N ATOM 244 CA ILE A 15 58.217 -3.986 -5.973 1.00 15.00 C ATOM 245 C ILE A 15 58.125 -3.193 -7.280 1.00 15.00 C ATOM 246 O ILE A 15 57.283 -2.323 -7.423 1.00 15.00 O ATOM 247 CB ILE A 15 56.889 -4.700 -5.666 1.00 15.00 C ATOM 248 CG1 ILE A 15 56.999 -5.452 -4.333 1.00 15.00 C ATOM 249 CG2 ILE A 15 56.569 -5.705 -6.779 1.00 15.00 C ATOM 250 CD1 ILE A 15 55.606 -5.893 -3.877 1.00 15.00 C ATOM 0 H ILE A 15 57.615 -2.480 -4.583 1.00 15.00 H new ATOM 0 HA ILE A 15 59.030 -4.704 -6.082 1.00 15.00 H new ATOM 0 HB ILE A 15 56.096 -3.955 -5.604 1.00 15.00 H new ATOM 0 HG12 ILE A 15 57.648 -6.321 -4.446 1.00 15.00 H new ATOM 0 HG13 ILE A 15 57.454 -4.811 -3.578 1.00 15.00 H new ATOM 0 HG21 ILE A 15 55.628 -6.207 -6.556 1.00 15.00 H new ATOM 0 HG22 ILE A 15 56.483 -5.180 -7.730 1.00 15.00 H new ATOM 0 HG23 ILE A 15 57.368 -6.444 -6.843 1.00 15.00 H new ATOM 0 HD11 ILE A 15 55.685 -6.427 -2.930 1.00 15.00 H new ATOM 0 HD12 ILE A 15 54.971 -5.016 -3.747 1.00 15.00 H new ATOM 0 HD13 ILE A 15 55.168 -6.550 -4.629 1.00 15.00 H new ATOM 262 N SER A 16 58.983 -3.491 -8.227 1.00 15.00 N ATOM 263 CA SER A 16 59.062 -2.664 -9.472 1.00 15.00 C ATOM 264 C SER A 16 58.183 -3.258 -10.579 1.00 15.00 C ATOM 265 O SER A 16 57.654 -4.347 -10.451 1.00 15.00 O ATOM 266 CB SER A 16 60.535 -2.701 -9.880 1.00 15.00 C ATOM 267 OG SER A 16 61.252 -1.725 -9.137 1.00 15.00 O ATOM 0 H SER A 16 59.634 -4.275 -8.190 1.00 15.00 H new ATOM 0 HA SER A 16 58.706 -1.647 -9.306 1.00 15.00 H new ATOM 0 HB2 SER A 16 60.950 -3.692 -9.697 1.00 15.00 H new ATOM 0 HB3 SER A 16 60.634 -2.507 -10.948 1.00 15.00 H new ATOM 0 HG SER A 16 62.197 -1.747 -9.395 1.00 15.00 H new ATOM 273 N LYS A 17 58.032 -2.543 -11.671 1.00 15.00 N ATOM 274 CA LYS A 17 57.151 -3.026 -12.791 1.00 15.00 C ATOM 275 C LYS A 17 57.639 -4.375 -13.349 1.00 15.00 C ATOM 276 O LYS A 17 56.891 -5.083 -13.997 1.00 15.00 O ATOM 277 CB LYS A 17 57.243 -1.944 -13.871 1.00 15.00 C ATOM 278 CG LYS A 17 56.189 -2.206 -14.951 1.00 15.00 C ATOM 279 CD LYS A 17 54.808 -1.808 -14.425 1.00 15.00 C ATOM 280 CE LYS A 17 53.762 -2.019 -15.522 1.00 15.00 C ATOM 281 NZ LYS A 17 52.682 -1.039 -15.216 1.00 15.00 N ATOM 0 H LYS A 17 58.482 -1.643 -11.837 1.00 15.00 H new ATOM 0 HA LYS A 17 56.129 -3.186 -12.448 1.00 15.00 H new ATOM 0 HB2 LYS A 17 57.088 -0.960 -13.428 1.00 15.00 H new ATOM 0 HB3 LYS A 17 58.239 -1.941 -14.314 1.00 15.00 H new ATOM 0 HG2 LYS A 17 56.425 -1.637 -15.850 1.00 15.00 H new ATOM 0 HG3 LYS A 17 56.194 -3.260 -15.230 1.00 15.00 H new ATOM 0 HD2 LYS A 17 54.556 -2.404 -13.548 1.00 15.00 H new ATOM 0 HD3 LYS A 17 54.814 -0.765 -14.110 1.00 15.00 H new ATOM 0 HE2 LYS A 17 54.186 -1.844 -16.511 1.00 15.00 H new ATOM 0 HE3 LYS A 17 53.382 -3.041 -15.514 1.00 15.00 H new ATOM 0 HZ1 LYS A 17 51.926 -1.122 -15.926 1.00 15.00 H new ATOM 0 HZ2 LYS A 17 52.293 -1.235 -14.271 1.00 15.00 H new ATOM 0 HZ3 LYS A 17 53.072 -0.075 -15.237 1.00 15.00 H new ATOM 295 N ALA A 18 58.880 -4.735 -13.103 1.00 15.00 N ATOM 296 CA ALA A 18 59.416 -6.023 -13.650 1.00 15.00 C ATOM 297 C ALA A 18 59.188 -7.184 -12.668 1.00 15.00 C ATOM 298 O ALA A 18 59.808 -8.223 -12.787 1.00 15.00 O ATOM 299 CB ALA A 18 60.915 -5.777 -13.842 1.00 15.00 C ATOM 0 H ALA A 18 59.542 -4.193 -12.548 1.00 15.00 H new ATOM 0 HA ALA A 18 58.916 -6.303 -14.577 1.00 15.00 H new ATOM 0 HB1 ALA A 18 61.383 -6.677 -14.241 1.00 15.00 H new ATOM 0 HB2 ALA A 18 61.062 -4.952 -14.539 1.00 15.00 H new ATOM 0 HB3 ALA A 18 61.369 -5.527 -12.883 1.00 15.00 H new ATOM 305 N GLU A 19 58.307 -7.018 -11.697 1.00 15.00 N ATOM 306 CA GLU A 19 57.992 -8.122 -10.725 1.00 15.00 C ATOM 307 C GLU A 19 59.262 -8.596 -10.008 1.00 15.00 C ATOM 308 O GLU A 19 59.364 -9.739 -9.601 1.00 15.00 O ATOM 309 CB GLU A 19 57.373 -9.259 -11.552 1.00 15.00 C ATOM 310 CG GLU A 19 55.939 -8.887 -11.938 1.00 15.00 C ATOM 311 CD GLU A 19 55.957 -7.948 -13.148 1.00 15.00 C ATOM 312 OE1 GLU A 19 55.190 -7.000 -13.148 1.00 15.00 O ATOM 313 OE2 GLU A 19 56.735 -8.196 -14.056 1.00 15.00 O ATOM 0 H GLU A 19 57.789 -6.154 -11.538 1.00 15.00 H new ATOM 0 HA GLU A 19 57.306 -7.781 -9.950 1.00 15.00 H new ATOM 0 HB2 GLU A 19 57.968 -9.437 -12.448 1.00 15.00 H new ATOM 0 HB3 GLU A 19 57.378 -10.185 -10.977 1.00 15.00 H new ATOM 0 HG2 GLU A 19 55.370 -9.787 -12.172 1.00 15.00 H new ATOM 0 HG3 GLU A 19 55.440 -8.404 -11.098 1.00 15.00 H new ATOM 320 N ILE A 20 60.227 -7.721 -9.854 1.00 15.00 N ATOM 321 CA ILE A 20 61.422 -8.047 -9.017 1.00 15.00 C ATOM 322 C ILE A 20 61.318 -7.299 -7.683 1.00 15.00 C ATOM 323 O ILE A 20 60.810 -6.193 -7.625 1.00 15.00 O ATOM 324 CB ILE A 20 62.636 -7.563 -9.827 1.00 15.00 C ATOM 325 CG1 ILE A 20 62.715 -8.337 -11.148 1.00 15.00 C ATOM 326 CG2 ILE A 20 63.924 -7.803 -9.030 1.00 15.00 C ATOM 327 CD1 ILE A 20 63.704 -7.645 -12.089 1.00 15.00 C ATOM 0 H ILE A 20 60.237 -6.792 -10.274 1.00 15.00 H new ATOM 0 HA ILE A 20 61.503 -9.110 -8.792 1.00 15.00 H new ATOM 0 HB ILE A 20 62.525 -6.498 -10.029 1.00 15.00 H new ATOM 0 HG12 ILE A 20 63.032 -9.363 -10.962 1.00 15.00 H new ATOM 0 HG13 ILE A 20 61.730 -8.387 -11.612 1.00 15.00 H new ATOM 0 HG21 ILE A 20 64.780 -7.458 -9.610 1.00 15.00 H new ATOM 0 HG22 ILE A 20 63.877 -7.254 -8.089 1.00 15.00 H new ATOM 0 HG23 ILE A 20 64.031 -8.868 -8.824 1.00 15.00 H new ATOM 0 HD11 ILE A 20 63.759 -8.196 -13.028 1.00 15.00 H new ATOM 0 HD12 ILE A 20 63.368 -6.627 -12.285 1.00 15.00 H new ATOM 0 HD13 ILE A 20 64.690 -7.619 -11.625 1.00 15.00 H new ATOM 339 N ARG A 21 61.791 -7.899 -6.619 1.00 15.00 N ATOM 340 CA ARG A 21 61.679 -7.256 -5.276 1.00 15.00 C ATOM 341 C ARG A 21 63.034 -6.688 -4.843 1.00 15.00 C ATOM 342 O ARG A 21 64.012 -7.404 -4.743 1.00 15.00 O ATOM 343 CB ARG A 21 61.242 -8.381 -4.337 1.00 15.00 C ATOM 344 CG ARG A 21 60.863 -7.795 -2.974 1.00 15.00 C ATOM 345 CD ARG A 21 60.499 -8.929 -2.013 1.00 15.00 C ATOM 346 NE ARG A 21 59.973 -8.248 -0.789 1.00 15.00 N ATOM 347 CZ ARG A 21 58.761 -7.728 -0.753 1.00 15.00 C ATOM 348 NH1 ARG A 21 57.962 -7.766 -1.796 1.00 15.00 N ATOM 349 NH2 ARG A 21 58.346 -7.157 0.344 1.00 15.00 N ATOM 0 H ARG A 21 62.251 -8.809 -6.624 1.00 15.00 H new ATOM 0 HA ARG A 21 60.974 -6.424 -5.273 1.00 15.00 H new ATOM 0 HB2 ARG A 21 60.393 -8.915 -4.763 1.00 15.00 H new ATOM 0 HB3 ARG A 21 62.048 -9.105 -4.221 1.00 15.00 H new ATOM 0 HG2 ARG A 21 61.694 -7.216 -2.572 1.00 15.00 H new ATOM 0 HG3 ARG A 21 60.021 -7.111 -3.082 1.00 15.00 H new ATOM 0 HD2 ARG A 21 59.750 -9.590 -2.449 1.00 15.00 H new ATOM 0 HD3 ARG A 21 61.369 -9.543 -1.780 1.00 15.00 H new ATOM 0 HE ARG A 21 60.566 -8.184 0.038 1.00 15.00 H new ATOM 0 HH11 ARG A 21 58.274 -8.206 -2.662 1.00 15.00 H new ATOM 0 HH12 ARG A 21 57.030 -7.356 -1.740 1.00 15.00 H new ATOM 0 HH21 ARG A 21 58.956 -7.117 1.160 1.00 15.00 H new ATOM 0 HH22 ARG A 21 57.411 -6.751 0.385 1.00 15.00 H new ATOM 363 N TYR A 22 63.089 -5.404 -4.587 1.00 15.00 N ATOM 364 CA TYR A 22 64.345 -4.780 -4.072 1.00 15.00 C ATOM 365 C TYR A 22 64.142 -4.336 -2.622 1.00 15.00 C ATOM 366 O TYR A 22 63.151 -3.711 -2.300 1.00 15.00 O ATOM 367 CB TYR A 22 64.582 -3.559 -4.962 1.00 15.00 C ATOM 368 CG TYR A 22 64.959 -3.897 -6.385 1.00 15.00 C ATOM 369 CD1 TYR A 22 66.324 -4.029 -6.743 1.00 15.00 C ATOM 370 CD2 TYR A 22 63.949 -4.074 -7.362 1.00 15.00 C ATOM 371 CE1 TYR A 22 66.676 -4.337 -8.080 1.00 15.00 C ATOM 372 CE2 TYR A 22 64.302 -4.382 -8.698 1.00 15.00 C ATOM 373 CZ TYR A 22 65.666 -4.514 -9.057 1.00 15.00 C ATOM 374 OH TYR A 22 66.011 -4.813 -10.360 1.00 15.00 O ATOM 0 H TYR A 22 62.311 -4.757 -4.714 1.00 15.00 H new ATOM 0 HA TYR A 22 65.188 -5.471 -4.094 1.00 15.00 H new ATOM 0 HB2 TYR A 22 63.679 -2.949 -4.972 1.00 15.00 H new ATOM 0 HB3 TYR A 22 65.373 -2.951 -4.523 1.00 15.00 H new ATOM 0 HD1 TYR A 22 67.094 -3.895 -5.998 1.00 15.00 H new ATOM 0 HD2 TYR A 22 62.909 -3.974 -7.088 1.00 15.00 H new ATOM 0 HE1 TYR A 22 67.716 -4.437 -8.355 1.00 15.00 H new ATOM 0 HE2 TYR A 22 63.532 -4.516 -9.443 1.00 15.00 H new ATOM 0 HH TYR A 22 65.199 -4.903 -10.901 1.00 15.00 H new ATOM 384 N GLU A 23 65.066 -4.651 -1.750 1.00 15.00 N ATOM 385 CA GLU A 23 64.962 -4.170 -0.338 1.00 15.00 C ATOM 386 C GLU A 23 66.125 -3.230 -0.022 1.00 15.00 C ATOM 387 O GLU A 23 67.243 -3.460 -0.435 1.00 15.00 O ATOM 388 CB GLU A 23 65.047 -5.433 0.517 1.00 15.00 C ATOM 389 CG GLU A 23 64.511 -5.137 1.920 1.00 15.00 C ATOM 390 CD GLU A 23 65.596 -4.443 2.744 1.00 15.00 C ATOM 391 OE1 GLU A 23 66.720 -4.915 2.724 1.00 15.00 O ATOM 392 OE2 GLU A 23 65.284 -3.451 3.382 1.00 15.00 O ATOM 0 H GLU A 23 65.888 -5.220 -1.954 1.00 15.00 H new ATOM 0 HA GLU A 23 64.042 -3.616 -0.153 1.00 15.00 H new ATOM 0 HB2 GLU A 23 64.470 -6.235 0.058 1.00 15.00 H new ATOM 0 HB3 GLU A 23 66.080 -5.776 0.576 1.00 15.00 H new ATOM 0 HG2 GLU A 23 63.626 -4.503 1.857 1.00 15.00 H new ATOM 0 HG3 GLU A 23 64.206 -6.063 2.407 1.00 15.00 H new ATOM 399 N GLY A 24 65.861 -2.178 0.712 1.00 15.00 N ATOM 400 CA GLY A 24 66.938 -1.206 1.065 1.00 15.00 C ATOM 401 C GLY A 24 66.429 -0.282 2.170 1.00 15.00 C ATOM 402 O GLY A 24 65.311 -0.422 2.630 1.00 15.00 O ATOM 0 H GLY A 24 64.939 -1.950 1.084 1.00 15.00 H new ATOM 0 HA2 GLY A 24 67.830 -1.737 1.399 1.00 15.00 H new ATOM 0 HA3 GLY A 24 67.222 -0.624 0.188 1.00 15.00 H new ATOM 406 N ILE A 25 67.232 0.661 2.599 1.00 15.00 N ATOM 407 CA ILE A 25 66.776 1.598 3.675 1.00 15.00 C ATOM 408 C ILE A 25 66.487 2.975 3.070 1.00 15.00 C ATOM 409 O ILE A 25 67.219 3.456 2.226 1.00 15.00 O ATOM 410 CB ILE A 25 67.930 1.680 4.690 1.00 15.00 C ATOM 411 CG1 ILE A 25 68.372 0.267 5.132 1.00 15.00 C ATOM 412 CG2 ILE A 25 67.471 2.477 5.917 1.00 15.00 C ATOM 413 CD1 ILE A 25 67.197 -0.503 5.752 1.00 15.00 C ATOM 0 H ILE A 25 68.178 0.823 2.254 1.00 15.00 H new ATOM 0 HA ILE A 25 65.860 1.252 4.155 1.00 15.00 H new ATOM 0 HB ILE A 25 68.777 2.177 4.217 1.00 15.00 H new ATOM 0 HG12 ILE A 25 68.760 -0.282 4.274 1.00 15.00 H new ATOM 0 HG13 ILE A 25 69.184 0.345 5.855 1.00 15.00 H new ATOM 0 HG21 ILE A 25 68.286 2.537 6.638 1.00 15.00 H new ATOM 0 HG22 ILE A 25 67.183 3.483 5.611 1.00 15.00 H new ATOM 0 HG23 ILE A 25 66.617 1.979 6.376 1.00 15.00 H new ATOM 0 HD11 ILE A 25 67.532 -1.495 6.056 1.00 15.00 H new ATOM 0 HD12 ILE A 25 66.827 0.038 6.623 1.00 15.00 H new ATOM 0 HD13 ILE A 25 66.397 -0.599 5.018 1.00 15.00 H new ATOM 425 N LEU A 26 65.422 3.608 3.502 1.00 15.00 N ATOM 426 CA LEU A 26 65.038 4.936 2.922 1.00 15.00 C ATOM 427 C LEU A 26 66.099 5.987 3.251 1.00 15.00 C ATOM 428 O LEU A 26 66.269 6.364 4.395 1.00 15.00 O ATOM 429 CB LEU A 26 63.706 5.296 3.587 1.00 15.00 C ATOM 430 CG LEU A 26 63.066 6.479 2.856 1.00 15.00 C ATOM 431 CD1 LEU A 26 62.563 6.024 1.485 1.00 15.00 C ATOM 432 CD2 LEU A 26 61.890 7.006 3.679 1.00 15.00 C ATOM 0 H LEU A 26 64.800 3.262 4.233 1.00 15.00 H new ATOM 0 HA LEU A 26 64.954 4.898 1.836 1.00 15.00 H new ATOM 0 HB2 LEU A 26 63.035 4.437 3.566 1.00 15.00 H new ATOM 0 HB3 LEU A 26 63.868 5.549 4.635 1.00 15.00 H new ATOM 0 HG LEU A 26 63.806 7.269 2.726 1.00 15.00 H new ATOM 0 HD11 LEU A 26 62.108 6.868 0.966 1.00 15.00 H new ATOM 0 HD12 LEU A 26 63.400 5.645 0.898 1.00 15.00 H new ATOM 0 HD13 LEU A 26 61.823 5.234 1.613 1.00 15.00 H new ATOM 0 HD21 LEU A 26 61.432 7.849 3.161 1.00 15.00 H new ATOM 0 HD22 LEU A 26 61.152 6.214 3.807 1.00 15.00 H new ATOM 0 HD23 LEU A 26 62.247 7.331 4.656 1.00 15.00 H new ATOM 444 N TYR A 27 66.809 6.458 2.255 1.00 15.00 N ATOM 445 CA TYR A 27 67.897 7.451 2.504 1.00 15.00 C ATOM 446 C TYR A 27 67.380 8.876 2.294 1.00 15.00 C ATOM 447 O TYR A 27 67.531 9.729 3.150 1.00 15.00 O ATOM 448 CB TYR A 27 68.982 7.118 1.480 1.00 15.00 C ATOM 449 CG TYR A 27 70.230 7.953 1.635 1.00 15.00 C ATOM 450 CD1 TYR A 27 70.964 7.910 2.846 1.00 15.00 C ATOM 451 CD2 TYR A 27 70.666 8.782 0.573 1.00 15.00 C ATOM 452 CE1 TYR A 27 72.133 8.696 2.995 1.00 15.00 C ATOM 453 CE2 TYR A 27 71.835 9.568 0.722 1.00 15.00 C ATOM 454 CZ TYR A 27 72.568 9.524 1.932 1.00 15.00 C ATOM 455 OH TYR A 27 73.707 10.289 2.077 1.00 15.00 O ATOM 0 H TYR A 27 66.680 6.196 1.278 1.00 15.00 H new ATOM 0 HA TYR A 27 68.271 7.400 3.526 1.00 15.00 H new ATOM 0 HB2 TYR A 27 69.245 6.064 1.571 1.00 15.00 H new ATOM 0 HB3 TYR A 27 68.580 7.261 0.477 1.00 15.00 H new ATOM 0 HD1 TYR A 27 70.632 7.278 3.656 1.00 15.00 H new ATOM 0 HD2 TYR A 27 70.107 8.815 -0.351 1.00 15.00 H new ATOM 0 HE1 TYR A 27 72.692 8.664 3.919 1.00 15.00 H new ATOM 0 HE2 TYR A 27 72.167 10.201 -0.088 1.00 15.00 H new ATOM 0 HH TYR A 27 73.866 10.798 1.255 1.00 15.00 H new ATOM 465 N THR A 28 66.771 9.139 1.162 1.00 15.00 N ATOM 466 CA THR A 28 66.266 10.521 0.882 1.00 15.00 C ATOM 467 C THR A 28 64.954 10.466 0.095 1.00 15.00 C ATOM 468 O THR A 28 64.775 9.627 -0.769 1.00 15.00 O ATOM 469 CB THR A 28 67.363 11.187 0.050 1.00 15.00 C ATOM 470 OG1 THR A 28 67.765 10.311 -0.994 1.00 15.00 O ATOM 471 CG2 THR A 28 68.564 11.505 0.944 1.00 15.00 C ATOM 0 H THR A 28 66.602 8.458 0.422 1.00 15.00 H new ATOM 0 HA THR A 28 66.058 11.072 1.799 1.00 15.00 H new ATOM 0 HB THR A 28 66.979 12.112 -0.381 1.00 15.00 H new ATOM 0 HG1 THR A 28 68.346 10.792 -1.619 1.00 15.00 H new ATOM 0 HG21 THR A 28 69.345 11.979 0.349 1.00 15.00 H new ATOM 0 HG22 THR A 28 68.255 12.180 1.742 1.00 15.00 H new ATOM 0 HG23 THR A 28 68.949 10.582 1.378 1.00 15.00 H new ATOM 479 N ILE A 29 64.041 11.360 0.390 1.00 15.00 N ATOM 480 CA ILE A 29 62.725 11.370 -0.326 1.00 15.00 C ATOM 481 C ILE A 29 62.580 12.676 -1.119 1.00 15.00 C ATOM 482 O ILE A 29 62.719 13.756 -0.577 1.00 15.00 O ATOM 483 CB ILE A 29 61.657 11.286 0.778 1.00 15.00 C ATOM 484 CG1 ILE A 29 61.857 10.013 1.614 1.00 15.00 C ATOM 485 CG2 ILE A 29 60.261 11.250 0.147 1.00 15.00 C ATOM 486 CD1 ILE A 29 61.002 10.092 2.883 1.00 15.00 C ATOM 0 H ILE A 29 64.151 12.086 1.098 1.00 15.00 H new ATOM 0 HA ILE A 29 62.632 10.546 -1.034 1.00 15.00 H new ATOM 0 HB ILE A 29 61.752 12.162 1.420 1.00 15.00 H new ATOM 0 HG12 ILE A 29 61.579 9.135 1.030 1.00 15.00 H new ATOM 0 HG13 ILE A 29 62.909 9.901 1.878 1.00 15.00 H new ATOM 0 HG21 ILE A 29 59.508 11.190 0.933 1.00 15.00 H new ATOM 0 HG22 ILE A 29 60.103 12.155 -0.439 1.00 15.00 H new ATOM 0 HG23 ILE A 29 60.178 10.378 -0.502 1.00 15.00 H new ATOM 0 HD11 ILE A 29 61.145 9.188 3.475 1.00 15.00 H new ATOM 0 HD12 ILE A 29 61.301 10.961 3.469 1.00 15.00 H new ATOM 0 HD13 ILE A 29 59.951 10.183 2.609 1.00 15.00 H new ATOM 498 N ASP A 30 62.300 12.579 -2.397 1.00 15.00 N ATOM 499 CA ASP A 30 62.081 13.806 -3.222 1.00 15.00 C ATOM 500 C ASP A 30 60.615 13.884 -3.656 1.00 15.00 C ATOM 501 O ASP A 30 60.223 13.295 -4.646 1.00 15.00 O ATOM 502 CB ASP A 30 62.996 13.637 -4.436 1.00 15.00 C ATOM 503 CG ASP A 30 63.030 14.941 -5.236 1.00 15.00 C ATOM 504 OD1 ASP A 30 61.990 15.330 -5.741 1.00 15.00 O ATOM 505 OD2 ASP A 30 64.095 15.529 -5.330 1.00 15.00 O ATOM 0 H ASP A 30 62.214 11.698 -2.905 1.00 15.00 H new ATOM 0 HA ASP A 30 62.303 14.723 -2.675 1.00 15.00 H new ATOM 0 HB2 ASP A 30 64.002 13.371 -4.112 1.00 15.00 H new ATOM 0 HB3 ASP A 30 62.637 12.822 -5.064 1.00 15.00 H new ATOM 510 N THR A 31 59.807 14.607 -2.918 1.00 15.00 N ATOM 511 CA THR A 31 58.346 14.677 -3.242 1.00 15.00 C ATOM 512 C THR A 31 58.126 15.453 -4.543 1.00 15.00 C ATOM 513 O THR A 31 57.296 15.090 -5.355 1.00 15.00 O ATOM 514 CB THR A 31 57.702 15.414 -2.064 1.00 15.00 C ATOM 515 OG1 THR A 31 58.129 14.819 -0.846 1.00 15.00 O ATOM 516 CG2 THR A 31 56.179 15.322 -2.172 1.00 15.00 C ATOM 0 H THR A 31 60.096 15.152 -2.105 1.00 15.00 H new ATOM 0 HA THR A 31 57.914 13.687 -3.385 1.00 15.00 H new ATOM 0 HB THR A 31 58.002 16.462 -2.083 1.00 15.00 H new ATOM 0 HG1 THR A 31 57.719 15.290 -0.091 1.00 15.00 H new ATOM 0 HG21 THR A 31 55.722 15.847 -1.333 1.00 15.00 H new ATOM 0 HG22 THR A 31 55.852 15.778 -3.107 1.00 15.00 H new ATOM 0 HG23 THR A 31 55.876 14.275 -2.154 1.00 15.00 H new ATOM 524 N GLU A 32 58.869 16.512 -4.749 1.00 15.00 N ATOM 525 CA GLU A 32 58.604 17.417 -5.918 1.00 15.00 C ATOM 526 C GLU A 32 58.726 16.655 -7.244 1.00 15.00 C ATOM 527 O GLU A 32 58.079 16.991 -8.219 1.00 15.00 O ATOM 528 CB GLU A 32 59.672 18.512 -5.836 1.00 15.00 C ATOM 529 CG GLU A 32 59.430 19.371 -4.593 1.00 15.00 C ATOM 530 CD GLU A 32 60.453 20.509 -4.547 1.00 15.00 C ATOM 531 OE1 GLU A 32 60.685 21.113 -5.582 1.00 15.00 O ATOM 532 OE2 GLU A 32 60.986 20.756 -3.478 1.00 15.00 O ATOM 0 H GLU A 32 59.651 16.792 -4.158 1.00 15.00 H new ATOM 0 HA GLU A 32 57.594 17.824 -5.884 1.00 15.00 H new ATOM 0 HB2 GLU A 32 60.665 18.064 -5.793 1.00 15.00 H new ATOM 0 HB3 GLU A 32 59.641 19.133 -6.731 1.00 15.00 H new ATOM 0 HG2 GLU A 32 58.419 19.778 -4.611 1.00 15.00 H new ATOM 0 HG3 GLU A 32 59.511 18.759 -3.695 1.00 15.00 H new ATOM 539 N ASN A 33 59.549 15.635 -7.287 1.00 15.00 N ATOM 540 CA ASN A 33 59.762 14.888 -8.569 1.00 15.00 C ATOM 541 C ASN A 33 59.172 13.469 -8.501 1.00 15.00 C ATOM 542 O ASN A 33 59.438 12.650 -9.360 1.00 15.00 O ATOM 543 CB ASN A 33 61.283 14.821 -8.734 1.00 15.00 C ATOM 544 CG ASN A 33 61.840 16.226 -8.985 1.00 15.00 C ATOM 545 OD1 ASN A 33 61.173 17.069 -9.554 1.00 15.00 O ATOM 546 ND2 ASN A 33 63.049 16.515 -8.585 1.00 15.00 N ATOM 0 H ASN A 33 60.083 15.287 -6.491 1.00 15.00 H new ATOM 0 HA ASN A 33 59.268 15.382 -9.405 1.00 15.00 H new ATOM 0 HB2 ASN A 33 61.737 14.394 -7.839 1.00 15.00 H new ATOM 0 HB3 ASN A 33 61.539 14.164 -9.565 1.00 15.00 H new ATOM 0 HD21 ASN A 33 63.432 17.446 -8.750 1.00 15.00 H new ATOM 0 HD22 ASN A 33 63.610 15.810 -8.108 1.00 15.00 H new ATOM 553 N SER A 34 58.369 13.170 -7.496 1.00 15.00 N ATOM 554 CA SER A 34 57.804 11.782 -7.336 1.00 15.00 C ATOM 555 C SER A 34 58.910 10.714 -7.428 1.00 15.00 C ATOM 556 O SER A 34 58.753 9.701 -8.087 1.00 15.00 O ATOM 557 CB SER A 34 56.798 11.622 -8.479 1.00 15.00 C ATOM 558 OG SER A 34 55.617 12.354 -8.173 1.00 15.00 O ATOM 0 H SER A 34 58.080 13.833 -6.776 1.00 15.00 H new ATOM 0 HA SER A 34 57.338 11.650 -6.360 1.00 15.00 H new ATOM 0 HB2 SER A 34 57.231 11.982 -9.412 1.00 15.00 H new ATOM 0 HB3 SER A 34 56.559 10.568 -8.624 1.00 15.00 H new ATOM 0 HG SER A 34 54.972 12.255 -8.904 1.00 15.00 H new ATOM 564 N THR A 35 60.022 10.937 -6.769 1.00 15.00 N ATOM 565 CA THR A 35 61.159 9.966 -6.849 1.00 15.00 C ATOM 566 C THR A 35 61.705 9.658 -5.451 1.00 15.00 C ATOM 567 O THR A 35 61.654 10.483 -4.559 1.00 15.00 O ATOM 568 CB THR A 35 62.229 10.664 -7.697 1.00 15.00 C ATOM 569 OG1 THR A 35 62.387 12.003 -7.247 1.00 15.00 O ATOM 570 CG2 THR A 35 61.813 10.667 -9.172 1.00 15.00 C ATOM 0 H THR A 35 60.191 11.751 -6.178 1.00 15.00 H new ATOM 0 HA THR A 35 60.849 9.016 -7.284 1.00 15.00 H new ATOM 0 HB THR A 35 63.172 10.127 -7.595 1.00 15.00 H new ATOM 0 HG1 THR A 35 63.072 12.451 -7.786 1.00 15.00 H new ATOM 0 HG21 THR A 35 62.580 11.165 -9.765 1.00 15.00 H new ATOM 0 HG22 THR A 35 61.696 9.640 -9.519 1.00 15.00 H new ATOM 0 HG23 THR A 35 60.867 11.198 -9.282 1.00 15.00 H new ATOM 578 N VAL A 36 62.228 8.471 -5.263 1.00 15.00 N ATOM 579 CA VAL A 36 62.815 8.100 -3.936 1.00 15.00 C ATOM 580 C VAL A 36 64.194 7.461 -4.144 1.00 15.00 C ATOM 581 O VAL A 36 64.393 6.687 -5.062 1.00 15.00 O ATOM 582 CB VAL A 36 61.829 7.090 -3.324 1.00 15.00 C ATOM 583 CG1 VAL A 36 62.325 6.650 -1.942 1.00 15.00 C ATOM 584 CG2 VAL A 36 60.448 7.739 -3.173 1.00 15.00 C ATOM 0 H VAL A 36 62.274 7.740 -5.973 1.00 15.00 H new ATOM 0 HA VAL A 36 62.955 8.962 -3.284 1.00 15.00 H new ATOM 0 HB VAL A 36 61.759 6.224 -3.982 1.00 15.00 H new ATOM 0 HG11 VAL A 36 61.622 5.935 -1.514 1.00 15.00 H new ATOM 0 HG12 VAL A 36 63.305 6.182 -2.039 1.00 15.00 H new ATOM 0 HG13 VAL A 36 62.401 7.519 -1.289 1.00 15.00 H new ATOM 0 HG21 VAL A 36 59.753 7.020 -2.739 1.00 15.00 H new ATOM 0 HG22 VAL A 36 60.524 8.609 -2.521 1.00 15.00 H new ATOM 0 HG23 VAL A 36 60.083 8.051 -4.152 1.00 15.00 H new ATOM 594 N ALA A 37 65.143 7.783 -3.297 1.00 15.00 N ATOM 595 CA ALA A 37 66.506 7.178 -3.420 1.00 15.00 C ATOM 596 C ALA A 37 66.772 6.242 -2.241 1.00 15.00 C ATOM 597 O ALA A 37 66.606 6.619 -1.093 1.00 15.00 O ATOM 598 CB ALA A 37 67.480 8.363 -3.400 1.00 15.00 C ATOM 0 H ALA A 37 65.031 8.440 -2.525 1.00 15.00 H new ATOM 0 HA ALA A 37 66.613 6.586 -4.329 1.00 15.00 H new ATOM 0 HB1 ALA A 37 68.502 7.995 -3.487 1.00 15.00 H new ATOM 0 HB2 ALA A 37 67.262 9.028 -4.236 1.00 15.00 H new ATOM 0 HB3 ALA A 37 67.369 8.909 -2.463 1.00 15.00 H new ATOM 604 N LEU A 38 67.186 5.029 -2.519 1.00 15.00 N ATOM 605 CA LEU A 38 67.451 4.044 -1.426 1.00 15.00 C ATOM 606 C LEU A 38 68.931 3.660 -1.425 1.00 15.00 C ATOM 607 O LEU A 38 69.528 3.466 -2.468 1.00 15.00 O ATOM 608 CB LEU A 38 66.591 2.818 -1.757 1.00 15.00 C ATOM 609 CG LEU A 38 65.102 3.188 -1.750 1.00 15.00 C ATOM 610 CD1 LEU A 38 64.280 1.981 -2.208 1.00 15.00 C ATOM 611 CD2 LEU A 38 64.672 3.582 -0.334 1.00 15.00 C ATOM 0 H LEU A 38 67.352 4.678 -3.462 1.00 15.00 H new ATOM 0 HA LEU A 38 67.212 4.451 -0.443 1.00 15.00 H new ATOM 0 HB2 LEU A 38 66.869 2.425 -2.735 1.00 15.00 H new ATOM 0 HB3 LEU A 38 66.779 2.028 -1.030 1.00 15.00 H new ATOM 0 HG LEU A 38 64.936 4.028 -2.425 1.00 15.00 H new ATOM 0 HD11 LEU A 38 63.221 2.239 -2.205 1.00 15.00 H new ATOM 0 HD12 LEU A 38 64.581 1.697 -3.216 1.00 15.00 H new ATOM 0 HD13 LEU A 38 64.452 1.145 -1.530 1.00 15.00 H new ATOM 0 HD21 LEU A 38 63.614 3.844 -0.335 1.00 15.00 H new ATOM 0 HD22 LEU A 38 64.838 2.744 0.343 1.00 15.00 H new ATOM 0 HD23 LEU A 38 65.258 4.439 -0.001 1.00 15.00 H new ATOM 623 N ALA A 39 69.524 3.550 -0.261 1.00 15.00 N ATOM 624 CA ALA A 39 70.961 3.155 -0.178 1.00 15.00 C ATOM 625 C ALA A 39 71.088 1.795 0.511 1.00 15.00 C ATOM 626 O ALA A 39 70.174 1.342 1.177 1.00 15.00 O ATOM 627 CB ALA A 39 71.626 4.248 0.659 1.00 15.00 C ATOM 0 H ALA A 39 69.071 3.718 0.637 1.00 15.00 H new ATOM 0 HA ALA A 39 71.425 3.061 -1.160 1.00 15.00 H new ATOM 0 HB1 ALA A 39 72.688 4.029 0.766 1.00 15.00 H new ATOM 0 HB2 ALA A 39 71.502 5.211 0.164 1.00 15.00 H new ATOM 0 HB3 ALA A 39 71.162 4.284 1.645 1.00 15.00 H new ATOM 633 N LYS A 40 72.221 1.138 0.354 1.00 15.00 N ATOM 634 CA LYS A 40 72.413 -0.234 0.942 1.00 15.00 C ATOM 635 C LYS A 40 71.259 -1.161 0.528 1.00 15.00 C ATOM 636 O LYS A 40 70.525 -1.670 1.359 1.00 15.00 O ATOM 637 CB LYS A 40 72.438 -0.028 2.463 1.00 15.00 C ATOM 638 CG LYS A 40 72.863 -1.329 3.148 1.00 15.00 C ATOM 639 CD LYS A 40 72.966 -1.102 4.658 1.00 15.00 C ATOM 640 CE LYS A 40 71.563 -0.967 5.252 1.00 15.00 C ATOM 641 NZ LYS A 40 71.713 -1.353 6.683 1.00 15.00 N ATOM 0 H LYS A 40 73.026 1.497 -0.160 1.00 15.00 H new ATOM 0 HA LYS A 40 73.331 -0.705 0.590 1.00 15.00 H new ATOM 0 HB2 LYS A 40 73.130 0.774 2.721 1.00 15.00 H new ATOM 0 HB3 LYS A 40 71.452 0.276 2.816 1.00 15.00 H new ATOM 0 HG2 LYS A 40 72.140 -2.117 2.937 1.00 15.00 H new ATOM 0 HG3 LYS A 40 73.823 -1.663 2.754 1.00 15.00 H new ATOM 0 HD2 LYS A 40 73.492 -1.934 5.126 1.00 15.00 H new ATOM 0 HD3 LYS A 40 73.547 -0.202 4.862 1.00 15.00 H new ATOM 0 HE2 LYS A 40 71.189 0.052 5.155 1.00 15.00 H new ATOM 0 HE3 LYS A 40 70.853 -1.617 4.740 1.00 15.00 H new ATOM 0 HZ1 LYS A 40 70.791 -1.286 7.159 1.00 15.00 H new ATOM 0 HZ2 LYS A 40 72.064 -2.330 6.744 1.00 15.00 H new ATOM 0 HZ3 LYS A 40 72.389 -0.713 7.146 1.00 15.00 H new ATOM 655 N VAL A 41 71.101 -1.380 -0.755 1.00 15.00 N ATOM 656 CA VAL A 41 69.924 -2.157 -1.252 1.00 15.00 C ATOM 657 C VAL A 41 70.389 -3.397 -2.030 1.00 15.00 C ATOM 658 O VAL A 41 71.416 -3.381 -2.684 1.00 15.00 O ATOM 659 CB VAL A 41 69.149 -1.176 -2.154 1.00 15.00 C ATOM 660 CG1 VAL A 41 69.994 -0.782 -3.372 1.00 15.00 C ATOM 661 CG2 VAL A 41 67.847 -1.830 -2.631 1.00 15.00 C ATOM 0 H VAL A 41 71.739 -1.053 -1.481 1.00 15.00 H new ATOM 0 HA VAL A 41 69.297 -2.529 -0.442 1.00 15.00 H new ATOM 0 HB VAL A 41 68.922 -0.280 -1.576 1.00 15.00 H new ATOM 0 HG11 VAL A 41 69.431 -0.089 -3.997 1.00 15.00 H new ATOM 0 HG12 VAL A 41 70.914 -0.303 -3.037 1.00 15.00 H new ATOM 0 HG13 VAL A 41 70.239 -1.674 -3.949 1.00 15.00 H new ATOM 0 HG21 VAL A 41 67.302 -1.133 -3.268 1.00 15.00 H new ATOM 0 HG22 VAL A 41 68.079 -2.733 -3.196 1.00 15.00 H new ATOM 0 HG23 VAL A 41 67.233 -2.089 -1.769 1.00 15.00 H new ATOM 671 N ARG A 42 69.633 -4.463 -1.957 1.00 15.00 N ATOM 672 CA ARG A 42 69.988 -5.704 -2.711 1.00 15.00 C ATOM 673 C ARG A 42 68.756 -6.241 -3.445 1.00 15.00 C ATOM 674 O ARG A 42 67.636 -6.067 -2.997 1.00 15.00 O ATOM 675 CB ARG A 42 70.451 -6.699 -1.644 1.00 15.00 C ATOM 676 CG ARG A 42 71.771 -6.223 -1.037 1.00 15.00 C ATOM 677 CD ARG A 42 72.235 -7.221 0.028 1.00 15.00 C ATOM 678 NE ARG A 42 72.644 -8.450 -0.728 1.00 15.00 N ATOM 679 CZ ARG A 42 72.787 -9.613 -0.123 1.00 15.00 C ATOM 680 NH1 ARG A 42 72.587 -9.749 1.168 1.00 15.00 N ATOM 681 NH2 ARG A 42 73.142 -10.655 -0.824 1.00 15.00 N ATOM 0 H ARG A 42 68.779 -4.527 -1.403 1.00 15.00 H new ATOM 0 HA ARG A 42 70.757 -5.527 -3.462 1.00 15.00 H new ATOM 0 HB2 ARG A 42 69.694 -6.792 -0.866 1.00 15.00 H new ATOM 0 HB3 ARG A 42 70.577 -7.688 -2.085 1.00 15.00 H new ATOM 0 HG2 ARG A 42 72.528 -6.128 -1.816 1.00 15.00 H new ATOM 0 HG3 ARG A 42 71.644 -5.235 -0.594 1.00 15.00 H new ATOM 0 HD2 ARG A 42 73.068 -6.820 0.606 1.00 15.00 H new ATOM 0 HD3 ARG A 42 71.435 -7.442 0.734 1.00 15.00 H new ATOM 0 HE ARG A 42 72.815 -8.385 -1.731 1.00 15.00 H new ATOM 0 HH11 ARG A 42 72.314 -8.943 1.729 1.00 15.00 H new ATOM 0 HH12 ARG A 42 72.705 -10.661 1.609 1.00 15.00 H new ATOM 0 HH21 ARG A 42 73.305 -10.564 -1.827 1.00 15.00 H new ATOM 0 HH22 ARG A 42 73.256 -11.561 -0.369 1.00 15.00 H new ATOM 695 N SER A 43 68.956 -6.891 -4.565 1.00 15.00 N ATOM 696 CA SER A 43 67.805 -7.483 -5.315 1.00 15.00 C ATOM 697 C SER A 43 67.676 -8.972 -4.978 1.00 15.00 C ATOM 698 O SER A 43 68.643 -9.711 -5.023 1.00 15.00 O ATOM 699 CB SER A 43 68.151 -7.281 -6.792 1.00 15.00 C ATOM 700 OG SER A 43 69.202 -8.168 -7.159 1.00 15.00 O ATOM 0 H SER A 43 69.870 -7.038 -4.993 1.00 15.00 H new ATOM 0 HA SER A 43 66.852 -7.019 -5.060 1.00 15.00 H new ATOM 0 HB2 SER A 43 67.273 -7.465 -7.411 1.00 15.00 H new ATOM 0 HB3 SER A 43 68.454 -6.249 -6.968 1.00 15.00 H new ATOM 0 HG SER A 43 69.468 -8.700 -6.380 1.00 15.00 H new ATOM 706 N PHE A 44 66.488 -9.417 -4.641 1.00 15.00 N ATOM 707 CA PHE A 44 66.316 -10.829 -4.172 1.00 15.00 C ATOM 708 C PHE A 44 66.425 -11.809 -5.344 1.00 15.00 C ATOM 709 O PHE A 44 67.017 -12.866 -5.219 1.00 15.00 O ATOM 710 CB PHE A 44 64.913 -10.887 -3.561 1.00 15.00 C ATOM 711 CG PHE A 44 64.836 -10.299 -2.172 1.00 15.00 C ATOM 712 CD1 PHE A 44 65.604 -10.860 -1.122 1.00 15.00 C ATOM 713 CD2 PHE A 44 63.992 -9.191 -1.918 1.00 15.00 C ATOM 714 CE1 PHE A 44 65.528 -10.310 0.181 1.00 15.00 C ATOM 715 CE2 PHE A 44 63.917 -8.642 -0.615 1.00 15.00 C ATOM 716 CZ PHE A 44 64.685 -9.202 0.435 1.00 15.00 C ATOM 0 H PHE A 44 65.631 -8.864 -4.671 1.00 15.00 H new ATOM 0 HA PHE A 44 67.087 -11.109 -3.454 1.00 15.00 H new ATOM 0 HB2 PHE A 44 64.220 -10.354 -4.212 1.00 15.00 H new ATOM 0 HB3 PHE A 44 64.583 -11.925 -3.526 1.00 15.00 H new ATOM 0 HD1 PHE A 44 66.247 -11.706 -1.315 1.00 15.00 H new ATOM 0 HD2 PHE A 44 63.405 -8.765 -2.718 1.00 15.00 H new ATOM 0 HE1 PHE A 44 66.114 -10.737 0.982 1.00 15.00 H new ATOM 0 HE2 PHE A 44 63.274 -7.796 -0.422 1.00 15.00 H new ATOM 0 HZ PHE A 44 64.627 -8.784 1.429 1.00 15.00 H new ATOM 984 N PHE A 62 74.333 -2.880 -3.832 1.00 15.00 N ATOM 985 CA PHE A 62 74.329 -1.562 -4.536 1.00 15.00 C ATOM 986 C PHE A 62 74.331 -0.423 -3.513 1.00 15.00 C ATOM 987 O PHE A 62 73.483 -0.364 -2.642 1.00 15.00 O ATOM 988 CB PHE A 62 73.125 -1.447 -5.472 1.00 15.00 C ATOM 989 CG PHE A 62 73.125 -2.452 -6.587 1.00 15.00 C ATOM 990 CD1 PHE A 62 72.315 -3.572 -6.528 1.00 15.00 C ATOM 991 CD2 PHE A 62 73.932 -2.276 -7.698 1.00 15.00 C ATOM 992 CE1 PHE A 62 72.315 -4.500 -7.554 1.00 15.00 C ATOM 993 CE2 PHE A 62 73.935 -3.200 -8.726 1.00 15.00 C ATOM 994 CZ PHE A 62 73.125 -4.313 -8.654 1.00 15.00 C ATOM 0 HA PHE A 62 75.231 -1.490 -5.143 1.00 15.00 H new ATOM 0 HB2 PHE A 62 72.211 -1.565 -4.889 1.00 15.00 H new ATOM 0 HB3 PHE A 62 73.103 -0.444 -5.899 1.00 15.00 H new ATOM 0 HD1 PHE A 62 71.675 -3.724 -5.671 1.00 15.00 H new ATOM 0 HD2 PHE A 62 74.568 -1.405 -7.762 1.00 15.00 H new ATOM 0 HE1 PHE A 62 71.680 -5.372 -7.493 1.00 15.00 H new ATOM 0 HE2 PHE A 62 74.572 -3.050 -9.585 1.00 15.00 H new ATOM 0 HZ PHE A 62 73.125 -5.036 -9.456 1.00 15.00 H new ATOM 1004 N GLU A 63 75.278 0.477 -3.619 1.00 15.00 N ATOM 1005 CA GLU A 63 75.397 1.577 -2.607 1.00 15.00 C ATOM 1006 C GLU A 63 74.217 2.547 -2.726 1.00 15.00 C ATOM 1007 O GLU A 63 73.617 2.925 -1.737 1.00 15.00 O ATOM 1008 CB GLU A 63 76.711 2.291 -2.935 1.00 15.00 C ATOM 1009 CG GLU A 63 77.051 3.279 -1.817 1.00 15.00 C ATOM 1010 CD GLU A 63 78.299 4.076 -2.202 1.00 15.00 C ATOM 1011 OE1 GLU A 63 78.172 5.270 -2.418 1.00 15.00 O ATOM 1012 OE2 GLU A 63 79.360 3.480 -2.273 1.00 15.00 O ATOM 0 H GLU A 63 75.975 0.499 -4.363 1.00 15.00 H new ATOM 0 HA GLU A 63 75.388 1.191 -1.588 1.00 15.00 H new ATOM 0 HB2 GLU A 63 77.514 1.563 -3.047 1.00 15.00 H new ATOM 0 HB3 GLU A 63 76.623 2.818 -3.885 1.00 15.00 H new ATOM 0 HG2 GLU A 63 76.213 3.955 -1.647 1.00 15.00 H new ATOM 0 HG3 GLU A 63 77.222 2.743 -0.883 1.00 15.00 H new ATOM 1019 N TYR A 64 73.881 2.949 -3.929 1.00 15.00 N ATOM 1020 CA TYR A 64 72.779 3.942 -4.113 1.00 15.00 C ATOM 1021 C TYR A 64 72.065 3.709 -5.448 1.00 15.00 C ATOM 1022 O TYR A 64 72.676 3.744 -6.500 1.00 15.00 O ATOM 1023 CB TYR A 64 73.477 5.303 -4.110 1.00 15.00 C ATOM 1024 CG TYR A 64 72.536 6.474 -3.948 1.00 15.00 C ATOM 1025 CD1 TYR A 64 71.601 6.782 -4.967 1.00 15.00 C ATOM 1026 CD2 TYR A 64 72.593 7.270 -2.778 1.00 15.00 C ATOM 1027 CE1 TYR A 64 70.725 7.883 -4.815 1.00 15.00 C ATOM 1028 CE2 TYR A 64 71.715 8.371 -2.627 1.00 15.00 C ATOM 1029 CZ TYR A 64 70.783 8.678 -3.645 1.00 15.00 C ATOM 1030 OH TYR A 64 69.929 9.751 -3.497 1.00 15.00 O ATOM 0 H TYR A 64 74.324 2.631 -4.791 1.00 15.00 H new ATOM 0 HA TYR A 64 72.020 3.865 -3.334 1.00 15.00 H new ATOM 0 HB2 TYR A 64 74.209 5.323 -3.302 1.00 15.00 H new ATOM 0 HB3 TYR A 64 74.029 5.419 -5.043 1.00 15.00 H new ATOM 0 HD1 TYR A 64 71.557 6.176 -5.860 1.00 15.00 H new ATOM 0 HD2 TYR A 64 73.306 7.037 -2.001 1.00 15.00 H new ATOM 0 HE1 TYR A 64 70.012 8.117 -5.592 1.00 15.00 H new ATOM 0 HE2 TYR A 64 71.757 8.976 -1.734 1.00 15.00 H new ATOM 0 HH TYR A 64 70.100 10.189 -2.637 1.00 15.00 H new ATOM 1040 N ILE A 65 70.777 3.472 -5.407 1.00 15.00 N ATOM 1041 CA ILE A 65 69.983 3.357 -6.674 1.00 15.00 C ATOM 1042 C ILE A 65 68.724 4.230 -6.574 1.00 15.00 C ATOM 1043 O ILE A 65 68.160 4.398 -5.508 1.00 15.00 O ATOM 1044 CB ILE A 65 69.611 1.890 -6.961 1.00 15.00 C ATOM 1045 CG1 ILE A 65 70.867 1.069 -7.258 1.00 15.00 C ATOM 1046 CG2 ILE A 65 68.681 1.801 -8.162 1.00 15.00 C ATOM 1047 CD1 ILE A 65 70.581 -0.356 -7.675 1.00 15.00 C ATOM 0 H ILE A 65 70.238 3.353 -4.549 1.00 15.00 H new ATOM 0 HA ILE A 65 70.594 3.710 -7.505 1.00 15.00 H new ATOM 0 HB ILE A 65 69.111 1.494 -6.077 1.00 15.00 H new ATOM 0 HG12 ILE A 65 71.433 1.562 -8.048 1.00 15.00 H new ATOM 0 HG13 ILE A 65 71.500 1.058 -6.371 1.00 15.00 H new ATOM 0 HG21 ILE A 65 68.429 0.757 -8.350 1.00 15.00 H new ATOM 0 HG22 ILE A 65 67.770 2.364 -7.959 1.00 15.00 H new ATOM 0 HG23 ILE A 65 69.177 2.218 -9.038 1.00 15.00 H new ATOM 0 HD11 ILE A 65 71.520 -0.874 -7.868 1.00 15.00 H new ATOM 0 HD12 ILE A 65 70.042 -0.867 -6.877 1.00 15.00 H new ATOM 0 HD13 ILE A 65 69.974 -0.355 -8.580 1.00 15.00 H new ATOM 1059 N ILE A 66 68.286 4.781 -7.681 1.00 15.00 N ATOM 1060 CA ILE A 66 67.089 5.678 -7.663 1.00 15.00 C ATOM 1061 C ILE A 66 65.914 4.992 -8.373 1.00 15.00 C ATOM 1062 O ILE A 66 66.076 4.400 -9.425 1.00 15.00 O ATOM 1063 CB ILE A 66 67.517 6.947 -8.423 1.00 15.00 C ATOM 1064 CG1 ILE A 66 68.710 7.601 -7.715 1.00 15.00 C ATOM 1065 CG2 ILE A 66 66.355 7.948 -8.462 1.00 15.00 C ATOM 1066 CD1 ILE A 66 69.332 8.658 -8.630 1.00 15.00 C ATOM 0 H ILE A 66 68.709 4.647 -8.600 1.00 15.00 H new ATOM 0 HA ILE A 66 66.762 5.911 -6.650 1.00 15.00 H new ATOM 0 HB ILE A 66 67.798 6.669 -9.439 1.00 15.00 H new ATOM 0 HG12 ILE A 66 68.385 8.059 -6.781 1.00 15.00 H new ATOM 0 HG13 ILE A 66 69.452 6.845 -7.458 1.00 15.00 H new ATOM 0 HG21 ILE A 66 66.664 8.844 -9.001 1.00 15.00 H new ATOM 0 HG22 ILE A 66 65.502 7.496 -8.968 1.00 15.00 H new ATOM 0 HG23 ILE A 66 66.072 8.217 -7.444 1.00 15.00 H new ATOM 0 HD11 ILE A 66 70.180 9.122 -8.126 1.00 15.00 H new ATOM 0 HD12 ILE A 66 69.672 8.186 -9.552 1.00 15.00 H new ATOM 0 HD13 ILE A 66 68.588 9.419 -8.865 1.00 15.00 H new ATOM 1078 N PHE A 67 64.738 5.072 -7.801 1.00 15.00 N ATOM 1079 CA PHE A 67 63.527 4.504 -8.467 1.00 15.00 C ATOM 1080 C PHE A 67 62.437 5.573 -8.570 1.00 15.00 C ATOM 1081 O PHE A 67 62.281 6.395 -7.685 1.00 15.00 O ATOM 1082 CB PHE A 67 63.073 3.360 -7.560 1.00 15.00 C ATOM 1083 CG PHE A 67 64.010 2.176 -7.569 1.00 15.00 C ATOM 1084 CD1 PHE A 67 64.080 1.337 -8.708 1.00 15.00 C ATOM 1085 CD2 PHE A 67 64.821 1.903 -6.439 1.00 15.00 C ATOM 1086 CE1 PHE A 67 64.958 0.226 -8.717 1.00 15.00 C ATOM 1087 CE2 PHE A 67 65.699 0.793 -6.448 1.00 15.00 C ATOM 1088 CZ PHE A 67 65.768 -0.046 -7.587 1.00 15.00 C ATOM 0 H PHE A 67 64.565 5.509 -6.896 1.00 15.00 H new ATOM 0 HA PHE A 67 63.734 4.159 -9.480 1.00 15.00 H new ATOM 0 HB2 PHE A 67 62.979 3.731 -6.539 1.00 15.00 H new ATOM 0 HB3 PHE A 67 62.082 3.031 -7.872 1.00 15.00 H new ATOM 0 HD1 PHE A 67 63.463 1.545 -9.570 1.00 15.00 H new ATOM 0 HD2 PHE A 67 64.769 2.543 -5.570 1.00 15.00 H new ATOM 0 HE1 PHE A 67 65.010 -0.414 -9.585 1.00 15.00 H new ATOM 0 HE2 PHE A 67 66.316 0.586 -5.586 1.00 15.00 H new ATOM 0 HZ PHE A 67 66.438 -0.893 -7.594 1.00 15.00 H new ATOM 1098 N ARG A 68 61.684 5.567 -9.644 1.00 15.00 N ATOM 1099 CA ARG A 68 60.611 6.591 -9.824 1.00 15.00 C ATOM 1100 C ARG A 68 59.234 5.955 -9.616 1.00 15.00 C ATOM 1101 O ARG A 68 59.048 4.775 -9.845 1.00 15.00 O ATOM 1102 CB ARG A 68 60.763 7.082 -11.266 1.00 15.00 C ATOM 1103 CG ARG A 68 62.091 7.827 -11.418 1.00 15.00 C ATOM 1104 CD ARG A 68 62.215 8.368 -12.846 1.00 15.00 C ATOM 1105 NE ARG A 68 63.627 8.858 -12.965 1.00 15.00 N ATOM 1106 CZ ARG A 68 64.186 9.067 -14.141 1.00 15.00 C ATOM 1107 NH1 ARG A 68 63.531 8.867 -15.263 1.00 15.00 N ATOM 1108 NH2 ARG A 68 65.420 9.488 -14.192 1.00 15.00 N ATOM 0 H ARG A 68 61.768 4.894 -10.405 1.00 15.00 H new ATOM 0 HA ARG A 68 60.697 7.407 -9.107 1.00 15.00 H new ATOM 0 HB2 ARG A 68 60.728 6.237 -11.954 1.00 15.00 H new ATOM 0 HB3 ARG A 68 59.934 7.740 -11.526 1.00 15.00 H new ATOM 0 HG2 ARG A 68 62.144 8.647 -10.702 1.00 15.00 H new ATOM 0 HG3 ARG A 68 62.923 7.158 -11.198 1.00 15.00 H new ATOM 0 HD2 ARG A 68 62.006 7.590 -13.580 1.00 15.00 H new ATOM 0 HD3 ARG A 68 61.503 9.174 -13.024 1.00 15.00 H new ATOM 0 HE ARG A 68 64.167 9.034 -12.118 1.00 15.00 H new ATOM 0 HH11 ARG A 68 62.565 8.542 -15.238 1.00 15.00 H new ATOM 0 HH12 ARG A 68 63.989 9.037 -16.158 1.00 15.00 H new ATOM 0 HH21 ARG A 68 65.939 9.651 -13.329 1.00 15.00 H new ATOM 0 HH22 ARG A 68 65.865 9.654 -15.095 1.00 15.00 H new ATOM 1122 N GLY A 69 58.268 6.732 -9.184 1.00 15.00 N ATOM 1123 CA GLY A 69 56.897 6.181 -8.928 1.00 15.00 C ATOM 1124 C GLY A 69 56.332 5.516 -10.194 1.00 15.00 C ATOM 1125 O GLY A 69 55.499 4.632 -10.114 1.00 15.00 O ATOM 0 H GLY A 69 58.371 7.729 -8.997 1.00 15.00 H new ATOM 0 HA2 GLY A 69 56.938 5.454 -8.117 1.00 15.00 H new ATOM 0 HA3 GLY A 69 56.232 6.982 -8.605 1.00 15.00 H new ATOM 1129 N SER A 70 56.779 5.934 -11.356 1.00 15.00 N ATOM 1130 CA SER A 70 56.243 5.350 -12.631 1.00 15.00 C ATOM 1131 C SER A 70 56.622 3.869 -12.749 1.00 15.00 C ATOM 1132 O SER A 70 55.799 3.039 -13.091 1.00 15.00 O ATOM 1133 CB SER A 70 56.897 6.158 -13.754 1.00 15.00 C ATOM 1134 OG SER A 70 56.644 7.541 -13.546 1.00 15.00 O ATOM 0 H SER A 70 57.491 6.654 -11.478 1.00 15.00 H new ATOM 0 HA SER A 70 55.155 5.402 -12.672 1.00 15.00 H new ATOM 0 HB2 SER A 70 57.971 5.972 -13.774 1.00 15.00 H new ATOM 0 HB3 SER A 70 56.501 5.845 -14.720 1.00 15.00 H new ATOM 0 HG SER A 70 57.063 8.062 -14.263 1.00 15.00 H new ATOM 1140 N ASP A 71 57.859 3.534 -12.469 1.00 15.00 N ATOM 1141 CA ASP A 71 58.311 2.112 -12.620 1.00 15.00 C ATOM 1142 C ASP A 71 57.915 1.284 -11.390 1.00 15.00 C ATOM 1143 O ASP A 71 57.658 0.099 -11.491 1.00 15.00 O ATOM 1144 CB ASP A 71 59.841 2.174 -12.779 1.00 15.00 C ATOM 1145 CG ASP A 71 60.488 2.793 -11.532 1.00 15.00 C ATOM 1146 OD1 ASP A 71 60.764 3.980 -11.561 1.00 15.00 O ATOM 1147 OD2 ASP A 71 60.696 2.067 -10.574 1.00 15.00 O ATOM 0 H ASP A 71 58.575 4.182 -12.143 1.00 15.00 H new ATOM 0 HA ASP A 71 57.844 1.629 -13.479 1.00 15.00 H new ATOM 0 HB2 ASP A 71 60.236 1.171 -12.941 1.00 15.00 H new ATOM 0 HB3 ASP A 71 60.097 2.764 -13.659 1.00 15.00 H new ATOM 1152 N ILE A 72 57.867 1.901 -10.233 1.00 15.00 N ATOM 1153 CA ILE A 72 57.488 1.155 -8.988 1.00 15.00 C ATOM 1154 C ILE A 72 56.024 0.701 -9.076 1.00 15.00 C ATOM 1155 O ILE A 72 55.184 1.394 -9.621 1.00 15.00 O ATOM 1156 CB ILE A 72 57.682 2.148 -7.828 1.00 15.00 C ATOM 1157 CG1 ILE A 72 59.149 2.589 -7.759 1.00 15.00 C ATOM 1158 CG2 ILE A 72 57.302 1.483 -6.499 1.00 15.00 C ATOM 1159 CD1 ILE A 72 59.265 3.843 -6.891 1.00 15.00 C ATOM 0 H ILE A 72 58.074 2.890 -10.096 1.00 15.00 H new ATOM 0 HA ILE A 72 58.095 0.261 -8.847 1.00 15.00 H new ATOM 0 HB ILE A 72 57.044 3.014 -8.001 1.00 15.00 H new ATOM 0 HG12 ILE A 72 59.761 1.789 -7.344 1.00 15.00 H new ATOM 0 HG13 ILE A 72 59.526 2.792 -8.761 1.00 15.00 H new ATOM 0 HG21 ILE A 72 57.442 2.193 -5.684 1.00 15.00 H new ATOM 0 HG22 ILE A 72 56.258 1.172 -6.533 1.00 15.00 H new ATOM 0 HG23 ILE A 72 57.935 0.611 -6.334 1.00 15.00 H new ATOM 0 HD11 ILE A 72 60.308 4.156 -6.842 1.00 15.00 H new ATOM 0 HD12 ILE A 72 58.666 4.643 -7.326 1.00 15.00 H new ATOM 0 HD13 ILE A 72 58.904 3.624 -5.886 1.00 15.00 H new ATOM 1171 N LYS A 73 55.722 -0.458 -8.543 1.00 15.00 N ATOM 1172 CA LYS A 73 54.320 -0.974 -8.592 1.00 15.00 C ATOM 1173 C LYS A 73 53.672 -0.875 -7.209 1.00 15.00 C ATOM 1174 O LYS A 73 52.528 -0.480 -7.081 1.00 15.00 O ATOM 1175 CB LYS A 73 54.455 -2.437 -9.020 1.00 15.00 C ATOM 1176 CG LYS A 73 53.071 -3.006 -9.337 1.00 15.00 C ATOM 1177 CD LYS A 73 53.199 -4.488 -9.694 1.00 15.00 C ATOM 1178 CE LYS A 73 51.842 -5.021 -10.162 1.00 15.00 C ATOM 1179 NZ LYS A 73 51.108 -5.353 -8.910 1.00 15.00 N ATOM 0 H LYS A 73 56.390 -1.070 -8.074 1.00 15.00 H new ATOM 0 HA LYS A 73 53.692 -0.405 -9.277 1.00 15.00 H new ATOM 0 HB2 LYS A 73 55.100 -2.513 -9.895 1.00 15.00 H new ATOM 0 HB3 LYS A 73 54.925 -3.017 -8.226 1.00 15.00 H new ATOM 0 HG2 LYS A 73 52.410 -2.883 -8.479 1.00 15.00 H new ATOM 0 HG3 LYS A 73 52.622 -2.459 -10.166 1.00 15.00 H new ATOM 0 HD2 LYS A 73 53.944 -4.621 -10.479 1.00 15.00 H new ATOM 0 HD3 LYS A 73 53.544 -5.053 -8.828 1.00 15.00 H new ATOM 0 HE2 LYS A 73 51.306 -4.275 -10.748 1.00 15.00 H new ATOM 0 HE3 LYS A 73 51.960 -5.900 -10.796 1.00 15.00 H new ATOM 0 HZ1 LYS A 73 50.180 -5.757 -9.148 1.00 15.00 H new ATOM 0 HZ2 LYS A 73 51.656 -6.045 -8.360 1.00 15.00 H new ATOM 0 HZ3 LYS A 73 50.975 -4.489 -8.346 1.00 15.00 H new ATOM 1193 N ASP A 74 54.396 -1.233 -6.176 1.00 15.00 N ATOM 1194 CA ASP A 74 53.815 -1.196 -4.796 1.00 15.00 C ATOM 1195 C ASP A 74 54.911 -0.935 -3.755 1.00 15.00 C ATOM 1196 O ASP A 74 56.058 -1.281 -3.955 1.00 15.00 O ATOM 1197 CB ASP A 74 53.202 -2.582 -4.590 1.00 15.00 C ATOM 1198 CG ASP A 74 52.355 -2.582 -3.316 1.00 15.00 C ATOM 1199 OD1 ASP A 74 52.868 -2.995 -2.288 1.00 15.00 O ATOM 1200 OD2 ASP A 74 51.209 -2.169 -3.388 1.00 15.00 O ATOM 0 H ASP A 74 55.364 -1.549 -6.228 1.00 15.00 H new ATOM 0 HA ASP A 74 53.080 -0.399 -4.683 1.00 15.00 H new ATOM 0 HB2 ASP A 74 52.586 -2.850 -5.449 1.00 15.00 H new ATOM 0 HB3 ASP A 74 53.989 -3.332 -4.516 1.00 15.00 H new ATOM 1205 N LEU A 75 54.554 -0.327 -2.648 1.00 15.00 N ATOM 1206 CA LEU A 75 55.559 -0.044 -1.575 1.00 15.00 C ATOM 1207 C LEU A 75 55.039 -0.539 -0.219 1.00 15.00 C ATOM 1208 O LEU A 75 53.925 -0.239 0.170 1.00 15.00 O ATOM 1209 CB LEU A 75 55.709 1.478 -1.568 1.00 15.00 C ATOM 1210 CG LEU A 75 56.955 1.869 -0.768 1.00 15.00 C ATOM 1211 CD1 LEU A 75 57.438 3.250 -1.218 1.00 15.00 C ATOM 1212 CD2 LEU A 75 56.613 1.914 0.724 1.00 15.00 C ATOM 0 H LEU A 75 53.606 -0.014 -2.441 1.00 15.00 H new ATOM 0 HA LEU A 75 56.509 -0.548 -1.754 1.00 15.00 H new ATOM 0 HB2 LEU A 75 55.789 1.850 -2.589 1.00 15.00 H new ATOM 0 HB3 LEU A 75 54.824 1.939 -1.129 1.00 15.00 H new ATOM 0 HG LEU A 75 57.740 1.133 -0.940 1.00 15.00 H new ATOM 0 HD11 LEU A 75 58.325 3.529 -0.649 1.00 15.00 H new ATOM 0 HD12 LEU A 75 57.682 3.222 -2.280 1.00 15.00 H new ATOM 0 HD13 LEU A 75 56.651 3.984 -1.046 1.00 15.00 H new ATOM 0 HD21 LEU A 75 57.500 2.192 1.292 1.00 15.00 H new ATOM 0 HD22 LEU A 75 55.827 2.650 0.895 1.00 15.00 H new ATOM 0 HD23 LEU A 75 56.268 0.932 1.048 1.00 15.00 H new ATOM 1224 N THR A 76 55.839 -1.293 0.498 1.00 15.00 N ATOM 1225 CA THR A 76 55.409 -1.794 1.841 1.00 15.00 C ATOM 1226 C THR A 76 56.509 -1.547 2.881 1.00 15.00 C ATOM 1227 O THR A 76 57.684 -1.657 2.588 1.00 15.00 O ATOM 1228 CB THR A 76 55.183 -3.295 1.648 1.00 15.00 C ATOM 1229 OG1 THR A 76 54.349 -3.504 0.515 1.00 15.00 O ATOM 1230 CG2 THR A 76 54.510 -3.877 2.892 1.00 15.00 C ATOM 0 H THR A 76 56.773 -1.583 0.209 1.00 15.00 H new ATOM 0 HA THR A 76 54.514 -1.287 2.202 1.00 15.00 H new ATOM 0 HB THR A 76 56.142 -3.790 1.492 1.00 15.00 H new ATOM 0 HG1 THR A 76 54.204 -4.465 0.388 1.00 15.00 H new ATOM 0 HG21 THR A 76 54.350 -4.946 2.753 1.00 15.00 H new ATOM 0 HG22 THR A 76 55.149 -3.716 3.760 1.00 15.00 H new ATOM 0 HG23 THR A 76 53.551 -3.384 3.051 1.00 15.00 H new