USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 761 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 48 GLN : amide:sc= -8.97! C(o=-10!,f=-3.1!) USER MOD Set 1.2: A 68 SER OG : rot 90:sc= -1.51! USER MOD Set 2.1: A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 35 THR OG1 : rot -140:sc= 0 USER MOD Single : A 14 GLN : amide:sc= -0.83! C(o=-0.83!,f=-1!) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.627 USER MOD Single : A 18 THR OG1 : rot 180:sc= -0.773 USER MOD Single : A 20 GLN : amide:sc= -6.68! C(o=-6.7!,f=-17!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot 110:sc= -0.715 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot -30:sc= -2.46! USER MOD Single : A 40 SER OG : rot 180:sc= -0.311 USER MOD Single : A 49 HIS : no HD1:sc= -3.32! C(o=-3.3!,f=-4.2!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 166:sc= -0.339 (180deg=-1.16!) USER MOD Single : A 62 ASN : amide:sc= -0.0492 K(o=-0.049,f=-1.8!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN : amide:sc= 0.0975 X(o=0.098,f=-0.24) USER MOD Single : A 81 MET CE :methyl -125:sc= -0.88 (180deg=-3.65!) USER MOD Single : A 82 SER OG : rot 117:sc= -6.67! USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl -117:sc= -3.27! (180deg=-6.94!) USER MOD Single : A 88 ASN : amide:sc= -0.0077 X(o=-0.0077,f=-0.0077) USER MOD Single : A 96 THR OG1 : rot 100:sc= -6.11! USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 TYR OH : rot 165:sc= -0.0383 USER MOD Single : A 105 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0777) USER MOD ----------------------------------------------------------------- ATOM 175 N VAL A 13 -7.089 16.792 -7.343 1.00 0.00 N ATOM 176 CA VAL A 13 -7.455 18.047 -8.057 1.00 0.00 C ATOM 177 C VAL A 13 -6.290 18.491 -8.942 1.00 0.00 C ATOM 178 O VAL A 13 -5.161 18.573 -8.501 1.00 0.00 O ATOM 179 CB VAL A 13 -7.761 19.144 -7.037 1.00 0.00 C ATOM 180 CG1 VAL A 13 -8.285 20.387 -7.763 1.00 0.00 C ATOM 181 CG2 VAL A 13 -8.820 18.646 -6.053 1.00 0.00 C ATOM 0 HA VAL A 13 -8.334 17.867 -8.675 1.00 0.00 H new ATOM 0 HB VAL A 13 -6.850 19.397 -6.494 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.503 21.169 -7.035 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.531 20.744 -8.464 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -9.195 20.134 -8.307 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -9.038 19.428 -5.326 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -9.730 18.392 -6.596 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -8.448 17.762 -5.534 1.00 0.00 H new ATOM 191 N GLN A 14 -6.552 18.784 -10.187 1.00 0.00 N ATOM 192 CA GLN A 14 -5.453 19.228 -11.088 1.00 0.00 C ATOM 193 C GLN A 14 -5.583 20.733 -11.329 1.00 0.00 C ATOM 194 O GLN A 14 -6.586 21.207 -11.826 1.00 0.00 O ATOM 195 CB GLN A 14 -5.546 18.481 -12.421 1.00 0.00 C ATOM 196 CG GLN A 14 -5.156 17.015 -12.216 1.00 0.00 C ATOM 197 CD GLN A 14 -3.871 16.937 -11.388 1.00 0.00 C ATOM 198 OE1 GLN A 14 -2.897 17.598 -11.691 1.00 0.00 O ATOM 199 NE2 GLN A 14 -3.826 16.150 -10.347 1.00 0.00 N ATOM 0 H GLN A 14 -7.476 18.735 -10.617 1.00 0.00 H new ATOM 0 HA GLN A 14 -4.489 19.012 -10.627 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -6.560 18.546 -12.816 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -4.887 18.944 -13.156 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -5.960 16.482 -11.709 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -5.009 16.529 -13.180 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -4.643 15.595 -10.092 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -2.974 16.090 -9.789 1.00 0.00 H new ATOM 208 N VAL A 15 -4.583 21.490 -10.971 1.00 0.00 N ATOM 209 CA VAL A 15 -4.659 22.962 -11.168 1.00 0.00 C ATOM 210 C VAL A 15 -3.409 23.459 -11.901 1.00 0.00 C ATOM 211 O VAL A 15 -2.306 23.025 -11.633 1.00 0.00 O ATOM 212 CB VAL A 15 -4.751 23.637 -9.802 1.00 0.00 C ATOM 213 CG1 VAL A 15 -3.439 23.431 -9.047 1.00 0.00 C ATOM 214 CG2 VAL A 15 -5.009 25.134 -9.982 1.00 0.00 C ATOM 0 H VAL A 15 -3.717 21.152 -10.551 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.538 23.205 -11.766 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.572 23.198 -9.235 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -3.502 23.912 -8.071 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -3.259 22.364 -8.915 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -2.619 23.870 -9.616 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.074 25.612 -9.005 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.191 25.578 -10.550 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.946 25.280 -10.520 1.00 0.00 H new ATOM 224 N THR A 16 -3.574 24.372 -12.821 1.00 0.00 N ATOM 225 CA THR A 16 -2.399 24.903 -13.570 1.00 0.00 C ATOM 226 C THR A 16 -2.576 26.408 -13.790 1.00 0.00 C ATOM 227 O THR A 16 -3.674 26.894 -13.974 1.00 0.00 O ATOM 228 CB THR A 16 -2.292 24.197 -14.924 1.00 0.00 C ATOM 229 OG1 THR A 16 -3.441 24.500 -15.705 1.00 0.00 O ATOM 230 CG2 THR A 16 -2.204 22.686 -14.708 1.00 0.00 C ATOM 0 H THR A 16 -4.474 24.773 -13.086 1.00 0.00 H new ATOM 0 HA THR A 16 -1.490 24.722 -12.996 1.00 0.00 H new ATOM 0 HB THR A 16 -1.397 24.539 -15.444 1.00 0.00 H new ATOM 0 HG1 THR A 16 -3.374 24.051 -16.573 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.128 22.184 -15.673 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.324 22.455 -14.108 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.098 22.340 -14.189 1.00 0.00 H new ATOM 238 N PHE A 17 -1.502 27.152 -13.768 1.00 0.00 N ATOM 239 CA PHE A 17 -1.610 28.627 -13.970 1.00 0.00 C ATOM 240 C PHE A 17 -0.835 29.034 -15.223 1.00 0.00 C ATOM 241 O PHE A 17 0.274 28.595 -15.446 1.00 0.00 O ATOM 242 CB PHE A 17 -1.010 29.352 -12.764 1.00 0.00 C ATOM 243 CG PHE A 17 -1.731 28.936 -11.506 1.00 0.00 C ATOM 244 CD1 PHE A 17 -1.685 27.602 -11.078 1.00 0.00 C ATOM 245 CD2 PHE A 17 -2.438 29.885 -10.761 1.00 0.00 C ATOM 246 CE1 PHE A 17 -2.348 27.220 -9.906 1.00 0.00 C ATOM 247 CE2 PHE A 17 -3.100 29.504 -9.589 1.00 0.00 C ATOM 248 CZ PHE A 17 -3.055 28.171 -9.161 1.00 0.00 C ATOM 0 H PHE A 17 -0.555 26.803 -13.619 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.661 28.895 -14.082 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.051 29.119 -12.679 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -1.090 30.431 -12.900 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -1.138 26.869 -11.652 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -2.473 30.913 -11.091 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -2.314 26.192 -9.577 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -3.646 30.238 -9.014 1.00 0.00 H new ATOM 0 HZ PHE A 17 -3.566 27.877 -8.256 1.00 0.00 H new ATOM 258 N THR A 18 -1.396 29.882 -16.039 1.00 0.00 N ATOM 259 CA THR A 18 -0.667 30.315 -17.264 1.00 0.00 C ATOM 260 C THR A 18 -0.716 31.841 -17.369 1.00 0.00 C ATOM 261 O THR A 18 -1.769 32.445 -17.307 1.00 0.00 O ATOM 262 CB THR A 18 -1.315 29.690 -18.502 1.00 0.00 C ATOM 263 OG1 THR A 18 -1.281 28.274 -18.387 1.00 0.00 O ATOM 264 CG2 THR A 18 -0.551 30.122 -19.755 1.00 0.00 C ATOM 0 H THR A 18 -2.321 30.292 -15.912 1.00 0.00 H new ATOM 0 HA THR A 18 0.371 29.987 -17.203 1.00 0.00 H new ATOM 0 HB THR A 18 -2.350 30.024 -18.579 1.00 0.00 H new ATOM 0 HG1 THR A 18 -1.697 27.871 -19.178 1.00 0.00 H new ATOM 0 HG21 THR A 18 -1.014 29.676 -20.635 1.00 0.00 H new ATOM 0 HG22 THR A 18 -0.579 31.208 -19.842 1.00 0.00 H new ATOM 0 HG23 THR A 18 0.485 29.790 -19.682 1.00 0.00 H new ATOM 272 N VAL A 19 0.416 32.470 -17.529 1.00 0.00 N ATOM 273 CA VAL A 19 0.436 33.957 -17.640 1.00 0.00 C ATOM 274 C VAL A 19 -0.068 34.364 -19.025 1.00 0.00 C ATOM 275 O VAL A 19 0.327 33.801 -20.026 1.00 0.00 O ATOM 276 CB VAL A 19 1.867 34.464 -17.451 1.00 0.00 C ATOM 277 CG1 VAL A 19 1.866 35.994 -17.412 1.00 0.00 C ATOM 278 CG2 VAL A 19 2.431 33.921 -16.135 1.00 0.00 C ATOM 0 H VAL A 19 1.329 32.019 -17.588 1.00 0.00 H new ATOM 0 HA VAL A 19 -0.206 34.390 -16.873 1.00 0.00 H new ATOM 0 HB VAL A 19 2.486 34.122 -18.281 1.00 0.00 H new ATOM 0 HG11 VAL A 19 2.886 36.355 -17.277 1.00 0.00 H new ATOM 0 HG12 VAL A 19 1.464 36.382 -18.348 1.00 0.00 H new ATOM 0 HG13 VAL A 19 1.247 36.336 -16.583 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.451 34.282 -16.000 1.00 0.00 H new ATOM 0 HG22 VAL A 19 1.812 34.263 -15.305 1.00 0.00 H new ATOM 0 HG23 VAL A 19 2.432 32.831 -16.162 1.00 0.00 H new ATOM 288 N GLN A 20 -0.942 35.331 -19.094 1.00 0.00 N ATOM 289 CA GLN A 20 -1.469 35.757 -20.419 1.00 0.00 C ATOM 290 C GLN A 20 -0.864 37.107 -20.813 1.00 0.00 C ATOM 291 O GLN A 20 -0.437 37.878 -19.976 1.00 0.00 O ATOM 292 CB GLN A 20 -2.992 35.890 -20.340 1.00 0.00 C ATOM 293 CG GLN A 20 -3.589 34.604 -19.765 1.00 0.00 C ATOM 294 CD GLN A 20 -3.030 33.397 -20.521 1.00 0.00 C ATOM 295 OE1 GLN A 20 -1.845 33.134 -20.478 1.00 0.00 O ATOM 296 NE2 GLN A 20 -3.840 32.648 -21.219 1.00 0.00 N ATOM 0 H GLN A 20 -1.312 35.842 -18.293 1.00 0.00 H new ATOM 0 HA GLN A 20 -1.201 35.011 -21.167 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -3.261 36.740 -19.713 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -3.403 36.082 -21.331 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -3.352 34.523 -18.704 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -4.676 34.627 -19.848 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -4.835 32.869 -21.255 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -3.478 31.842 -21.728 1.00 0.00 H new ATOM 305 N LYS A 21 -0.830 37.394 -22.084 1.00 0.00 N ATOM 306 CA LYS A 21 -0.261 38.690 -22.552 1.00 0.00 C ATOM 307 C LYS A 21 -0.902 39.849 -21.785 1.00 0.00 C ATOM 308 O LYS A 21 -2.086 40.096 -21.899 1.00 0.00 O ATOM 309 CB LYS A 21 -0.560 38.853 -24.044 1.00 0.00 C ATOM 310 CG LYS A 21 0.315 37.889 -24.848 1.00 0.00 C ATOM 311 CD LYS A 21 0.115 38.143 -26.343 1.00 0.00 C ATOM 312 CE LYS A 21 0.815 37.045 -27.145 1.00 0.00 C ATOM 313 NZ LYS A 21 0.047 36.773 -28.392 1.00 0.00 N ATOM 0 H LYS A 21 -1.174 36.783 -22.824 1.00 0.00 H new ATOM 0 HA LYS A 21 0.815 38.696 -22.379 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -1.614 38.653 -24.239 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.368 39.880 -24.354 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.363 38.025 -24.582 1.00 0.00 H new ATOM 0 HG3 LYS A 21 0.056 36.858 -24.606 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.949 38.160 -26.581 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.518 39.119 -26.614 1.00 0.00 H new ATOM 0 HE2 LYS A 21 1.832 37.352 -27.391 1.00 0.00 H new ATOM 0 HE3 LYS A 21 0.892 36.137 -26.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 0.523 36.026 -28.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -0.915 36.463 -28.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -0.004 37.640 -28.964 1.00 0.00 H new ATOM 327 N GLY A 22 -0.135 40.575 -21.016 1.00 0.00 N ATOM 328 CA GLY A 22 -0.721 41.722 -20.265 1.00 0.00 C ATOM 329 C GLY A 22 -0.179 41.757 -18.834 1.00 0.00 C ATOM 330 O GLY A 22 -0.514 42.632 -18.060 1.00 0.00 O ATOM 0 H GLY A 22 0.864 40.425 -20.876 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -0.484 42.657 -20.773 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -1.807 41.636 -20.247 1.00 0.00 H new ATOM 334 N SER A 23 0.650 40.819 -18.467 1.00 0.00 N ATOM 335 CA SER A 23 1.196 40.820 -17.079 1.00 0.00 C ATOM 336 C SER A 23 1.974 42.118 -16.839 1.00 0.00 C ATOM 337 O SER A 23 2.622 42.637 -17.727 1.00 0.00 O ATOM 338 CB SER A 23 2.126 39.621 -16.894 1.00 0.00 C ATOM 339 OG SER A 23 3.078 39.588 -17.946 1.00 0.00 O ATOM 0 H SER A 23 0.972 40.056 -19.063 1.00 0.00 H new ATOM 0 HA SER A 23 0.375 40.752 -16.365 1.00 0.00 H new ATOM 0 HB2 SER A 23 2.635 39.688 -15.932 1.00 0.00 H new ATOM 0 HB3 SER A 23 1.547 38.697 -16.885 1.00 0.00 H new ATOM 0 HG SER A 23 3.964 39.812 -17.592 1.00 0.00 H new ATOM 345 N ASP A 24 1.910 42.648 -15.648 1.00 0.00 N ATOM 346 CA ASP A 24 2.643 43.916 -15.354 1.00 0.00 C ATOM 347 C ASP A 24 3.343 43.805 -13.997 1.00 0.00 C ATOM 348 O ASP A 24 3.115 42.879 -13.244 1.00 0.00 O ATOM 349 CB ASP A 24 1.652 45.085 -15.322 1.00 0.00 C ATOM 350 CG ASP A 24 0.390 44.715 -16.103 1.00 0.00 C ATOM 351 OD1 ASP A 24 -0.334 43.847 -15.644 1.00 0.00 O ATOM 352 OD2 ASP A 24 0.168 45.306 -17.147 1.00 0.00 O ATOM 0 H ASP A 24 1.383 42.260 -14.866 1.00 0.00 H new ATOM 0 HA ASP A 24 3.387 44.090 -16.131 1.00 0.00 H new ATOM 0 HB2 ASP A 24 1.395 45.328 -14.291 1.00 0.00 H new ATOM 0 HB3 ASP A 24 2.111 45.975 -15.754 1.00 0.00 H new ATOM 357 N PRO A 25 4.216 44.778 -13.682 1.00 0.00 N ATOM 358 CA PRO A 25 4.961 44.800 -12.415 1.00 0.00 C ATOM 359 C PRO A 25 4.051 45.113 -11.223 1.00 0.00 C ATOM 360 O PRO A 25 4.291 44.678 -10.115 1.00 0.00 O ATOM 361 CB PRO A 25 5.970 45.930 -12.611 1.00 0.00 C ATOM 362 CG PRO A 25 5.344 46.822 -13.630 1.00 0.00 C ATOM 363 CD PRO A 25 4.546 45.930 -14.539 1.00 0.00 C ATOM 0 HA PRO A 25 5.418 43.835 -12.195 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.155 46.463 -11.678 1.00 0.00 H new ATOM 0 HB3 PRO A 25 6.931 45.548 -12.956 1.00 0.00 H new ATOM 0 HG2 PRO A 25 4.704 47.566 -13.155 1.00 0.00 H new ATOM 0 HG3 PRO A 25 6.104 47.367 -14.189 1.00 0.00 H new ATOM 0 HD2 PRO A 25 3.649 46.429 -14.905 1.00 0.00 H new ATOM 0 HD3 PRO A 25 5.122 45.628 -15.414 1.00 0.00 H new ATOM 371 N LYS A 26 3.001 45.857 -11.444 1.00 0.00 N ATOM 372 CA LYS A 26 2.072 46.186 -10.326 1.00 0.00 C ATOM 373 C LYS A 26 0.728 45.505 -10.585 1.00 0.00 C ATOM 374 O LYS A 26 -0.239 45.719 -9.881 1.00 0.00 O ATOM 375 CB LYS A 26 1.875 47.701 -10.247 1.00 0.00 C ATOM 376 CG LYS A 26 3.231 48.387 -10.073 1.00 0.00 C ATOM 377 CD LYS A 26 3.056 49.901 -10.209 1.00 0.00 C ATOM 378 CE LYS A 26 4.421 50.554 -10.440 1.00 0.00 C ATOM 379 NZ LYS A 26 4.672 50.674 -11.904 1.00 0.00 N ATOM 0 H LYS A 26 2.747 46.251 -12.350 1.00 0.00 H new ATOM 0 HA LYS A 26 2.490 45.834 -9.383 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.387 48.062 -11.152 1.00 0.00 H new ATOM 0 HB3 LYS A 26 1.221 47.950 -9.412 1.00 0.00 H new ATOM 0 HG2 LYS A 26 3.651 48.145 -9.097 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.934 48.022 -10.822 1.00 0.00 H new ATOM 0 HD2 LYS A 26 2.387 50.127 -11.040 1.00 0.00 H new ATOM 0 HD3 LYS A 26 2.595 50.307 -9.309 1.00 0.00 H new ATOM 0 HE2 LYS A 26 4.449 51.539 -9.973 1.00 0.00 H new ATOM 0 HE3 LYS A 26 5.205 49.958 -9.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 5.599 51.118 -12.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 4.662 49.728 -12.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 3.930 51.260 -12.337 1.00 0.00 H new ATOM 393 N LYS A 27 0.670 44.682 -11.595 1.00 0.00 N ATOM 394 CA LYS A 27 -0.595 43.970 -11.921 1.00 0.00 C ATOM 395 C LYS A 27 -0.253 42.556 -12.391 1.00 0.00 C ATOM 396 O LYS A 27 0.630 42.364 -13.203 1.00 0.00 O ATOM 397 CB LYS A 27 -1.321 44.716 -13.044 1.00 0.00 C ATOM 398 CG LYS A 27 -2.042 45.934 -12.465 1.00 0.00 C ATOM 399 CD LYS A 27 -2.733 46.701 -13.595 1.00 0.00 C ATOM 400 CE LYS A 27 -2.895 48.168 -13.192 1.00 0.00 C ATOM 401 NZ LYS A 27 -2.225 49.037 -14.202 1.00 0.00 N ATOM 0 H LYS A 27 1.453 44.471 -12.214 1.00 0.00 H new ATOM 0 HA LYS A 27 -1.237 43.926 -11.041 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -0.608 45.031 -13.806 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -2.037 44.054 -13.531 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -2.776 45.618 -11.724 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -1.331 46.582 -11.953 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -2.146 46.627 -14.511 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -3.708 46.261 -13.805 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -3.953 48.422 -13.122 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -2.461 48.336 -12.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -2.335 50.035 -13.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -1.213 48.800 -14.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -2.659 48.884 -15.135 1.00 0.00 H new ATOM 415 N LEU A 28 -0.935 41.563 -11.895 1.00 0.00 N ATOM 416 CA LEU A 28 -0.625 40.174 -12.331 1.00 0.00 C ATOM 417 C LEU A 28 -1.877 39.544 -12.943 1.00 0.00 C ATOM 418 O LEU A 28 -2.915 39.443 -12.319 1.00 0.00 O ATOM 419 CB LEU A 28 -0.146 39.347 -11.130 1.00 0.00 C ATOM 420 CG LEU A 28 0.643 38.112 -11.592 1.00 0.00 C ATOM 421 CD1 LEU A 28 0.156 37.647 -12.964 1.00 0.00 C ATOM 422 CD2 LEU A 28 2.130 38.455 -11.670 1.00 0.00 C ATOM 0 H LEU A 28 -1.688 41.651 -11.212 1.00 0.00 H new ATOM 0 HA LEU A 28 0.167 40.193 -13.079 1.00 0.00 H new ATOM 0 HB2 LEU A 28 0.481 39.964 -10.486 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.003 39.033 -10.534 1.00 0.00 H new ATOM 0 HG LEU A 28 0.486 37.308 -10.873 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.726 36.772 -13.275 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -0.902 37.390 -12.907 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.296 38.448 -13.690 1.00 0.00 H new ATOM 0 HD21 LEU A 28 2.689 37.578 -11.998 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.279 39.267 -12.381 1.00 0.00 H new ATOM 0 HD23 LEU A 28 2.484 38.764 -10.687 1.00 0.00 H new ATOM 434 N VAL A 29 -1.764 39.107 -14.167 1.00 0.00 N ATOM 435 CA VAL A 29 -2.911 38.459 -14.857 1.00 0.00 C ATOM 436 C VAL A 29 -2.505 37.030 -15.205 1.00 0.00 C ATOM 437 O VAL A 29 -1.503 36.806 -15.855 1.00 0.00 O ATOM 438 CB VAL A 29 -3.237 39.225 -16.142 1.00 0.00 C ATOM 439 CG1 VAL A 29 -4.454 38.590 -16.819 1.00 0.00 C ATOM 440 CG2 VAL A 29 -3.543 40.685 -15.804 1.00 0.00 C ATOM 0 H VAL A 29 -0.913 39.173 -14.725 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.791 38.460 -14.213 1.00 0.00 H new ATOM 0 HB VAL A 29 -2.382 39.182 -16.817 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -4.687 39.135 -17.734 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.234 37.550 -17.062 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.309 38.632 -16.144 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.775 41.229 -16.719 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -4.397 40.731 -15.128 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.675 41.137 -15.323 1.00 0.00 H new ATOM 450 N LEU A 30 -3.258 36.057 -14.777 1.00 0.00 N ATOM 451 CA LEU A 30 -2.877 34.652 -15.089 1.00 0.00 C ATOM 452 C LEU A 30 -4.124 33.808 -15.330 1.00 0.00 C ATOM 453 O LEU A 30 -5.140 33.977 -14.683 1.00 0.00 O ATOM 454 CB LEU A 30 -2.105 34.052 -13.910 1.00 0.00 C ATOM 455 CG LEU A 30 -0.893 34.923 -13.575 1.00 0.00 C ATOM 456 CD1 LEU A 30 -0.880 35.216 -12.073 1.00 0.00 C ATOM 457 CD2 LEU A 30 0.387 34.180 -13.959 1.00 0.00 C ATOM 0 H LEU A 30 -4.112 36.171 -14.231 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.256 34.654 -15.985 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.758 33.974 -13.040 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.779 33.041 -14.156 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.951 35.860 -14.129 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.017 35.837 -11.831 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.794 35.742 -11.797 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.819 34.279 -11.520 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.252 34.799 -13.721 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.446 33.245 -13.402 1.00 0.00 H new ATOM 0 HD23 LEU A 30 0.377 33.966 -15.028 1.00 0.00 H new ATOM 469 N ASP A 31 -4.041 32.871 -16.232 1.00 0.00 N ATOM 470 CA ASP A 31 -5.202 31.983 -16.484 1.00 0.00 C ATOM 471 C ASP A 31 -5.126 30.844 -15.471 1.00 0.00 C ATOM 472 O ASP A 31 -4.065 30.313 -15.211 1.00 0.00 O ATOM 473 CB ASP A 31 -5.131 31.423 -17.907 1.00 0.00 C ATOM 474 CG ASP A 31 -6.410 30.641 -18.211 1.00 0.00 C ATOM 475 OD1 ASP A 31 -7.372 31.258 -18.635 1.00 0.00 O ATOM 476 OD2 ASP A 31 -6.404 29.436 -18.015 1.00 0.00 O ATOM 0 H ASP A 31 -3.218 32.684 -16.804 1.00 0.00 H new ATOM 0 HA ASP A 31 -6.139 32.530 -16.382 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -5.010 32.235 -18.623 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -4.262 30.774 -18.011 1.00 0.00 H new ATOM 481 N ILE A 32 -6.222 30.469 -14.881 1.00 0.00 N ATOM 482 CA ILE A 32 -6.153 29.375 -13.877 1.00 0.00 C ATOM 483 C ILE A 32 -7.040 28.206 -14.289 1.00 0.00 C ATOM 484 O ILE A 32 -8.203 28.367 -14.600 1.00 0.00 O ATOM 485 CB ILE A 32 -6.608 29.894 -12.513 1.00 0.00 C ATOM 486 CG1 ILE A 32 -5.560 30.862 -11.961 1.00 0.00 C ATOM 487 CG2 ILE A 32 -6.778 28.713 -11.555 1.00 0.00 C ATOM 488 CD1 ILE A 32 -6.162 31.655 -10.799 1.00 0.00 C ATOM 0 H ILE A 32 -7.148 30.864 -15.045 1.00 0.00 H new ATOM 0 HA ILE A 32 -5.120 29.031 -13.817 1.00 0.00 H new ATOM 0 HB ILE A 32 -7.559 30.416 -12.616 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -4.682 30.311 -11.623 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -5.228 31.542 -12.746 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -7.102 29.079 -10.581 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -7.526 28.027 -11.953 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.827 28.191 -11.448 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -5.416 32.345 -10.405 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -7.027 32.217 -11.152 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -6.473 30.968 -10.012 1.00 0.00 H new ATOM 500 N LYS A 33 -6.497 27.024 -14.252 1.00 0.00 N ATOM 501 CA LYS A 33 -7.296 25.823 -14.595 1.00 0.00 C ATOM 502 C LYS A 33 -7.501 25.028 -13.308 1.00 0.00 C ATOM 503 O LYS A 33 -6.557 24.621 -12.664 1.00 0.00 O ATOM 504 CB LYS A 33 -6.552 24.973 -15.626 1.00 0.00 C ATOM 505 CG LYS A 33 -7.496 23.904 -16.181 1.00 0.00 C ATOM 506 CD LYS A 33 -6.746 23.035 -17.193 1.00 0.00 C ATOM 507 CE LYS A 33 -7.734 22.098 -17.888 1.00 0.00 C ATOM 508 NZ LYS A 33 -7.556 20.713 -17.368 1.00 0.00 N ATOM 0 H LYS A 33 -5.527 26.839 -13.997 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.255 26.110 -15.026 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.183 25.603 -16.435 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.683 24.503 -15.167 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.880 23.286 -15.369 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -8.356 24.375 -16.657 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -6.245 23.664 -17.929 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -5.972 22.456 -16.689 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -8.756 22.435 -17.713 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -7.573 22.117 -18.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -8.228 20.076 -17.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -6.584 20.393 -17.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -7.731 20.702 -16.343 1.00 0.00 H new ATOM 522 N TYR A 34 -8.724 24.822 -12.919 1.00 0.00 N ATOM 523 CA TYR A 34 -8.983 24.073 -11.660 1.00 0.00 C ATOM 524 C TYR A 34 -9.808 22.824 -11.968 1.00 0.00 C ATOM 525 O TYR A 34 -10.957 22.907 -12.356 1.00 0.00 O ATOM 526 CB TYR A 34 -9.741 24.978 -10.693 1.00 0.00 C ATOM 527 CG TYR A 34 -9.980 24.250 -9.393 1.00 0.00 C ATOM 528 CD1 TYR A 34 -8.987 24.237 -8.406 1.00 0.00 C ATOM 529 CD2 TYR A 34 -11.196 23.593 -9.170 1.00 0.00 C ATOM 530 CE1 TYR A 34 -9.209 23.565 -7.199 1.00 0.00 C ATOM 531 CE2 TYR A 34 -11.418 22.922 -7.962 1.00 0.00 C ATOM 532 CZ TYR A 34 -10.424 22.907 -6.976 1.00 0.00 C ATOM 533 OH TYR A 34 -10.642 22.246 -5.785 1.00 0.00 O ATOM 0 H TYR A 34 -9.556 25.139 -13.417 1.00 0.00 H new ATOM 0 HA TYR A 34 -8.040 23.768 -11.207 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -9.171 25.889 -10.511 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -10.692 25.279 -11.132 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -8.050 24.746 -8.576 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -11.963 23.604 -9.930 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -8.442 23.554 -6.439 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -12.356 22.416 -7.790 1.00 0.00 H new ATOM 0 HH TYR A 34 -9.789 21.915 -5.434 1.00 0.00 H new ATOM 543 N THR A 35 -9.230 21.666 -11.801 1.00 0.00 N ATOM 544 CA THR A 35 -9.984 20.414 -12.090 1.00 0.00 C ATOM 545 C THR A 35 -10.163 19.611 -10.800 1.00 0.00 C ATOM 546 O THR A 35 -9.211 19.149 -10.204 1.00 0.00 O ATOM 547 CB THR A 35 -9.215 19.577 -13.113 1.00 0.00 C ATOM 548 OG1 THR A 35 -8.918 20.376 -14.250 1.00 0.00 O ATOM 549 CG2 THR A 35 -10.065 18.378 -13.537 1.00 0.00 C ATOM 0 H THR A 35 -8.272 21.533 -11.478 1.00 0.00 H new ATOM 0 HA THR A 35 -10.964 20.669 -12.494 1.00 0.00 H new ATOM 0 HB THR A 35 -8.286 19.221 -12.667 1.00 0.00 H new ATOM 0 HG1 THR A 35 -9.035 19.843 -15.064 1.00 0.00 H new ATOM 0 HG21 THR A 35 -9.516 17.782 -14.266 1.00 0.00 H new ATOM 0 HG22 THR A 35 -10.291 17.765 -12.664 1.00 0.00 H new ATOM 0 HG23 THR A 35 -10.995 18.731 -13.983 1.00 0.00 H new ATOM 557 N ARG A 36 -11.383 19.443 -10.371 1.00 0.00 N ATOM 558 CA ARG A 36 -11.642 18.668 -9.125 1.00 0.00 C ATOM 559 C ARG A 36 -12.865 17.773 -9.334 1.00 0.00 C ATOM 560 O ARG A 36 -13.862 18.190 -9.888 1.00 0.00 O ATOM 561 CB ARG A 36 -11.906 19.632 -7.967 1.00 0.00 C ATOM 562 CG ARG A 36 -11.952 18.848 -6.653 1.00 0.00 C ATOM 563 CD ARG A 36 -12.033 19.823 -5.477 1.00 0.00 C ATOM 564 NE ARG A 36 -12.465 19.090 -4.255 1.00 0.00 N ATOM 565 CZ ARG A 36 -11.722 18.132 -3.772 1.00 0.00 C ATOM 566 NH1 ARG A 36 -10.474 18.366 -3.469 1.00 0.00 N ATOM 567 NH2 ARG A 36 -12.226 16.942 -3.592 1.00 0.00 N ATOM 0 H ARG A 36 -12.215 19.811 -10.832 1.00 0.00 H new ATOM 0 HA ARG A 36 -10.773 18.053 -8.890 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -11.123 20.389 -7.924 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -12.849 20.156 -8.124 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -12.814 18.181 -6.646 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -11.064 18.223 -6.560 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -11.062 20.290 -5.310 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -12.737 20.624 -5.702 1.00 0.00 H new ATOM 0 HE ARG A 36 -13.342 19.337 -3.795 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -10.081 19.297 -3.610 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -9.892 17.618 -3.091 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -13.201 16.760 -3.829 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -11.645 16.194 -3.214 1.00 0.00 H new ATOM 581 N PRO A 37 -12.778 16.512 -8.885 1.00 0.00 N ATOM 582 CA PRO A 37 -13.872 15.542 -9.025 1.00 0.00 C ATOM 583 C PRO A 37 -15.068 15.880 -8.129 1.00 0.00 C ATOM 584 O PRO A 37 -14.994 15.797 -6.918 1.00 0.00 O ATOM 585 CB PRO A 37 -13.241 14.225 -8.573 1.00 0.00 C ATOM 586 CG PRO A 37 -12.127 14.633 -7.668 1.00 0.00 C ATOM 587 CD PRO A 37 -11.606 15.934 -8.205 1.00 0.00 C ATOM 0 HA PRO A 37 -14.265 15.522 -10.042 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -13.964 13.597 -8.053 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -12.872 13.650 -9.422 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -12.480 14.748 -6.643 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -11.342 13.877 -7.651 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -11.243 16.582 -7.407 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -10.775 15.781 -8.894 1.00 0.00 H new ATOM 595 N GLY A 38 -16.176 16.245 -8.717 1.00 0.00 N ATOM 596 CA GLY A 38 -17.383 16.574 -7.906 1.00 0.00 C ATOM 597 C GLY A 38 -17.263 17.985 -7.327 1.00 0.00 C ATOM 598 O GLY A 38 -18.137 18.448 -6.619 1.00 0.00 O ATOM 0 H GLY A 38 -16.297 16.329 -9.726 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -18.277 16.502 -8.526 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -17.496 15.850 -7.099 1.00 0.00 H new ATOM 602 N ASP A 39 -16.195 18.676 -7.613 1.00 0.00 N ATOM 603 CA ASP A 39 -16.038 20.053 -7.065 1.00 0.00 C ATOM 604 C ASP A 39 -15.576 21.004 -8.172 1.00 0.00 C ATOM 605 O ASP A 39 -15.256 20.589 -9.268 1.00 0.00 O ATOM 606 CB ASP A 39 -15.001 20.039 -5.940 1.00 0.00 C ATOM 607 CG ASP A 39 -15.658 19.550 -4.647 1.00 0.00 C ATOM 608 OD1 ASP A 39 -16.872 19.624 -4.559 1.00 0.00 O ATOM 609 OD2 ASP A 39 -14.935 19.108 -3.770 1.00 0.00 O ATOM 0 H ASP A 39 -15.427 18.349 -8.200 1.00 0.00 H new ATOM 0 HA ASP A 39 -16.997 20.395 -6.675 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -14.168 19.388 -6.206 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -14.591 21.039 -5.797 1.00 0.00 H new ATOM 614 N SER A 40 -15.541 22.279 -7.890 1.00 0.00 N ATOM 615 CA SER A 40 -15.100 23.262 -8.921 1.00 0.00 C ATOM 616 C SER A 40 -14.534 24.504 -8.228 1.00 0.00 C ATOM 617 O SER A 40 -14.776 24.738 -7.062 1.00 0.00 O ATOM 618 CB SER A 40 -16.293 23.660 -9.790 1.00 0.00 C ATOM 619 OG SER A 40 -16.959 22.491 -10.244 1.00 0.00 O ATOM 0 H SER A 40 -15.799 22.682 -6.989 1.00 0.00 H new ATOM 0 HA SER A 40 -14.330 22.812 -9.548 1.00 0.00 H new ATOM 0 HB2 SER A 40 -16.980 24.284 -9.219 1.00 0.00 H new ATOM 0 HB3 SER A 40 -15.956 24.253 -10.640 1.00 0.00 H new ATOM 0 HG SER A 40 -17.725 22.746 -10.800 1.00 0.00 H new ATOM 625 N LEU A 41 -13.777 25.297 -8.935 1.00 0.00 N ATOM 626 CA LEU A 41 -13.186 26.520 -8.317 1.00 0.00 C ATOM 627 C LEU A 41 -14.278 27.569 -8.094 1.00 0.00 C ATOM 628 O LEU A 41 -15.050 27.872 -8.982 1.00 0.00 O ATOM 629 CB LEU A 41 -12.124 27.090 -9.261 1.00 0.00 C ATOM 630 CG LEU A 41 -11.131 27.948 -8.477 1.00 0.00 C ATOM 631 CD1 LEU A 41 -10.263 28.737 -9.459 1.00 0.00 C ATOM 632 CD2 LEU A 41 -11.884 28.923 -7.570 1.00 0.00 C ATOM 0 H LEU A 41 -13.541 25.151 -9.917 1.00 0.00 H new ATOM 0 HA LEU A 41 -12.736 26.262 -7.358 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.598 26.278 -9.762 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.600 27.689 -10.038 1.00 0.00 H new ATOM 0 HG LEU A 41 -10.504 27.302 -7.863 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -9.553 29.351 -8.905 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -9.720 28.045 -10.102 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -10.897 29.379 -10.071 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.169 29.530 -7.015 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -12.516 29.571 -8.177 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -12.505 28.363 -6.870 1.00 0.00 H new ATOM 644 N ALA A 42 -14.345 28.134 -6.919 1.00 0.00 N ATOM 645 CA ALA A 42 -15.382 29.169 -6.650 1.00 0.00 C ATOM 646 C ALA A 42 -14.707 30.517 -6.390 1.00 0.00 C ATOM 647 O ALA A 42 -15.175 31.549 -6.831 1.00 0.00 O ATOM 648 CB ALA A 42 -16.197 28.770 -5.420 1.00 0.00 C ATOM 0 H ALA A 42 -13.727 27.924 -6.135 1.00 0.00 H new ATOM 0 HA ALA A 42 -16.040 29.250 -7.515 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -16.955 29.528 -5.224 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -16.681 27.810 -5.600 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -15.536 28.687 -4.557 1.00 0.00 H new ATOM 654 N GLU A 43 -13.615 30.523 -5.673 1.00 0.00 N ATOM 655 CA GLU A 43 -12.925 31.814 -5.385 1.00 0.00 C ATOM 656 C GLU A 43 -11.407 31.620 -5.416 1.00 0.00 C ATOM 657 O GLU A 43 -10.898 30.556 -5.120 1.00 0.00 O ATOM 658 CB GLU A 43 -13.343 32.315 -4.002 1.00 0.00 C ATOM 659 CG GLU A 43 -14.854 32.553 -3.982 1.00 0.00 C ATOM 660 CD GLU A 43 -15.266 33.098 -2.612 1.00 0.00 C ATOM 661 OE1 GLU A 43 -14.444 33.064 -1.711 1.00 0.00 O ATOM 662 OE2 GLU A 43 -16.395 33.541 -2.489 1.00 0.00 O ATOM 0 H GLU A 43 -13.173 29.694 -5.276 1.00 0.00 H new ATOM 0 HA GLU A 43 -13.206 32.544 -6.144 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.069 31.585 -3.241 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -12.815 33.238 -3.763 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -15.132 33.259 -4.765 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -15.382 31.622 -4.189 1.00 0.00 H new ATOM 669 N VAL A 44 -10.679 32.645 -5.773 1.00 0.00 N ATOM 670 CA VAL A 44 -9.193 32.533 -5.827 1.00 0.00 C ATOM 671 C VAL A 44 -8.562 33.810 -5.269 1.00 0.00 C ATOM 672 O VAL A 44 -8.992 34.905 -5.572 1.00 0.00 O ATOM 673 CB VAL A 44 -8.755 32.361 -7.283 1.00 0.00 C ATOM 674 CG1 VAL A 44 -7.297 31.898 -7.325 1.00 0.00 C ATOM 675 CG2 VAL A 44 -9.641 31.316 -7.959 1.00 0.00 C ATOM 0 H VAL A 44 -11.052 33.559 -6.031 1.00 0.00 H new ATOM 0 HA VAL A 44 -8.873 31.676 -5.235 1.00 0.00 H new ATOM 0 HB VAL A 44 -8.849 33.312 -7.807 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -6.984 31.775 -8.362 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -6.665 32.642 -6.841 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -7.202 30.946 -6.802 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -9.331 31.192 -8.996 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.546 30.365 -7.436 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -10.680 31.645 -7.928 1.00 0.00 H new ATOM 685 N GLU A 45 -7.540 33.689 -4.465 1.00 0.00 N ATOM 686 CA GLU A 45 -6.892 34.912 -3.913 1.00 0.00 C ATOM 687 C GLU A 45 -5.382 34.832 -4.138 1.00 0.00 C ATOM 688 O GLU A 45 -4.807 33.763 -4.195 1.00 0.00 O ATOM 689 CB GLU A 45 -7.189 35.031 -2.417 1.00 0.00 C ATOM 690 CG GLU A 45 -8.703 35.088 -2.200 1.00 0.00 C ATOM 691 CD GLU A 45 -8.999 35.237 -0.707 1.00 0.00 C ATOM 692 OE1 GLU A 45 -8.086 35.048 0.080 1.00 0.00 O ATOM 693 OE2 GLU A 45 -10.134 35.537 -0.375 1.00 0.00 O ATOM 0 H GLU A 45 -7.129 32.804 -4.169 1.00 0.00 H new ATOM 0 HA GLU A 45 -7.288 35.791 -4.422 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -6.766 34.180 -1.883 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -6.719 35.927 -2.012 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -9.129 35.926 -2.751 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -9.171 34.182 -2.586 1.00 0.00 H new ATOM 700 N LEU A 46 -4.735 35.958 -4.276 1.00 0.00 N ATOM 701 CA LEU A 46 -3.264 35.953 -4.509 1.00 0.00 C ATOM 702 C LEU A 46 -2.558 36.682 -3.365 1.00 0.00 C ATOM 703 O LEU A 46 -3.019 37.697 -2.884 1.00 0.00 O ATOM 704 CB LEU A 46 -2.960 36.671 -5.826 1.00 0.00 C ATOM 705 CG LEU A 46 -1.478 36.504 -6.170 1.00 0.00 C ATOM 706 CD1 LEU A 46 -1.246 36.902 -7.629 1.00 0.00 C ATOM 707 CD2 LEU A 46 -0.635 37.400 -5.259 1.00 0.00 C ATOM 0 H LEU A 46 -5.164 36.883 -4.237 1.00 0.00 H new ATOM 0 HA LEU A 46 -2.909 34.924 -4.557 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -3.578 36.263 -6.626 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -3.207 37.729 -5.741 1.00 0.00 H new ATOM 0 HG LEU A 46 -1.188 35.463 -6.024 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.191 36.783 -7.875 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -1.844 36.264 -8.280 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -1.537 37.942 -7.773 1.00 0.00 H new ATOM 0 HD21 LEU A 46 0.420 37.280 -5.505 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -0.925 38.441 -5.403 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -0.799 37.118 -4.219 1.00 0.00 H new ATOM 719 N ARG A 47 -1.434 36.179 -2.936 1.00 0.00 N ATOM 720 CA ARG A 47 -0.691 36.851 -1.834 1.00 0.00 C ATOM 721 C ARG A 47 0.750 37.100 -2.282 1.00 0.00 C ATOM 722 O ARG A 47 1.423 36.213 -2.769 1.00 0.00 O ATOM 723 CB ARG A 47 -0.698 35.965 -0.588 1.00 0.00 C ATOM 724 CG ARG A 47 0.155 36.614 0.503 1.00 0.00 C ATOM 725 CD ARG A 47 -0.181 35.986 1.856 1.00 0.00 C ATOM 726 NE ARG A 47 0.511 34.672 1.979 1.00 0.00 N ATOM 727 CZ ARG A 47 0.624 34.101 3.146 1.00 0.00 C ATOM 728 NH1 ARG A 47 -0.217 34.393 4.101 1.00 0.00 N ATOM 729 NH2 ARG A 47 1.579 33.237 3.361 1.00 0.00 N ATOM 0 H ARG A 47 -0.998 35.332 -3.301 1.00 0.00 H new ATOM 0 HA ARG A 47 -1.171 37.800 -1.596 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -1.719 35.827 -0.232 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -0.308 34.976 -0.829 1.00 0.00 H new ATOM 0 HG2 ARG A 47 1.213 36.479 0.280 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.030 37.688 0.533 1.00 0.00 H new ATOM 0 HD2 ARG A 47 0.129 36.649 2.664 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -1.259 35.852 1.949 1.00 0.00 H new ATOM 0 HE ARG A 47 0.896 34.219 1.150 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -0.963 35.068 3.935 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -0.128 33.946 5.013 1.00 0.00 H new ATOM 0 HH21 ARG A 47 2.237 33.008 2.616 1.00 0.00 H new ATOM 0 HH22 ARG A 47 1.667 32.791 4.274 1.00 0.00 H new ATOM 743 N GLN A 48 1.224 38.306 -2.130 1.00 0.00 N ATOM 744 CA GLN A 48 2.618 38.622 -2.553 1.00 0.00 C ATOM 745 C GLN A 48 3.612 37.989 -1.580 1.00 0.00 C ATOM 746 O GLN A 48 3.370 37.911 -0.392 1.00 0.00 O ATOM 747 CB GLN A 48 2.813 40.139 -2.563 1.00 0.00 C ATOM 748 CG GLN A 48 1.731 40.786 -3.429 1.00 0.00 C ATOM 749 CD GLN A 48 2.133 42.226 -3.755 1.00 0.00 C ATOM 750 OE1 GLN A 48 3.027 42.773 -3.141 1.00 0.00 O ATOM 751 NE2 GLN A 48 1.505 42.866 -4.702 1.00 0.00 N ATOM 0 H GLN A 48 0.705 39.088 -1.730 1.00 0.00 H new ATOM 0 HA GLN A 48 2.790 38.222 -3.552 1.00 0.00 H new ATOM 0 HB2 GLN A 48 2.762 40.530 -1.547 1.00 0.00 H new ATOM 0 HB3 GLN A 48 3.801 40.387 -2.951 1.00 0.00 H new ATOM 0 HG2 GLN A 48 1.598 40.217 -4.349 1.00 0.00 H new ATOM 0 HG3 GLN A 48 0.775 40.773 -2.905 1.00 0.00 H new ATOM 0 HE21 GLN A 48 0.754 42.406 -5.217 1.00 0.00 H new ATOM 0 HE22 GLN A 48 1.764 43.826 -4.927 1.00 0.00 H new ATOM 760 N HIS A 49 4.733 37.542 -2.075 1.00 0.00 N ATOM 761 CA HIS A 49 5.748 36.917 -1.183 1.00 0.00 C ATOM 762 C HIS A 49 6.216 37.942 -0.147 1.00 0.00 C ATOM 763 O HIS A 49 6.814 38.946 -0.478 1.00 0.00 O ATOM 764 CB HIS A 49 6.947 36.458 -2.015 1.00 0.00 C ATOM 765 CG HIS A 49 7.611 35.293 -1.336 1.00 0.00 C ATOM 766 ND1 HIS A 49 8.987 35.190 -1.220 1.00 0.00 N ATOM 767 CD2 HIS A 49 7.099 34.171 -0.731 1.00 0.00 C ATOM 768 CE1 HIS A 49 9.256 34.044 -0.570 1.00 0.00 C ATOM 769 NE2 HIS A 49 8.139 33.383 -0.248 1.00 0.00 N ATOM 0 H HIS A 49 4.990 37.583 -3.061 1.00 0.00 H new ATOM 0 HA HIS A 49 5.305 36.059 -0.677 1.00 0.00 H new ATOM 0 HB2 HIS A 49 6.621 36.172 -3.015 1.00 0.00 H new ATOM 0 HB3 HIS A 49 7.657 37.277 -2.133 1.00 0.00 H new ATOM 0 HD2 HIS A 49 6.048 33.936 -0.644 1.00 0.00 H new ATOM 0 HE1 HIS A 49 10.253 33.699 -0.336 1.00 0.00 H new ATOM 0 HE2 HIS A 49 8.065 32.493 0.245 1.00 0.00 H new ATOM 777 N GLY A 50 5.951 37.691 1.105 1.00 0.00 N ATOM 778 CA GLY A 50 6.383 38.646 2.163 1.00 0.00 C ATOM 779 C GLY A 50 5.164 39.391 2.711 1.00 0.00 C ATOM 780 O GLY A 50 5.284 40.259 3.553 1.00 0.00 O ATOM 0 H GLY A 50 5.454 36.866 1.441 1.00 0.00 H new ATOM 0 HA2 GLY A 50 6.886 38.110 2.968 1.00 0.00 H new ATOM 0 HA3 GLY A 50 7.102 39.356 1.755 1.00 0.00 H new ATOM 784 N SER A 51 3.991 39.061 2.243 1.00 0.00 N ATOM 785 CA SER A 51 2.770 39.755 2.742 1.00 0.00 C ATOM 786 C SER A 51 1.899 38.763 3.514 1.00 0.00 C ATOM 787 O SER A 51 1.967 37.568 3.306 1.00 0.00 O ATOM 788 CB SER A 51 1.981 40.317 1.559 1.00 0.00 C ATOM 789 OG SER A 51 0.893 41.092 2.040 1.00 0.00 O ATOM 0 H SER A 51 3.826 38.342 1.538 1.00 0.00 H new ATOM 0 HA SER A 51 3.061 40.572 3.402 1.00 0.00 H new ATOM 0 HB2 SER A 51 2.630 40.931 0.934 1.00 0.00 H new ATOM 0 HB3 SER A 51 1.613 39.503 0.934 1.00 0.00 H new ATOM 0 HG SER A 51 0.388 41.454 1.282 1.00 0.00 H new ATOM 795 N GLU A 52 1.080 39.249 4.407 1.00 0.00 N ATOM 796 CA GLU A 52 0.207 38.336 5.196 1.00 0.00 C ATOM 797 C GLU A 52 -1.261 38.622 4.871 1.00 0.00 C ATOM 798 O GLU A 52 -2.159 38.009 5.414 1.00 0.00 O ATOM 799 CB GLU A 52 0.452 38.565 6.690 1.00 0.00 C ATOM 800 CG GLU A 52 -0.248 37.472 7.501 1.00 0.00 C ATOM 801 CD GLU A 52 -0.213 37.838 8.986 1.00 0.00 C ATOM 802 OE1 GLU A 52 0.303 38.897 9.302 1.00 0.00 O ATOM 803 OE2 GLU A 52 -0.704 37.054 9.781 1.00 0.00 O ATOM 0 H GLU A 52 0.978 40.240 4.624 1.00 0.00 H new ATOM 0 HA GLU A 52 0.439 37.302 4.942 1.00 0.00 H new ATOM 0 HB2 GLU A 52 1.522 38.557 6.898 1.00 0.00 H new ATOM 0 HB3 GLU A 52 0.077 39.546 6.984 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -1.280 37.361 7.167 1.00 0.00 H new ATOM 0 HG3 GLU A 52 0.244 36.513 7.340 1.00 0.00 H new ATOM 810 N GLU A 53 -1.517 39.551 3.989 1.00 0.00 N ATOM 811 CA GLU A 53 -2.929 39.872 3.638 1.00 0.00 C ATOM 812 C GLU A 53 -3.234 39.373 2.224 1.00 0.00 C ATOM 813 O GLU A 53 -3.019 40.066 1.249 1.00 0.00 O ATOM 814 CB GLU A 53 -3.140 41.385 3.697 1.00 0.00 C ATOM 815 CG GLU A 53 -3.032 41.860 5.147 1.00 0.00 C ATOM 816 CD GLU A 53 -3.474 43.322 5.239 1.00 0.00 C ATOM 817 OE1 GLU A 53 -3.774 43.895 4.205 1.00 0.00 O ATOM 818 OE2 GLU A 53 -3.503 43.844 6.342 1.00 0.00 O ATOM 0 H GLU A 53 -0.811 40.100 3.498 1.00 0.00 H new ATOM 0 HA GLU A 53 -3.596 39.382 4.348 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -2.396 41.891 3.081 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -4.118 41.642 3.291 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -3.655 41.239 5.792 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -2.006 41.756 5.499 1.00 0.00 H new ATOM 825 N TRP A 54 -3.739 38.177 2.108 1.00 0.00 N ATOM 826 CA TRP A 54 -4.068 37.633 0.761 1.00 0.00 C ATOM 827 C TRP A 54 -4.934 38.637 0.000 1.00 0.00 C ATOM 828 O TRP A 54 -5.832 39.244 0.550 1.00 0.00 O ATOM 829 CB TRP A 54 -4.831 36.319 0.920 1.00 0.00 C ATOM 830 CG TRP A 54 -3.868 35.216 1.215 1.00 0.00 C ATOM 831 CD1 TRP A 54 -3.342 34.948 2.431 1.00 0.00 C ATOM 832 CD2 TRP A 54 -3.308 34.233 0.299 1.00 0.00 C ATOM 833 NE1 TRP A 54 -2.493 33.860 2.320 1.00 0.00 N ATOM 834 CE2 TRP A 54 -2.438 33.385 1.025 1.00 0.00 C ATOM 835 CE3 TRP A 54 -3.468 33.998 -1.078 1.00 0.00 C ATOM 836 CZ2 TRP A 54 -1.753 32.339 0.405 1.00 0.00 C ATOM 837 CZ3 TRP A 54 -2.780 32.948 -1.705 1.00 0.00 C ATOM 838 CH2 TRP A 54 -1.923 32.120 -0.965 1.00 0.00 C ATOM 0 H TRP A 54 -3.938 37.552 2.889 1.00 0.00 H new ATOM 0 HA TRP A 54 -3.147 37.457 0.205 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -5.560 36.405 1.726 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -5.387 36.097 0.009 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -3.550 35.493 3.340 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -1.972 33.459 3.100 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -4.125 34.630 -1.657 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -1.096 31.703 0.980 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -2.911 32.776 -2.763 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -1.395 31.314 -1.453 1.00 0.00 H new ATOM 849 N GLU A 55 -4.669 38.815 -1.266 1.00 0.00 N ATOM 850 CA GLU A 55 -5.472 39.778 -2.071 1.00 0.00 C ATOM 851 C GLU A 55 -6.431 39.004 -2.977 1.00 0.00 C ATOM 852 O GLU A 55 -6.056 38.032 -3.605 1.00 0.00 O ATOM 853 CB GLU A 55 -4.538 40.634 -2.928 1.00 0.00 C ATOM 854 CG GLU A 55 -4.754 42.112 -2.598 1.00 0.00 C ATOM 855 CD GLU A 55 -3.896 42.973 -3.526 1.00 0.00 C ATOM 856 OE1 GLU A 55 -4.242 43.079 -4.692 1.00 0.00 O ATOM 857 OE2 GLU A 55 -2.907 43.512 -3.056 1.00 0.00 O ATOM 0 H GLU A 55 -3.930 38.334 -1.778 1.00 0.00 H new ATOM 0 HA GLU A 55 -6.042 40.424 -1.403 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -3.500 40.357 -2.742 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -4.731 40.455 -3.986 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -5.806 42.371 -2.714 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -4.491 42.306 -1.558 1.00 0.00 H new ATOM 864 N PRO A 56 -7.694 39.446 -3.040 1.00 0.00 N ATOM 865 CA PRO A 56 -8.719 38.797 -3.866 1.00 0.00 C ATOM 866 C PRO A 56 -8.475 39.023 -5.361 1.00 0.00 C ATOM 867 O PRO A 56 -8.008 40.068 -5.771 1.00 0.00 O ATOM 868 CB PRO A 56 -10.012 39.489 -3.439 1.00 0.00 C ATOM 869 CG PRO A 56 -9.576 40.818 -2.922 1.00 0.00 C ATOM 870 CD PRO A 56 -8.220 40.611 -2.310 1.00 0.00 C ATOM 0 HA PRO A 56 -8.731 37.716 -3.727 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -10.700 39.596 -4.278 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -10.533 38.917 -2.671 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -9.531 41.552 -3.727 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -10.282 41.198 -2.183 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -7.583 41.487 -2.437 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -8.287 40.418 -1.239 1.00 0.00 H new ATOM 878 N LEU A 57 -8.793 38.059 -6.178 1.00 0.00 N ATOM 879 CA LEU A 57 -8.585 38.225 -7.644 1.00 0.00 C ATOM 880 C LEU A 57 -9.942 38.411 -8.322 1.00 0.00 C ATOM 881 O LEU A 57 -10.933 37.847 -7.902 1.00 0.00 O ATOM 882 CB LEU A 57 -7.903 36.977 -8.208 1.00 0.00 C ATOM 883 CG LEU A 57 -6.391 37.093 -8.014 1.00 0.00 C ATOM 884 CD1 LEU A 57 -6.021 36.621 -6.607 1.00 0.00 C ATOM 885 CD2 LEU A 57 -5.675 36.224 -9.049 1.00 0.00 C ATOM 0 H LEU A 57 -9.188 37.162 -5.894 1.00 0.00 H new ATOM 0 HA LEU A 57 -7.956 39.096 -7.830 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -8.278 36.086 -7.705 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -8.138 36.868 -9.267 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.087 38.132 -8.141 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.943 36.703 -6.467 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -6.531 37.241 -5.869 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -6.325 35.582 -6.480 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.597 36.307 -8.911 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.978 35.185 -8.924 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -5.939 36.560 -10.052 1.00 0.00 H new ATOM 897 N THR A 58 -10.006 39.194 -9.366 1.00 0.00 N ATOM 898 CA THR A 58 -11.315 39.391 -10.044 1.00 0.00 C ATOM 899 C THR A 58 -11.433 38.403 -11.205 1.00 0.00 C ATOM 900 O THR A 58 -10.566 38.324 -12.055 1.00 0.00 O ATOM 901 CB THR A 58 -11.419 40.823 -10.576 1.00 0.00 C ATOM 902 OG1 THR A 58 -11.245 41.738 -9.505 1.00 0.00 O ATOM 903 CG2 THR A 58 -12.794 41.032 -11.213 1.00 0.00 C ATOM 0 H THR A 58 -9.218 39.699 -9.773 1.00 0.00 H new ATOM 0 HA THR A 58 -12.121 39.219 -9.330 1.00 0.00 H new ATOM 0 HB THR A 58 -10.645 40.991 -11.325 1.00 0.00 H new ATOM 0 HG1 THR A 58 -11.310 42.655 -9.844 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.868 42.051 -11.592 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.925 40.329 -12.036 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.570 40.865 -10.466 1.00 0.00 H new ATOM 911 N LYS A 59 -12.496 37.648 -11.246 1.00 0.00 N ATOM 912 CA LYS A 59 -12.664 36.665 -12.350 1.00 0.00 C ATOM 913 C LYS A 59 -12.943 37.419 -13.651 1.00 0.00 C ATOM 914 O LYS A 59 -13.987 38.017 -13.816 1.00 0.00 O ATOM 915 CB LYS A 59 -13.840 35.742 -12.032 1.00 0.00 C ATOM 916 CG LYS A 59 -13.688 34.435 -12.810 1.00 0.00 C ATOM 917 CD LYS A 59 -14.696 33.410 -12.286 1.00 0.00 C ATOM 918 CE LYS A 59 -14.408 32.044 -12.912 1.00 0.00 C ATOM 919 NZ LYS A 59 -15.519 31.106 -12.587 1.00 0.00 N ATOM 0 H LYS A 59 -13.254 37.670 -10.563 1.00 0.00 H new ATOM 0 HA LYS A 59 -11.757 36.070 -12.458 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -13.877 35.538 -10.962 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -14.779 36.228 -12.297 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -13.851 34.611 -13.873 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -12.673 34.051 -12.703 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -14.633 33.345 -11.200 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -15.711 33.726 -12.528 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -14.304 32.142 -13.993 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -13.464 31.651 -12.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -15.324 30.177 -13.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -15.597 31.005 -11.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -16.412 31.480 -12.967 1.00 0.00 H new ATOM 933 N LYS A 60 -12.024 37.404 -14.577 1.00 0.00 N ATOM 934 CA LYS A 60 -12.261 38.132 -15.856 1.00 0.00 C ATOM 935 C LYS A 60 -12.410 37.126 -16.998 1.00 0.00 C ATOM 936 O LYS A 60 -11.475 36.440 -17.360 1.00 0.00 O ATOM 937 CB LYS A 60 -11.079 39.061 -16.140 1.00 0.00 C ATOM 938 CG LYS A 60 -11.053 40.186 -15.104 1.00 0.00 C ATOM 939 CD LYS A 60 -10.628 41.492 -15.783 1.00 0.00 C ATOM 940 CE LYS A 60 -10.809 42.656 -14.808 1.00 0.00 C ATOM 941 NZ LYS A 60 -9.614 42.754 -13.923 1.00 0.00 N ATOM 0 H LYS A 60 -11.127 36.924 -14.505 1.00 0.00 H new ATOM 0 HA LYS A 60 -13.174 38.722 -15.775 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -10.145 38.500 -16.106 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -11.164 39.478 -17.143 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -12.038 40.302 -14.652 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -10.360 39.939 -14.300 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -9.587 41.428 -16.100 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -11.224 41.659 -16.680 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -10.945 43.587 -15.358 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -11.707 42.506 -14.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -9.622 43.669 -13.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -9.635 41.983 -13.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -8.750 42.678 -14.497 1.00 0.00 H new ATOM 955 N GLY A 61 -13.580 37.029 -17.570 1.00 0.00 N ATOM 956 CA GLY A 61 -13.785 36.065 -18.687 1.00 0.00 C ATOM 957 C GLY A 61 -13.426 34.655 -18.213 1.00 0.00 C ATOM 958 O GLY A 61 -14.175 34.021 -17.497 1.00 0.00 O ATOM 0 H GLY A 61 -14.402 37.576 -17.312 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -14.822 36.095 -19.022 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -13.166 36.343 -19.540 1.00 0.00 H new ATOM 962 N ASN A 62 -12.284 34.159 -18.607 1.00 0.00 N ATOM 963 CA ASN A 62 -11.878 32.791 -18.177 1.00 0.00 C ATOM 964 C ASN A 62 -10.521 32.861 -17.475 1.00 0.00 C ATOM 965 O ASN A 62 -9.843 31.865 -17.312 1.00 0.00 O ATOM 966 CB ASN A 62 -11.772 31.881 -19.402 1.00 0.00 C ATOM 967 CG ASN A 62 -13.174 31.565 -19.926 1.00 0.00 C ATOM 968 OD1 ASN A 62 -14.151 31.741 -19.227 1.00 0.00 O ATOM 969 ND2 ASN A 62 -13.313 31.101 -21.138 1.00 0.00 N ATOM 0 H ASN A 62 -11.616 34.642 -19.207 1.00 0.00 H new ATOM 0 HA ASN A 62 -12.623 32.389 -17.490 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -11.183 32.367 -20.179 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -11.254 30.959 -19.139 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -14.243 30.886 -21.498 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -12.492 30.953 -21.725 1.00 0.00 H new ATOM 976 N VAL A 63 -10.119 34.029 -17.055 1.00 0.00 N ATOM 977 CA VAL A 63 -8.808 34.164 -16.362 1.00 0.00 C ATOM 978 C VAL A 63 -8.998 34.960 -15.070 1.00 0.00 C ATOM 979 O VAL A 63 -10.107 35.241 -14.662 1.00 0.00 O ATOM 980 CB VAL A 63 -7.823 34.900 -17.271 1.00 0.00 C ATOM 981 CG1 VAL A 63 -7.474 34.014 -18.469 1.00 0.00 C ATOM 982 CG2 VAL A 63 -8.461 36.199 -17.766 1.00 0.00 C ATOM 0 H VAL A 63 -10.644 34.897 -17.162 1.00 0.00 H new ATOM 0 HA VAL A 63 -8.416 33.174 -16.128 1.00 0.00 H new ATOM 0 HB VAL A 63 -6.915 35.130 -16.713 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -6.772 34.538 -19.117 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -7.020 33.088 -18.117 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -8.381 33.784 -19.028 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -7.760 36.725 -18.414 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -9.369 35.969 -18.324 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -8.710 36.830 -16.913 1.00 0.00 H new ATOM 992 N TRP A 64 -7.926 35.331 -14.423 1.00 0.00 N ATOM 993 CA TRP A 64 -8.056 36.113 -13.162 1.00 0.00 C ATOM 994 C TRP A 64 -7.078 37.288 -13.188 1.00 0.00 C ATOM 995 O TRP A 64 -5.966 37.174 -13.671 1.00 0.00 O ATOM 996 CB TRP A 64 -7.747 35.211 -11.966 1.00 0.00 C ATOM 997 CG TRP A 64 -8.833 34.194 -11.820 1.00 0.00 C ATOM 998 CD1 TRP A 64 -8.992 33.109 -12.612 1.00 0.00 C ATOM 999 CD2 TRP A 64 -9.912 34.148 -10.842 1.00 0.00 C ATOM 1000 NE1 TRP A 64 -10.099 32.400 -12.182 1.00 0.00 N ATOM 1001 CE2 TRP A 64 -10.700 33.001 -11.094 1.00 0.00 C ATOM 1002 CE3 TRP A 64 -10.279 34.983 -9.771 1.00 0.00 C ATOM 1003 CZ2 TRP A 64 -11.814 32.692 -10.311 1.00 0.00 C ATOM 1004 CZ3 TRP A 64 -11.399 34.675 -8.981 1.00 0.00 C ATOM 1005 CH2 TRP A 64 -12.164 33.531 -9.251 1.00 0.00 C ATOM 0 H TRP A 64 -6.970 35.127 -14.713 1.00 0.00 H new ATOM 0 HA TRP A 64 -9.074 36.492 -13.073 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -6.786 34.716 -12.108 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -7.667 35.807 -11.057 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -8.358 32.840 -13.444 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -10.431 31.538 -12.616 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -9.696 35.866 -9.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -12.401 31.811 -10.524 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -11.672 35.323 -8.161 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -13.023 33.299 -8.639 1.00 0.00 H new ATOM 1016 N GLU A 65 -7.481 38.420 -12.677 1.00 0.00 N ATOM 1017 CA GLU A 65 -6.574 39.604 -12.679 1.00 0.00 C ATOM 1018 C GLU A 65 -6.369 40.101 -11.247 1.00 0.00 C ATOM 1019 O GLU A 65 -7.305 40.224 -10.481 1.00 0.00 O ATOM 1020 CB GLU A 65 -7.198 40.720 -13.519 1.00 0.00 C ATOM 1021 CG GLU A 65 -7.302 40.263 -14.976 1.00 0.00 C ATOM 1022 CD GLU A 65 -7.214 41.481 -15.898 1.00 0.00 C ATOM 1023 OE1 GLU A 65 -7.311 42.589 -15.397 1.00 0.00 O ATOM 1024 OE2 GLU A 65 -7.053 41.284 -17.093 1.00 0.00 O ATOM 0 H GLU A 65 -8.398 38.576 -12.259 1.00 0.00 H new ATOM 0 HA GLU A 65 -5.611 39.320 -13.103 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -8.186 40.971 -13.134 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -6.591 41.623 -13.452 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -6.501 39.560 -15.206 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -8.243 39.738 -15.138 1.00 0.00 H new ATOM 1031 N VAL A 66 -5.151 40.392 -10.880 1.00 0.00 N ATOM 1032 CA VAL A 66 -4.883 40.886 -9.500 1.00 0.00 C ATOM 1033 C VAL A 66 -4.015 42.143 -9.575 1.00 0.00 C ATOM 1034 O VAL A 66 -3.001 42.168 -10.245 1.00 0.00 O ATOM 1035 CB VAL A 66 -4.152 39.802 -8.703 1.00 0.00 C ATOM 1036 CG1 VAL A 66 -2.682 39.757 -9.127 1.00 0.00 C ATOM 1037 CG2 VAL A 66 -4.243 40.118 -7.209 1.00 0.00 C ATOM 0 H VAL A 66 -4.329 40.309 -11.478 1.00 0.00 H new ATOM 0 HA VAL A 66 -5.825 41.123 -9.005 1.00 0.00 H new ATOM 0 HB VAL A 66 -4.615 38.835 -8.899 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.163 38.985 -8.559 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.617 39.530 -10.191 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.218 40.724 -8.933 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.723 39.346 -6.642 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -3.782 41.086 -7.013 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -5.290 40.147 -6.906 1.00 0.00 H new ATOM 1047 N LYS A 67 -4.400 43.190 -8.896 1.00 0.00 N ATOM 1048 CA LYS A 67 -3.590 44.439 -8.937 1.00 0.00 C ATOM 1049 C LYS A 67 -3.165 44.826 -7.520 1.00 0.00 C ATOM 1050 O LYS A 67 -3.954 44.817 -6.596 1.00 0.00 O ATOM 1051 CB LYS A 67 -4.421 45.569 -9.550 1.00 0.00 C ATOM 1052 CG LYS A 67 -3.711 46.906 -9.324 1.00 0.00 C ATOM 1053 CD LYS A 67 -4.532 48.032 -9.954 1.00 0.00 C ATOM 1054 CE LYS A 67 -3.658 49.278 -10.106 1.00 0.00 C ATOM 1055 NZ LYS A 67 -3.700 50.072 -8.845 1.00 0.00 N ATOM 0 H LYS A 67 -5.238 43.233 -8.316 1.00 0.00 H new ATOM 0 HA LYS A 67 -2.701 44.271 -9.545 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -4.560 45.395 -10.617 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -5.413 45.591 -9.099 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -3.585 47.087 -8.257 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -2.714 46.879 -9.763 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -4.911 47.720 -10.927 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -5.399 48.256 -9.332 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -2.632 48.990 -10.333 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -4.011 49.883 -10.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -3.106 50.919 -8.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -4.680 50.358 -8.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -3.343 49.493 -8.058 1.00 0.00 H new ATOM 1069 N SER A 68 -1.917 45.165 -7.346 1.00 0.00 N ATOM 1070 CA SER A 68 -1.421 45.554 -5.996 1.00 0.00 C ATOM 1071 C SER A 68 -0.939 47.005 -6.035 1.00 0.00 C ATOM 1072 O SER A 68 -0.558 47.513 -7.069 1.00 0.00 O ATOM 1073 CB SER A 68 -0.255 44.645 -5.607 1.00 0.00 C ATOM 1074 OG SER A 68 0.003 44.773 -4.215 1.00 0.00 O ATOM 0 H SER A 68 -1.215 45.189 -8.086 1.00 0.00 H new ATOM 0 HA SER A 68 -2.224 45.454 -5.266 1.00 0.00 H new ATOM 0 HB2 SER A 68 -0.491 43.609 -5.850 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.634 44.912 -6.178 1.00 0.00 H new ATOM 0 HG SER A 68 -0.532 44.117 -3.721 1.00 0.00 H new ATOM 1080 N SER A 69 -0.947 47.674 -4.917 1.00 0.00 N ATOM 1081 CA SER A 69 -0.482 49.089 -4.899 1.00 0.00 C ATOM 1082 C SER A 69 1.048 49.118 -4.863 1.00 0.00 C ATOM 1083 O SER A 69 1.661 50.164 -4.925 1.00 0.00 O ATOM 1084 CB SER A 69 -1.036 49.795 -3.660 1.00 0.00 C ATOM 1085 OG SER A 69 -2.449 49.655 -3.627 1.00 0.00 O ATOM 0 H SER A 69 -1.254 47.304 -4.017 1.00 0.00 H new ATOM 0 HA SER A 69 -0.836 49.601 -5.794 1.00 0.00 H new ATOM 0 HB2 SER A 69 -0.597 49.368 -2.758 1.00 0.00 H new ATOM 0 HB3 SER A 69 -0.765 50.851 -3.678 1.00 0.00 H new ATOM 0 HG SER A 69 -2.804 50.106 -2.832 1.00 0.00 H new ATOM 1091 N LYS A 70 1.667 47.973 -4.766 1.00 0.00 N ATOM 1092 CA LYS A 70 3.156 47.929 -4.728 1.00 0.00 C ATOM 1093 C LYS A 70 3.657 46.939 -5.782 1.00 0.00 C ATOM 1094 O LYS A 70 2.880 46.279 -6.443 1.00 0.00 O ATOM 1095 CB LYS A 70 3.614 47.475 -3.340 1.00 0.00 C ATOM 1096 CG LYS A 70 4.256 48.651 -2.603 1.00 0.00 C ATOM 1097 CD LYS A 70 4.660 48.212 -1.194 1.00 0.00 C ATOM 1098 CE LYS A 70 4.495 49.385 -0.226 1.00 0.00 C ATOM 1099 NZ LYS A 70 5.829 49.778 0.309 1.00 0.00 N ATOM 0 H LYS A 70 1.205 47.065 -4.711 1.00 0.00 H new ATOM 0 HA LYS A 70 3.560 48.920 -4.937 1.00 0.00 H new ATOM 0 HB2 LYS A 70 2.765 47.096 -2.771 1.00 0.00 H new ATOM 0 HB3 LYS A 70 4.328 46.656 -3.431 1.00 0.00 H new ATOM 0 HG2 LYS A 70 5.130 49.003 -3.150 1.00 0.00 H new ATOM 0 HG3 LYS A 70 3.557 49.485 -2.549 1.00 0.00 H new ATOM 0 HD2 LYS A 70 4.044 47.372 -0.873 1.00 0.00 H new ATOM 0 HD3 LYS A 70 5.694 47.868 -1.192 1.00 0.00 H new ATOM 0 HE2 LYS A 70 4.033 50.230 -0.737 1.00 0.00 H new ATOM 0 HE3 LYS A 70 3.831 49.105 0.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 5.718 50.575 0.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 6.253 48.972 0.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 6.448 50.062 -0.477 1.00 0.00 H new ATOM 1113 N PRO A 71 4.985 46.836 -5.940 1.00 0.00 N ATOM 1114 CA PRO A 71 5.595 45.924 -6.915 1.00 0.00 C ATOM 1115 C PRO A 71 5.413 44.457 -6.511 1.00 0.00 C ATOM 1116 O PRO A 71 5.787 44.050 -5.429 1.00 0.00 O ATOM 1117 CB PRO A 71 7.076 46.301 -6.882 1.00 0.00 C ATOM 1118 CG PRO A 71 7.280 46.899 -5.530 1.00 0.00 C ATOM 1119 CD PRO A 71 5.995 47.596 -5.182 1.00 0.00 C ATOM 0 HA PRO A 71 5.143 46.017 -7.903 1.00 0.00 H new ATOM 0 HB2 PRO A 71 7.711 45.428 -7.029 1.00 0.00 H new ATOM 0 HB3 PRO A 71 7.322 47.011 -7.671 1.00 0.00 H new ATOM 0 HG2 PRO A 71 7.517 46.129 -4.795 1.00 0.00 H new ATOM 0 HG3 PRO A 71 8.114 47.601 -5.536 1.00 0.00 H new ATOM 0 HD2 PRO A 71 5.799 47.568 -4.110 1.00 0.00 H new ATOM 0 HD3 PRO A 71 6.014 48.646 -5.476 1.00 0.00 H new ATOM 1127 N LEU A 72 4.839 43.664 -7.373 1.00 0.00 N ATOM 1128 CA LEU A 72 4.628 42.226 -7.041 1.00 0.00 C ATOM 1129 C LEU A 72 5.971 41.563 -6.735 1.00 0.00 C ATOM 1130 O LEU A 72 6.966 41.818 -7.384 1.00 0.00 O ATOM 1131 CB LEU A 72 3.965 41.523 -8.227 1.00 0.00 C ATOM 1132 CG LEU A 72 2.683 42.268 -8.609 1.00 0.00 C ATOM 1133 CD1 LEU A 72 2.331 41.965 -10.066 1.00 0.00 C ATOM 1134 CD2 LEU A 72 1.538 41.809 -7.703 1.00 0.00 C ATOM 0 H LEU A 72 4.506 43.950 -8.294 1.00 0.00 H new ATOM 0 HA LEU A 72 3.984 42.148 -6.165 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.649 41.495 -9.075 1.00 0.00 H new ATOM 0 HB3 LEU A 72 3.735 40.489 -7.969 1.00 0.00 H new ATOM 0 HG LEU A 72 2.837 43.340 -8.488 1.00 0.00 H new ATOM 0 HD11 LEU A 72 1.418 42.495 -10.338 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.146 42.290 -10.712 1.00 0.00 H new ATOM 0 HD13 LEU A 72 2.177 40.893 -10.188 1.00 0.00 H new ATOM 0 HD21 LEU A 72 0.625 42.339 -7.974 1.00 0.00 H new ATOM 0 HD22 LEU A 72 1.385 40.737 -7.825 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.787 42.024 -6.664 1.00 0.00 H new ATOM 1146 N VAL A 73 6.005 40.714 -5.744 1.00 0.00 N ATOM 1147 CA VAL A 73 7.279 40.031 -5.384 1.00 0.00 C ATOM 1148 C VAL A 73 7.067 38.515 -5.391 1.00 0.00 C ATOM 1149 O VAL A 73 6.196 37.997 -4.719 1.00 0.00 O ATOM 1150 CB VAL A 73 7.715 40.476 -3.986 1.00 0.00 C ATOM 1151 CG1 VAL A 73 9.066 39.842 -3.647 1.00 0.00 C ATOM 1152 CG2 VAL A 73 7.843 41.999 -3.953 1.00 0.00 C ATOM 0 H VAL A 73 5.202 40.464 -5.167 1.00 0.00 H new ATOM 0 HA VAL A 73 8.049 40.293 -6.109 1.00 0.00 H new ATOM 0 HB VAL A 73 6.972 40.158 -3.255 1.00 0.00 H new ATOM 0 HG11 VAL A 73 9.377 40.159 -2.651 1.00 0.00 H new ATOM 0 HG12 VAL A 73 8.974 38.756 -3.670 1.00 0.00 H new ATOM 0 HG13 VAL A 73 9.810 40.159 -4.378 1.00 0.00 H new ATOM 0 HG21 VAL A 73 8.153 42.317 -2.958 1.00 0.00 H new ATOM 0 HG22 VAL A 73 8.586 42.318 -4.684 1.00 0.00 H new ATOM 0 HG23 VAL A 73 6.881 42.450 -4.194 1.00 0.00 H new ATOM 1162 N GLY A 74 7.856 37.800 -6.142 1.00 0.00 N ATOM 1163 CA GLY A 74 7.703 36.317 -6.189 1.00 0.00 C ATOM 1164 C GLY A 74 8.676 35.674 -5.197 1.00 0.00 C ATOM 1165 O GLY A 74 9.575 36.319 -4.694 1.00 0.00 O ATOM 0 H GLY A 74 8.602 38.178 -6.727 1.00 0.00 H new ATOM 0 HA2 GLY A 74 6.678 36.038 -5.943 1.00 0.00 H new ATOM 0 HA3 GLY A 74 7.900 35.952 -7.197 1.00 0.00 H new ATOM 1169 N PRO A 75 8.489 34.376 -4.908 1.00 0.00 N ATOM 1170 CA PRO A 75 7.411 33.570 -5.500 1.00 0.00 C ATOM 1171 C PRO A 75 6.027 34.035 -5.042 1.00 0.00 C ATOM 1172 O PRO A 75 5.846 34.498 -3.934 1.00 0.00 O ATOM 1173 CB PRO A 75 7.698 32.158 -4.992 1.00 0.00 C ATOM 1174 CG PRO A 75 8.474 32.366 -3.738 1.00 0.00 C ATOM 1175 CD PRO A 75 9.313 33.589 -3.973 1.00 0.00 C ATOM 0 HA PRO A 75 7.394 33.646 -6.587 1.00 0.00 H new ATOM 0 HB2 PRO A 75 6.776 31.609 -4.802 1.00 0.00 H new ATOM 0 HB3 PRO A 75 8.268 31.582 -5.721 1.00 0.00 H new ATOM 0 HG2 PRO A 75 7.809 32.506 -2.886 1.00 0.00 H new ATOM 0 HG3 PRO A 75 9.098 31.500 -3.517 1.00 0.00 H new ATOM 0 HD2 PRO A 75 9.505 34.132 -3.047 1.00 0.00 H new ATOM 0 HD3 PRO A 75 10.283 33.338 -4.402 1.00 0.00 H new ATOM 1183 N PHE A 76 5.055 33.924 -5.903 1.00 0.00 N ATOM 1184 CA PHE A 76 3.678 34.368 -5.553 1.00 0.00 C ATOM 1185 C PHE A 76 2.884 33.212 -4.942 1.00 0.00 C ATOM 1186 O PHE A 76 3.101 32.056 -5.257 1.00 0.00 O ATOM 1187 CB PHE A 76 2.975 34.845 -6.824 1.00 0.00 C ATOM 1188 CG PHE A 76 3.698 36.056 -7.365 1.00 0.00 C ATOM 1189 CD1 PHE A 76 3.636 37.271 -6.673 1.00 0.00 C ATOM 1190 CD2 PHE A 76 4.433 35.963 -8.553 1.00 0.00 C ATOM 1191 CE1 PHE A 76 4.308 38.393 -7.170 1.00 0.00 C ATOM 1192 CE2 PHE A 76 5.106 37.085 -9.049 1.00 0.00 C ATOM 1193 CZ PHE A 76 5.044 38.301 -8.358 1.00 0.00 C ATOM 0 H PHE A 76 5.157 33.541 -6.843 1.00 0.00 H new ATOM 0 HA PHE A 76 3.737 35.177 -4.825 1.00 0.00 H new ATOM 0 HB2 PHE A 76 2.965 34.049 -7.569 1.00 0.00 H new ATOM 0 HB3 PHE A 76 1.936 35.093 -6.608 1.00 0.00 H new ATOM 0 HD1 PHE A 76 3.070 37.342 -5.756 1.00 0.00 H new ATOM 0 HD2 PHE A 76 4.481 35.025 -9.087 1.00 0.00 H new ATOM 0 HE1 PHE A 76 4.259 39.331 -6.637 1.00 0.00 H new ATOM 0 HE2 PHE A 76 5.673 37.013 -9.965 1.00 0.00 H new ATOM 0 HZ PHE A 76 5.563 39.167 -8.741 1.00 0.00 H new ATOM 1203 N ASN A 77 1.953 33.521 -4.080 1.00 0.00 N ATOM 1204 CA ASN A 77 1.126 32.452 -3.455 1.00 0.00 C ATOM 1205 C ASN A 77 -0.311 32.577 -3.968 1.00 0.00 C ATOM 1206 O ASN A 77 -0.813 33.665 -4.172 1.00 0.00 O ATOM 1207 CB ASN A 77 1.139 32.617 -1.933 1.00 0.00 C ATOM 1208 CG ASN A 77 2.562 32.926 -1.465 1.00 0.00 C ATOM 1209 OD1 ASN A 77 3.404 32.050 -1.423 1.00 0.00 O ATOM 1210 ND2 ASN A 77 2.868 34.143 -1.106 1.00 0.00 N ATOM 0 H ASN A 77 1.730 34.471 -3.782 1.00 0.00 H new ATOM 0 HA ASN A 77 1.530 31.473 -3.713 1.00 0.00 H new ATOM 0 HB2 ASN A 77 0.465 33.421 -1.638 1.00 0.00 H new ATOM 0 HB3 ASN A 77 0.777 31.707 -1.455 1.00 0.00 H new ATOM 0 HD21 ASN A 77 3.814 34.359 -0.790 1.00 0.00 H new ATOM 0 HD22 ASN A 77 2.162 34.878 -1.141 1.00 0.00 H new ATOM 1217 N PHE A 78 -0.979 31.478 -4.183 1.00 0.00 N ATOM 1218 CA PHE A 78 -2.379 31.550 -4.688 1.00 0.00 C ATOM 1219 C PHE A 78 -3.264 30.583 -3.896 1.00 0.00 C ATOM 1220 O PHE A 78 -3.016 29.393 -3.861 1.00 0.00 O ATOM 1221 CB PHE A 78 -2.409 31.158 -6.167 1.00 0.00 C ATOM 1222 CG PHE A 78 -1.671 32.189 -6.995 1.00 0.00 C ATOM 1223 CD1 PHE A 78 -0.280 32.114 -7.132 1.00 0.00 C ATOM 1224 CD2 PHE A 78 -2.382 33.211 -7.635 1.00 0.00 C ATOM 1225 CE1 PHE A 78 0.401 33.061 -7.909 1.00 0.00 C ATOM 1226 CE2 PHE A 78 -1.702 34.159 -8.412 1.00 0.00 C ATOM 1227 CZ PHE A 78 -0.310 34.084 -8.549 1.00 0.00 C ATOM 0 H PHE A 78 -0.618 30.536 -4.032 1.00 0.00 H new ATOM 0 HA PHE A 78 -2.751 32.568 -4.568 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -1.951 30.178 -6.301 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -3.441 31.077 -6.509 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.269 31.326 -6.639 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.455 33.269 -7.530 1.00 0.00 H new ATOM 0 HE1 PHE A 78 1.474 33.002 -8.014 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -2.251 34.947 -8.905 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.214 34.814 -9.147 1.00 0.00 H new ATOM 1237 N ARG A 79 -4.302 31.073 -3.268 1.00 0.00 N ATOM 1238 CA ARG A 79 -5.197 30.162 -2.499 1.00 0.00 C ATOM 1239 C ARG A 79 -6.470 29.927 -3.313 1.00 0.00 C ATOM 1240 O ARG A 79 -6.958 30.810 -3.991 1.00 0.00 O ATOM 1241 CB ARG A 79 -5.542 30.784 -1.144 1.00 0.00 C ATOM 1242 CG ARG A 79 -6.622 29.945 -0.457 1.00 0.00 C ATOM 1243 CD ARG A 79 -6.858 30.477 0.958 1.00 0.00 C ATOM 1244 NE ARG A 79 -7.636 31.746 0.889 1.00 0.00 N ATOM 1245 CZ ARG A 79 -7.849 32.441 1.973 1.00 0.00 C ATOM 1246 NH1 ARG A 79 -7.164 32.190 3.055 1.00 0.00 N ATOM 1247 NH2 ARG A 79 -8.747 33.388 1.976 1.00 0.00 N ATOM 0 H ARG A 79 -4.566 32.058 -3.255 1.00 0.00 H new ATOM 0 HA ARG A 79 -4.694 29.212 -2.320 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -4.652 30.833 -0.517 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -5.893 31.807 -1.280 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -7.548 29.984 -1.031 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -6.315 28.900 -0.418 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -7.398 29.738 1.550 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -5.904 30.649 1.457 1.00 0.00 H new ATOM 0 HE ARG A 79 -8.002 32.072 -0.006 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -6.462 31.450 3.054 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -7.331 32.734 3.902 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -9.283 33.585 1.131 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -8.913 33.931 2.824 1.00 0.00 H new ATOM 1261 N PHE A 80 -6.988 28.730 -3.288 1.00 0.00 N ATOM 1262 CA PHE A 80 -8.201 28.426 -4.099 1.00 0.00 C ATOM 1263 C PHE A 80 -9.322 27.843 -3.238 1.00 0.00 C ATOM 1264 O PHE A 80 -9.088 27.080 -2.326 1.00 0.00 O ATOM 1265 CB PHE A 80 -7.819 27.391 -5.151 1.00 0.00 C ATOM 1266 CG PHE A 80 -7.141 28.086 -6.307 1.00 0.00 C ATOM 1267 CD1 PHE A 80 -5.815 28.517 -6.180 1.00 0.00 C ATOM 1268 CD2 PHE A 80 -7.837 28.305 -7.501 1.00 0.00 C ATOM 1269 CE1 PHE A 80 -5.186 29.167 -7.248 1.00 0.00 C ATOM 1270 CE2 PHE A 80 -7.206 28.954 -8.569 1.00 0.00 C ATOM 1271 CZ PHE A 80 -5.882 29.385 -8.442 1.00 0.00 C ATOM 0 H PHE A 80 -6.624 27.949 -2.741 1.00 0.00 H new ATOM 0 HA PHE A 80 -8.559 29.352 -4.550 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -7.153 26.644 -4.719 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -8.707 26.863 -5.499 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -5.278 28.348 -5.258 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -8.860 27.974 -7.599 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -4.163 29.500 -7.150 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -7.742 29.122 -9.491 1.00 0.00 H new ATOM 0 HZ PHE A 80 -5.396 29.886 -9.266 1.00 0.00 H new ATOM 1281 N MET A 81 -10.547 28.182 -3.542 1.00 0.00 N ATOM 1282 CA MET A 81 -11.693 27.627 -2.765 1.00 0.00 C ATOM 1283 C MET A 81 -12.678 26.998 -3.753 1.00 0.00 C ATOM 1284 O MET A 81 -13.081 27.615 -4.718 1.00 0.00 O ATOM 1285 CB MET A 81 -12.380 28.742 -1.970 1.00 0.00 C ATOM 1286 CG MET A 81 -13.757 28.264 -1.506 1.00 0.00 C ATOM 1287 SD MET A 81 -14.512 29.529 -0.454 1.00 0.00 S ATOM 1288 CE MET A 81 -14.565 28.554 1.069 1.00 0.00 C ATOM 0 H MET A 81 -10.803 28.820 -4.296 1.00 0.00 H new ATOM 0 HA MET A 81 -11.340 26.876 -2.059 1.00 0.00 H new ATOM 0 HB2 MET A 81 -11.770 29.018 -1.110 1.00 0.00 H new ATOM 0 HB3 MET A 81 -12.482 29.634 -2.588 1.00 0.00 H new ATOM 0 HG2 MET A 81 -14.394 28.065 -2.368 1.00 0.00 H new ATOM 0 HG3 MET A 81 -13.662 27.328 -0.956 1.00 0.00 H new ATOM 0 HE1 MET A 81 -15.586 28.529 1.450 1.00 0.00 H new ATOM 0 HE2 MET A 81 -14.230 27.537 0.862 1.00 0.00 H new ATOM 0 HE3 MET A 81 -13.911 29.007 1.814 1.00 0.00 H new ATOM 1298 N SER A 82 -13.039 25.760 -3.542 1.00 0.00 N ATOM 1299 CA SER A 82 -13.960 25.088 -4.498 1.00 0.00 C ATOM 1300 C SER A 82 -15.399 25.552 -4.268 1.00 0.00 C ATOM 1301 O SER A 82 -15.808 25.794 -3.148 1.00 0.00 O ATOM 1302 CB SER A 82 -13.885 23.574 -4.297 1.00 0.00 C ATOM 1303 OG SER A 82 -14.691 23.207 -3.187 1.00 0.00 O ATOM 0 H SER A 82 -12.737 25.189 -2.753 1.00 0.00 H new ATOM 0 HA SER A 82 -13.660 25.346 -5.514 1.00 0.00 H new ATOM 0 HB2 SER A 82 -14.227 23.059 -5.195 1.00 0.00 H new ATOM 0 HB3 SER A 82 -12.852 23.269 -4.128 1.00 0.00 H new ATOM 0 HG SER A 82 -15.418 22.623 -3.489 1.00 0.00 H new ATOM 1309 N LYS A 83 -16.171 25.652 -5.316 1.00 0.00 N ATOM 1310 CA LYS A 83 -17.592 26.078 -5.160 1.00 0.00 C ATOM 1311 C LYS A 83 -18.237 25.254 -4.043 1.00 0.00 C ATOM 1312 O LYS A 83 -18.935 25.776 -3.197 1.00 0.00 O ATOM 1313 CB LYS A 83 -18.347 25.848 -6.471 1.00 0.00 C ATOM 1314 CG LYS A 83 -17.748 26.731 -7.567 1.00 0.00 C ATOM 1315 CD LYS A 83 -18.735 26.838 -8.732 1.00 0.00 C ATOM 1316 CE LYS A 83 -18.214 27.850 -9.753 1.00 0.00 C ATOM 1317 NZ LYS A 83 -19.364 28.469 -10.472 1.00 0.00 N ATOM 0 H LYS A 83 -15.879 25.457 -6.274 1.00 0.00 H new ATOM 0 HA LYS A 83 -17.633 27.138 -4.908 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -18.284 24.799 -6.760 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -19.404 26.080 -6.340 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -17.528 27.722 -7.171 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -16.804 26.309 -7.913 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -18.864 25.864 -9.204 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -19.714 27.147 -8.366 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -17.628 28.620 -9.251 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -17.550 27.357 -10.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -19.009 29.157 -11.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -19.905 27.729 -10.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -19.981 28.953 -9.789 1.00 0.00 H new ATOM 1331 N GLY A 84 -18.005 23.969 -4.034 1.00 0.00 N ATOM 1332 CA GLY A 84 -18.598 23.108 -2.971 1.00 0.00 C ATOM 1333 C GLY A 84 -18.096 23.569 -1.598 1.00 0.00 C ATOM 1334 O GLY A 84 -18.539 23.091 -0.572 1.00 0.00 O ATOM 0 H GLY A 84 -17.429 23.478 -4.718 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -19.686 23.163 -3.009 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -18.325 22.066 -3.138 1.00 0.00 H new ATOM 1338 N GLY A 85 -17.181 24.500 -1.570 1.00 0.00 N ATOM 1339 CA GLY A 85 -16.660 24.996 -0.266 1.00 0.00 C ATOM 1340 C GLY A 85 -15.363 24.266 0.086 1.00 0.00 C ATOM 1341 O GLY A 85 -15.080 24.009 1.239 1.00 0.00 O ATOM 0 H GLY A 85 -16.772 24.938 -2.395 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -16.480 26.070 -0.321 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -17.402 24.836 0.517 1.00 0.00 H new ATOM 1345 N MET A 86 -14.567 23.932 -0.894 1.00 0.00 N ATOM 1346 CA MET A 86 -13.287 23.222 -0.597 1.00 0.00 C ATOM 1347 C MET A 86 -12.123 24.198 -0.776 1.00 0.00 C ATOM 1348 O MET A 86 -11.790 24.591 -1.875 1.00 0.00 O ATOM 1349 CB MET A 86 -13.118 22.035 -1.548 1.00 0.00 C ATOM 1350 CG MET A 86 -14.415 21.224 -1.583 1.00 0.00 C ATOM 1351 SD MET A 86 -14.337 19.909 -0.341 1.00 0.00 S ATOM 1352 CE MET A 86 -12.847 19.095 -0.966 1.00 0.00 C ATOM 0 H MET A 86 -14.745 24.118 -1.881 1.00 0.00 H new ATOM 0 HA MET A 86 -13.303 22.852 0.428 1.00 0.00 H new ATOM 0 HB2 MET A 86 -12.870 22.389 -2.549 1.00 0.00 H new ATOM 0 HB3 MET A 86 -12.291 21.406 -1.219 1.00 0.00 H new ATOM 0 HG2 MET A 86 -15.268 21.874 -1.388 1.00 0.00 H new ATOM 0 HG3 MET A 86 -14.562 20.795 -2.574 1.00 0.00 H new ATOM 0 HE1 MET A 86 -13.092 18.081 -1.283 1.00 0.00 H new ATOM 0 HE2 MET A 86 -12.455 19.656 -1.814 1.00 0.00 H new ATOM 0 HE3 MET A 86 -12.095 19.057 -0.178 1.00 0.00 H new ATOM 1362 N ARG A 87 -11.509 24.603 0.301 1.00 0.00 N ATOM 1363 CA ARG A 87 -10.380 25.569 0.197 1.00 0.00 C ATOM 1364 C ARG A 87 -9.062 24.833 -0.059 1.00 0.00 C ATOM 1365 O ARG A 87 -8.746 23.853 0.586 1.00 0.00 O ATOM 1366 CB ARG A 87 -10.268 26.359 1.502 1.00 0.00 C ATOM 1367 CG ARG A 87 -11.537 27.188 1.708 1.00 0.00 C ATOM 1368 CD ARG A 87 -11.412 28.002 2.998 1.00 0.00 C ATOM 1369 NE ARG A 87 -11.167 27.081 4.144 1.00 0.00 N ATOM 1370 CZ ARG A 87 -10.740 27.555 5.282 1.00 0.00 C ATOM 1371 NH1 ARG A 87 -10.786 28.838 5.514 1.00 0.00 N ATOM 1372 NH2 ARG A 87 -10.265 26.745 6.189 1.00 0.00 N ATOM 0 H ARG A 87 -11.741 24.307 1.249 1.00 0.00 H new ATOM 0 HA ARG A 87 -10.574 26.244 -0.636 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -10.126 25.678 2.341 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -9.396 27.012 1.470 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -11.691 27.854 0.859 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -12.407 26.533 1.761 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -10.594 28.718 2.911 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -12.322 28.577 3.168 1.00 0.00 H new ATOM 0 HE ARG A 87 -11.333 26.080 4.039 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -11.156 29.471 4.805 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -10.452 29.208 6.404 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -10.228 25.742 6.008 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -9.931 27.115 7.079 1.00 0.00 H new ATOM 1386 N ASN A 88 -8.279 25.327 -0.979 1.00 0.00 N ATOM 1387 CA ASN A 88 -6.962 24.697 -1.268 1.00 0.00 C ATOM 1388 C ASN A 88 -5.921 25.814 -1.362 1.00 0.00 C ATOM 1389 O ASN A 88 -6.187 26.871 -1.896 1.00 0.00 O ATOM 1390 CB ASN A 88 -7.027 23.927 -2.588 1.00 0.00 C ATOM 1391 CG ASN A 88 -7.942 22.711 -2.425 1.00 0.00 C ATOM 1392 OD1 ASN A 88 -9.068 22.717 -2.881 1.00 0.00 O ATOM 1393 ND2 ASN A 88 -7.503 21.660 -1.788 1.00 0.00 N ATOM 0 H ASN A 88 -8.498 26.146 -1.546 1.00 0.00 H new ATOM 0 HA ASN A 88 -6.695 23.994 -0.479 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -7.402 24.574 -3.381 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -6.028 23.607 -2.884 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -8.105 20.845 -1.673 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -6.558 21.654 -1.405 1.00 0.00 H new ATOM 1400 N VAL A 89 -4.751 25.607 -0.828 1.00 0.00 N ATOM 1401 CA VAL A 89 -3.724 26.685 -0.878 1.00 0.00 C ATOM 1402 C VAL A 89 -2.453 26.185 -1.564 1.00 0.00 C ATOM 1403 O VAL A 89 -1.983 25.093 -1.310 1.00 0.00 O ATOM 1404 CB VAL A 89 -3.386 27.123 0.548 1.00 0.00 C ATOM 1405 CG1 VAL A 89 -2.437 28.323 0.502 1.00 0.00 C ATOM 1406 CG2 VAL A 89 -4.672 27.518 1.278 1.00 0.00 C ATOM 0 H VAL A 89 -4.462 24.746 -0.363 1.00 0.00 H new ATOM 0 HA VAL A 89 -4.123 27.525 -1.446 1.00 0.00 H new ATOM 0 HB VAL A 89 -2.905 26.300 1.077 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -2.196 28.635 1.518 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -1.521 28.043 -0.018 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.917 29.147 -0.026 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.432 27.830 2.294 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -5.152 28.341 0.749 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.349 26.664 1.311 1.00 0.00 H new ATOM 1416 N PHE A 90 -1.886 26.989 -2.420 1.00 0.00 N ATOM 1417 CA PHE A 90 -0.633 26.583 -3.113 1.00 0.00 C ATOM 1418 C PHE A 90 0.435 27.647 -2.852 1.00 0.00 C ATOM 1419 O PHE A 90 0.252 28.809 -3.155 1.00 0.00 O ATOM 1420 CB PHE A 90 -0.883 26.469 -4.618 1.00 0.00 C ATOM 1421 CG PHE A 90 -2.043 25.538 -4.874 1.00 0.00 C ATOM 1422 CD1 PHE A 90 -3.347 26.044 -4.931 1.00 0.00 C ATOM 1423 CD2 PHE A 90 -1.815 24.170 -5.058 1.00 0.00 C ATOM 1424 CE1 PHE A 90 -4.423 25.182 -5.172 1.00 0.00 C ATOM 1425 CE2 PHE A 90 -2.891 23.307 -5.301 1.00 0.00 C ATOM 1426 CZ PHE A 90 -4.195 23.814 -5.359 1.00 0.00 C ATOM 0 H PHE A 90 -2.238 27.913 -2.670 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.300 25.616 -2.737 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -1.095 27.453 -5.036 1.00 0.00 H new ATOM 0 HB3 PHE A 90 0.011 26.096 -5.117 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -3.523 27.100 -4.789 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.809 23.779 -5.013 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -5.429 25.573 -5.214 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -2.715 22.251 -5.444 1.00 0.00 H new ATOM 0 HZ PHE A 90 -5.025 23.149 -5.548 1.00 0.00 H new ATOM 1436 N ASP A 91 1.542 27.261 -2.285 1.00 0.00 N ATOM 1437 CA ASP A 91 2.613 28.255 -1.999 1.00 0.00 C ATOM 1438 C ASP A 91 3.696 28.172 -3.076 1.00 0.00 C ATOM 1439 O ASP A 91 3.957 27.124 -3.632 1.00 0.00 O ATOM 1440 CB ASP A 91 3.232 27.956 -0.632 1.00 0.00 C ATOM 1441 CG ASP A 91 3.681 26.495 -0.584 1.00 0.00 C ATOM 1442 OD1 ASP A 91 3.166 25.711 -1.364 1.00 0.00 O ATOM 1443 OD2 ASP A 91 4.534 26.183 0.232 1.00 0.00 O ATOM 0 H ASP A 91 1.752 26.302 -2.007 1.00 0.00 H new ATOM 0 HA ASP A 91 2.184 29.257 -1.996 1.00 0.00 H new ATOM 0 HB2 ASP A 91 4.082 28.615 -0.454 1.00 0.00 H new ATOM 0 HB3 ASP A 91 2.507 28.151 0.158 1.00 0.00 H new ATOM 1448 N GLU A 92 4.334 29.272 -3.368 1.00 0.00 N ATOM 1449 CA GLU A 92 5.404 29.262 -4.399 1.00 0.00 C ATOM 1450 C GLU A 92 4.875 28.648 -5.696 1.00 0.00 C ATOM 1451 O GLU A 92 5.482 27.758 -6.257 1.00 0.00 O ATOM 1452 CB GLU A 92 6.585 28.433 -3.892 1.00 0.00 C ATOM 1453 CG GLU A 92 7.839 28.784 -4.696 1.00 0.00 C ATOM 1454 CD GLU A 92 8.931 27.749 -4.418 1.00 0.00 C ATOM 1455 OE1 GLU A 92 8.765 26.976 -3.487 1.00 0.00 O ATOM 1456 OE2 GLU A 92 9.913 27.744 -5.141 1.00 0.00 O ATOM 0 H GLU A 92 4.158 30.178 -2.935 1.00 0.00 H new ATOM 0 HA GLU A 92 5.725 30.285 -4.593 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.753 28.629 -2.833 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.364 27.370 -3.988 1.00 0.00 H new ATOM 0 HG2 GLU A 92 7.607 28.806 -5.761 1.00 0.00 H new ATOM 0 HG3 GLU A 92 8.190 29.780 -4.426 1.00 0.00 H new ATOM 1463 N VAL A 93 3.757 29.112 -6.188 1.00 0.00 N ATOM 1464 CA VAL A 93 3.217 28.541 -7.455 1.00 0.00 C ATOM 1465 C VAL A 93 3.930 29.191 -8.641 1.00 0.00 C ATOM 1466 O VAL A 93 4.162 28.567 -9.657 1.00 0.00 O ATOM 1467 CB VAL A 93 1.715 28.819 -7.543 1.00 0.00 C ATOM 1468 CG1 VAL A 93 1.205 28.432 -8.934 1.00 0.00 C ATOM 1469 CG2 VAL A 93 0.981 27.995 -6.485 1.00 0.00 C ATOM 0 H VAL A 93 3.198 29.856 -5.771 1.00 0.00 H new ATOM 0 HA VAL A 93 3.384 27.464 -7.473 1.00 0.00 H new ATOM 0 HB VAL A 93 1.531 29.879 -7.370 1.00 0.00 H new ATOM 0 HG11 VAL A 93 0.135 28.630 -8.997 1.00 0.00 H new ATOM 0 HG12 VAL A 93 1.728 29.019 -9.689 1.00 0.00 H new ATOM 0 HG13 VAL A 93 1.389 27.372 -9.107 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -0.089 28.193 -6.547 1.00 0.00 H new ATOM 0 HG22 VAL A 93 1.165 26.935 -6.658 1.00 0.00 H new ATOM 0 HG23 VAL A 93 1.343 28.269 -5.494 1.00 0.00 H new ATOM 1479 N ILE A 94 4.284 30.440 -8.517 1.00 0.00 N ATOM 1480 CA ILE A 94 4.986 31.132 -9.632 1.00 0.00 C ATOM 1481 C ILE A 94 6.104 32.003 -9.055 1.00 0.00 C ATOM 1482 O ILE A 94 5.882 32.798 -8.163 1.00 0.00 O ATOM 1483 CB ILE A 94 3.991 32.006 -10.398 1.00 0.00 C ATOM 1484 CG1 ILE A 94 3.025 31.112 -11.178 1.00 0.00 C ATOM 1485 CG2 ILE A 94 4.749 32.911 -11.370 1.00 0.00 C ATOM 1486 CD1 ILE A 94 1.796 31.924 -11.593 1.00 0.00 C ATOM 0 H ILE A 94 4.117 31.012 -7.689 1.00 0.00 H new ATOM 0 HA ILE A 94 5.412 30.396 -10.314 1.00 0.00 H new ATOM 0 HB ILE A 94 3.430 32.621 -9.695 1.00 0.00 H new ATOM 0 HG12 ILE A 94 3.521 30.707 -12.060 1.00 0.00 H new ATOM 0 HG13 ILE A 94 2.723 30.264 -10.564 1.00 0.00 H new ATOM 0 HG21 ILE A 94 4.040 33.534 -11.916 1.00 0.00 H new ATOM 0 HG22 ILE A 94 5.437 33.547 -10.813 1.00 0.00 H new ATOM 0 HG23 ILE A 94 5.311 32.298 -12.075 1.00 0.00 H new ATOM 0 HD11 ILE A 94 1.109 31.286 -12.149 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.296 32.308 -10.704 1.00 0.00 H new ATOM 0 HD13 ILE A 94 2.106 32.758 -12.223 1.00 0.00 H new ATOM 1498 N PRO A 95 7.331 31.841 -9.569 1.00 0.00 N ATOM 1499 CA PRO A 95 8.493 32.604 -9.098 1.00 0.00 C ATOM 1500 C PRO A 95 8.404 34.082 -9.487 1.00 0.00 C ATOM 1501 O PRO A 95 7.660 34.461 -10.370 1.00 0.00 O ATOM 1502 CB PRO A 95 9.671 31.941 -9.810 1.00 0.00 C ATOM 1503 CG PRO A 95 9.073 31.328 -11.032 1.00 0.00 C ATOM 1504 CD PRO A 95 7.682 30.904 -10.651 1.00 0.00 C ATOM 0 HA PRO A 95 8.575 32.592 -8.011 1.00 0.00 H new ATOM 0 HB2 PRO A 95 10.440 32.669 -10.067 1.00 0.00 H new ATOM 0 HB3 PRO A 95 10.143 31.188 -9.179 1.00 0.00 H new ATOM 0 HG2 PRO A 95 9.050 32.043 -11.855 1.00 0.00 H new ATOM 0 HG3 PRO A 95 9.662 30.474 -11.367 1.00 0.00 H new ATOM 0 HD2 PRO A 95 6.992 30.982 -11.491 1.00 0.00 H new ATOM 0 HD3 PRO A 95 7.655 29.868 -10.312 1.00 0.00 H new ATOM 1512 N THR A 96 9.158 34.919 -8.827 1.00 0.00 N ATOM 1513 CA THR A 96 9.120 36.374 -9.145 1.00 0.00 C ATOM 1514 C THR A 96 9.309 36.584 -10.649 1.00 0.00 C ATOM 1515 O THR A 96 8.605 37.356 -11.268 1.00 0.00 O ATOM 1516 CB THR A 96 10.243 37.087 -8.388 1.00 0.00 C ATOM 1517 OG1 THR A 96 10.078 36.878 -6.993 1.00 0.00 O ATOM 1518 CG2 THR A 96 10.193 38.586 -8.691 1.00 0.00 C ATOM 0 H THR A 96 9.800 34.656 -8.079 1.00 0.00 H new ATOM 0 HA THR A 96 8.155 36.782 -8.845 1.00 0.00 H new ATOM 0 HB THR A 96 11.206 36.687 -8.704 1.00 0.00 H new ATOM 0 HG1 THR A 96 10.682 36.166 -6.695 1.00 0.00 H new ATOM 0 HG21 THR A 96 10.993 39.093 -8.152 1.00 0.00 H new ATOM 0 HG22 THR A 96 10.320 38.745 -9.762 1.00 0.00 H new ATOM 0 HG23 THR A 96 9.231 38.989 -8.376 1.00 0.00 H new ATOM 1526 N ALA A 97 10.257 35.911 -11.243 1.00 0.00 N ATOM 1527 CA ALA A 97 10.481 36.092 -12.704 1.00 0.00 C ATOM 1528 C ALA A 97 9.688 35.038 -13.482 1.00 0.00 C ATOM 1529 O ALA A 97 10.065 33.885 -13.543 1.00 0.00 O ATOM 1530 CB ALA A 97 11.972 35.943 -13.016 1.00 0.00 C ATOM 0 H ALA A 97 10.881 35.249 -10.783 1.00 0.00 H new ATOM 0 HA ALA A 97 10.146 37.086 -12.999 1.00 0.00 H new ATOM 0 HB1 ALA A 97 12.135 36.076 -14.086 1.00 0.00 H new ATOM 0 HB2 ALA A 97 12.536 36.697 -12.467 1.00 0.00 H new ATOM 0 HB3 ALA A 97 12.309 34.950 -12.718 1.00 0.00 H new ATOM 1536 N PHE A 98 8.594 35.427 -14.077 1.00 0.00 N ATOM 1537 CA PHE A 98 7.781 34.449 -14.852 1.00 0.00 C ATOM 1538 C PHE A 98 7.872 34.783 -16.342 1.00 0.00 C ATOM 1539 O PHE A 98 8.060 35.921 -16.721 1.00 0.00 O ATOM 1540 CB PHE A 98 6.322 34.529 -14.400 1.00 0.00 C ATOM 1541 CG PHE A 98 5.812 35.936 -14.598 1.00 0.00 C ATOM 1542 CD1 PHE A 98 5.330 36.338 -15.851 1.00 0.00 C ATOM 1543 CD2 PHE A 98 5.822 36.841 -13.530 1.00 0.00 C ATOM 1544 CE1 PHE A 98 4.858 37.643 -16.033 1.00 0.00 C ATOM 1545 CE2 PHE A 98 5.350 38.146 -13.712 1.00 0.00 C ATOM 1546 CZ PHE A 98 4.868 38.547 -14.964 1.00 0.00 C ATOM 0 H PHE A 98 8.229 36.379 -14.060 1.00 0.00 H new ATOM 0 HA PHE A 98 8.160 33.441 -14.680 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.714 33.827 -14.970 1.00 0.00 H new ATOM 0 HB3 PHE A 98 6.239 34.244 -13.351 1.00 0.00 H new ATOM 0 HD1 PHE A 98 5.323 35.641 -16.676 1.00 0.00 H new ATOM 0 HD2 PHE A 98 6.194 36.532 -12.565 1.00 0.00 H new ATOM 0 HE1 PHE A 98 4.486 37.953 -16.998 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.358 38.843 -12.887 1.00 0.00 H new ATOM 0 HZ PHE A 98 4.504 39.554 -15.105 1.00 0.00 H new ATOM 1556 N SER A 99 7.738 33.802 -17.192 1.00 0.00 N ATOM 1557 CA SER A 99 7.817 34.070 -18.653 1.00 0.00 C ATOM 1558 C SER A 99 6.406 34.074 -19.241 1.00 0.00 C ATOM 1559 O SER A 99 5.451 33.704 -18.587 1.00 0.00 O ATOM 1560 CB SER A 99 8.649 32.980 -19.330 1.00 0.00 C ATOM 1561 OG SER A 99 10.030 33.247 -19.129 1.00 0.00 O ATOM 0 H SER A 99 7.577 32.828 -16.937 1.00 0.00 H new ATOM 0 HA SER A 99 8.287 35.039 -18.821 1.00 0.00 H new ATOM 0 HB2 SER A 99 8.393 32.004 -18.919 1.00 0.00 H new ATOM 0 HB3 SER A 99 8.425 32.946 -20.396 1.00 0.00 H new ATOM 0 HG SER A 99 10.565 32.548 -19.561 1.00 0.00 H new ATOM 1567 N ILE A 100 6.264 34.485 -20.470 1.00 0.00 N ATOM 1568 CA ILE A 100 4.909 34.505 -21.087 1.00 0.00 C ATOM 1569 C ILE A 100 4.769 33.316 -22.038 1.00 0.00 C ATOM 1570 O ILE A 100 5.658 33.017 -22.810 1.00 0.00 O ATOM 1571 CB ILE A 100 4.716 35.809 -21.864 1.00 0.00 C ATOM 1572 CG1 ILE A 100 4.916 37.000 -20.924 1.00 0.00 C ATOM 1573 CG2 ILE A 100 3.302 35.852 -22.447 1.00 0.00 C ATOM 1574 CD1 ILE A 100 3.773 37.045 -19.907 1.00 0.00 C ATOM 0 H ILE A 100 7.023 34.806 -21.071 1.00 0.00 H new ATOM 0 HA ILE A 100 4.152 34.438 -20.305 1.00 0.00 H new ATOM 0 HB ILE A 100 5.445 35.859 -22.673 1.00 0.00 H new ATOM 0 HG12 ILE A 100 5.872 36.913 -20.408 1.00 0.00 H new ATOM 0 HG13 ILE A 100 4.945 37.927 -21.496 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.165 36.781 -23.000 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.159 35.005 -23.118 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.573 35.801 -21.638 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.915 37.893 -19.237 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.823 37.152 -20.431 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.765 36.122 -19.327 1.00 0.00 H new ATOM 1586 N GLY A 101 3.656 32.637 -21.994 1.00 0.00 N ATOM 1587 CA GLY A 101 3.458 31.473 -22.900 1.00 0.00 C ATOM 1588 C GLY A 101 3.836 30.177 -22.178 1.00 0.00 C ATOM 1589 O GLY A 101 3.919 29.126 -22.780 1.00 0.00 O ATOM 0 H GLY A 101 2.875 32.839 -21.369 1.00 0.00 H new ATOM 0 HA2 GLY A 101 2.419 31.428 -23.226 1.00 0.00 H new ATOM 0 HA3 GLY A 101 4.068 31.591 -23.796 1.00 0.00 H new ATOM 1593 N LYS A 102 4.066 30.236 -20.892 1.00 0.00 N ATOM 1594 CA LYS A 102 4.433 28.995 -20.153 1.00 0.00 C ATOM 1595 C LYS A 102 3.411 28.747 -19.042 1.00 0.00 C ATOM 1596 O LYS A 102 2.923 29.672 -18.424 1.00 0.00 O ATOM 1597 CB LYS A 102 5.827 29.152 -19.542 1.00 0.00 C ATOM 1598 CG LYS A 102 6.378 27.775 -19.168 1.00 0.00 C ATOM 1599 CD LYS A 102 7.803 27.924 -18.629 1.00 0.00 C ATOM 1600 CE LYS A 102 8.429 26.540 -18.453 1.00 0.00 C ATOM 1601 NZ LYS A 102 9.673 26.450 -19.270 1.00 0.00 N ATOM 0 H LYS A 102 4.016 31.083 -20.327 1.00 0.00 H new ATOM 0 HA LYS A 102 4.437 28.150 -20.841 1.00 0.00 H new ATOM 0 HB2 LYS A 102 6.494 29.642 -20.252 1.00 0.00 H new ATOM 0 HB3 LYS A 102 5.779 29.788 -18.658 1.00 0.00 H new ATOM 0 HG2 LYS A 102 5.741 27.308 -18.417 1.00 0.00 H new ATOM 0 HG3 LYS A 102 6.374 27.121 -20.040 1.00 0.00 H new ATOM 0 HD2 LYS A 102 8.402 28.521 -19.316 1.00 0.00 H new ATOM 0 HD3 LYS A 102 7.789 28.453 -17.676 1.00 0.00 H new ATOM 0 HE2 LYS A 102 8.658 26.364 -17.402 1.00 0.00 H new ATOM 0 HE3 LYS A 102 7.723 25.768 -18.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 10.099 25.509 -19.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 9.442 26.601 -20.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 10.347 27.178 -18.957 1.00 0.00 H new ATOM 1615 N THR A 103 3.078 27.512 -18.781 1.00 0.00 N ATOM 1616 CA THR A 103 2.083 27.232 -17.709 1.00 0.00 C ATOM 1617 C THR A 103 2.779 27.324 -16.350 1.00 0.00 C ATOM 1618 O THR A 103 3.974 27.531 -16.277 1.00 0.00 O ATOM 1619 CB THR A 103 1.513 25.824 -17.896 1.00 0.00 C ATOM 1620 OG1 THR A 103 1.198 25.621 -19.267 1.00 0.00 O ATOM 1621 CG2 THR A 103 0.248 25.667 -17.051 1.00 0.00 C ATOM 0 H THR A 103 3.449 26.691 -19.260 1.00 0.00 H new ATOM 0 HA THR A 103 1.272 27.958 -17.759 1.00 0.00 H new ATOM 0 HB THR A 103 2.252 25.087 -17.579 1.00 0.00 H new ATOM 0 HG1 THR A 103 0.834 24.719 -19.389 1.00 0.00 H new ATOM 0 HG21 THR A 103 -0.157 24.664 -17.185 1.00 0.00 H new ATOM 0 HG22 THR A 103 0.491 25.823 -16.000 1.00 0.00 H new ATOM 0 HG23 THR A 103 -0.493 26.402 -17.365 1.00 0.00 H new ATOM 1629 N TYR A 104 2.063 27.165 -15.273 1.00 0.00 N ATOM 1630 CA TYR A 104 2.715 27.236 -13.937 1.00 0.00 C ATOM 1631 C TYR A 104 1.796 26.595 -12.897 1.00 0.00 C ATOM 1632 O TYR A 104 0.890 27.220 -12.386 1.00 0.00 O ATOM 1633 CB TYR A 104 2.975 28.698 -13.572 1.00 0.00 C ATOM 1634 CG TYR A 104 4.256 29.145 -14.229 1.00 0.00 C ATOM 1635 CD1 TYR A 104 5.479 28.612 -13.806 1.00 0.00 C ATOM 1636 CD2 TYR A 104 4.221 30.086 -15.265 1.00 0.00 C ATOM 1637 CE1 TYR A 104 6.669 29.019 -14.418 1.00 0.00 C ATOM 1638 CE2 TYR A 104 5.412 30.494 -15.878 1.00 0.00 C ATOM 1639 CZ TYR A 104 6.636 29.961 -15.455 1.00 0.00 C ATOM 1640 OH TYR A 104 7.810 30.362 -16.059 1.00 0.00 O ATOM 0 H TYR A 104 1.058 26.990 -15.260 1.00 0.00 H new ATOM 0 HA TYR A 104 3.665 26.702 -13.960 1.00 0.00 H new ATOM 0 HB2 TYR A 104 2.145 29.322 -13.902 1.00 0.00 H new ATOM 0 HB3 TYR A 104 3.047 28.809 -12.490 1.00 0.00 H new ATOM 0 HD1 TYR A 104 5.504 27.886 -13.007 1.00 0.00 H new ATOM 0 HD2 TYR A 104 3.277 30.497 -15.591 1.00 0.00 H new ATOM 0 HE1 TYR A 104 7.613 28.608 -14.092 1.00 0.00 H new ATOM 0 HE2 TYR A 104 5.387 31.220 -16.677 1.00 0.00 H new ATOM 0 HH TYR A 104 7.605 30.822 -16.899 1.00 0.00 H new ATOM 1650 N LYS A 105 2.019 25.348 -12.588 1.00 0.00 N ATOM 1651 CA LYS A 105 1.152 24.664 -11.588 1.00 0.00 C ATOM 1652 C LYS A 105 1.882 24.575 -10.247 1.00 0.00 C ATOM 1653 O LYS A 105 3.080 24.763 -10.169 1.00 0.00 O ATOM 1654 CB LYS A 105 0.812 23.255 -12.082 1.00 0.00 C ATOM 1655 CG LYS A 105 2.047 22.616 -12.722 1.00 0.00 C ATOM 1656 CD LYS A 105 3.195 22.595 -11.712 1.00 0.00 C ATOM 1657 CE LYS A 105 4.126 21.420 -12.019 1.00 0.00 C ATOM 1658 NZ LYS A 105 4.780 21.637 -13.339 1.00 0.00 N ATOM 0 H LYS A 105 2.763 24.773 -12.984 1.00 0.00 H new ATOM 0 HA LYS A 105 0.232 25.234 -11.459 1.00 0.00 H new ATOM 0 HB2 LYS A 105 0.464 22.642 -11.250 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -0.001 23.300 -12.806 1.00 0.00 H new ATOM 0 HG2 LYS A 105 1.817 21.601 -13.047 1.00 0.00 H new ATOM 0 HG3 LYS A 105 2.340 23.177 -13.610 1.00 0.00 H new ATOM 0 HD2 LYS A 105 3.749 23.533 -11.756 1.00 0.00 H new ATOM 0 HD3 LYS A 105 2.801 22.505 -10.700 1.00 0.00 H new ATOM 0 HE2 LYS A 105 4.881 21.326 -11.238 1.00 0.00 H new ATOM 0 HE3 LYS A 105 3.561 20.488 -12.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 5.499 20.902 -13.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 4.065 21.587 -14.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 5.233 22.573 -13.352 1.00 0.00 H new ATOM 1672 N PRO A 106 1.138 24.283 -9.172 1.00 0.00 N ATOM 1673 CA PRO A 106 1.706 24.167 -7.822 1.00 0.00 C ATOM 1674 C PRO A 106 2.611 22.939 -7.687 1.00 0.00 C ATOM 1675 O PRO A 106 2.728 22.138 -8.591 1.00 0.00 O ATOM 1676 CB PRO A 106 0.474 24.010 -6.930 1.00 0.00 C ATOM 1677 CG PRO A 106 -0.571 23.445 -7.830 1.00 0.00 C ATOM 1678 CD PRO A 106 -0.317 24.041 -9.185 1.00 0.00 C ATOM 0 HA PRO A 106 2.330 25.023 -7.565 1.00 0.00 H new ATOM 0 HB2 PRO A 106 0.675 23.346 -6.090 1.00 0.00 H new ATOM 0 HB3 PRO A 106 0.162 24.967 -6.512 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -0.510 22.357 -7.865 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -1.570 23.697 -7.474 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -0.606 23.361 -9.986 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -0.879 24.964 -9.332 1.00 0.00 H new