USER MOD reduce.3.24.130724 H: found=0, std=0, add=414, rem=0, adj=13 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= -2.08! USER MOD Set 1.2: A 64 TYR OH : rot 180:sc= -0.977 USER MOD Single : A 10 SER OG : rot 28:sc= 0.187 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 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 -55:sc= 0.0344 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.693 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 4:sc= 0.562 USER MOD Single : A 70 SER OG : rot 180:sc= -0.136 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 64.260 4.158 7.951 1.00 15.00 N ATOM 162 CA SER A 10 63.410 2.936 8.115 1.00 15.00 C ATOM 163 C SER A 10 63.630 1.976 6.940 1.00 15.00 C ATOM 164 O SER A 10 63.997 2.388 5.857 1.00 15.00 O ATOM 165 CB SER A 10 61.971 3.450 8.124 1.00 15.00 C ATOM 166 OG SER A 10 61.807 4.365 9.200 1.00 15.00 O ATOM 0 HA SER A 10 63.651 2.386 9.025 1.00 15.00 H new ATOM 0 HB2 SER A 10 61.741 3.939 7.177 1.00 15.00 H new ATOM 0 HB3 SER A 10 61.276 2.617 8.230 1.00 15.00 H new ATOM 0 HG SER A 10 62.665 4.797 9.396 1.00 15.00 H new ATOM 172 N LYS A 11 63.408 0.701 7.153 1.00 15.00 N ATOM 173 CA LYS A 11 63.613 -0.301 6.059 1.00 15.00 C ATOM 174 C LYS A 11 62.343 -0.435 5.211 1.00 15.00 C ATOM 175 O LYS A 11 61.247 -0.552 5.732 1.00 15.00 O ATOM 176 CB LYS A 11 63.919 -1.619 6.774 1.00 15.00 C ATOM 177 CG LYS A 11 64.438 -2.643 5.762 1.00 15.00 C ATOM 178 CD LYS A 11 64.371 -4.044 6.372 1.00 15.00 C ATOM 179 CE LYS A 11 65.459 -4.192 7.438 1.00 15.00 C ATOM 180 NZ LYS A 11 65.613 -5.661 7.628 1.00 15.00 N ATOM 0 H LYS A 11 63.093 0.310 8.041 1.00 15.00 H new ATOM 0 HA LYS A 11 64.416 -0.008 5.383 1.00 15.00 H new ATOM 0 HB2 LYS A 11 64.661 -1.457 7.556 1.00 15.00 H new ATOM 0 HB3 LYS A 11 63.020 -1.997 7.261 1.00 15.00 H new ATOM 0 HG2 LYS A 11 63.842 -2.603 4.850 1.00 15.00 H new ATOM 0 HG3 LYS A 11 65.464 -2.405 5.482 1.00 15.00 H new ATOM 0 HD2 LYS A 11 63.389 -4.213 6.814 1.00 15.00 H new ATOM 0 HD3 LYS A 11 64.504 -4.797 5.595 1.00 15.00 H new ATOM 0 HE2 LYS A 11 66.394 -3.736 7.114 1.00 15.00 H new ATOM 0 HE3 LYS A 11 65.170 -3.702 8.368 1.00 15.00 H new ATOM 0 HZ1 LYS A 11 66.343 -5.844 8.346 1.00 15.00 H new ATOM 0 HZ2 LYS A 11 64.709 -6.067 7.943 1.00 15.00 H new ATOM 0 HZ3 LYS A 11 65.895 -6.100 6.728 1.00 15.00 H new ATOM 194 N ILE A 12 62.486 -0.420 3.907 1.00 15.00 N ATOM 195 CA ILE A 12 61.293 -0.498 3.009 1.00 15.00 C ATOM 196 C ILE A 12 61.514 -1.570 1.936 1.00 15.00 C ATOM 197 O ILE A 12 62.627 -1.802 1.496 1.00 15.00 O ATOM 198 CB ILE A 12 61.164 0.898 2.374 1.00 15.00 C ATOM 199 CG1 ILE A 12 60.946 1.948 3.472 1.00 15.00 C ATOM 200 CG2 ILE A 12 59.968 0.924 1.413 1.00 15.00 C ATOM 201 CD1 ILE A 12 61.053 3.352 2.874 1.00 15.00 C ATOM 0 H ILE A 12 63.383 -0.357 3.425 1.00 15.00 H new ATOM 0 HA ILE A 12 60.387 -0.772 3.550 1.00 15.00 H new ATOM 0 HB ILE A 12 62.079 1.123 1.826 1.00 15.00 H new ATOM 0 HG12 ILE A 12 59.966 1.811 3.930 1.00 15.00 H new ATOM 0 HG13 ILE A 12 61.687 1.821 4.261 1.00 15.00 H new ATOM 0 HG21 ILE A 12 59.882 1.915 0.966 1.00 15.00 H new ATOM 0 HG22 ILE A 12 60.117 0.183 0.627 1.00 15.00 H new ATOM 0 HG23 ILE A 12 59.055 0.692 1.962 1.00 15.00 H new ATOM 0 HD11 ILE A 12 60.898 4.094 3.657 1.00 15.00 H new ATOM 0 HD12 ILE A 12 62.043 3.487 2.437 1.00 15.00 H new ATOM 0 HD13 ILE A 12 60.295 3.477 2.101 1.00 15.00 H new ATOM 213 N SER A 13 60.455 -2.221 1.520 1.00 15.00 N ATOM 214 CA SER A 13 60.553 -3.211 0.408 1.00 15.00 C ATOM 215 C SER A 13 59.833 -2.665 -0.827 1.00 15.00 C ATOM 216 O SER A 13 58.701 -2.224 -0.748 1.00 15.00 O ATOM 217 CB SER A 13 59.853 -4.465 0.930 1.00 15.00 C ATOM 218 OG SER A 13 59.987 -5.509 -0.026 1.00 15.00 O ATOM 0 H SER A 13 59.519 -2.106 1.909 1.00 15.00 H new ATOM 0 HA SER A 13 61.583 -3.418 0.118 1.00 15.00 H new ATOM 0 HB2 SER A 13 60.289 -4.769 1.882 1.00 15.00 H new ATOM 0 HB3 SER A 13 58.799 -4.257 1.114 1.00 15.00 H new ATOM 0 HG SER A 13 59.541 -6.316 0.306 1.00 15.00 H new ATOM 224 N LEU A 14 60.485 -2.694 -1.961 1.00 15.00 N ATOM 225 CA LEU A 14 59.903 -2.079 -3.190 1.00 15.00 C ATOM 226 C LEU A 14 59.731 -3.137 -4.284 1.00 15.00 C ATOM 227 O LEU A 14 60.643 -3.885 -4.578 1.00 15.00 O ATOM 228 CB LEU A 14 60.933 -1.032 -3.619 1.00 15.00 C ATOM 229 CG LEU A 14 60.336 -0.133 -4.703 1.00 15.00 C ATOM 230 CD1 LEU A 14 59.511 0.975 -4.048 1.00 15.00 C ATOM 231 CD2 LEU A 14 61.468 0.493 -5.524 1.00 15.00 C ATOM 0 H LEU A 14 61.403 -3.121 -2.088 1.00 15.00 H new ATOM 0 HA LEU A 14 58.919 -1.646 -3.013 1.00 15.00 H new ATOM 0 HB2 LEU A 14 61.234 -0.432 -2.761 1.00 15.00 H new ATOM 0 HB3 LEU A 14 61.830 -1.524 -3.995 1.00 15.00 H new ATOM 0 HG LEU A 14 59.696 -0.726 -5.356 1.00 15.00 H new ATOM 0 HD11 LEU A 14 59.085 1.616 -4.820 1.00 15.00 H new ATOM 0 HD12 LEU A 14 58.707 0.531 -3.461 1.00 15.00 H new ATOM 0 HD13 LEU A 14 60.152 1.569 -3.396 1.00 15.00 H new ATOM 0 HD21 LEU A 14 61.045 1.134 -6.297 1.00 15.00 H new ATOM 0 HD22 LEU A 14 62.107 1.086 -4.870 1.00 15.00 H new ATOM 0 HD23 LEU A 14 62.059 -0.296 -5.990 1.00 15.00 H new ATOM 243 N ILE A 15 58.569 -3.202 -4.882 1.00 15.00 N ATOM 244 CA ILE A 15 58.339 -4.175 -5.995 1.00 15.00 C ATOM 245 C ILE A 15 58.215 -3.404 -7.314 1.00 15.00 C ATOM 246 O ILE A 15 57.331 -2.580 -7.474 1.00 15.00 O ATOM 247 CB ILE A 15 57.023 -4.892 -5.649 1.00 15.00 C ATOM 248 CG1 ILE A 15 57.164 -5.618 -4.306 1.00 15.00 C ATOM 249 CG2 ILE A 15 56.688 -5.920 -6.737 1.00 15.00 C ATOM 250 CD1 ILE A 15 55.784 -6.064 -3.815 1.00 15.00 C ATOM 0 H ILE A 15 57.765 -2.620 -4.647 1.00 15.00 H new ATOM 0 HA ILE A 15 59.154 -4.890 -6.108 1.00 15.00 H new ATOM 0 HB ILE A 15 56.226 -4.151 -5.585 1.00 15.00 H new ATOM 0 HG12 ILE A 15 57.819 -6.482 -4.416 1.00 15.00 H new ATOM 0 HG13 ILE A 15 57.627 -4.959 -3.572 1.00 15.00 H new ATOM 0 HG21 ILE A 15 55.755 -6.424 -6.486 1.00 15.00 H new ATOM 0 HG22 ILE A 15 56.580 -5.413 -7.696 1.00 15.00 H new ATOM 0 HG23 ILE A 15 57.491 -6.654 -6.803 1.00 15.00 H new ATOM 0 HD11 ILE A 15 55.887 -6.580 -2.860 1.00 15.00 H new ATOM 0 HD12 ILE A 15 55.143 -5.191 -3.689 1.00 15.00 H new ATOM 0 HD13 ILE A 15 55.338 -6.739 -4.546 1.00 15.00 H new ATOM 262 N SER A 16 59.094 -3.671 -8.252 1.00 15.00 N ATOM 263 CA SER A 16 59.153 -2.841 -9.495 1.00 15.00 C ATOM 264 C SER A 16 58.279 -3.445 -10.599 1.00 15.00 C ATOM 265 O SER A 16 57.786 -4.551 -10.481 1.00 15.00 O ATOM 266 CB SER A 16 60.626 -2.853 -9.910 1.00 15.00 C ATOM 267 OG SER A 16 61.320 -1.831 -9.208 1.00 15.00 O ATOM 0 H SER A 16 59.774 -4.430 -8.209 1.00 15.00 H new ATOM 0 HA SER A 16 58.781 -1.831 -9.325 1.00 15.00 H new ATOM 0 HB2 SER A 16 61.069 -3.825 -9.692 1.00 15.00 H new ATOM 0 HB3 SER A 16 60.714 -2.696 -10.985 1.00 15.00 H new ATOM 0 HG SER A 16 62.264 -1.837 -9.470 1.00 15.00 H new ATOM 273 N LYS A 17 58.090 -2.718 -11.677 1.00 15.00 N ATOM 274 CA LYS A 17 57.218 -3.215 -12.796 1.00 15.00 C ATOM 275 C LYS A 17 57.757 -4.527 -13.391 1.00 15.00 C ATOM 276 O LYS A 17 57.040 -5.241 -14.069 1.00 15.00 O ATOM 277 CB LYS A 17 57.244 -2.106 -13.852 1.00 15.00 C ATOM 278 CG LYS A 17 56.179 -2.383 -14.914 1.00 15.00 C ATOM 279 CD LYS A 17 56.153 -1.235 -15.925 1.00 15.00 C ATOM 280 CE LYS A 17 57.395 -1.309 -16.815 1.00 15.00 C ATOM 281 NZ LYS A 17 57.159 -0.303 -17.889 1.00 15.00 N ATOM 0 H LYS A 17 58.503 -1.798 -11.832 1.00 15.00 H new ATOM 0 HA LYS A 17 56.209 -3.430 -12.443 1.00 15.00 H new ATOM 0 HB2 LYS A 17 57.061 -1.139 -13.383 1.00 15.00 H new ATOM 0 HB3 LYS A 17 58.229 -2.054 -14.315 1.00 15.00 H new ATOM 0 HG2 LYS A 17 56.393 -3.324 -15.422 1.00 15.00 H new ATOM 0 HG3 LYS A 17 55.201 -2.490 -14.444 1.00 15.00 H new ATOM 0 HD2 LYS A 17 55.252 -1.294 -16.535 1.00 15.00 H new ATOM 0 HD3 LYS A 17 56.123 -0.278 -15.404 1.00 15.00 H new ATOM 0 HE2 LYS A 17 58.299 -1.080 -16.251 1.00 15.00 H new ATOM 0 HE3 LYS A 17 57.524 -2.308 -17.231 1.00 15.00 H new ATOM 0 HZ1 LYS A 17 57.969 -0.294 -18.541 1.00 15.00 H new ATOM 0 HZ2 LYS A 17 56.296 -0.551 -18.413 1.00 15.00 H new ATOM 0 HZ3 LYS A 17 57.047 0.639 -17.463 1.00 15.00 H new ATOM 295 N ALA A 18 59.007 -4.853 -13.145 1.00 15.00 N ATOM 296 CA ALA A 18 59.588 -6.111 -13.713 1.00 15.00 C ATOM 297 C ALA A 18 59.374 -7.303 -12.764 1.00 15.00 C ATOM 298 O ALA A 18 60.006 -8.331 -12.913 1.00 15.00 O ATOM 299 CB ALA A 18 61.084 -5.822 -13.866 1.00 15.00 C ATOM 0 H ALA A 18 59.648 -4.301 -12.575 1.00 15.00 H new ATOM 0 HA ALA A 18 59.114 -6.379 -14.657 1.00 15.00 H new ATOM 0 HB1 ALA A 18 61.584 -6.699 -14.278 1.00 15.00 H new ATOM 0 HB2 ALA A 18 61.224 -4.975 -14.538 1.00 15.00 H new ATOM 0 HB3 ALA A 18 61.511 -5.586 -12.891 1.00 15.00 H new ATOM 305 N GLU A 19 58.490 -7.176 -11.789 1.00 15.00 N ATOM 306 CA GLU A 19 58.215 -8.301 -10.829 1.00 15.00 C ATOM 307 C GLU A 19 59.504 -8.735 -10.120 1.00 15.00 C ATOM 308 O GLU A 19 59.657 -9.881 -9.739 1.00 15.00 O ATOM 309 CB GLU A 19 57.635 -9.453 -11.662 1.00 15.00 C ATOM 310 CG GLU A 19 56.301 -9.021 -12.277 1.00 15.00 C ATOM 311 CD GLU A 19 55.592 -10.238 -12.877 1.00 15.00 C ATOM 312 OE1 GLU A 19 54.391 -10.347 -12.693 1.00 15.00 O ATOM 313 OE2 GLU A 19 56.259 -11.038 -13.512 1.00 15.00 O ATOM 0 H GLU A 19 57.944 -6.331 -11.619 1.00 15.00 H new ATOM 0 HA GLU A 19 57.516 -7.992 -10.051 1.00 15.00 H new ATOM 0 HB2 GLU A 19 58.335 -9.735 -12.448 1.00 15.00 H new ATOM 0 HB3 GLU A 19 57.490 -10.332 -11.034 1.00 15.00 H new ATOM 0 HG2 GLU A 19 55.671 -8.559 -11.516 1.00 15.00 H new ATOM 0 HG3 GLU A 19 56.471 -8.270 -13.049 1.00 15.00 H new ATOM 320 N ILE A 20 60.428 -7.821 -9.943 1.00 15.00 N ATOM 321 CA ILE A 20 61.643 -8.113 -9.124 1.00 15.00 C ATOM 322 C ILE A 20 61.501 -7.424 -7.762 1.00 15.00 C ATOM 323 O ILE A 20 60.947 -6.342 -7.666 1.00 15.00 O ATOM 324 CB ILE A 20 62.826 -7.528 -9.910 1.00 15.00 C ATOM 325 CG1 ILE A 20 62.918 -8.192 -11.289 1.00 15.00 C ATOM 326 CG2 ILE A 20 64.129 -7.784 -9.143 1.00 15.00 C ATOM 327 CD1 ILE A 20 63.889 -7.407 -12.174 1.00 15.00 C ATOM 0 H ILE A 20 60.391 -6.880 -10.334 1.00 15.00 H new ATOM 0 HA ILE A 20 61.784 -9.179 -8.946 1.00 15.00 H new ATOM 0 HB ILE A 20 62.673 -6.456 -10.033 1.00 15.00 H new ATOM 0 HG12 ILE A 20 63.257 -9.223 -11.185 1.00 15.00 H new ATOM 0 HG13 ILE A 20 61.933 -8.226 -11.754 1.00 15.00 H new ATOM 0 HG21 ILE A 20 64.968 -7.369 -9.702 1.00 15.00 H new ATOM 0 HG22 ILE A 20 64.074 -7.309 -8.164 1.00 15.00 H new ATOM 0 HG23 ILE A 20 64.273 -8.857 -9.018 1.00 15.00 H new ATOM 0 HD11 ILE A 20 63.953 -7.881 -13.154 1.00 15.00 H new ATOM 0 HD12 ILE A 20 63.531 -6.384 -12.288 1.00 15.00 H new ATOM 0 HD13 ILE A 20 64.876 -7.396 -11.711 1.00 15.00 H new ATOM 339 N ARG A 21 61.995 -8.040 -6.717 1.00 15.00 N ATOM 340 CA ARG A 21 61.847 -7.450 -5.353 1.00 15.00 C ATOM 341 C ARG A 21 63.179 -6.861 -4.877 1.00 15.00 C ATOM 342 O ARG A 21 64.170 -7.559 -4.760 1.00 15.00 O ATOM 343 CB ARG A 21 61.426 -8.619 -4.462 1.00 15.00 C ATOM 344 CG ARG A 21 61.014 -8.093 -3.085 1.00 15.00 C ATOM 345 CD ARG A 21 60.183 -9.156 -2.358 1.00 15.00 C ATOM 346 NE ARG A 21 61.128 -10.290 -2.097 1.00 15.00 N ATOM 347 CZ ARG A 21 60.868 -11.208 -1.185 1.00 15.00 C ATOM 348 NH1 ARG A 21 59.764 -11.180 -0.472 1.00 15.00 N ATOM 349 NH2 ARG A 21 61.725 -12.172 -0.989 1.00 15.00 N ATOM 0 H ARG A 21 62.495 -8.928 -6.751 1.00 15.00 H new ATOM 0 HA ARG A 21 61.121 -6.638 -5.332 1.00 15.00 H new ATOM 0 HB2 ARG A 21 60.596 -9.158 -4.920 1.00 15.00 H new ATOM 0 HB3 ARG A 21 62.249 -9.327 -4.361 1.00 15.00 H new ATOM 0 HG2 ARG A 21 61.899 -7.845 -2.499 1.00 15.00 H new ATOM 0 HG3 ARG A 21 60.436 -7.175 -3.193 1.00 15.00 H new ATOM 0 HD2 ARG A 21 59.772 -8.765 -1.427 1.00 15.00 H new ATOM 0 HD3 ARG A 21 59.339 -9.480 -2.968 1.00 15.00 H new ATOM 0 HE ARG A 21 61.991 -10.354 -2.636 1.00 15.00 H new ATOM 0 HH11 ARG A 21 59.082 -10.435 -0.617 1.00 15.00 H new ATOM 0 HH12 ARG A 21 59.589 -11.903 0.226 1.00 15.00 H new ATOM 0 HH21 ARG A 21 62.584 -12.210 -1.538 1.00 15.00 H new ATOM 0 HH22 ARG A 21 61.536 -12.888 -0.287 1.00 15.00 H new ATOM 363 N TYR A 22 63.202 -5.579 -4.606 1.00 15.00 N ATOM 364 CA TYR A 22 64.434 -4.932 -4.060 1.00 15.00 C ATOM 365 C TYR A 22 64.185 -4.493 -2.615 1.00 15.00 C ATOM 366 O TYR A 22 63.138 -3.963 -2.301 1.00 15.00 O ATOM 367 CB TYR A 22 64.667 -3.705 -4.942 1.00 15.00 C ATOM 368 CG TYR A 22 65.068 -4.026 -6.364 1.00 15.00 C ATOM 369 CD1 TYR A 22 66.435 -4.209 -6.689 1.00 15.00 C ATOM 370 CD2 TYR A 22 64.080 -4.131 -7.374 1.00 15.00 C ATOM 371 CE1 TYR A 22 66.811 -4.497 -8.024 1.00 15.00 C ATOM 372 CE2 TYR A 22 64.456 -4.419 -8.708 1.00 15.00 C ATOM 373 CZ TYR A 22 65.822 -4.601 -9.033 1.00 15.00 C ATOM 374 OH TYR A 22 66.190 -4.881 -10.334 1.00 15.00 O ATOM 0 H TYR A 22 62.412 -4.948 -4.741 1.00 15.00 H new ATOM 0 HA TYR A 22 65.291 -5.606 -4.062 1.00 15.00 H new ATOM 0 HB2 TYR A 22 63.756 -3.107 -4.960 1.00 15.00 H new ATOM 0 HB3 TYR A 22 65.443 -3.089 -4.489 1.00 15.00 H new ATOM 0 HD1 TYR A 22 67.189 -4.129 -5.920 1.00 15.00 H new ATOM 0 HD2 TYR A 22 63.038 -3.991 -7.126 1.00 15.00 H new ATOM 0 HE1 TYR A 22 67.853 -4.637 -8.273 1.00 15.00 H new ATOM 0 HE2 TYR A 22 63.702 -4.500 -9.477 1.00 15.00 H new ATOM 0 HH TYR A 22 65.390 -4.919 -10.899 1.00 15.00 H new ATOM 384 N GLU A 23 65.132 -4.708 -1.737 1.00 15.00 N ATOM 385 CA GLU A 23 64.987 -4.203 -0.336 1.00 15.00 C ATOM 386 C GLU A 23 66.145 -3.263 0.002 1.00 15.00 C ATOM 387 O GLU A 23 67.275 -3.506 -0.373 1.00 15.00 O ATOM 388 CB GLU A 23 65.036 -5.453 0.544 1.00 15.00 C ATOM 389 CG GLU A 23 64.674 -5.081 1.984 1.00 15.00 C ATOM 390 CD GLU A 23 64.837 -6.307 2.885 1.00 15.00 C ATOM 391 OE1 GLU A 23 64.203 -7.312 2.604 1.00 15.00 O ATOM 392 OE2 GLU A 23 65.591 -6.220 3.840 1.00 15.00 O ATOM 0 H GLU A 23 65.999 -5.211 -1.929 1.00 15.00 H new ATOM 0 HA GLU A 23 64.065 -3.641 -0.190 1.00 15.00 H new ATOM 0 HB2 GLU A 23 64.342 -6.204 0.166 1.00 15.00 H new ATOM 0 HB3 GLU A 23 66.032 -5.895 0.511 1.00 15.00 H new ATOM 0 HG2 GLU A 23 65.315 -4.272 2.334 1.00 15.00 H new ATOM 0 HG3 GLU A 23 63.648 -4.717 2.030 1.00 15.00 H new ATOM 399 N GLY A 24 65.866 -2.196 0.709 1.00 15.00 N ATOM 400 CA GLY A 24 66.941 -1.222 1.069 1.00 15.00 C ATOM 401 C GLY A 24 66.414 -0.268 2.139 1.00 15.00 C ATOM 402 O GLY A 24 65.286 -0.388 2.579 1.00 15.00 O ATOM 0 H GLY A 24 64.936 -1.957 1.053 1.00 15.00 H new ATOM 0 HA2 GLY A 24 67.820 -1.751 1.437 1.00 15.00 H new ATOM 0 HA3 GLY A 24 67.252 -0.663 0.187 1.00 15.00 H new ATOM 406 N ILE A 25 67.218 0.676 2.564 1.00 15.00 N ATOM 407 CA ILE A 25 66.763 1.625 3.629 1.00 15.00 C ATOM 408 C ILE A 25 66.502 3.004 3.015 1.00 15.00 C ATOM 409 O ILE A 25 67.216 3.446 2.134 1.00 15.00 O ATOM 410 CB ILE A 25 67.907 1.694 4.656 1.00 15.00 C ATOM 411 CG1 ILE A 25 68.315 0.277 5.119 1.00 15.00 C ATOM 412 CG2 ILE A 25 67.453 2.514 5.870 1.00 15.00 C ATOM 413 CD1 ILE A 25 67.115 -0.464 5.728 1.00 15.00 C ATOM 0 H ILE A 25 68.166 0.831 2.221 1.00 15.00 H new ATOM 0 HA ILE A 25 65.836 1.296 4.099 1.00 15.00 H new ATOM 0 HB ILE A 25 68.768 2.168 4.185 1.00 15.00 H new ATOM 0 HG12 ILE A 25 68.706 -0.288 4.273 1.00 15.00 H new ATOM 0 HG13 ILE A 25 69.117 0.346 5.854 1.00 15.00 H new ATOM 0 HG21 ILE A 25 68.262 2.564 6.599 1.00 15.00 H new ATOM 0 HG22 ILE A 25 67.190 3.522 5.550 1.00 15.00 H new ATOM 0 HG23 ILE A 25 66.584 2.039 6.325 1.00 15.00 H new ATOM 0 HD11 ILE A 25 67.425 -1.459 6.047 1.00 15.00 H new ATOM 0 HD12 ILE A 25 66.742 0.093 6.588 1.00 15.00 H new ATOM 0 HD13 ILE A 25 66.325 -0.552 4.982 1.00 15.00 H new ATOM 425 N LEU A 26 65.481 3.683 3.481 1.00 15.00 N ATOM 426 CA LEU A 26 65.135 5.026 2.911 1.00 15.00 C ATOM 427 C LEU A 26 66.253 6.029 3.200 1.00 15.00 C ATOM 428 O LEU A 26 66.483 6.393 4.338 1.00 15.00 O ATOM 429 CB LEU A 26 63.844 5.445 3.623 1.00 15.00 C ATOM 430 CG LEU A 26 63.239 6.664 2.924 1.00 15.00 C ATOM 431 CD1 LEU A 26 62.679 6.249 1.563 1.00 15.00 C ATOM 432 CD2 LEU A 26 62.110 7.233 3.788 1.00 15.00 C ATOM 0 H LEU A 26 64.870 3.365 4.233 1.00 15.00 H new ATOM 0 HA LEU A 26 65.010 4.991 1.829 1.00 15.00 H new ATOM 0 HB2 LEU A 26 63.131 4.620 3.618 1.00 15.00 H new ATOM 0 HB3 LEU A 26 64.053 5.679 4.667 1.00 15.00 H new ATOM 0 HG LEU A 26 64.009 7.422 2.781 1.00 15.00 H new ATOM 0 HD11 LEU A 26 62.248 7.118 1.066 1.00 15.00 H new ATOM 0 HD12 LEU A 26 63.481 5.841 0.949 1.00 15.00 H new ATOM 0 HD13 LEU A 26 61.907 5.492 1.703 1.00 15.00 H new ATOM 0 HD21 LEU A 26 61.676 8.102 3.293 1.00 15.00 H new ATOM 0 HD22 LEU A 26 61.341 6.473 3.928 1.00 15.00 H new ATOM 0 HD23 LEU A 26 62.508 7.529 4.758 1.00 15.00 H new ATOM 444 N TYR A 27 66.943 6.473 2.178 1.00 15.00 N ATOM 445 CA TYR A 27 68.080 7.421 2.388 1.00 15.00 C ATOM 446 C TYR A 27 67.613 8.865 2.188 1.00 15.00 C ATOM 447 O TYR A 27 67.828 9.714 3.035 1.00 15.00 O ATOM 448 CB TYR A 27 69.115 7.040 1.329 1.00 15.00 C ATOM 449 CG TYR A 27 70.399 7.826 1.435 1.00 15.00 C ATOM 450 CD1 TYR A 27 71.195 7.727 2.602 1.00 15.00 C ATOM 451 CD2 TYR A 27 70.808 8.663 0.368 1.00 15.00 C ATOM 452 CE1 TYR A 27 72.399 8.466 2.703 1.00 15.00 C ATOM 453 CE2 TYR A 27 72.012 9.402 0.470 1.00 15.00 C ATOM 454 CZ TYR A 27 72.808 9.303 1.638 1.00 15.00 C ATOM 455 OH TYR A 27 73.981 10.023 1.737 1.00 15.00 O ATOM 0 H TYR A 27 66.767 6.219 1.206 1.00 15.00 H new ATOM 0 HA TYR A 27 68.487 7.358 3.397 1.00 15.00 H new ATOM 0 HB2 TYR A 27 69.340 5.977 1.418 1.00 15.00 H new ATOM 0 HB3 TYR A 27 68.685 7.193 0.339 1.00 15.00 H new ATOM 0 HD1 TYR A 27 70.884 7.088 3.415 1.00 15.00 H new ATOM 0 HD2 TYR A 27 70.202 8.738 -0.523 1.00 15.00 H new ATOM 0 HE1 TYR A 27 73.005 8.391 3.594 1.00 15.00 H new ATOM 0 HE2 TYR A 27 72.323 10.041 -0.343 1.00 15.00 H new ATOM 0 HH TYR A 27 74.114 10.545 0.919 1.00 15.00 H new ATOM 465 N THR A 28 66.978 9.148 1.076 1.00 15.00 N ATOM 466 CA THR A 28 66.510 10.545 0.809 1.00 15.00 C ATOM 467 C THR A 28 65.168 10.529 0.072 1.00 15.00 C ATOM 468 O THR A 28 64.924 9.685 -0.770 1.00 15.00 O ATOM 469 CB THR A 28 67.597 11.173 -0.067 1.00 15.00 C ATOM 470 OG1 THR A 28 67.936 10.277 -1.116 1.00 15.00 O ATOM 471 CG2 THR A 28 68.836 11.462 0.781 1.00 15.00 C ATOM 0 H THR A 28 66.764 8.473 0.342 1.00 15.00 H new ATOM 0 HA THR A 28 66.356 11.106 1.731 1.00 15.00 H new ATOM 0 HB THR A 28 67.226 12.106 -0.492 1.00 15.00 H new ATOM 0 HG1 THR A 28 68.508 10.736 -1.766 1.00 15.00 H new ATOM 0 HG21 THR A 28 69.609 11.909 0.156 1.00 15.00 H new ATOM 0 HG22 THR A 28 68.575 12.152 1.584 1.00 15.00 H new ATOM 0 HG23 THR A 28 69.209 10.532 1.209 1.00 15.00 H new ATOM 479 N ILE A 29 64.301 11.462 0.385 1.00 15.00 N ATOM 480 CA ILE A 29 62.956 11.502 -0.269 1.00 15.00 C ATOM 481 C ILE A 29 62.809 12.800 -1.075 1.00 15.00 C ATOM 482 O ILE A 29 62.999 13.884 -0.553 1.00 15.00 O ATOM 483 CB ILE A 29 61.938 11.468 0.887 1.00 15.00 C ATOM 484 CG1 ILE A 29 62.142 10.207 1.738 1.00 15.00 C ATOM 485 CG2 ILE A 29 60.514 11.457 0.322 1.00 15.00 C ATOM 486 CD1 ILE A 29 61.360 10.340 3.048 1.00 15.00 C ATOM 0 H ILE A 29 64.469 12.200 1.068 1.00 15.00 H new ATOM 0 HA ILE A 29 62.807 10.672 -0.959 1.00 15.00 H new ATOM 0 HB ILE A 29 62.087 12.353 1.506 1.00 15.00 H new ATOM 0 HG12 ILE A 29 61.805 9.327 1.189 1.00 15.00 H new ATOM 0 HG13 ILE A 29 63.202 10.065 1.948 1.00 15.00 H new ATOM 0 HG21 ILE A 29 59.797 11.433 1.143 1.00 15.00 H new ATOM 0 HG22 ILE A 29 60.352 12.355 -0.275 1.00 15.00 H new ATOM 0 HG23 ILE A 29 60.378 10.575 -0.305 1.00 15.00 H new ATOM 0 HD11 ILE A 29 61.506 9.444 3.651 1.00 15.00 H new ATOM 0 HD12 ILE A 29 61.718 11.210 3.598 1.00 15.00 H new ATOM 0 HD13 ILE A 29 60.299 10.461 2.828 1.00 15.00 H new ATOM 498 N ASP A 30 62.476 12.695 -2.339 1.00 15.00 N ATOM 499 CA ASP A 30 62.254 13.917 -3.169 1.00 15.00 C ATOM 500 C ASP A 30 60.773 14.026 -3.546 1.00 15.00 C ATOM 501 O ASP A 30 60.325 13.421 -4.502 1.00 15.00 O ATOM 502 CB ASP A 30 63.114 13.712 -4.416 1.00 15.00 C ATOM 503 CG ASP A 30 63.201 15.025 -5.198 1.00 15.00 C ATOM 504 OD1 ASP A 30 62.335 15.255 -6.026 1.00 15.00 O ATOM 505 OD2 ASP A 30 64.130 15.776 -4.954 1.00 15.00 O ATOM 0 H ASP A 30 62.348 11.811 -2.832 1.00 15.00 H new ATOM 0 HA ASP A 30 62.520 14.834 -2.642 1.00 15.00 H new ATOM 0 HB2 ASP A 30 64.112 13.379 -4.132 1.00 15.00 H new ATOM 0 HB3 ASP A 30 62.684 12.931 -5.043 1.00 15.00 H new ATOM 510 N THR A 31 60.017 14.791 -2.796 1.00 15.00 N ATOM 511 CA THR A 31 58.545 14.889 -3.057 1.00 15.00 C ATOM 512 C THR A 31 58.284 15.653 -4.359 1.00 15.00 C ATOM 513 O THR A 31 57.380 15.328 -5.105 1.00 15.00 O ATOM 514 CB THR A 31 57.970 15.654 -1.863 1.00 15.00 C ATOM 515 OG1 THR A 31 58.434 15.064 -0.656 1.00 15.00 O ATOM 516 CG2 THR A 31 56.442 15.598 -1.905 1.00 15.00 C ATOM 0 H THR A 31 60.355 15.352 -2.014 1.00 15.00 H new ATOM 0 HA THR A 31 58.086 13.907 -3.167 1.00 15.00 H new ATOM 0 HB THR A 31 58.294 16.694 -1.908 1.00 15.00 H new ATOM 0 HG1 THR A 31 58.068 15.554 0.110 1.00 15.00 H new ATOM 0 HG21 THR A 31 56.034 16.143 -1.054 1.00 15.00 H new ATOM 0 HG22 THR A 31 56.087 16.051 -2.830 1.00 15.00 H new ATOM 0 HG23 THR A 31 56.115 14.559 -1.861 1.00 15.00 H new ATOM 524 N GLU A 32 59.075 16.660 -4.638 1.00 15.00 N ATOM 525 CA GLU A 32 58.776 17.572 -5.795 1.00 15.00 C ATOM 526 C GLU A 32 58.719 16.789 -7.115 1.00 15.00 C ATOM 527 O GLU A 32 58.016 17.168 -8.034 1.00 15.00 O ATOM 528 CB GLU A 32 59.928 18.580 -5.826 1.00 15.00 C ATOM 529 CG GLU A 32 59.589 19.715 -6.795 1.00 15.00 C ATOM 530 CD GLU A 32 58.502 20.606 -6.190 1.00 15.00 C ATOM 531 OE1 GLU A 32 57.608 20.997 -6.923 1.00 15.00 O ATOM 532 OE2 GLU A 32 58.581 20.884 -5.004 1.00 15.00 O ATOM 0 H GLU A 32 59.919 16.893 -4.114 1.00 15.00 H new ATOM 0 HA GLU A 32 57.807 18.058 -5.678 1.00 15.00 H new ATOM 0 HB2 GLU A 32 60.102 18.980 -4.827 1.00 15.00 H new ATOM 0 HB3 GLU A 32 60.849 18.086 -6.136 1.00 15.00 H new ATOM 0 HG2 GLU A 32 60.481 20.305 -7.004 1.00 15.00 H new ATOM 0 HG3 GLU A 32 59.248 19.304 -7.745 1.00 15.00 H new ATOM 539 N ASN A 33 59.449 15.704 -7.212 1.00 15.00 N ATOM 540 CA ASN A 33 59.489 14.932 -8.496 1.00 15.00 C ATOM 541 C ASN A 33 58.903 13.520 -8.323 1.00 15.00 C ATOM 542 O ASN A 33 59.077 12.672 -9.178 1.00 15.00 O ATOM 543 CB ASN A 33 60.973 14.849 -8.858 1.00 15.00 C ATOM 544 CG ASN A 33 61.505 16.244 -9.202 1.00 15.00 C ATOM 545 OD1 ASN A 33 60.775 17.085 -9.691 1.00 15.00 O ATOM 546 ND2 ASN A 33 62.756 16.527 -8.966 1.00 15.00 N ATOM 0 H ASN A 33 60.019 15.319 -6.459 1.00 15.00 H new ATOM 0 HA ASN A 33 58.894 15.415 -9.271 1.00 15.00 H new ATOM 0 HB2 ASN A 33 61.537 14.431 -8.024 1.00 15.00 H new ATOM 0 HB3 ASN A 33 61.112 14.178 -9.706 1.00 15.00 H new ATOM 0 HD21 ASN A 33 63.121 17.452 -9.191 1.00 15.00 H new ATOM 0 HD22 ASN A 33 63.370 15.823 -8.556 1.00 15.00 H new ATOM 553 N SER A 34 58.208 13.259 -7.231 1.00 15.00 N ATOM 554 CA SER A 34 57.666 11.879 -6.963 1.00 15.00 C ATOM 555 C SER A 34 58.760 10.808 -7.129 1.00 15.00 C ATOM 556 O SER A 34 58.557 9.791 -7.772 1.00 15.00 O ATOM 557 CB SER A 34 56.547 11.678 -7.992 1.00 15.00 C ATOM 558 OG SER A 34 55.724 10.594 -7.586 1.00 15.00 O ATOM 0 H SER A 34 57.992 13.948 -6.510 1.00 15.00 H new ATOM 0 HA SER A 34 57.302 11.783 -5.940 1.00 15.00 H new ATOM 0 HB2 SER A 34 55.952 12.587 -8.082 1.00 15.00 H new ATOM 0 HB3 SER A 34 56.973 11.478 -8.975 1.00 15.00 H new ATOM 0 HG SER A 34 56.277 9.796 -7.452 1.00 15.00 H new ATOM 564 N THR A 35 59.917 11.033 -6.550 1.00 15.00 N ATOM 565 CA THR A 35 61.041 10.056 -6.698 1.00 15.00 C ATOM 566 C THR A 35 61.657 9.737 -5.332 1.00 15.00 C ATOM 567 O THR A 35 61.669 10.562 -4.438 1.00 15.00 O ATOM 568 CB THR A 35 62.066 10.755 -7.597 1.00 15.00 C ATOM 569 OG1 THR A 35 62.281 12.078 -7.127 1.00 15.00 O ATOM 570 CG2 THR A 35 61.552 10.802 -9.040 1.00 15.00 C ATOM 0 H THR A 35 60.130 11.852 -5.981 1.00 15.00 H new ATOM 0 HA THR A 35 60.705 9.110 -7.122 1.00 15.00 H new ATOM 0 HB THR A 35 63.003 10.199 -7.571 1.00 15.00 H new ATOM 0 HG1 THR A 35 62.938 12.526 -7.700 1.00 15.00 H new ATOM 0 HG21 THR A 35 62.287 11.301 -9.672 1.00 15.00 H new ATOM 0 HG22 THR A 35 61.391 9.787 -9.402 1.00 15.00 H new ATOM 0 HG23 THR A 35 60.612 11.352 -9.074 1.00 15.00 H new ATOM 578 N VAL A 36 62.173 8.542 -5.172 1.00 15.00 N ATOM 579 CA VAL A 36 62.796 8.151 -3.869 1.00 15.00 C ATOM 580 C VAL A 36 64.160 7.497 -4.125 1.00 15.00 C ATOM 581 O VAL A 36 64.322 6.733 -5.060 1.00 15.00 O ATOM 582 CB VAL A 36 61.816 7.147 -3.238 1.00 15.00 C ATOM 583 CG1 VAL A 36 62.351 6.679 -1.881 1.00 15.00 C ATOM 584 CG2 VAL A 36 60.452 7.816 -3.030 1.00 15.00 C ATOM 0 H VAL A 36 62.189 7.818 -5.891 1.00 15.00 H new ATOM 0 HA VAL A 36 62.968 9.005 -3.214 1.00 15.00 H new ATOM 0 HB VAL A 36 61.710 6.292 -3.905 1.00 15.00 H new ATOM 0 HG11 VAL A 36 61.652 5.968 -1.440 1.00 15.00 H new ATOM 0 HG12 VAL A 36 63.320 6.198 -2.018 1.00 15.00 H new ATOM 0 HG13 VAL A 36 62.463 7.537 -1.218 1.00 15.00 H new ATOM 0 HG21 VAL A 36 59.761 7.102 -2.583 1.00 15.00 H new ATOM 0 HG22 VAL A 36 60.565 8.675 -2.368 1.00 15.00 H new ATOM 0 HG23 VAL A 36 60.059 8.148 -3.991 1.00 15.00 H new ATOM 594 N ALA A 37 65.136 7.794 -3.301 1.00 15.00 N ATOM 595 CA ALA A 37 66.483 7.164 -3.462 1.00 15.00 C ATOM 596 C ALA A 37 66.772 6.239 -2.276 1.00 15.00 C ATOM 597 O ALA A 37 66.645 6.636 -1.130 1.00 15.00 O ATOM 598 CB ALA A 37 67.477 8.329 -3.494 1.00 15.00 C ATOM 0 H ALA A 37 65.057 8.448 -2.522 1.00 15.00 H new ATOM 0 HA ALA A 37 66.549 6.558 -4.365 1.00 15.00 H new ATOM 0 HB1 ALA A 37 68.489 7.941 -3.610 1.00 15.00 H new ATOM 0 HB2 ALA A 37 67.242 8.985 -4.332 1.00 15.00 H new ATOM 0 HB3 ALA A 37 67.409 8.891 -2.563 1.00 15.00 H new ATOM 604 N LEU A 38 67.163 5.018 -2.549 1.00 15.00 N ATOM 605 CA LEU A 38 67.434 4.041 -1.449 1.00 15.00 C ATOM 606 C LEU A 38 68.908 3.633 -1.469 1.00 15.00 C ATOM 607 O LEU A 38 69.483 3.419 -2.521 1.00 15.00 O ATOM 608 CB LEU A 38 66.548 2.825 -1.750 1.00 15.00 C ATOM 609 CG LEU A 38 65.067 3.219 -1.728 1.00 15.00 C ATOM 610 CD1 LEU A 38 64.219 2.020 -2.159 1.00 15.00 C ATOM 611 CD2 LEU A 38 64.661 3.640 -0.312 1.00 15.00 C ATOM 0 H LEU A 38 67.307 4.655 -3.491 1.00 15.00 H new ATOM 0 HA LEU A 38 67.221 4.463 -0.467 1.00 15.00 H new ATOM 0 HB2 LEU A 38 66.806 2.413 -2.726 1.00 15.00 H new ATOM 0 HB3 LEU A 38 66.733 2.042 -1.014 1.00 15.00 H new ATOM 0 HG LEU A 38 64.907 4.052 -2.412 1.00 15.00 H new ATOM 0 HD11 LEU A 38 63.165 2.296 -2.145 1.00 15.00 H new ATOM 0 HD12 LEU A 38 64.501 1.718 -3.168 1.00 15.00 H new ATOM 0 HD13 LEU A 38 64.386 1.190 -1.472 1.00 15.00 H new ATOM 0 HD21 LEU A 38 63.607 3.919 -0.303 1.00 15.00 H new ATOM 0 HD22 LEU A 38 64.822 2.809 0.375 1.00 15.00 H new ATOM 0 HD23 LEU A 38 65.264 4.492 0.001 1.00 15.00 H new ATOM 623 N ALA A 39 69.520 3.527 -0.315 1.00 15.00 N ATOM 624 CA ALA A 39 70.954 3.115 -0.254 1.00 15.00 C ATOM 625 C ALA A 39 71.081 1.781 0.485 1.00 15.00 C ATOM 626 O ALA A 39 70.157 1.342 1.148 1.00 15.00 O ATOM 627 CB ALA A 39 71.655 4.230 0.523 1.00 15.00 C ATOM 0 H ALA A 39 69.085 3.709 0.590 1.00 15.00 H new ATOM 0 HA ALA A 39 71.390 2.976 -1.243 1.00 15.00 H new ATOM 0 HB1 ALA A 39 72.717 4.000 0.611 1.00 15.00 H new ATOM 0 HB2 ALA A 39 71.531 5.175 -0.005 1.00 15.00 H new ATOM 0 HB3 ALA A 39 71.218 4.310 1.518 1.00 15.00 H new ATOM 633 N LYS A 40 72.222 1.131 0.374 1.00 15.00 N ATOM 634 CA LYS A 40 72.414 -0.221 1.008 1.00 15.00 C ATOM 635 C LYS A 40 71.275 -1.169 0.601 1.00 15.00 C ATOM 636 O LYS A 40 70.530 -1.660 1.432 1.00 15.00 O ATOM 637 CB LYS A 40 72.408 0.032 2.522 1.00 15.00 C ATOM 638 CG LYS A 40 72.822 -1.246 3.255 1.00 15.00 C ATOM 639 CD LYS A 40 74.331 -1.452 3.115 1.00 15.00 C ATOM 640 CE LYS A 40 74.749 -2.709 3.880 1.00 15.00 C ATOM 641 NZ LYS A 40 76.211 -2.548 4.114 1.00 15.00 N ATOM 0 H LYS A 40 73.035 1.482 -0.133 1.00 15.00 H new ATOM 0 HA LYS A 40 73.342 -0.695 0.689 1.00 15.00 H new ATOM 0 HB2 LYS A 40 73.093 0.843 2.769 1.00 15.00 H new ATOM 0 HB3 LYS A 40 71.415 0.344 2.845 1.00 15.00 H new ATOM 0 HG2 LYS A 40 72.550 -1.177 4.308 1.00 15.00 H new ATOM 0 HG3 LYS A 40 72.288 -2.103 2.843 1.00 15.00 H new ATOM 0 HD2 LYS A 40 74.599 -1.548 2.063 1.00 15.00 H new ATOM 0 HD3 LYS A 40 74.864 -0.584 3.502 1.00 15.00 H new ATOM 0 HE2 LYS A 40 74.206 -2.798 4.821 1.00 15.00 H new ATOM 0 HE3 LYS A 40 74.538 -3.610 3.304 1.00 15.00 H new ATOM 0 HZ1 LYS A 40 76.572 -3.373 4.635 1.00 15.00 H new ATOM 0 HZ2 LYS A 40 76.703 -2.473 3.201 1.00 15.00 H new ATOM 0 HZ3 LYS A 40 76.381 -1.686 4.670 1.00 15.00 H new ATOM 655 N VAL A 41 71.142 -1.427 -0.678 1.00 15.00 N ATOM 656 CA VAL A 41 69.978 -2.224 -1.174 1.00 15.00 C ATOM 657 C VAL A 41 70.461 -3.499 -1.883 1.00 15.00 C ATOM 658 O VAL A 41 71.489 -3.508 -2.534 1.00 15.00 O ATOM 659 CB VAL A 41 69.229 -1.283 -2.139 1.00 15.00 C ATOM 660 CG1 VAL A 41 70.100 -0.950 -3.358 1.00 15.00 C ATOM 661 CG2 VAL A 41 67.934 -1.955 -2.610 1.00 15.00 C ATOM 0 H VAL A 41 71.792 -1.119 -1.401 1.00 15.00 H new ATOM 0 HA VAL A 41 69.328 -2.560 -0.366 1.00 15.00 H new ATOM 0 HB VAL A 41 68.997 -0.358 -1.610 1.00 15.00 H new ATOM 0 HG11 VAL A 41 69.552 -0.285 -4.026 1.00 15.00 H new ATOM 0 HG12 VAL A 41 71.016 -0.459 -3.028 1.00 15.00 H new ATOM 0 HG13 VAL A 41 70.352 -1.869 -3.887 1.00 15.00 H new ATOM 0 HG21 VAL A 41 67.406 -1.289 -3.292 1.00 15.00 H new ATOM 0 HG22 VAL A 41 68.173 -2.886 -3.125 1.00 15.00 H new ATOM 0 HG23 VAL A 41 67.301 -2.169 -1.749 1.00 15.00 H new ATOM 671 N ARG A 42 69.716 -4.568 -1.753 1.00 15.00 N ATOM 672 CA ARG A 42 70.088 -5.849 -2.426 1.00 15.00 C ATOM 673 C ARG A 42 68.903 -6.368 -3.245 1.00 15.00 C ATOM 674 O ARG A 42 67.758 -6.117 -2.913 1.00 15.00 O ATOM 675 CB ARG A 42 70.411 -6.818 -1.286 1.00 15.00 C ATOM 676 CG ARG A 42 71.674 -6.357 -0.555 1.00 15.00 C ATOM 677 CD ARG A 42 71.768 -7.066 0.799 1.00 15.00 C ATOM 678 NE ARG A 42 73.231 -7.138 1.102 1.00 15.00 N ATOM 679 CZ ARG A 42 74.017 -8.019 0.513 1.00 15.00 C ATOM 680 NH1 ARG A 42 73.560 -8.859 -0.388 1.00 15.00 N ATOM 681 NH2 ARG A 42 75.282 -8.055 0.830 1.00 15.00 N ATOM 0 H ARG A 42 68.857 -4.608 -1.204 1.00 15.00 H new ATOM 0 HA ARG A 42 70.929 -5.730 -3.110 1.00 15.00 H new ATOM 0 HB2 ARG A 42 69.574 -6.866 -0.589 1.00 15.00 H new ATOM 0 HB3 ARG A 42 70.555 -7.824 -1.681 1.00 15.00 H new ATOM 0 HG2 ARG A 42 72.556 -6.579 -1.156 1.00 15.00 H new ATOM 0 HG3 ARG A 42 71.650 -5.277 -0.411 1.00 15.00 H new ATOM 0 HD2 ARG A 42 71.233 -6.513 1.571 1.00 15.00 H new ATOM 0 HD3 ARG A 42 71.325 -8.061 0.754 1.00 15.00 H new ATOM 0 HE ARG A 42 73.631 -6.490 1.781 1.00 15.00 H new ATOM 0 HH11 ARG A 42 72.574 -8.841 -0.649 1.00 15.00 H new ATOM 0 HH12 ARG A 42 74.191 -9.529 -0.827 1.00 15.00 H new ATOM 0 HH21 ARG A 42 75.652 -7.407 1.525 1.00 15.00 H new ATOM 0 HH22 ARG A 42 75.901 -8.731 0.382 1.00 15.00 H new ATOM 695 N SER A 43 69.171 -7.086 -4.307 1.00 15.00 N ATOM 696 CA SER A 43 68.063 -7.663 -5.130 1.00 15.00 C ATOM 697 C SER A 43 67.902 -9.154 -4.817 1.00 15.00 C ATOM 698 O SER A 43 68.861 -9.902 -4.830 1.00 15.00 O ATOM 699 CB SER A 43 68.500 -7.455 -6.581 1.00 15.00 C ATOM 700 OG SER A 43 69.592 -8.318 -6.875 1.00 15.00 O ATOM 0 H SER A 43 70.111 -7.298 -4.640 1.00 15.00 H new ATOM 0 HA SER A 43 67.101 -7.192 -4.927 1.00 15.00 H new ATOM 0 HB2 SER A 43 67.669 -7.660 -7.255 1.00 15.00 H new ATOM 0 HB3 SER A 43 68.790 -6.416 -6.739 1.00 15.00 H new ATOM 0 HG SER A 43 69.777 -8.887 -6.099 1.00 15.00 H new ATOM 706 N PHE A 44 66.695 -9.585 -4.535 1.00 15.00 N ATOM 707 CA PHE A 44 66.479 -11.017 -4.148 1.00 15.00 C ATOM 708 C PHE A 44 66.656 -11.931 -5.363 1.00 15.00 C ATOM 709 O PHE A 44 67.226 -13.002 -5.262 1.00 15.00 O ATOM 710 CB PHE A 44 65.039 -11.087 -3.633 1.00 15.00 C ATOM 711 CG PHE A 44 64.884 -10.602 -2.211 1.00 15.00 C ATOM 712 CD1 PHE A 44 65.394 -11.374 -1.140 1.00 15.00 C ATOM 713 CD2 PHE A 44 64.226 -9.375 -1.949 1.00 15.00 C ATOM 714 CE1 PHE A 44 65.248 -10.920 0.194 1.00 15.00 C ATOM 715 CE2 PHE A 44 64.080 -8.921 -0.616 1.00 15.00 C ATOM 716 CZ PHE A 44 64.590 -9.693 0.455 1.00 15.00 C ATOM 0 H PHE A 44 65.853 -9.010 -4.556 1.00 15.00 H new ATOM 0 HA PHE A 44 67.195 -11.346 -3.395 1.00 15.00 H new ATOM 0 HB2 PHE A 44 64.399 -10.491 -4.284 1.00 15.00 H new ATOM 0 HB3 PHE A 44 64.688 -12.117 -3.698 1.00 15.00 H new ATOM 0 HD1 PHE A 44 65.895 -12.310 -1.340 1.00 15.00 H new ATOM 0 HD2 PHE A 44 63.836 -8.786 -2.766 1.00 15.00 H new ATOM 0 HE1 PHE A 44 65.638 -11.509 1.011 1.00 15.00 H new ATOM 0 HE2 PHE A 44 63.579 -7.985 -0.416 1.00 15.00 H new ATOM 0 HZ PHE A 44 64.477 -9.346 1.472 1.00 15.00 H new ATOM 984 N PHE A 62 74.360 -2.962 -3.719 1.00 15.00 N ATOM 985 CA PHE A 62 74.345 -1.679 -4.486 1.00 15.00 C ATOM 986 C PHE A 62 74.329 -0.493 -3.517 1.00 15.00 C ATOM 987 O PHE A 62 73.475 -0.402 -2.655 1.00 15.00 O ATOM 988 CB PHE A 62 73.057 -1.719 -5.306 1.00 15.00 C ATOM 989 CG PHE A 62 73.007 -2.859 -6.298 1.00 15.00 C ATOM 990 CD1 PHE A 62 73.959 -2.930 -7.343 1.00 15.00 C ATOM 991 CD2 PHE A 62 72.008 -3.855 -6.180 1.00 15.00 C ATOM 992 CE1 PHE A 62 73.912 -3.997 -8.273 1.00 15.00 C ATOM 993 CE2 PHE A 62 71.961 -4.922 -7.110 1.00 15.00 C ATOM 994 CZ PHE A 62 72.913 -4.994 -8.156 1.00 15.00 C ATOM 0 HA PHE A 62 75.224 -1.564 -5.120 1.00 15.00 H new ATOM 0 HB2 PHE A 62 72.207 -1.800 -4.628 1.00 15.00 H new ATOM 0 HB3 PHE A 62 72.948 -0.776 -5.842 1.00 15.00 H new ATOM 0 HD1 PHE A 62 74.721 -2.170 -7.431 1.00 15.00 H new ATOM 0 HD2 PHE A 62 71.283 -3.801 -5.382 1.00 15.00 H new ATOM 0 HE1 PHE A 62 74.638 -4.050 -9.071 1.00 15.00 H new ATOM 0 HE2 PHE A 62 71.198 -5.682 -7.021 1.00 15.00 H new ATOM 0 HZ PHE A 62 72.877 -5.809 -8.864 1.00 15.00 H new ATOM 1004 N GLU A 63 75.270 0.409 -3.657 1.00 15.00 N ATOM 1005 CA GLU A 63 75.376 1.551 -2.692 1.00 15.00 C ATOM 1006 C GLU A 63 74.176 2.500 -2.829 1.00 15.00 C ATOM 1007 O GLU A 63 73.641 2.975 -1.843 1.00 15.00 O ATOM 1008 CB GLU A 63 76.693 2.269 -3.038 1.00 15.00 C ATOM 1009 CG GLU A 63 76.637 2.857 -4.456 1.00 15.00 C ATOM 1010 CD GLU A 63 78.023 3.372 -4.849 1.00 15.00 C ATOM 1011 OE1 GLU A 63 78.637 2.763 -5.710 1.00 15.00 O ATOM 1012 OE2 GLU A 63 78.447 4.366 -4.283 1.00 15.00 O ATOM 0 H GLU A 63 75.971 0.405 -4.398 1.00 15.00 H new ATOM 0 HA GLU A 63 75.372 1.203 -1.659 1.00 15.00 H new ATOM 0 HB2 GLU A 63 76.879 3.065 -2.317 1.00 15.00 H new ATOM 0 HB3 GLU A 63 77.525 1.569 -2.962 1.00 15.00 H new ATOM 0 HG2 GLU A 63 76.305 2.097 -5.164 1.00 15.00 H new ATOM 0 HG3 GLU A 63 75.911 3.669 -4.496 1.00 15.00 H new ATOM 1019 N TYR A 64 73.752 2.777 -4.039 1.00 15.00 N ATOM 1020 CA TYR A 64 72.663 3.782 -4.243 1.00 15.00 C ATOM 1021 C TYR A 64 71.916 3.512 -5.554 1.00 15.00 C ATOM 1022 O TYR A 64 72.504 3.491 -6.619 1.00 15.00 O ATOM 1023 CB TYR A 64 73.388 5.127 -4.310 1.00 15.00 C ATOM 1024 CG TYR A 64 72.474 6.322 -4.154 1.00 15.00 C ATOM 1025 CD1 TYR A 64 71.501 6.607 -5.143 1.00 15.00 C ATOM 1026 CD2 TYR A 64 72.597 7.162 -3.020 1.00 15.00 C ATOM 1027 CE1 TYR A 64 70.653 7.732 -4.998 1.00 15.00 C ATOM 1028 CE2 TYR A 64 71.747 8.284 -2.875 1.00 15.00 C ATOM 1029 CZ TYR A 64 70.776 8.570 -3.864 1.00 15.00 C ATOM 1030 OH TYR A 64 69.948 9.665 -3.724 1.00 15.00 O ATOM 0 H TYR A 64 74.113 2.351 -4.893 1.00 15.00 H new ATOM 0 HA TYR A 64 71.918 3.749 -3.448 1.00 15.00 H new ATOM 0 HB2 TYR A 64 74.148 5.159 -3.530 1.00 15.00 H new ATOM 0 HB3 TYR A 64 73.908 5.202 -5.265 1.00 15.00 H new ATOM 0 HD1 TYR A 64 71.406 5.967 -6.007 1.00 15.00 H new ATOM 0 HD2 TYR A 64 73.340 6.946 -2.266 1.00 15.00 H new ATOM 0 HE1 TYR A 64 69.912 7.951 -5.753 1.00 15.00 H new ATOM 0 HE2 TYR A 64 71.839 8.923 -2.009 1.00 15.00 H new ATOM 0 HH TYR A 64 70.163 10.133 -2.890 1.00 15.00 H new ATOM 1040 N ILE A 65 70.623 3.303 -5.477 1.00 15.00 N ATOM 1041 CA ILE A 65 69.796 3.185 -6.721 1.00 15.00 C ATOM 1042 C ILE A 65 68.578 4.115 -6.625 1.00 15.00 C ATOM 1043 O ILE A 65 68.055 4.354 -5.552 1.00 15.00 O ATOM 1044 CB ILE A 65 69.361 1.711 -6.797 1.00 15.00 C ATOM 1045 CG1 ILE A 65 70.605 0.815 -6.908 1.00 15.00 C ATOM 1046 CG2 ILE A 65 68.471 1.495 -8.031 1.00 15.00 C ATOM 1047 CD1 ILE A 65 70.196 -0.660 -6.836 1.00 15.00 C ATOM 0 H ILE A 65 70.103 3.209 -4.604 1.00 15.00 H new ATOM 0 HA ILE A 65 70.351 3.474 -7.614 1.00 15.00 H new ATOM 0 HB ILE A 65 68.802 1.455 -5.897 1.00 15.00 H new ATOM 0 HG12 ILE A 65 71.123 1.012 -7.847 1.00 15.00 H new ATOM 0 HG13 ILE A 65 71.303 1.047 -6.104 1.00 15.00 H new ATOM 0 HG21 ILE A 65 68.165 0.450 -8.081 1.00 15.00 H new ATOM 0 HG22 ILE A 65 67.587 2.128 -7.957 1.00 15.00 H new ATOM 0 HG23 ILE A 65 69.028 1.753 -8.931 1.00 15.00 H new ATOM 0 HD11 ILE A 65 71.083 -1.288 -6.915 1.00 15.00 H new ATOM 0 HD12 ILE A 65 69.698 -0.854 -5.886 1.00 15.00 H new ATOM 0 HD13 ILE A 65 69.515 -0.889 -7.656 1.00 15.00 H new ATOM 1059 N ILE A 66 68.131 4.638 -7.742 1.00 15.00 N ATOM 1060 CA ILE A 66 66.966 5.579 -7.731 1.00 15.00 C ATOM 1061 C ILE A 66 65.745 4.907 -8.374 1.00 15.00 C ATOM 1062 O ILE A 66 65.853 4.252 -9.394 1.00 15.00 O ATOM 1063 CB ILE A 66 67.418 6.794 -8.562 1.00 15.00 C ATOM 1064 CG1 ILE A 66 68.643 7.444 -7.909 1.00 15.00 C ATOM 1065 CG2 ILE A 66 66.288 7.829 -8.633 1.00 15.00 C ATOM 1066 CD1 ILE A 66 69.290 8.418 -8.895 1.00 15.00 C ATOM 0 H ILE A 66 68.525 4.453 -8.665 1.00 15.00 H new ATOM 0 HA ILE A 66 66.677 5.869 -6.721 1.00 15.00 H new ATOM 0 HB ILE A 66 67.670 6.455 -9.567 1.00 15.00 H new ATOM 0 HG12 ILE A 66 68.348 7.971 -7.002 1.00 15.00 H new ATOM 0 HG13 ILE A 66 69.360 6.678 -7.614 1.00 15.00 H new ATOM 0 HG21 ILE A 66 66.616 8.685 -9.222 1.00 15.00 H new ATOM 0 HG22 ILE A 66 65.412 7.380 -9.101 1.00 15.00 H new ATOM 0 HG23 ILE A 66 66.032 8.158 -7.626 1.00 15.00 H new ATOM 0 HD11 ILE A 66 70.161 8.880 -8.431 1.00 15.00 H new ATOM 0 HD12 ILE A 66 69.599 7.878 -9.790 1.00 15.00 H new ATOM 0 HD13 ILE A 66 68.571 9.191 -9.168 1.00 15.00 H new ATOM 1078 N PHE A 67 64.589 5.068 -7.776 1.00 15.00 N ATOM 1079 CA PHE A 67 63.337 4.522 -8.383 1.00 15.00 C ATOM 1080 C PHE A 67 62.267 5.616 -8.444 1.00 15.00 C ATOM 1081 O PHE A 67 62.170 6.445 -7.559 1.00 15.00 O ATOM 1082 CB PHE A 67 62.899 3.395 -7.447 1.00 15.00 C ATOM 1083 CG PHE A 67 63.854 2.226 -7.424 1.00 15.00 C ATOM 1084 CD1 PHE A 67 63.991 1.401 -8.568 1.00 15.00 C ATOM 1085 CD2 PHE A 67 64.614 1.953 -6.261 1.00 15.00 C ATOM 1086 CE1 PHE A 67 64.885 0.304 -8.546 1.00 15.00 C ATOM 1087 CE2 PHE A 67 65.509 0.856 -6.240 1.00 15.00 C ATOM 1088 CZ PHE A 67 65.645 0.031 -7.383 1.00 15.00 C ATOM 0 H PHE A 67 64.460 5.556 -6.890 1.00 15.00 H new ATOM 0 HA PHE A 67 63.491 4.165 -9.402 1.00 15.00 H new ATOM 0 HB2 PHE A 67 62.798 3.791 -6.437 1.00 15.00 H new ATOM 0 HB3 PHE A 67 61.913 3.043 -7.751 1.00 15.00 H new ATOM 0 HD1 PHE A 67 63.413 1.609 -9.456 1.00 15.00 H new ATOM 0 HD2 PHE A 67 64.511 2.582 -5.389 1.00 15.00 H new ATOM 0 HE1 PHE A 67 64.988 -0.326 -9.417 1.00 15.00 H new ATOM 0 HE2 PHE A 67 66.088 0.648 -5.352 1.00 15.00 H new ATOM 0 HZ PHE A 67 66.328 -0.806 -7.368 1.00 15.00 H new ATOM 1098 N ARG A 68 61.468 5.622 -9.484 1.00 15.00 N ATOM 1099 CA ARG A 68 60.404 6.665 -9.614 1.00 15.00 C ATOM 1100 C ARG A 68 59.022 6.036 -9.414 1.00 15.00 C ATOM 1101 O ARG A 68 58.815 4.871 -9.696 1.00 15.00 O ATOM 1102 CB ARG A 68 60.545 7.209 -11.038 1.00 15.00 C ATOM 1103 CG ARG A 68 61.885 7.934 -11.181 1.00 15.00 C ATOM 1104 CD ARG A 68 61.962 8.601 -12.558 1.00 15.00 C ATOM 1105 NE ARG A 68 63.366 9.105 -12.669 1.00 15.00 N ATOM 1106 CZ ARG A 68 64.376 8.294 -12.918 1.00 15.00 C ATOM 1107 NH1 ARG A 68 64.200 7.000 -13.067 1.00 15.00 N ATOM 1108 NH2 ARG A 68 65.581 8.786 -13.014 1.00 15.00 N ATOM 0 H ARG A 68 61.508 4.948 -10.249 1.00 15.00 H new ATOM 0 HA ARG A 68 60.507 7.453 -8.868 1.00 15.00 H new ATOM 0 HB2 ARG A 68 60.483 6.393 -11.758 1.00 15.00 H new ATOM 0 HB3 ARG A 68 59.725 7.892 -11.260 1.00 15.00 H new ATOM 0 HG2 ARG A 68 61.991 8.683 -10.396 1.00 15.00 H new ATOM 0 HG3 ARG A 68 62.707 7.228 -11.061 1.00 15.00 H new ATOM 0 HD2 ARG A 68 61.734 7.891 -13.353 1.00 15.00 H new ATOM 0 HD3 ARG A 68 61.243 9.416 -12.642 1.00 15.00 H new ATOM 0 HE ARG A 68 63.547 10.102 -12.549 1.00 15.00 H new ATOM 0 HH11 ARG A 68 63.265 6.600 -12.991 1.00 15.00 H new ATOM 0 HH12 ARG A 68 64.999 6.395 -13.259 1.00 15.00 H new ATOM 0 HH21 ARG A 68 65.734 9.788 -12.897 1.00 15.00 H new ATOM 0 HH22 ARG A 68 66.370 8.169 -13.206 1.00 15.00 H new ATOM 1122 N GLY A 69 58.074 6.803 -8.929 1.00 15.00 N ATOM 1123 CA GLY A 69 56.700 6.257 -8.675 1.00 15.00 C ATOM 1124 C GLY A 69 56.099 5.677 -9.965 1.00 15.00 C ATOM 1125 O GLY A 69 55.255 4.800 -9.919 1.00 15.00 O ATOM 0 H GLY A 69 58.193 7.789 -8.697 1.00 15.00 H new ATOM 0 HA2 GLY A 69 56.747 5.482 -7.909 1.00 15.00 H new ATOM 0 HA3 GLY A 69 56.055 7.047 -8.290 1.00 15.00 H new ATOM 1129 N SER A 70 56.526 6.158 -11.110 1.00 15.00 N ATOM 1130 CA SER A 70 55.942 5.670 -12.403 1.00 15.00 C ATOM 1131 C SER A 70 56.304 4.198 -12.641 1.00 15.00 C ATOM 1132 O SER A 70 55.484 3.421 -13.095 1.00 15.00 O ATOM 1133 CB SER A 70 56.562 6.552 -13.488 1.00 15.00 C ATOM 1134 OG SER A 70 57.954 6.276 -13.579 1.00 15.00 O ATOM 0 H SER A 70 57.253 6.867 -11.205 1.00 15.00 H new ATOM 0 HA SER A 70 54.854 5.731 -12.400 1.00 15.00 H new ATOM 0 HB2 SER A 70 56.079 6.363 -14.447 1.00 15.00 H new ATOM 0 HB3 SER A 70 56.403 7.604 -13.253 1.00 15.00 H new ATOM 0 HG SER A 70 58.354 6.838 -14.275 1.00 15.00 H new ATOM 1140 N ASP A 71 57.521 3.814 -12.338 1.00 15.00 N ATOM 1141 CA ASP A 71 57.958 2.406 -12.614 1.00 15.00 C ATOM 1142 C ASP A 71 57.586 1.483 -11.445 1.00 15.00 C ATOM 1143 O ASP A 71 57.307 0.313 -11.637 1.00 15.00 O ATOM 1144 CB ASP A 71 59.483 2.475 -12.804 1.00 15.00 C ATOM 1145 CG ASP A 71 60.166 2.964 -11.520 1.00 15.00 C ATOM 1146 OD1 ASP A 71 60.505 4.133 -11.462 1.00 15.00 O ATOM 1147 OD2 ASP A 71 60.337 2.158 -10.620 1.00 15.00 O ATOM 0 H ASP A 71 58.230 4.412 -11.913 1.00 15.00 H new ATOM 0 HA ASP A 71 57.467 1.996 -13.496 1.00 15.00 H new ATOM 0 HB2 ASP A 71 59.866 1.491 -13.074 1.00 15.00 H new ATOM 0 HB3 ASP A 71 59.722 3.147 -13.628 1.00 15.00 H new ATOM 1152 N ILE A 72 57.581 2.002 -10.240 1.00 15.00 N ATOM 1153 CA ILE A 72 57.247 1.153 -9.046 1.00 15.00 C ATOM 1154 C ILE A 72 55.791 0.673 -9.135 1.00 15.00 C ATOM 1155 O ILE A 72 54.905 1.420 -9.509 1.00 15.00 O ATOM 1156 CB ILE A 72 57.448 2.059 -7.818 1.00 15.00 C ATOM 1157 CG1 ILE A 72 58.912 2.511 -7.743 1.00 15.00 C ATOM 1158 CG2 ILE A 72 57.100 1.289 -6.538 1.00 15.00 C ATOM 1159 CD1 ILE A 72 59.036 3.674 -6.758 1.00 15.00 C ATOM 0 H ILE A 72 57.794 2.977 -10.029 1.00 15.00 H new ATOM 0 HA ILE A 72 57.876 0.265 -8.988 1.00 15.00 H new ATOM 0 HB ILE A 72 56.796 2.928 -7.911 1.00 15.00 H new ATOM 0 HG12 ILE A 72 59.544 1.682 -7.425 1.00 15.00 H new ATOM 0 HG13 ILE A 72 59.260 2.817 -8.729 1.00 15.00 H new ATOM 0 HG21 ILE A 72 57.245 1.937 -5.673 1.00 15.00 H new ATOM 0 HG22 ILE A 72 56.060 0.966 -6.579 1.00 15.00 H new ATOM 0 HG23 ILE A 72 57.748 0.417 -6.451 1.00 15.00 H new ATOM 0 HD11 ILE A 72 60.076 3.996 -6.704 1.00 15.00 H new ATOM 0 HD12 ILE A 72 58.416 4.505 -7.096 1.00 15.00 H new ATOM 0 HD13 ILE A 72 58.704 3.352 -5.771 1.00 15.00 H new ATOM 1171 N LYS A 73 55.547 -0.568 -8.791 1.00 15.00 N ATOM 1172 CA LYS A 73 54.153 -1.103 -8.819 1.00 15.00 C ATOM 1173 C LYS A 73 53.560 -1.102 -7.407 1.00 15.00 C ATOM 1174 O LYS A 73 52.408 -0.759 -7.213 1.00 15.00 O ATOM 1175 CB LYS A 73 54.288 -2.534 -9.343 1.00 15.00 C ATOM 1176 CG LYS A 73 52.899 -3.100 -9.644 1.00 15.00 C ATOM 1177 CD LYS A 73 53.029 -4.550 -10.118 1.00 15.00 C ATOM 1178 CE LYS A 73 51.666 -5.056 -10.593 1.00 15.00 C ATOM 1179 NZ LYS A 73 51.761 -6.541 -10.520 1.00 15.00 N ATOM 0 H LYS A 73 56.258 -1.235 -8.491 1.00 15.00 H new ATOM 0 HA LYS A 73 53.491 -0.502 -9.443 1.00 15.00 H new ATOM 0 HB2 LYS A 73 54.901 -2.546 -10.244 1.00 15.00 H new ATOM 0 HB3 LYS A 73 54.794 -3.157 -8.605 1.00 15.00 H new ATOM 0 HG2 LYS A 73 52.274 -3.053 -8.752 1.00 15.00 H new ATOM 0 HG3 LYS A 73 52.408 -2.499 -10.409 1.00 15.00 H new ATOM 0 HD2 LYS A 73 53.755 -4.615 -10.928 1.00 15.00 H new ATOM 0 HD3 LYS A 73 53.399 -5.177 -9.307 1.00 15.00 H new ATOM 0 HE2 LYS A 73 50.862 -4.680 -9.960 1.00 15.00 H new ATOM 0 HE3 LYS A 73 51.453 -4.723 -11.609 1.00 15.00 H new ATOM 0 HZ1 LYS A 73 50.862 -6.962 -10.831 1.00 15.00 H new ATOM 0 HZ2 LYS A 73 52.530 -6.870 -11.138 1.00 15.00 H new ATOM 0 HZ3 LYS A 73 51.957 -6.829 -9.540 1.00 15.00 H new ATOM 1193 N ASP A 74 54.341 -1.482 -6.423 1.00 15.00 N ATOM 1194 CA ASP A 74 53.822 -1.522 -5.020 1.00 15.00 C ATOM 1195 C ASP A 74 54.937 -1.189 -4.022 1.00 15.00 C ATOM 1196 O ASP A 74 56.084 -1.539 -4.225 1.00 15.00 O ATOM 1197 CB ASP A 74 53.337 -2.959 -4.820 1.00 15.00 C ATOM 1198 CG ASP A 74 52.555 -3.058 -3.509 1.00 15.00 C ATOM 1199 OD1 ASP A 74 51.375 -2.749 -3.521 1.00 15.00 O ATOM 1200 OD2 ASP A 74 53.150 -3.441 -2.515 1.00 15.00 O ATOM 0 H ASP A 74 55.315 -1.766 -6.532 1.00 15.00 H new ATOM 0 HA ASP A 74 53.028 -0.793 -4.857 1.00 15.00 H new ATOM 0 HB2 ASP A 74 52.705 -3.260 -5.656 1.00 15.00 H new ATOM 0 HB3 ASP A 74 54.187 -3.641 -4.801 1.00 15.00 H new ATOM 1205 N LEU A 75 54.601 -0.517 -2.947 1.00 15.00 N ATOM 1206 CA LEU A 75 55.622 -0.184 -1.905 1.00 15.00 C ATOM 1207 C LEU A 75 55.074 -0.508 -0.510 1.00 15.00 C ATOM 1208 O LEU A 75 53.974 -0.117 -0.164 1.00 15.00 O ATOM 1209 CB LEU A 75 55.859 1.320 -2.051 1.00 15.00 C ATOM 1210 CG LEU A 75 57.130 1.717 -1.297 1.00 15.00 C ATOM 1211 CD1 LEU A 75 57.685 3.018 -1.880 1.00 15.00 C ATOM 1212 CD2 LEU A 75 56.802 1.926 0.184 1.00 15.00 C ATOM 0 H LEU A 75 53.658 -0.183 -2.746 1.00 15.00 H new ATOM 0 HA LEU A 75 56.542 -0.755 -2.028 1.00 15.00 H new ATOM 0 HB2 LEU A 75 55.953 1.583 -3.105 1.00 15.00 H new ATOM 0 HB3 LEU A 75 55.005 1.872 -1.660 1.00 15.00 H new ATOM 0 HG LEU A 75 57.872 0.925 -1.399 1.00 15.00 H new ATOM 0 HD11 LEU A 75 58.590 3.300 -1.343 1.00 15.00 H new ATOM 0 HD12 LEU A 75 57.919 2.873 -2.935 1.00 15.00 H new ATOM 0 HD13 LEU A 75 56.941 3.808 -1.779 1.00 15.00 H new ATOM 0 HD21 LEU A 75 57.708 2.209 0.721 1.00 15.00 H new ATOM 0 HD22 LEU A 75 56.059 2.717 0.284 1.00 15.00 H new ATOM 0 HD23 LEU A 75 56.406 1.001 0.603 1.00 15.00 H new ATOM 1224 N THR A 76 55.833 -1.220 0.288 1.00 15.00 N ATOM 1225 CA THR A 76 55.359 -1.588 1.660 1.00 15.00 C ATOM 1226 C THR A 76 56.446 -1.296 2.700 1.00 15.00 C ATOM 1227 O THR A 76 57.622 -1.453 2.437 1.00 15.00 O ATOM 1228 CB THR A 76 55.074 -3.090 1.589 1.00 15.00 C ATOM 1229 OG1 THR A 76 54.256 -3.361 0.460 1.00 15.00 O ATOM 1230 CG2 THR A 76 54.356 -3.538 2.862 1.00 15.00 C ATOM 0 H THR A 76 56.763 -1.563 0.048 1.00 15.00 H new ATOM 0 HA THR A 76 54.479 -1.017 1.957 1.00 15.00 H new ATOM 0 HB THR A 76 56.014 -3.634 1.497 1.00 15.00 H new ATOM 0 HG1 THR A 76 54.073 -4.323 0.412 1.00 15.00 H new ATOM 0 HG21 THR A 76 54.154 -4.608 2.809 1.00 15.00 H new ATOM 0 HG22 THR A 76 54.986 -3.330 3.727 1.00 15.00 H new ATOM 0 HG23 THR A 76 53.415 -2.996 2.959 1.00 15.00 H new