USER MOD reduce.3.24.130724 H: found=0, std=0, add=940, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 940 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 57 TYR OH : rot 0:sc= 0.655 USER MOD Set 1.2: A 60 LYS NZ :NH3+ 159:sc= 0.776 (180deg=0) USER MOD Set 2.1: A 50 THR OG1 : rot 180:sc= 0.185 USER MOD Set 2.2: A 54 SER OG : rot 144:sc= 0.224 USER MOD Set 3.1: A 34 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot -98:sc= -0.0563 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 HIS : no HE2:sc= -3.51! C(o=-3.5!,f=-4.6!) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 72:sc= 0.0731 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot -18:sc= 0.361 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 CYS SG : rot 180:sc= -0.0607 USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.281! USER MOD Single : A 79 CYS SG : rot 180:sc= -0.763 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= -0.0112 X(o=-0.011,f=0.38) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot 98:sc= 0.841 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 83:sc= 0.0118 USER MOD Single : A 112 THR OG1 : rot -74:sc= -1.5 USER MOD Single : A 115 SER OG : rot 180:sc= 0.0932 USER MOD Single : A 118 GLN : amide:sc= -0.195 K(o=-0.2,f=-1.8!) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -0.373 X(o=-0.37,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 HIS : no HD1:sc= -0.0832 X(o=-0.083,f=-0.46) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 225 N PRO A 17 -2.289 5.939 2.632 1.00 0.00 N ATOM 226 CA PRO A 17 -3.692 5.744 2.958 1.00 0.00 C ATOM 227 C PRO A 17 -4.566 6.793 2.266 1.00 0.00 C ATOM 228 O PRO A 17 -4.389 7.991 2.479 1.00 0.00 O ATOM 229 CB PRO A 17 -3.758 5.822 4.474 1.00 0.00 C ATOM 230 CG PRO A 17 -2.479 6.516 4.912 1.00 0.00 C ATOM 231 CD PRO A 17 -1.525 6.526 3.729 1.00 0.00 C ATOM 0 HA PRO A 17 -4.077 4.787 2.605 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -4.636 6.380 4.798 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -3.833 4.827 4.913 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -2.690 7.534 5.241 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -2.032 5.994 5.758 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -1.202 7.539 3.489 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -0.626 5.947 3.940 1.00 0.00 H new ATOM 239 N LEU A 18 -5.490 6.304 1.453 1.00 0.00 N ATOM 240 CA LEU A 18 -6.391 7.184 0.729 1.00 0.00 C ATOM 241 C LEU A 18 -7.425 7.758 1.700 1.00 0.00 C ATOM 242 O LEU A 18 -7.775 7.117 2.690 1.00 0.00 O ATOM 243 CB LEU A 18 -7.009 6.453 -0.465 1.00 0.00 C ATOM 244 CG LEU A 18 -7.900 7.296 -1.379 1.00 0.00 C ATOM 245 CD1 LEU A 18 -7.061 8.116 -2.361 1.00 0.00 C ATOM 246 CD2 LEU A 18 -8.931 6.423 -2.097 1.00 0.00 C ATOM 0 H LEU A 18 -5.634 5.309 1.279 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.844 8.028 0.309 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.202 6.032 -1.065 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -7.597 5.616 -0.089 1.00 0.00 H new ATOM 0 HG LEU A 18 -8.451 8.003 -0.759 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.720 8.706 -2.998 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.400 8.783 -1.807 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.464 7.445 -2.978 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.551 7.047 -2.740 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -8.417 5.676 -2.702 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -9.560 5.923 -1.361 1.00 0.00 H new ATOM 258 N TYR A 19 -7.884 8.960 1.382 1.00 0.00 N ATOM 259 CA TYR A 19 -8.871 9.627 2.214 1.00 0.00 C ATOM 260 C TYR A 19 -10.069 10.087 1.382 1.00 0.00 C ATOM 261 O TYR A 19 -11.215 9.815 1.734 1.00 0.00 O ATOM 262 CB TYR A 19 -8.169 10.855 2.797 1.00 0.00 C ATOM 263 CG TYR A 19 -7.004 10.521 3.732 1.00 0.00 C ATOM 264 CD1 TYR A 19 -7.039 9.371 4.494 1.00 0.00 C ATOM 265 CD2 TYR A 19 -5.919 11.370 3.812 1.00 0.00 C ATOM 266 CE1 TYR A 19 -5.943 9.056 5.373 1.00 0.00 C ATOM 267 CE2 TYR A 19 -4.823 11.055 4.692 1.00 0.00 C ATOM 268 CZ TYR A 19 -4.889 9.914 5.428 1.00 0.00 C ATOM 269 OH TYR A 19 -3.853 9.617 6.259 1.00 0.00 O ATOM 0 H TYR A 19 -7.591 9.489 0.560 1.00 0.00 H new ATOM 0 HA TYR A 19 -9.243 8.952 2.985 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -7.799 11.472 1.978 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -8.899 11.453 3.342 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -7.889 8.707 4.431 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -5.892 12.270 3.215 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -5.957 8.159 5.975 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -3.968 11.711 4.765 1.00 0.00 H new ATOM 0 HH TYR A 19 -3.953 10.114 7.097 1.00 0.00 H new ATOM 279 N PHE A 20 -9.762 10.777 0.293 1.00 0.00 N ATOM 280 CA PHE A 20 -10.800 11.278 -0.593 1.00 0.00 C ATOM 281 C PHE A 20 -10.306 11.334 -2.040 1.00 0.00 C ATOM 282 O PHE A 20 -9.106 11.449 -2.286 1.00 0.00 O ATOM 283 CB PHE A 20 -11.140 12.695 -0.128 1.00 0.00 C ATOM 284 CG PHE A 20 -12.309 13.334 -0.881 1.00 0.00 C ATOM 285 CD1 PHE A 20 -13.440 12.616 -1.114 1.00 0.00 C ATOM 286 CD2 PHE A 20 -12.216 14.619 -1.316 1.00 0.00 C ATOM 287 CE1 PHE A 20 -14.525 13.209 -1.813 1.00 0.00 C ATOM 288 CE2 PHE A 20 -13.301 15.211 -2.015 1.00 0.00 C ATOM 289 CZ PHE A 20 -14.432 14.494 -2.249 1.00 0.00 C ATOM 0 H PHE A 20 -8.810 11.001 0.004 1.00 0.00 H new ATOM 0 HA PHE A 20 -11.668 10.619 -0.559 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -11.377 12.670 0.936 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -10.259 13.326 -0.244 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -13.513 11.596 -0.768 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -11.318 15.189 -1.130 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -15.424 12.640 -1.998 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -13.228 16.231 -2.361 1.00 0.00 H new ATOM 0 HZ PHE A 20 -15.257 14.945 -2.781 1.00 0.00 H new ATOM 299 N GLU A 21 -11.256 11.249 -2.960 1.00 0.00 N ATOM 300 CA GLU A 21 -10.932 11.289 -4.375 1.00 0.00 C ATOM 301 C GLU A 21 -12.061 11.960 -5.160 1.00 0.00 C ATOM 302 O GLU A 21 -13.222 11.905 -4.755 1.00 0.00 O ATOM 303 CB GLU A 21 -10.651 9.884 -4.913 1.00 0.00 C ATOM 304 CG GLU A 21 -11.879 8.984 -4.762 1.00 0.00 C ATOM 305 CD GLU A 21 -11.960 8.400 -3.350 1.00 0.00 C ATOM 306 OE1 GLU A 21 -12.554 9.082 -2.487 1.00 0.00 O ATOM 307 OE2 GLU A 21 -11.428 7.284 -3.166 1.00 0.00 O ATOM 0 H GLU A 21 -12.250 11.153 -2.752 1.00 0.00 H new ATOM 0 HA GLU A 21 -10.025 11.880 -4.503 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.366 9.943 -5.963 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.808 9.448 -4.378 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -12.782 9.556 -4.975 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.834 8.176 -5.492 1.00 0.00 H new ATOM 314 N GLY A 22 -11.682 12.579 -6.268 1.00 0.00 N ATOM 315 CA GLY A 22 -12.649 13.261 -7.112 1.00 0.00 C ATOM 316 C GLY A 22 -11.952 14.218 -8.081 1.00 0.00 C ATOM 317 O GLY A 22 -10.974 14.871 -7.719 1.00 0.00 O ATOM 0 H GLY A 22 -10.719 12.623 -6.601 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -13.228 12.528 -7.673 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -13.352 13.815 -6.491 1.00 0.00 H new ATOM 321 N PHE A 23 -12.481 14.270 -9.295 1.00 0.00 N ATOM 322 CA PHE A 23 -11.922 15.137 -10.319 1.00 0.00 C ATOM 323 C PHE A 23 -11.778 16.570 -9.805 1.00 0.00 C ATOM 324 O PHE A 23 -12.767 17.289 -9.673 1.00 0.00 O ATOM 325 CB PHE A 23 -12.899 15.125 -11.496 1.00 0.00 C ATOM 326 CG PHE A 23 -12.775 13.894 -12.396 1.00 0.00 C ATOM 327 CD1 PHE A 23 -11.547 13.452 -12.779 1.00 0.00 C ATOM 328 CD2 PHE A 23 -13.893 13.241 -12.812 1.00 0.00 C ATOM 329 CE1 PHE A 23 -11.432 12.310 -13.614 1.00 0.00 C ATOM 330 CE2 PHE A 23 -13.778 12.098 -13.647 1.00 0.00 C ATOM 331 CZ PHE A 23 -12.550 11.657 -14.030 1.00 0.00 C ATOM 0 H PHE A 23 -13.291 13.726 -9.593 1.00 0.00 H new ATOM 0 HA PHE A 23 -10.933 14.783 -10.608 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -13.917 15.179 -11.110 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -12.738 16.020 -12.097 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -10.659 13.970 -12.448 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -14.868 13.592 -12.507 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -10.457 11.960 -13.919 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -14.666 11.579 -13.978 1.00 0.00 H new ATOM 0 HZ PHE A 23 -12.463 10.788 -14.665 1.00 0.00 H new ATOM 341 N LEU A 24 -10.537 16.944 -9.528 1.00 0.00 N ATOM 342 CA LEU A 24 -10.250 18.279 -9.032 1.00 0.00 C ATOM 343 C LEU A 24 -9.591 19.100 -10.142 1.00 0.00 C ATOM 344 O LEU A 24 -9.059 18.542 -11.100 1.00 0.00 O ATOM 345 CB LEU A 24 -9.423 18.206 -7.747 1.00 0.00 C ATOM 346 CG LEU A 24 -9.313 19.505 -6.946 1.00 0.00 C ATOM 347 CD1 LEU A 24 -10.682 19.945 -6.422 1.00 0.00 C ATOM 348 CD2 LEU A 24 -8.285 19.370 -5.821 1.00 0.00 C ATOM 0 H LEU A 24 -9.719 16.345 -9.638 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.173 18.792 -8.761 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.856 17.441 -7.103 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -8.417 17.875 -8.004 1.00 0.00 H new ATOM 0 HG LEU A 24 -8.958 20.289 -7.615 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -10.575 20.871 -5.856 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.357 20.109 -7.262 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -11.090 19.169 -5.774 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.226 20.307 -5.267 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -8.587 18.568 -5.147 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -7.309 19.138 -6.246 1.00 0.00 H new ATOM 360 N LEU A 25 -9.648 20.414 -9.975 1.00 0.00 N ATOM 361 CA LEU A 25 -9.064 21.318 -10.951 1.00 0.00 C ATOM 362 C LEU A 25 -7.898 22.071 -10.308 1.00 0.00 C ATOM 363 O LEU A 25 -8.079 22.766 -9.308 1.00 0.00 O ATOM 364 CB LEU A 25 -10.137 22.234 -11.543 1.00 0.00 C ATOM 365 CG LEU A 25 -11.075 21.594 -12.568 1.00 0.00 C ATOM 366 CD1 LEU A 25 -12.470 22.218 -12.500 1.00 0.00 C ATOM 367 CD2 LEU A 25 -10.481 21.669 -13.976 1.00 0.00 C ATOM 0 H LEU A 25 -10.090 20.873 -9.179 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.657 20.758 -11.793 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -10.740 22.630 -10.726 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -9.642 23.083 -12.014 1.00 0.00 H new ATOM 0 HG LEU A 25 -11.183 20.538 -12.320 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -13.117 21.745 -13.239 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -12.887 22.069 -11.504 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -12.402 23.286 -12.708 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -11.167 21.207 -14.686 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -10.324 22.712 -14.250 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -9.528 21.141 -13.997 1.00 0.00 H new ATOM 379 N ILE A 26 -6.728 21.909 -10.907 1.00 0.00 N ATOM 380 CA ILE A 26 -5.532 22.565 -10.404 1.00 0.00 C ATOM 381 C ILE A 26 -5.094 23.645 -11.396 1.00 0.00 C ATOM 382 O ILE A 26 -4.968 23.381 -12.591 1.00 0.00 O ATOM 383 CB ILE A 26 -4.444 21.534 -10.097 1.00 0.00 C ATOM 384 CG1 ILE A 26 -5.017 20.348 -9.319 1.00 0.00 C ATOM 385 CG2 ILE A 26 -3.266 22.182 -9.367 1.00 0.00 C ATOM 386 CD1 ILE A 26 -5.411 20.761 -7.900 1.00 0.00 C ATOM 0 H ILE A 26 -6.582 21.333 -11.736 1.00 0.00 H new ATOM 0 HA ILE A 26 -5.740 23.065 -9.458 1.00 0.00 H new ATOM 0 HB ILE A 26 -4.064 21.146 -11.042 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -5.888 19.953 -9.841 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -4.280 19.546 -9.277 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -2.507 21.428 -9.160 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -2.838 22.966 -9.991 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -3.613 22.614 -8.428 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.815 19.899 -7.369 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -4.533 21.133 -7.372 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -6.166 21.546 -7.946 1.00 0.00 H new ATOM 398 N LYS A 27 -4.874 24.838 -10.863 1.00 0.00 N ATOM 399 CA LYS A 27 -4.452 25.959 -11.686 1.00 0.00 C ATOM 400 C LYS A 27 -3.211 26.603 -11.066 1.00 0.00 C ATOM 401 O LYS A 27 -3.282 27.708 -10.530 1.00 0.00 O ATOM 402 CB LYS A 27 -5.611 26.935 -11.896 1.00 0.00 C ATOM 403 CG LYS A 27 -5.426 27.736 -13.187 1.00 0.00 C ATOM 404 CD LYS A 27 -6.049 29.128 -13.062 1.00 0.00 C ATOM 405 CE LYS A 27 -6.875 29.473 -14.303 1.00 0.00 C ATOM 406 NZ LYS A 27 -6.645 30.878 -14.705 1.00 0.00 N ATOM 0 H LYS A 27 -4.980 25.053 -9.872 1.00 0.00 H new ATOM 0 HA LYS A 27 -4.170 25.616 -12.681 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.551 26.385 -11.936 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.676 27.616 -11.047 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.364 27.828 -13.413 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -5.884 27.202 -14.019 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -6.683 29.168 -12.176 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -5.263 29.871 -12.926 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -6.607 28.806 -15.122 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -7.934 29.316 -14.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -7.213 31.095 -15.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -6.923 31.511 -13.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -5.637 31.017 -14.921 1.00 0.00 H new ATOM 522 N TYR A 34 -7.960 26.127 -15.676 1.00 0.00 N ATOM 523 CA TYR A 34 -8.186 24.969 -14.829 1.00 0.00 C ATOM 524 C TYR A 34 -8.316 23.694 -15.666 1.00 0.00 C ATOM 525 O TYR A 34 -9.158 23.617 -16.559 1.00 0.00 O ATOM 526 CB TYR A 34 -9.510 25.227 -14.107 1.00 0.00 C ATOM 527 CG TYR A 34 -9.429 26.308 -13.027 1.00 0.00 C ATOM 528 CD1 TYR A 34 -8.882 26.014 -11.795 1.00 0.00 C ATOM 529 CD2 TYR A 34 -9.904 27.578 -13.287 1.00 0.00 C ATOM 530 CE1 TYR A 34 -8.806 27.032 -10.780 1.00 0.00 C ATOM 531 CE2 TYR A 34 -9.828 28.596 -12.271 1.00 0.00 C ATOM 532 CZ TYR A 34 -9.283 28.273 -11.068 1.00 0.00 C ATOM 533 OH TYR A 34 -9.211 29.235 -10.108 1.00 0.00 O ATOM 0 HA TYR A 34 -7.353 24.830 -14.140 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -10.262 25.517 -14.841 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -9.851 24.297 -13.651 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -8.511 25.020 -11.592 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -10.332 27.808 -14.251 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -8.380 26.815 -9.812 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -10.196 29.594 -12.460 1.00 0.00 H new ATOM 0 HH TYR A 34 -9.588 30.071 -10.454 1.00 0.00 H new ATOM 543 N GLU A 35 -7.469 22.726 -15.346 1.00 0.00 N ATOM 544 CA GLU A 35 -7.478 21.459 -16.057 1.00 0.00 C ATOM 545 C GLU A 35 -8.061 20.357 -15.171 1.00 0.00 C ATOM 546 O GLU A 35 -7.794 20.315 -13.971 1.00 0.00 O ATOM 547 CB GLU A 35 -6.074 21.090 -16.539 1.00 0.00 C ATOM 548 CG GLU A 35 -5.785 21.706 -17.909 1.00 0.00 C ATOM 549 CD GLU A 35 -6.780 21.203 -18.957 1.00 0.00 C ATOM 550 OE1 GLU A 35 -6.601 20.049 -19.402 1.00 0.00 O ATOM 551 OE2 GLU A 35 -7.697 21.984 -19.289 1.00 0.00 O ATOM 0 H GLU A 35 -6.772 22.794 -14.604 1.00 0.00 H new ATOM 0 HA GLU A 35 -8.112 21.564 -16.937 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -5.335 21.437 -15.817 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -5.979 20.006 -16.596 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -5.840 22.793 -17.842 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -4.770 21.457 -18.217 1.00 0.00 H new ATOM 558 N HIS A 36 -8.847 19.492 -15.795 1.00 0.00 N ATOM 559 CA HIS A 36 -9.470 18.393 -15.078 1.00 0.00 C ATOM 560 C HIS A 36 -8.464 17.252 -14.914 1.00 0.00 C ATOM 561 O HIS A 36 -7.908 16.763 -15.896 1.00 0.00 O ATOM 562 CB HIS A 36 -10.759 17.951 -15.774 1.00 0.00 C ATOM 563 CG HIS A 36 -11.918 18.898 -15.577 1.00 0.00 C ATOM 564 ND1 HIS A 36 -12.481 19.621 -16.614 1.00 0.00 N ATOM 565 CD2 HIS A 36 -12.615 19.232 -14.453 1.00 0.00 C ATOM 566 CE1 HIS A 36 -13.470 20.354 -16.125 1.00 0.00 C ATOM 567 NE2 HIS A 36 -13.551 20.112 -14.786 1.00 0.00 N ATOM 0 H HIS A 36 -9.067 19.530 -16.790 1.00 0.00 H new ATOM 0 HA HIS A 36 -9.759 18.723 -14.080 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -10.566 17.846 -16.842 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -11.041 16.966 -15.403 1.00 0.00 H new ATOM 0 HD1 HIS A 36 -12.185 19.594 -17.590 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -12.436 18.846 -13.460 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -14.101 21.025 -16.688 1.00 0.00 H new ATOM 575 N TYR A 37 -8.260 16.861 -13.664 1.00 0.00 N ATOM 576 CA TYR A 37 -7.330 15.787 -13.359 1.00 0.00 C ATOM 577 C TYR A 37 -7.828 14.951 -12.178 1.00 0.00 C ATOM 578 O TYR A 37 -8.285 15.497 -11.175 1.00 0.00 O ATOM 579 CB TYR A 37 -6.015 16.465 -12.970 1.00 0.00 C ATOM 580 CG TYR A 37 -5.202 16.976 -14.161 1.00 0.00 C ATOM 581 CD1 TYR A 37 -4.655 16.082 -15.058 1.00 0.00 C ATOM 582 CD2 TYR A 37 -5.016 18.332 -14.338 1.00 0.00 C ATOM 583 CE1 TYR A 37 -3.891 16.563 -16.179 1.00 0.00 C ATOM 584 CE2 TYR A 37 -4.251 18.814 -15.459 1.00 0.00 C ATOM 585 CZ TYR A 37 -3.726 17.905 -16.324 1.00 0.00 C ATOM 586 OH TYR A 37 -3.004 18.360 -17.383 1.00 0.00 O ATOM 0 H TYR A 37 -8.723 17.269 -12.851 1.00 0.00 H new ATOM 0 HA TYR A 37 -7.219 15.120 -14.214 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -6.232 17.302 -12.306 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -5.407 15.759 -12.405 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -4.800 15.021 -14.919 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -5.444 19.032 -13.636 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.459 15.874 -16.889 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -4.098 19.872 -15.609 1.00 0.00 H new ATOM 0 HH TYR A 37 -2.970 19.339 -17.359 1.00 0.00 H new ATOM 596 N TRP A 38 -7.722 13.640 -12.336 1.00 0.00 N ATOM 597 CA TRP A 38 -8.156 12.723 -11.296 1.00 0.00 C ATOM 598 C TRP A 38 -7.280 12.958 -10.063 1.00 0.00 C ATOM 599 O TRP A 38 -6.272 12.278 -9.875 1.00 0.00 O ATOM 600 CB TRP A 38 -8.117 11.275 -11.789 1.00 0.00 C ATOM 601 CG TRP A 38 -8.511 10.245 -10.729 1.00 0.00 C ATOM 602 CD1 TRP A 38 -7.706 9.449 -10.013 1.00 0.00 C ATOM 603 CD2 TRP A 38 -9.850 9.931 -10.291 1.00 0.00 C ATOM 604 NE1 TRP A 38 -8.425 8.647 -9.149 1.00 0.00 N ATOM 605 CE2 TRP A 38 -9.770 8.950 -9.324 1.00 0.00 C ATOM 606 CE3 TRP A 38 -11.088 10.458 -10.699 1.00 0.00 C ATOM 607 CZ2 TRP A 38 -10.892 8.411 -8.684 1.00 0.00 C ATOM 608 CZ3 TRP A 38 -12.200 9.909 -10.050 1.00 0.00 C ATOM 609 CH2 TRP A 38 -12.136 8.922 -9.074 1.00 0.00 C ATOM 0 H TRP A 38 -7.342 13.191 -13.169 1.00 0.00 H new ATOM 0 HA TRP A 38 -9.195 12.910 -11.026 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -8.786 11.175 -12.644 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -7.111 11.050 -12.143 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -6.630 9.436 -10.101 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -8.040 7.959 -8.502 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.174 11.226 -11.454 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -10.803 7.643 -7.930 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -13.176 10.278 -10.327 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -13.042 8.551 -8.618 1.00 0.00 H new ATOM 620 N THR A 39 -7.697 13.922 -9.256 1.00 0.00 N ATOM 621 CA THR A 39 -6.963 14.255 -8.047 1.00 0.00 C ATOM 622 C THR A 39 -7.325 13.286 -6.919 1.00 0.00 C ATOM 623 O THR A 39 -8.503 13.048 -6.655 1.00 0.00 O ATOM 624 CB THR A 39 -7.250 15.718 -7.707 1.00 0.00 C ATOM 625 OG1 THR A 39 -6.710 16.443 -8.808 1.00 0.00 O ATOM 626 CG2 THR A 39 -6.442 16.210 -6.504 1.00 0.00 C ATOM 0 H THR A 39 -8.534 14.483 -9.415 1.00 0.00 H new ATOM 0 HA THR A 39 -5.889 14.146 -8.194 1.00 0.00 H new ATOM 0 HB THR A 39 -8.314 15.841 -7.504 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.275 16.309 -9.597 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.684 17.254 -6.306 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.689 15.608 -5.629 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.377 16.119 -6.719 1.00 0.00 H new ATOM 634 N GLU A 40 -6.291 12.754 -6.284 1.00 0.00 N ATOM 635 CA GLU A 40 -6.486 11.817 -5.191 1.00 0.00 C ATOM 636 C GLU A 40 -5.805 12.333 -3.922 1.00 0.00 C ATOM 637 O GLU A 40 -4.623 12.673 -3.942 1.00 0.00 O ATOM 638 CB GLU A 40 -5.971 10.426 -5.563 1.00 0.00 C ATOM 639 CG GLU A 40 -7.033 9.635 -6.330 1.00 0.00 C ATOM 640 CD GLU A 40 -6.798 8.129 -6.196 1.00 0.00 C ATOM 641 OE1 GLU A 40 -5.620 7.726 -6.311 1.00 0.00 O ATOM 642 OE2 GLU A 40 -7.801 7.414 -5.982 1.00 0.00 O ATOM 0 H GLU A 40 -5.316 12.954 -6.506 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.555 11.732 -4.997 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -5.071 10.518 -6.171 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.691 9.884 -4.660 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -8.024 9.887 -5.951 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.013 9.918 -7.383 1.00 0.00 H new ATOM 649 N LEU A 41 -6.579 12.375 -2.847 1.00 0.00 N ATOM 650 CA LEU A 41 -6.064 12.843 -1.572 1.00 0.00 C ATOM 651 C LEU A 41 -5.514 11.654 -0.781 1.00 0.00 C ATOM 652 O LEU A 41 -6.252 10.726 -0.455 1.00 0.00 O ATOM 653 CB LEU A 41 -7.135 13.638 -0.822 1.00 0.00 C ATOM 654 CG LEU A 41 -6.637 14.835 -0.010 1.00 0.00 C ATOM 655 CD1 LEU A 41 -7.797 15.544 0.691 1.00 0.00 C ATOM 656 CD2 LEU A 41 -5.543 14.413 0.974 1.00 0.00 C ATOM 0 H LEU A 41 -7.559 12.092 -2.833 1.00 0.00 H new ATOM 0 HA LEU A 41 -5.235 13.534 -1.726 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -7.868 13.995 -1.546 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.658 12.959 -0.148 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.191 15.553 -0.699 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.415 16.391 1.261 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.509 15.900 -0.053 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.295 14.848 1.366 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -5.206 15.282 1.539 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.940 13.666 1.661 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.702 13.990 0.424 1.00 0.00 H new ATOM 668 N ARG A 42 -4.222 11.722 -0.496 1.00 0.00 N ATOM 669 CA ARG A 42 -3.564 10.663 0.250 1.00 0.00 C ATOM 670 C ARG A 42 -2.566 11.257 1.246 1.00 0.00 C ATOM 671 O ARG A 42 -1.709 12.056 0.871 1.00 0.00 O ATOM 672 CB ARG A 42 -2.829 9.703 -0.687 1.00 0.00 C ATOM 673 CG ARG A 42 -3.810 8.989 -1.620 1.00 0.00 C ATOM 674 CD ARG A 42 -3.342 7.564 -1.920 1.00 0.00 C ATOM 675 NE ARG A 42 -2.294 7.584 -2.965 1.00 0.00 N ATOM 676 CZ ARG A 42 -1.705 6.487 -3.460 1.00 0.00 C ATOM 677 NH1 ARG A 42 -2.058 5.276 -3.009 1.00 0.00 N ATOM 678 NH2 ARG A 42 -0.763 6.601 -4.406 1.00 0.00 N ATOM 0 H ARG A 42 -3.613 12.494 -0.768 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.334 10.109 0.788 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -2.096 10.254 -1.277 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -2.278 8.967 -0.101 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -4.799 8.962 -1.162 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -3.905 9.548 -2.551 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -2.953 7.102 -1.013 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -4.185 6.958 -2.251 1.00 0.00 H new ATOM 0 HE ARG A 42 -2.002 8.490 -3.331 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -2.775 5.189 -2.289 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -1.610 4.441 -3.386 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -0.494 7.523 -4.749 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -0.315 5.766 -4.783 1.00 0.00 H new ATOM 692 N GLY A 43 -2.709 10.843 2.497 1.00 0.00 N ATOM 693 CA GLY A 43 -1.831 11.324 3.550 1.00 0.00 C ATOM 694 C GLY A 43 -1.838 12.853 3.614 1.00 0.00 C ATOM 695 O GLY A 43 -2.720 13.448 4.230 1.00 0.00 O ATOM 0 H GLY A 43 -3.420 10.180 2.805 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.149 10.915 4.509 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.816 10.968 3.373 1.00 0.00 H new ATOM 699 N THR A 44 -0.843 13.444 2.968 1.00 0.00 N ATOM 700 CA THR A 44 -0.724 14.892 2.944 1.00 0.00 C ATOM 701 C THR A 44 -0.114 15.355 1.619 1.00 0.00 C ATOM 702 O THR A 44 0.442 16.449 1.536 1.00 0.00 O ATOM 703 CB THR A 44 0.088 15.320 4.169 1.00 0.00 C ATOM 704 OG1 THR A 44 1.152 14.375 4.228 1.00 0.00 O ATOM 705 CG2 THR A 44 -0.673 15.107 5.479 1.00 0.00 C ATOM 0 H THR A 44 -0.113 12.947 2.458 1.00 0.00 H new ATOM 0 HA THR A 44 -1.702 15.370 3.001 1.00 0.00 H new ATOM 0 HB THR A 44 0.361 16.371 4.074 1.00 0.00 H new ATOM 0 HG1 THR A 44 1.729 14.579 4.993 1.00 0.00 H new ATOM 0 HG21 THR A 44 -0.053 15.426 6.316 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.593 15.692 5.465 1.00 0.00 H new ATOM 0 HG23 THR A 44 -0.917 14.050 5.590 1.00 0.00 H new ATOM 713 N THR A 45 -0.239 14.499 0.616 1.00 0.00 N ATOM 714 CA THR A 45 0.293 14.806 -0.701 1.00 0.00 C ATOM 715 C THR A 45 -0.806 14.693 -1.759 1.00 0.00 C ATOM 716 O THR A 45 -1.407 13.632 -1.925 1.00 0.00 O ATOM 717 CB THR A 45 1.482 13.879 -0.958 1.00 0.00 C ATOM 718 OG1 THR A 45 2.566 14.509 -0.280 1.00 0.00 O ATOM 719 CG2 THR A 45 1.914 13.874 -2.426 1.00 0.00 C ATOM 0 H THR A 45 -0.701 13.593 0.689 1.00 0.00 H new ATOM 0 HA THR A 45 0.648 15.835 -0.755 1.00 0.00 H new ATOM 0 HB THR A 45 1.224 12.865 -0.652 1.00 0.00 H new ATOM 0 HG1 THR A 45 2.341 15.446 -0.104 1.00 0.00 H new ATOM 0 HG21 THR A 45 2.761 13.200 -2.554 1.00 0.00 H new ATOM 0 HG22 THR A 45 1.085 13.537 -3.048 1.00 0.00 H new ATOM 0 HG23 THR A 45 2.204 14.882 -2.723 1.00 0.00 H new ATOM 727 N LEU A 46 -1.035 15.801 -2.449 1.00 0.00 N ATOM 728 CA LEU A 46 -2.051 15.839 -3.487 1.00 0.00 C ATOM 729 C LEU A 46 -1.520 15.141 -4.741 1.00 0.00 C ATOM 730 O LEU A 46 -0.568 15.611 -5.361 1.00 0.00 O ATOM 731 CB LEU A 46 -2.512 17.277 -3.732 1.00 0.00 C ATOM 732 CG LEU A 46 -3.520 17.840 -2.728 1.00 0.00 C ATOM 733 CD1 LEU A 46 -3.554 19.368 -2.783 1.00 0.00 C ATOM 734 CD2 LEU A 46 -4.906 17.227 -2.940 1.00 0.00 C ATOM 0 H LEU A 46 -0.534 16.679 -2.309 1.00 0.00 H new ATOM 0 HA LEU A 46 -2.940 15.293 -3.171 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.634 17.923 -3.736 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.952 17.331 -4.728 1.00 0.00 H new ATOM 0 HG LEU A 46 -3.195 17.562 -1.725 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.278 19.742 -2.060 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -2.566 19.763 -2.545 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.841 19.690 -3.784 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -5.603 17.644 -2.214 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -5.254 17.453 -3.948 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -4.850 16.146 -2.810 1.00 0.00 H new ATOM 746 N PHE A 47 -2.160 14.030 -5.076 1.00 0.00 N ATOM 747 CA PHE A 47 -1.763 13.263 -6.245 1.00 0.00 C ATOM 748 C PHE A 47 -2.770 13.438 -7.383 1.00 0.00 C ATOM 749 O PHE A 47 -3.942 13.092 -7.240 1.00 0.00 O ATOM 750 CB PHE A 47 -1.737 11.792 -5.826 1.00 0.00 C ATOM 751 CG PHE A 47 -0.568 11.427 -4.908 1.00 0.00 C ATOM 752 CD1 PHE A 47 0.676 11.251 -5.429 1.00 0.00 C ATOM 753 CD2 PHE A 47 -0.773 11.279 -3.572 1.00 0.00 C ATOM 754 CE1 PHE A 47 1.761 10.913 -4.577 1.00 0.00 C ATOM 755 CE2 PHE A 47 0.312 10.941 -2.720 1.00 0.00 C ATOM 756 CZ PHE A 47 1.556 10.765 -3.241 1.00 0.00 C ATOM 0 H PHE A 47 -2.950 13.643 -4.559 1.00 0.00 H new ATOM 0 HA PHE A 47 -0.790 13.603 -6.601 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -2.672 11.553 -5.319 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -1.691 11.171 -6.720 1.00 0.00 H new ATOM 0 HD1 PHE A 47 0.839 11.368 -6.490 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -1.761 11.418 -3.159 1.00 0.00 H new ATOM 0 HE1 PHE A 47 2.749 10.774 -4.990 1.00 0.00 H new ATOM 0 HE2 PHE A 47 0.149 10.824 -1.659 1.00 0.00 H new ATOM 0 HZ PHE A 47 2.381 10.508 -2.593 1.00 0.00 H new ATOM 766 N PHE A 48 -2.277 13.976 -8.489 1.00 0.00 N ATOM 767 CA PHE A 48 -3.119 14.202 -9.652 1.00 0.00 C ATOM 768 C PHE A 48 -2.866 13.142 -10.726 1.00 0.00 C ATOM 769 O PHE A 48 -1.723 12.760 -10.969 1.00 0.00 O ATOM 770 CB PHE A 48 -2.749 15.577 -10.212 1.00 0.00 C ATOM 771 CG PHE A 48 -2.601 16.664 -9.145 1.00 0.00 C ATOM 772 CD1 PHE A 48 -3.580 16.845 -8.218 1.00 0.00 C ATOM 773 CD2 PHE A 48 -1.491 17.449 -9.124 1.00 0.00 C ATOM 774 CE1 PHE A 48 -3.442 17.854 -7.229 1.00 0.00 C ATOM 775 CE2 PHE A 48 -1.354 18.458 -8.135 1.00 0.00 C ATOM 776 CZ PHE A 48 -2.332 18.639 -7.208 1.00 0.00 C ATOM 0 H PHE A 48 -1.305 14.262 -8.605 1.00 0.00 H new ATOM 0 HA PHE A 48 -4.170 14.148 -9.367 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -1.812 15.493 -10.763 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.513 15.885 -10.926 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -4.462 16.221 -8.234 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -0.714 17.305 -9.860 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -4.219 17.998 -6.493 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.473 19.082 -8.119 1.00 0.00 H new ATOM 0 HZ PHE A 48 -2.227 19.406 -6.455 1.00 0.00 H new ATOM 786 N TYR A 49 -3.953 12.697 -11.340 1.00 0.00 N ATOM 787 CA TYR A 49 -3.864 11.689 -12.382 1.00 0.00 C ATOM 788 C TYR A 49 -4.716 12.074 -13.593 1.00 0.00 C ATOM 789 O TYR A 49 -5.637 12.882 -13.476 1.00 0.00 O ATOM 790 CB TYR A 49 -4.419 10.400 -11.772 1.00 0.00 C ATOM 791 CG TYR A 49 -3.477 9.730 -10.769 1.00 0.00 C ATOM 792 CD1 TYR A 49 -2.488 8.878 -11.216 1.00 0.00 C ATOM 793 CD2 TYR A 49 -3.617 9.978 -9.419 1.00 0.00 C ATOM 794 CE1 TYR A 49 -1.602 8.247 -10.272 1.00 0.00 C ATOM 795 CE2 TYR A 49 -2.730 9.348 -8.475 1.00 0.00 C ATOM 796 CZ TYR A 49 -1.767 8.513 -8.949 1.00 0.00 C ATOM 797 OH TYR A 49 -0.929 7.917 -8.058 1.00 0.00 O ATOM 0 H TYR A 49 -4.900 13.016 -11.135 1.00 0.00 H new ATOM 0 HA TYR A 49 -2.834 11.581 -12.723 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -5.363 10.623 -11.275 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -4.639 9.696 -12.574 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -2.378 8.684 -12.273 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -4.392 10.645 -9.070 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -0.824 7.577 -10.608 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.827 9.534 -7.416 1.00 0.00 H new ATOM 0 HH TYR A 49 -1.163 8.200 -7.149 1.00 0.00 H new ATOM 807 N THR A 50 -4.380 11.478 -14.727 1.00 0.00 N ATOM 808 CA THR A 50 -5.103 11.750 -15.958 1.00 0.00 C ATOM 809 C THR A 50 -6.334 10.847 -16.063 1.00 0.00 C ATOM 810 O THR A 50 -7.353 11.244 -16.625 1.00 0.00 O ATOM 811 CB THR A 50 -4.128 11.585 -17.125 1.00 0.00 C ATOM 812 OG1 THR A 50 -4.024 10.174 -17.295 1.00 0.00 O ATOM 813 CG2 THR A 50 -2.706 12.023 -16.767 1.00 0.00 C ATOM 0 H THR A 50 -3.617 10.808 -14.820 1.00 0.00 H new ATOM 0 HA THR A 50 -5.484 12.771 -15.976 1.00 0.00 H new ATOM 0 HB THR A 50 -4.482 12.164 -17.978 1.00 0.00 H new ATOM 0 HG1 THR A 50 -3.411 9.978 -18.034 1.00 0.00 H new ATOM 0 HG21 THR A 50 -2.055 11.885 -17.630 1.00 0.00 H new ATOM 0 HG22 THR A 50 -2.711 13.075 -16.480 1.00 0.00 H new ATOM 0 HG23 THR A 50 -2.339 11.422 -15.936 1.00 0.00 H new ATOM 821 N ASP A 51 -6.198 9.649 -15.513 1.00 0.00 N ATOM 822 CA ASP A 51 -7.287 8.687 -15.538 1.00 0.00 C ATOM 823 C ASP A 51 -6.979 7.550 -14.561 1.00 0.00 C ATOM 824 O ASP A 51 -5.816 7.273 -14.271 1.00 0.00 O ATOM 825 CB ASP A 51 -7.454 8.080 -16.932 1.00 0.00 C ATOM 826 CG ASP A 51 -7.651 9.095 -18.060 1.00 0.00 C ATOM 827 OD1 ASP A 51 -8.804 9.551 -18.217 1.00 0.00 O ATOM 828 OD2 ASP A 51 -6.645 9.392 -18.739 1.00 0.00 O ATOM 0 H ASP A 51 -5.351 9.323 -15.048 1.00 0.00 H new ATOM 0 HA ASP A 51 -8.203 9.207 -15.259 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -6.575 7.476 -17.157 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -8.310 7.405 -16.918 1.00 0.00 H new ATOM 833 N LYS A 52 -8.042 6.922 -14.080 1.00 0.00 N ATOM 834 CA LYS A 52 -7.900 5.822 -13.142 1.00 0.00 C ATOM 835 C LYS A 52 -7.055 4.718 -13.781 1.00 0.00 C ATOM 836 O LYS A 52 -6.443 3.915 -13.079 1.00 0.00 O ATOM 837 CB LYS A 52 -9.273 5.346 -12.663 1.00 0.00 C ATOM 838 CG LYS A 52 -10.047 4.673 -13.798 1.00 0.00 C ATOM 839 CD LYS A 52 -11.555 4.735 -13.546 1.00 0.00 C ATOM 840 CE LYS A 52 -12.140 6.057 -14.044 1.00 0.00 C ATOM 841 NZ LYS A 52 -13.561 6.178 -13.645 1.00 0.00 N ATOM 0 H LYS A 52 -9.005 7.154 -14.322 1.00 0.00 H new ATOM 0 HA LYS A 52 -7.372 6.150 -12.247 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -9.151 4.646 -11.836 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -9.843 6.193 -12.282 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -9.812 5.163 -14.743 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -9.733 3.633 -13.891 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -12.046 3.903 -14.051 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -11.754 4.624 -12.480 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -11.569 6.891 -13.636 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -12.055 6.113 -15.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -13.943 7.081 -13.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -14.105 5.392 -14.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -13.634 6.146 -12.608 1.00 0.00 H new ATOM 855 N LYS A 53 -7.049 4.714 -15.106 1.00 0.00 N ATOM 856 CA LYS A 53 -6.290 3.722 -15.848 1.00 0.00 C ATOM 857 C LYS A 53 -4.794 3.969 -15.638 1.00 0.00 C ATOM 858 O LYS A 53 -3.997 3.033 -15.668 1.00 0.00 O ATOM 859 CB LYS A 53 -6.711 3.715 -17.319 1.00 0.00 C ATOM 860 CG LYS A 53 -8.095 3.085 -17.490 1.00 0.00 C ATOM 861 CD LYS A 53 -8.003 1.558 -17.515 1.00 0.00 C ATOM 862 CE LYS A 53 -9.365 0.932 -17.820 1.00 0.00 C ATOM 863 NZ LYS A 53 -9.200 -0.452 -18.317 1.00 0.00 N ATOM 0 H LYS A 53 -7.558 5.382 -15.685 1.00 0.00 H new ATOM 0 HA LYS A 53 -6.504 2.721 -15.474 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -6.722 4.735 -17.703 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -5.980 3.161 -17.908 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -8.745 3.400 -16.674 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -8.549 3.441 -18.415 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -7.279 1.246 -18.267 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -7.640 1.196 -16.553 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -9.981 0.931 -16.921 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -9.889 1.532 -18.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -10.134 -0.862 -18.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -8.630 -0.443 -19.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -8.719 -1.025 -17.595 1.00 0.00 H new ATOM 877 N SER A 54 -4.460 5.234 -15.428 1.00 0.00 N ATOM 878 CA SER A 54 -3.074 5.616 -15.213 1.00 0.00 C ATOM 879 C SER A 54 -2.621 5.177 -13.819 1.00 0.00 C ATOM 880 O SER A 54 -3.344 5.363 -12.841 1.00 0.00 O ATOM 881 CB SER A 54 -2.886 7.125 -15.382 1.00 0.00 C ATOM 882 OG SER A 54 -2.563 7.475 -16.725 1.00 0.00 O ATOM 0 H SER A 54 -5.125 6.007 -15.402 1.00 0.00 H new ATOM 0 HA SER A 54 -2.461 5.115 -15.962 1.00 0.00 H new ATOM 0 HB2 SER A 54 -3.799 7.640 -15.083 1.00 0.00 H new ATOM 0 HB3 SER A 54 -2.094 7.468 -14.717 1.00 0.00 H new ATOM 0 HG SER A 54 -2.988 8.328 -16.952 1.00 0.00 H new ATOM 888 N ILE A 55 -1.428 4.603 -13.773 1.00 0.00 N ATOM 889 CA ILE A 55 -0.870 4.137 -12.515 1.00 0.00 C ATOM 890 C ILE A 55 -0.059 5.264 -11.873 1.00 0.00 C ATOM 891 O ILE A 55 -0.140 5.481 -10.665 1.00 0.00 O ATOM 892 CB ILE A 55 -0.073 2.849 -12.727 1.00 0.00 C ATOM 893 CG1 ILE A 55 -0.798 1.907 -13.690 1.00 0.00 C ATOM 894 CG2 ILE A 55 0.242 2.172 -11.392 1.00 0.00 C ATOM 895 CD1 ILE A 55 -0.115 1.889 -15.059 1.00 0.00 C ATOM 0 H ILE A 55 -0.832 4.450 -14.587 1.00 0.00 H new ATOM 0 HA ILE A 55 -1.667 3.880 -11.817 1.00 0.00 H new ATOM 0 HB ILE A 55 0.880 3.110 -13.188 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -0.815 0.899 -13.275 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.835 2.223 -13.801 1.00 0.00 H new ATOM 0 HG21 ILE A 55 0.809 1.259 -11.572 1.00 0.00 H new ATOM 0 HG22 ILE A 55 0.830 2.848 -10.771 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -0.688 1.926 -10.880 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -0.651 1.212 -15.724 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -0.122 2.893 -15.482 1.00 0.00 H new ATOM 0 HD13 ILE A 55 0.915 1.549 -14.947 1.00 0.00 H new ATOM 907 N ILE A 56 0.705 5.951 -12.710 1.00 0.00 N ATOM 908 CA ILE A 56 1.530 7.050 -12.239 1.00 0.00 C ATOM 909 C ILE A 56 0.724 8.349 -12.299 1.00 0.00 C ATOM 910 O ILE A 56 -0.123 8.519 -13.174 1.00 0.00 O ATOM 911 CB ILE A 56 2.845 7.105 -13.019 1.00 0.00 C ATOM 912 CG1 ILE A 56 3.525 5.735 -13.046 1.00 0.00 C ATOM 913 CG2 ILE A 56 3.767 8.192 -12.463 1.00 0.00 C ATOM 914 CD1 ILE A 56 3.267 5.020 -14.373 1.00 0.00 C ATOM 0 H ILE A 56 0.770 5.768 -13.711 1.00 0.00 H new ATOM 0 HA ILE A 56 1.811 6.897 -11.197 1.00 0.00 H new ATOM 0 HB ILE A 56 2.619 7.372 -14.051 1.00 0.00 H new ATOM 0 HG12 ILE A 56 4.598 5.855 -12.896 1.00 0.00 H new ATOM 0 HG13 ILE A 56 3.154 5.125 -12.222 1.00 0.00 H new ATOM 0 HG21 ILE A 56 4.695 8.210 -13.035 1.00 0.00 H new ATOM 0 HG22 ILE A 56 3.274 9.161 -12.540 1.00 0.00 H new ATOM 0 HG23 ILE A 56 3.990 7.980 -11.417 1.00 0.00 H new ATOM 0 HD11 ILE A 56 3.762 4.049 -14.365 1.00 0.00 H new ATOM 0 HD12 ILE A 56 2.195 4.880 -14.508 1.00 0.00 H new ATOM 0 HD13 ILE A 56 3.661 5.621 -15.193 1.00 0.00 H new ATOM 926 N TYR A 57 1.017 9.234 -11.357 1.00 0.00 N ATOM 927 CA TYR A 57 0.331 10.513 -11.291 1.00 0.00 C ATOM 928 C TYR A 57 1.024 11.553 -12.173 1.00 0.00 C ATOM 929 O TYR A 57 2.221 11.797 -12.028 1.00 0.00 O ATOM 930 CB TYR A 57 0.414 10.962 -9.831 1.00 0.00 C ATOM 931 CG TYR A 57 1.842 11.182 -9.328 1.00 0.00 C ATOM 932 CD1 TYR A 57 2.463 12.399 -9.524 1.00 0.00 C ATOM 933 CD2 TYR A 57 2.510 10.164 -8.679 1.00 0.00 C ATOM 934 CE1 TYR A 57 3.807 12.607 -9.051 1.00 0.00 C ATOM 935 CE2 TYR A 57 3.854 10.371 -8.206 1.00 0.00 C ATOM 936 CZ TYR A 57 4.436 11.582 -8.415 1.00 0.00 C ATOM 937 OH TYR A 57 5.706 11.778 -7.968 1.00 0.00 O ATOM 0 H TYR A 57 1.721 9.090 -10.633 1.00 0.00 H new ATOM 0 HA TYR A 57 -0.697 10.415 -11.640 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -0.148 11.888 -9.714 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.070 10.214 -9.203 1.00 0.00 H new ATOM 0 HD1 TYR A 57 1.940 13.196 -10.032 1.00 0.00 H new ATOM 0 HD2 TYR A 57 2.025 9.212 -8.526 1.00 0.00 H new ATOM 0 HE1 TYR A 57 4.304 13.555 -9.198 1.00 0.00 H new ATOM 0 HE2 TYR A 57 4.388 9.582 -7.697 1.00 0.00 H new ATOM 0 HH TYR A 57 5.993 12.689 -8.188 1.00 0.00 H new ATOM 947 N VAL A 58 0.242 12.139 -13.068 1.00 0.00 N ATOM 948 CA VAL A 58 0.767 13.148 -13.973 1.00 0.00 C ATOM 949 C VAL A 58 1.573 14.174 -13.175 1.00 0.00 C ATOM 950 O VAL A 58 2.666 14.564 -13.584 1.00 0.00 O ATOM 951 CB VAL A 58 -0.376 13.777 -14.773 1.00 0.00 C ATOM 952 CG1 VAL A 58 -1.469 14.308 -13.843 1.00 0.00 C ATOM 953 CG2 VAL A 58 0.144 14.882 -15.695 1.00 0.00 C ATOM 0 H VAL A 58 -0.750 11.935 -13.186 1.00 0.00 H new ATOM 0 HA VAL A 58 1.444 12.696 -14.698 1.00 0.00 H new ATOM 0 HB VAL A 58 -0.816 12.999 -15.397 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -2.269 14.750 -14.437 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -1.870 13.488 -13.247 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -1.048 15.065 -13.182 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.688 15.313 -16.252 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.622 15.659 -15.098 1.00 0.00 H new ATOM 0 HG23 VAL A 58 0.869 14.463 -16.392 1.00 0.00 H new ATOM 963 N ASP A 59 1.004 14.581 -12.050 1.00 0.00 N ATOM 964 CA ASP A 59 1.656 15.554 -11.190 1.00 0.00 C ATOM 965 C ASP A 59 1.090 15.438 -9.774 1.00 0.00 C ATOM 966 O ASP A 59 -0.031 14.967 -9.586 1.00 0.00 O ATOM 967 CB ASP A 59 1.407 16.981 -11.684 1.00 0.00 C ATOM 968 CG ASP A 59 2.617 17.665 -12.322 1.00 0.00 C ATOM 969 OD1 ASP A 59 3.412 18.246 -11.552 1.00 0.00 O ATOM 970 OD2 ASP A 59 2.720 17.593 -13.566 1.00 0.00 O ATOM 0 H ASP A 59 0.098 14.254 -11.714 1.00 0.00 H new ATOM 0 HA ASP A 59 2.727 15.350 -11.202 1.00 0.00 H new ATOM 0 HB2 ASP A 59 0.595 16.961 -12.411 1.00 0.00 H new ATOM 0 HB3 ASP A 59 1.068 17.586 -10.843 1.00 0.00 H new ATOM 975 N LYS A 60 1.890 15.877 -8.813 1.00 0.00 N ATOM 976 CA LYS A 60 1.482 15.828 -7.419 1.00 0.00 C ATOM 977 C LYS A 60 1.863 17.142 -6.735 1.00 0.00 C ATOM 978 O LYS A 60 2.712 17.881 -7.231 1.00 0.00 O ATOM 979 CB LYS A 60 2.060 14.588 -6.735 1.00 0.00 C ATOM 980 CG LYS A 60 3.576 14.711 -6.567 1.00 0.00 C ATOM 981 CD LYS A 60 4.123 13.587 -5.685 1.00 0.00 C ATOM 982 CE LYS A 60 5.507 13.942 -5.139 1.00 0.00 C ATOM 983 NZ LYS A 60 6.440 12.806 -5.311 1.00 0.00 N ATOM 0 H LYS A 60 2.818 16.268 -8.972 1.00 0.00 H new ATOM 0 HA LYS A 60 0.399 15.730 -7.342 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.592 14.455 -5.760 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.827 13.701 -7.324 1.00 0.00 H new ATOM 0 HG2 LYS A 60 4.058 14.678 -7.544 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.819 15.677 -6.124 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.438 13.403 -4.857 1.00 0.00 H new ATOM 0 HD3 LYS A 60 4.181 12.664 -6.261 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.894 14.820 -5.657 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.432 14.202 -4.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 7.420 13.153 -5.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 6.291 12.116 -4.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 6.265 12.349 -6.229 1.00 0.00 H new ATOM 997 N LEU A 61 1.217 17.393 -5.605 1.00 0.00 N ATOM 998 CA LEU A 61 1.478 18.605 -4.848 1.00 0.00 C ATOM 999 C LEU A 61 1.710 18.243 -3.379 1.00 0.00 C ATOM 1000 O LEU A 61 1.668 17.071 -3.011 1.00 0.00 O ATOM 1001 CB LEU A 61 0.355 19.622 -5.060 1.00 0.00 C ATOM 1002 CG LEU A 61 0.677 20.792 -5.992 1.00 0.00 C ATOM 1003 CD1 LEU A 61 -0.525 21.728 -6.132 1.00 0.00 C ATOM 1004 CD2 LEU A 61 1.931 21.535 -5.526 1.00 0.00 C ATOM 0 H LEU A 61 0.514 16.778 -5.196 1.00 0.00 H new ATOM 0 HA LEU A 61 2.387 19.089 -5.206 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -0.514 19.097 -5.456 1.00 0.00 H new ATOM 0 HB3 LEU A 61 0.069 20.025 -4.089 1.00 0.00 H new ATOM 0 HG LEU A 61 0.890 20.391 -6.983 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -0.270 22.551 -6.800 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -1.370 21.176 -6.543 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -0.793 22.125 -5.153 1.00 0.00 H new ATOM 0 HD21 LEU A 61 2.138 22.362 -6.206 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.771 21.923 -4.520 1.00 0.00 H new ATOM 0 HD23 LEU A 61 2.779 20.850 -5.520 1.00 0.00 H new ATOM 1016 N ASP A 62 1.950 19.273 -2.580 1.00 0.00 N ATOM 1017 CA ASP A 62 2.189 19.078 -1.160 1.00 0.00 C ATOM 1018 C ASP A 62 1.627 20.271 -0.385 1.00 0.00 C ATOM 1019 O ASP A 62 1.973 21.418 -0.666 1.00 0.00 O ATOM 1020 CB ASP A 62 3.687 18.983 -0.862 1.00 0.00 C ATOM 1021 CG ASP A 62 4.055 18.086 0.322 1.00 0.00 C ATOM 1022 OD1 ASP A 62 3.293 17.126 0.565 1.00 0.00 O ATOM 1023 OD2 ASP A 62 5.090 18.382 0.958 1.00 0.00 O ATOM 0 H ASP A 62 1.984 20.244 -2.889 1.00 0.00 H new ATOM 0 HA ASP A 62 1.702 18.150 -0.860 1.00 0.00 H new ATOM 0 HB2 ASP A 62 4.196 18.612 -1.751 1.00 0.00 H new ATOM 0 HB3 ASP A 62 4.069 19.986 -0.671 1.00 0.00 H new ATOM 1028 N ILE A 63 0.770 19.960 0.577 1.00 0.00 N ATOM 1029 CA ILE A 63 0.157 20.993 1.395 1.00 0.00 C ATOM 1030 C ILE A 63 0.406 20.682 2.872 1.00 0.00 C ATOM 1031 O ILE A 63 -0.271 21.220 3.746 1.00 0.00 O ATOM 1032 CB ILE A 63 -1.324 21.148 1.041 1.00 0.00 C ATOM 1033 CG1 ILE A 63 -2.045 19.799 1.095 1.00 0.00 C ATOM 1034 CG2 ILE A 63 -1.494 21.835 -0.315 1.00 0.00 C ATOM 1035 CD1 ILE A 63 -3.560 19.991 1.189 1.00 0.00 C ATOM 0 H ILE A 63 0.486 19.008 0.808 1.00 0.00 H new ATOM 0 HA ILE A 63 0.613 21.962 1.191 1.00 0.00 H new ATOM 0 HB ILE A 63 -1.789 21.791 1.788 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.803 19.217 0.206 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.693 19.229 1.955 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -2.555 21.933 -0.543 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.037 22.824 -0.282 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.011 21.238 -1.088 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -4.049 19.017 1.226 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -3.800 20.552 2.092 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -3.912 20.541 0.316 1.00 0.00 H new ATOM 1047 N VAL A 64 1.381 19.815 3.105 1.00 0.00 N ATOM 1048 CA VAL A 64 1.728 19.426 4.461 1.00 0.00 C ATOM 1049 C VAL A 64 2.199 20.659 5.236 1.00 0.00 C ATOM 1050 O VAL A 64 1.860 20.828 6.406 1.00 0.00 O ATOM 1051 CB VAL A 64 2.768 18.304 4.434 1.00 0.00 C ATOM 1052 CG1 VAL A 64 4.110 18.813 3.902 1.00 0.00 C ATOM 1053 CG2 VAL A 64 2.930 17.673 5.818 1.00 0.00 C ATOM 0 H VAL A 64 1.941 19.371 2.377 1.00 0.00 H new ATOM 0 HA VAL A 64 0.855 19.029 4.980 1.00 0.00 H new ATOM 0 HB VAL A 64 2.410 17.531 3.754 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.831 17.996 3.893 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.979 19.193 2.889 1.00 0.00 H new ATOM 0 HG13 VAL A 64 4.476 19.613 4.545 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.675 16.879 5.771 1.00 0.00 H new ATOM 0 HG22 VAL A 64 3.255 18.433 6.529 1.00 0.00 H new ATOM 0 HG23 VAL A 64 1.976 17.257 6.142 1.00 0.00 H new ATOM 1063 N ASP A 65 2.973 21.488 4.551 1.00 0.00 N ATOM 1064 CA ASP A 65 3.494 22.700 5.160 1.00 0.00 C ATOM 1065 C ASP A 65 2.535 23.859 4.881 1.00 0.00 C ATOM 1066 O ASP A 65 2.903 25.023 5.029 1.00 0.00 O ATOM 1067 CB ASP A 65 4.860 23.066 4.578 1.00 0.00 C ATOM 1068 CG ASP A 65 6.039 22.900 5.539 1.00 0.00 C ATOM 1069 OD1 ASP A 65 6.017 23.580 6.587 1.00 0.00 O ATOM 1070 OD2 ASP A 65 6.936 22.097 5.203 1.00 0.00 O ATOM 0 H ASP A 65 3.252 21.344 3.580 1.00 0.00 H new ATOM 0 HA ASP A 65 3.594 22.523 6.231 1.00 0.00 H new ATOM 0 HB2 ASP A 65 5.040 22.450 3.697 1.00 0.00 H new ATOM 0 HB3 ASP A 65 4.829 24.102 4.241 1.00 0.00 H new ATOM 1075 N LEU A 66 1.324 23.499 4.482 1.00 0.00 N ATOM 1076 CA LEU A 66 0.309 24.495 4.181 1.00 0.00 C ATOM 1077 C LEU A 66 0.296 25.554 5.285 1.00 0.00 C ATOM 1078 O LEU A 66 0.226 25.222 6.468 1.00 0.00 O ATOM 1079 CB LEU A 66 -1.048 23.825 3.955 1.00 0.00 C ATOM 1080 CG LEU A 66 -2.254 24.763 3.873 1.00 0.00 C ATOM 1081 CD1 LEU A 66 -2.793 24.839 2.443 1.00 0.00 C ATOM 1082 CD2 LEU A 66 -3.337 24.353 4.873 1.00 0.00 C ATOM 0 H LEU A 66 1.023 22.532 4.360 1.00 0.00 H new ATOM 0 HA LEU A 66 0.544 25.009 3.249 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.997 23.249 3.031 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.219 23.115 4.764 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.926 25.766 4.147 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.650 25.512 2.412 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -2.013 25.214 1.780 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.100 23.845 2.117 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.183 25.036 4.794 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.669 23.338 4.654 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.932 24.392 5.884 1.00 0.00 H new ATOM 1094 N THR A 67 0.363 26.807 4.860 1.00 0.00 N ATOM 1095 CA THR A 67 0.359 27.916 5.798 1.00 0.00 C ATOM 1096 C THR A 67 -1.072 28.252 6.222 1.00 0.00 C ATOM 1097 O THR A 67 -1.308 28.662 7.357 1.00 0.00 O ATOM 1098 CB THR A 67 1.091 29.090 5.145 1.00 0.00 C ATOM 1099 OG1 THR A 67 2.450 28.913 5.536 1.00 0.00 O ATOM 1100 CG2 THR A 67 0.700 30.437 5.756 1.00 0.00 C ATOM 0 H THR A 67 0.420 27.079 3.878 1.00 0.00 H new ATOM 0 HA THR A 67 0.884 27.658 6.718 1.00 0.00 H new ATOM 0 HB THR A 67 0.878 29.101 4.076 1.00 0.00 H new ATOM 0 HG1 THR A 67 2.996 29.631 5.154 1.00 0.00 H new ATOM 0 HG21 THR A 67 1.248 31.236 5.257 1.00 0.00 H new ATOM 0 HG22 THR A 67 -0.371 30.597 5.629 1.00 0.00 H new ATOM 0 HG23 THR A 67 0.944 30.439 6.818 1.00 0.00 H new ATOM 1108 N CYS A 68 -1.991 28.067 5.285 1.00 0.00 N ATOM 1109 CA CYS A 68 -3.393 28.345 5.547 1.00 0.00 C ATOM 1110 C CYS A 68 -4.161 28.225 4.229 1.00 0.00 C ATOM 1111 O CYS A 68 -3.602 27.804 3.217 1.00 0.00 O ATOM 1112 CB CYS A 68 -3.586 29.716 6.198 1.00 0.00 C ATOM 1113 SG CYS A 68 -4.259 29.518 7.888 1.00 0.00 S ATOM 0 H CYS A 68 -1.792 27.728 4.344 1.00 0.00 H new ATOM 0 HA CYS A 68 -3.783 27.619 6.261 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -2.635 30.246 6.237 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -4.264 30.321 5.596 1.00 0.00 H new ATOM 0 HG CYS A 68 -4.417 30.688 8.432 1.00 0.00 H new ATOM 1119 N LEU A 69 -5.429 28.604 4.284 1.00 0.00 N ATOM 1120 CA LEU A 69 -6.279 28.545 3.107 1.00 0.00 C ATOM 1121 C LEU A 69 -7.138 29.810 3.039 1.00 0.00 C ATOM 1122 O LEU A 69 -7.777 30.184 4.021 1.00 0.00 O ATOM 1123 CB LEU A 69 -7.092 27.249 3.097 1.00 0.00 C ATOM 1124 CG LEU A 69 -7.925 26.988 1.840 1.00 0.00 C ATOM 1125 CD1 LEU A 69 -7.533 25.661 1.188 1.00 0.00 C ATOM 1126 CD2 LEU A 69 -9.421 27.054 2.151 1.00 0.00 C ATOM 0 H LEU A 69 -5.888 28.953 5.125 1.00 0.00 H new ATOM 0 HA LEU A 69 -5.673 28.521 2.201 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.407 26.413 3.234 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.762 27.257 3.957 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.711 27.776 1.118 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.140 25.500 0.297 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -6.480 25.690 0.909 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.700 24.846 1.893 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.990 26.865 1.241 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.671 26.301 2.898 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.669 28.043 2.536 1.00 0.00 H new ATOM 1138 N THR A 70 -7.125 30.433 1.870 1.00 0.00 N ATOM 1139 CA THR A 70 -7.895 31.647 1.661 1.00 0.00 C ATOM 1140 C THR A 70 -8.950 31.430 0.575 1.00 0.00 C ATOM 1141 O THR A 70 -9.048 30.342 0.008 1.00 0.00 O ATOM 1142 CB THR A 70 -6.916 32.778 1.339 1.00 0.00 C ATOM 1143 OG1 THR A 70 -7.752 33.851 0.914 1.00 0.00 O ATOM 1144 CG2 THR A 70 -6.050 32.473 0.115 1.00 0.00 C ATOM 0 H THR A 70 -6.593 30.120 1.058 1.00 0.00 H new ATOM 0 HA THR A 70 -8.450 31.922 2.558 1.00 0.00 H new ATOM 0 HB THR A 70 -6.274 32.958 2.201 1.00 0.00 H new ATOM 0 HG1 THR A 70 -7.198 34.627 0.687 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.374 33.308 -0.069 1.00 0.00 H new ATOM 0 HG22 THR A 70 -5.469 31.569 0.296 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.689 32.325 -0.755 1.00 0.00 H new ATOM 1152 N GLU A 71 -9.713 32.482 0.317 1.00 0.00 N ATOM 1153 CA GLU A 71 -10.758 32.420 -0.691 1.00 0.00 C ATOM 1154 C GLU A 71 -10.568 33.535 -1.722 1.00 0.00 C ATOM 1155 O GLU A 71 -10.244 34.666 -1.364 1.00 0.00 O ATOM 1156 CB GLU A 71 -12.144 32.496 -0.050 1.00 0.00 C ATOM 1157 CG GLU A 71 -12.569 31.134 0.501 1.00 0.00 C ATOM 1158 CD GLU A 71 -13.736 31.278 1.480 1.00 0.00 C ATOM 1159 OE1 GLU A 71 -13.588 32.082 2.426 1.00 0.00 O ATOM 1160 OE2 GLU A 71 -14.750 30.581 1.261 1.00 0.00 O ATOM 0 H GLU A 71 -9.628 33.382 0.789 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.684 31.461 -1.204 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -12.137 33.231 0.755 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.871 32.837 -0.787 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.858 30.479 -0.321 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -11.725 30.661 1.003 1.00 0.00 H new ATOM 1274 N CYS A 79 -19.231 28.634 -6.386 1.00 0.00 N ATOM 1275 CA CYS A 79 -18.537 27.426 -5.974 1.00 0.00 C ATOM 1276 C CYS A 79 -17.488 27.807 -4.927 1.00 0.00 C ATOM 1277 O CYS A 79 -17.306 28.986 -4.627 1.00 0.00 O ATOM 1278 CB CYS A 79 -17.915 26.696 -7.166 1.00 0.00 C ATOM 1279 SG CYS A 79 -16.456 27.619 -7.773 1.00 0.00 S ATOM 0 HA CYS A 79 -19.249 26.727 -5.535 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -17.622 25.688 -6.873 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -18.650 26.595 -7.965 1.00 0.00 H new ATOM 0 HG CYS A 79 -15.934 26.990 -8.784 1.00 0.00 H new ATOM 1285 N ALA A 80 -16.826 26.787 -4.401 1.00 0.00 N ATOM 1286 CA ALA A 80 -15.800 27.001 -3.395 1.00 0.00 C ATOM 1287 C ALA A 80 -14.452 27.218 -4.085 1.00 0.00 C ATOM 1288 O ALA A 80 -13.924 26.310 -4.725 1.00 0.00 O ATOM 1289 CB ALA A 80 -15.776 25.814 -2.430 1.00 0.00 C ATOM 0 H ALA A 80 -16.980 25.811 -4.653 1.00 0.00 H new ATOM 0 HA ALA A 80 -16.018 27.894 -2.809 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -15.006 25.974 -1.675 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -16.747 25.721 -1.944 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -15.558 24.900 -2.983 1.00 0.00 H new ATOM 1295 N LYS A 81 -13.932 28.427 -3.931 1.00 0.00 N ATOM 1296 CA LYS A 81 -12.656 28.775 -4.532 1.00 0.00 C ATOM 1297 C LYS A 81 -11.687 29.223 -3.436 1.00 0.00 C ATOM 1298 O LYS A 81 -11.909 30.242 -2.784 1.00 0.00 O ATOM 1299 CB LYS A 81 -12.850 29.811 -5.641 1.00 0.00 C ATOM 1300 CG LYS A 81 -13.255 29.139 -6.954 1.00 0.00 C ATOM 1301 CD LYS A 81 -13.854 30.155 -7.929 1.00 0.00 C ATOM 1302 CE LYS A 81 -12.879 30.465 -9.066 1.00 0.00 C ATOM 1303 NZ LYS A 81 -11.782 31.334 -8.585 1.00 0.00 N ATOM 0 H LYS A 81 -14.371 29.178 -3.399 1.00 0.00 H new ATOM 0 HA LYS A 81 -12.213 27.904 -5.015 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.615 30.528 -5.344 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.927 30.372 -5.785 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.385 28.664 -7.407 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.980 28.350 -6.754 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.785 29.765 -8.340 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.101 31.073 -7.396 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -12.468 29.537 -9.464 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.408 30.956 -9.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -11.129 31.535 -9.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -12.178 32.227 -8.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -11.267 30.852 -7.821 1.00 0.00 H new ATOM 1317 N PHE A 82 -10.633 28.438 -3.266 1.00 0.00 N ATOM 1318 CA PHE A 82 -9.629 28.741 -2.260 1.00 0.00 C ATOM 1319 C PHE A 82 -8.222 28.451 -2.785 1.00 0.00 C ATOM 1320 O PHE A 82 -8.049 27.639 -3.692 1.00 0.00 O ATOM 1321 CB PHE A 82 -9.910 27.833 -1.061 1.00 0.00 C ATOM 1322 CG PHE A 82 -10.170 26.372 -1.434 1.00 0.00 C ATOM 1323 CD1 PHE A 82 -9.133 25.564 -1.784 1.00 0.00 C ATOM 1324 CD2 PHE A 82 -11.438 25.881 -1.415 1.00 0.00 C ATOM 1325 CE1 PHE A 82 -9.375 24.209 -2.130 1.00 0.00 C ATOM 1326 CE2 PHE A 82 -11.680 24.525 -1.761 1.00 0.00 C ATOM 1327 CZ PHE A 82 -10.643 23.718 -2.111 1.00 0.00 C ATOM 0 H PHE A 82 -10.453 27.593 -3.808 1.00 0.00 H new ATOM 0 HA PHE A 82 -9.677 29.796 -1.992 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -9.062 27.877 -0.378 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -10.775 28.219 -0.521 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -8.126 25.954 -1.799 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -12.261 26.522 -1.137 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -8.552 23.568 -2.408 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -12.687 24.135 -1.746 1.00 0.00 H new ATOM 0 HZ PHE A 82 -10.826 22.687 -2.374 1.00 0.00 H new ATOM 1337 N THR A 83 -7.252 29.132 -2.192 1.00 0.00 N ATOM 1338 CA THR A 83 -5.865 28.959 -2.589 1.00 0.00 C ATOM 1339 C THR A 83 -5.056 28.341 -1.447 1.00 0.00 C ATOM 1340 O THR A 83 -5.214 28.727 -0.290 1.00 0.00 O ATOM 1341 CB THR A 83 -5.330 30.317 -3.046 1.00 0.00 C ATOM 1342 OG1 THR A 83 -5.764 30.424 -4.400 1.00 0.00 O ATOM 1343 CG2 THR A 83 -3.803 30.344 -3.141 1.00 0.00 C ATOM 0 H THR A 83 -7.399 29.805 -1.440 1.00 0.00 H new ATOM 0 HA THR A 83 -5.777 28.262 -3.422 1.00 0.00 H new ATOM 0 HB THR A 83 -5.664 31.090 -2.353 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.461 31.278 -4.774 1.00 0.00 H new ATOM 0 HG21 THR A 83 -3.476 31.331 -3.470 1.00 0.00 H new ATOM 0 HG22 THR A 83 -3.374 30.127 -2.163 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.470 29.594 -3.858 1.00 0.00 H new ATOM 1351 N LEU A 84 -4.208 27.391 -1.812 1.00 0.00 N ATOM 1352 CA LEU A 84 -3.374 26.716 -0.832 1.00 0.00 C ATOM 1353 C LEU A 84 -2.117 27.549 -0.577 1.00 0.00 C ATOM 1354 O LEU A 84 -1.251 27.654 -1.445 1.00 0.00 O ATOM 1355 CB LEU A 84 -3.082 25.281 -1.275 1.00 0.00 C ATOM 1356 CG LEU A 84 -4.284 24.335 -1.321 1.00 0.00 C ATOM 1357 CD1 LEU A 84 -4.770 23.996 0.089 1.00 0.00 C ATOM 1358 CD2 LEU A 84 -5.403 24.913 -2.190 1.00 0.00 C ATOM 0 H LEU A 84 -4.080 27.073 -2.773 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.898 26.631 0.120 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.632 25.313 -2.267 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.338 24.858 -0.600 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.966 23.401 -1.784 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.625 23.322 0.027 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.966 23.512 0.644 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -5.066 24.911 0.602 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -6.245 24.221 -2.206 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -5.726 25.869 -1.778 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -5.036 25.061 -3.206 1.00 0.00 H new ATOM 1370 N VAL A 85 -2.056 28.120 0.617 1.00 0.00 N ATOM 1371 CA VAL A 85 -0.918 28.941 0.997 1.00 0.00 C ATOM 1372 C VAL A 85 0.217 28.038 1.483 1.00 0.00 C ATOM 1373 O VAL A 85 0.043 27.271 2.429 1.00 0.00 O ATOM 1374 CB VAL A 85 -1.346 29.978 2.037 1.00 0.00 C ATOM 1375 CG1 VAL A 85 -0.190 30.921 2.378 1.00 0.00 C ATOM 1376 CG2 VAL A 85 -2.570 30.762 1.560 1.00 0.00 C ATOM 0 H VAL A 85 -2.776 28.031 1.334 1.00 0.00 H new ATOM 0 HA VAL A 85 -0.544 29.498 0.138 1.00 0.00 H new ATOM 0 HB VAL A 85 -1.624 29.445 2.946 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -0.520 31.648 3.119 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.643 30.345 2.781 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.132 31.442 1.477 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -2.853 31.492 2.318 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.332 31.278 0.630 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.399 30.075 1.391 1.00 0.00 H new ATOM 1386 N LEU A 86 1.354 28.159 0.815 1.00 0.00 N ATOM 1387 CA LEU A 86 2.518 27.364 1.168 1.00 0.00 C ATOM 1388 C LEU A 86 3.707 28.292 1.424 1.00 0.00 C ATOM 1389 O LEU A 86 3.738 29.417 0.927 1.00 0.00 O ATOM 1390 CB LEU A 86 2.785 26.302 0.099 1.00 0.00 C ATOM 1391 CG LEU A 86 1.553 25.586 -0.458 1.00 0.00 C ATOM 1392 CD1 LEU A 86 1.755 25.212 -1.928 1.00 0.00 C ATOM 1393 CD2 LEU A 86 1.191 24.371 0.399 1.00 0.00 C ATOM 0 H LEU A 86 1.494 28.796 0.031 1.00 0.00 H new ATOM 0 HA LEU A 86 2.338 26.815 2.092 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.312 26.774 -0.730 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.457 25.553 0.519 1.00 0.00 H new ATOM 0 HG LEU A 86 0.708 26.274 -0.414 1.00 0.00 H new ATOM 0 HD11 LEU A 86 0.865 24.704 -2.300 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.928 26.115 -2.513 1.00 0.00 H new ATOM 0 HD13 LEU A 86 2.616 24.549 -2.020 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.312 23.880 -0.019 1.00 0.00 H new ATOM 0 HD22 LEU A 86 2.027 23.671 0.410 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.976 24.695 1.417 1.00 0.00 H new ATOM 1405 N PRO A 87 4.681 27.773 2.218 1.00 0.00 N ATOM 1406 CA PRO A 87 5.869 28.543 2.545 1.00 0.00 C ATOM 1407 C PRO A 87 6.827 28.607 1.354 1.00 0.00 C ATOM 1408 O PRO A 87 7.898 29.205 1.445 1.00 0.00 O ATOM 1409 CB PRO A 87 6.470 27.844 3.754 1.00 0.00 C ATOM 1410 CG PRO A 87 5.864 26.450 3.773 1.00 0.00 C ATOM 1411 CD PRO A 87 4.678 26.445 2.823 1.00 0.00 C ATOM 0 HA PRO A 87 5.645 29.585 2.774 1.00 0.00 H new ATOM 0 HB2 PRO A 87 7.556 27.797 3.678 1.00 0.00 H new ATOM 0 HB3 PRO A 87 6.238 28.383 4.672 1.00 0.00 H new ATOM 0 HG2 PRO A 87 6.602 25.709 3.466 1.00 0.00 H new ATOM 0 HG3 PRO A 87 5.546 26.185 4.782 1.00 0.00 H new ATOM 0 HD2 PRO A 87 4.779 25.666 2.068 1.00 0.00 H new ATOM 0 HD3 PRO A 87 3.746 26.254 3.355 1.00 0.00 H new ATOM 1419 N LYS A 88 6.406 27.983 0.263 1.00 0.00 N ATOM 1420 CA LYS A 88 7.213 27.962 -0.945 1.00 0.00 C ATOM 1421 C LYS A 88 6.493 28.739 -2.048 1.00 0.00 C ATOM 1422 O LYS A 88 7.038 29.697 -2.595 1.00 0.00 O ATOM 1423 CB LYS A 88 7.559 26.523 -1.332 1.00 0.00 C ATOM 1424 CG LYS A 88 8.618 25.941 -0.393 1.00 0.00 C ATOM 1425 CD LYS A 88 9.805 25.386 -1.182 1.00 0.00 C ATOM 1426 CE LYS A 88 11.119 25.627 -0.436 1.00 0.00 C ATOM 1427 NZ LYS A 88 12.263 25.114 -1.223 1.00 0.00 N ATOM 0 H LYS A 88 5.517 27.488 0.191 1.00 0.00 H new ATOM 0 HA LYS A 88 8.167 28.461 -0.775 1.00 0.00 H new ATOM 0 HB2 LYS A 88 6.660 25.907 -1.298 1.00 0.00 H new ATOM 0 HB3 LYS A 88 7.924 26.497 -2.359 1.00 0.00 H new ATOM 0 HG2 LYS A 88 8.963 26.713 0.295 1.00 0.00 H new ATOM 0 HG3 LYS A 88 8.177 25.149 0.212 1.00 0.00 H new ATOM 0 HD2 LYS A 88 9.668 24.318 -1.349 1.00 0.00 H new ATOM 0 HD3 LYS A 88 9.847 25.859 -2.163 1.00 0.00 H new ATOM 0 HE2 LYS A 88 11.248 26.693 -0.249 1.00 0.00 H new ATOM 0 HE3 LYS A 88 11.088 25.134 0.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 13.147 25.285 -0.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 12.146 24.093 -1.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 12.301 25.603 -2.140 1.00 0.00 H new ATOM 1441 N GLU A 89 5.278 28.299 -2.342 1.00 0.00 N ATOM 1442 CA GLU A 89 4.477 28.942 -3.370 1.00 0.00 C ATOM 1443 C GLU A 89 2.995 28.621 -3.166 1.00 0.00 C ATOM 1444 O GLU A 89 2.651 27.558 -2.653 1.00 0.00 O ATOM 1445 CB GLU A 89 4.941 28.525 -4.767 1.00 0.00 C ATOM 1446 CG GLU A 89 3.774 28.529 -5.756 1.00 0.00 C ATOM 1447 CD GLU A 89 4.248 28.162 -7.164 1.00 0.00 C ATOM 1448 OE1 GLU A 89 5.005 28.975 -7.737 1.00 0.00 O ATOM 1449 OE2 GLU A 89 3.842 27.078 -7.635 1.00 0.00 O ATOM 0 H GLU A 89 4.829 27.505 -1.886 1.00 0.00 H new ATOM 0 HA GLU A 89 4.610 30.021 -3.286 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.719 29.205 -5.114 1.00 0.00 H new ATOM 0 HB3 GLU A 89 5.384 27.530 -4.725 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.013 27.821 -5.429 1.00 0.00 H new ATOM 0 HG3 GLU A 89 3.308 29.514 -5.770 1.00 0.00 H new ATOM 1456 N GLU A 90 2.157 29.561 -3.578 1.00 0.00 N ATOM 1457 CA GLU A 90 0.720 29.392 -3.447 1.00 0.00 C ATOM 1458 C GLU A 90 0.156 28.673 -4.675 1.00 0.00 C ATOM 1459 O GLU A 90 0.644 28.861 -5.788 1.00 0.00 O ATOM 1460 CB GLU A 90 0.026 30.739 -3.235 1.00 0.00 C ATOM 1461 CG GLU A 90 0.496 31.399 -1.937 1.00 0.00 C ATOM 1462 CD GLU A 90 1.342 32.640 -2.227 1.00 0.00 C ATOM 1463 OE1 GLU A 90 0.727 33.698 -2.487 1.00 0.00 O ATOM 1464 OE2 GLU A 90 2.584 32.504 -2.184 1.00 0.00 O ATOM 0 H GLU A 90 2.446 30.442 -4.003 1.00 0.00 H new ATOM 0 HA GLU A 90 0.525 28.778 -2.568 1.00 0.00 H new ATOM 0 HB2 GLU A 90 0.236 31.397 -4.078 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -1.054 30.595 -3.204 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -0.368 31.677 -1.333 1.00 0.00 H new ATOM 0 HG3 GLU A 90 1.078 30.686 -1.353 1.00 0.00 H new ATOM 1471 N VAL A 91 -0.864 27.863 -4.430 1.00 0.00 N ATOM 1472 CA VAL A 91 -1.499 27.115 -5.501 1.00 0.00 C ATOM 1473 C VAL A 91 -3.004 27.389 -5.485 1.00 0.00 C ATOM 1474 O VAL A 91 -3.592 27.587 -4.423 1.00 0.00 O ATOM 1475 CB VAL A 91 -1.161 25.628 -5.372 1.00 0.00 C ATOM 1476 CG1 VAL A 91 -1.971 24.793 -6.366 1.00 0.00 C ATOM 1477 CG2 VAL A 91 0.340 25.390 -5.551 1.00 0.00 C ATOM 0 H VAL A 91 -1.266 27.709 -3.505 1.00 0.00 H new ATOM 0 HA VAL A 91 -1.120 27.438 -6.470 1.00 0.00 H new ATOM 0 HB VAL A 91 -1.434 25.308 -4.366 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.712 23.740 -6.253 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.035 24.927 -6.172 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -1.744 25.116 -7.382 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.554 24.325 -5.455 1.00 0.00 H new ATOM 0 HG22 VAL A 91 0.648 25.734 -6.538 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.889 25.941 -4.787 1.00 0.00 H new ATOM 1487 N GLN A 92 -3.585 27.392 -6.676 1.00 0.00 N ATOM 1488 CA GLN A 92 -5.010 27.638 -6.813 1.00 0.00 C ATOM 1489 C GLN A 92 -5.770 26.314 -6.918 1.00 0.00 C ATOM 1490 O GLN A 92 -5.393 25.437 -7.693 1.00 0.00 O ATOM 1491 CB GLN A 92 -5.298 28.533 -8.021 1.00 0.00 C ATOM 1492 CG GLN A 92 -4.710 29.931 -7.820 1.00 0.00 C ATOM 1493 CD GLN A 92 -4.646 30.694 -9.145 1.00 0.00 C ATOM 1494 OE1 GLN A 92 -3.845 30.407 -10.018 1.00 0.00 O ATOM 1495 NE2 GLN A 92 -5.534 31.680 -9.244 1.00 0.00 N ATOM 0 H GLN A 92 -3.094 27.228 -7.555 1.00 0.00 H new ATOM 0 HA GLN A 92 -5.356 28.163 -5.922 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -4.877 28.083 -8.920 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -6.375 28.606 -8.176 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -5.318 30.486 -7.106 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -3.710 29.851 -7.393 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -6.177 31.867 -8.474 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -5.572 32.249 -10.090 1.00 0.00 H new ATOM 1504 N LEU A 93 -6.828 26.212 -6.126 1.00 0.00 N ATOM 1505 CA LEU A 93 -7.644 25.010 -6.120 1.00 0.00 C ATOM 1506 C LEU A 93 -9.104 25.389 -6.377 1.00 0.00 C ATOM 1507 O LEU A 93 -9.686 26.173 -5.630 1.00 0.00 O ATOM 1508 CB LEU A 93 -7.431 24.224 -4.824 1.00 0.00 C ATOM 1509 CG LEU A 93 -6.816 22.832 -4.977 1.00 0.00 C ATOM 1510 CD1 LEU A 93 -5.293 22.888 -4.842 1.00 0.00 C ATOM 1511 CD2 LEU A 93 -7.443 21.844 -3.992 1.00 0.00 C ATOM 0 H LEU A 93 -7.138 26.942 -5.485 1.00 0.00 H new ATOM 0 HA LEU A 93 -7.342 24.340 -6.925 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.790 24.812 -4.167 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.393 24.121 -4.323 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.037 22.469 -5.981 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -4.881 21.885 -4.955 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -4.883 23.538 -5.615 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.029 23.281 -3.860 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -6.988 20.862 -4.122 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -7.274 22.190 -2.972 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -8.515 21.775 -4.179 1.00 0.00 H new ATOM 1523 N LYS A 94 -9.654 24.814 -7.437 1.00 0.00 N ATOM 1524 CA LYS A 94 -11.034 25.081 -7.801 1.00 0.00 C ATOM 1525 C LYS A 94 -11.790 23.757 -7.925 1.00 0.00 C ATOM 1526 O LYS A 94 -11.204 22.734 -8.276 1.00 0.00 O ATOM 1527 CB LYS A 94 -11.097 25.946 -9.062 1.00 0.00 C ATOM 1528 CG LYS A 94 -12.507 26.500 -9.277 1.00 0.00 C ATOM 1529 CD LYS A 94 -13.258 25.694 -10.338 1.00 0.00 C ATOM 1530 CE LYS A 94 -12.831 26.110 -11.747 1.00 0.00 C ATOM 1531 NZ LYS A 94 -13.722 27.171 -12.267 1.00 0.00 N ATOM 0 H LYS A 94 -9.168 24.164 -8.055 1.00 0.00 H new ATOM 0 HA LYS A 94 -11.529 25.659 -7.020 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.388 26.769 -8.978 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -10.799 25.355 -9.928 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -13.059 26.474 -8.337 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.448 27.545 -9.583 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -13.066 24.631 -10.195 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -14.331 25.843 -10.221 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -11.801 26.467 -11.731 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -12.858 25.246 -12.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -13.418 27.441 -13.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -14.700 26.818 -12.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -13.676 28.001 -11.642 1.00 0.00 H new ATOM 1545 N THR A 95 -13.081 23.819 -7.630 1.00 0.00 N ATOM 1546 CA THR A 95 -13.923 22.638 -7.704 1.00 0.00 C ATOM 1547 C THR A 95 -15.095 22.877 -8.658 1.00 0.00 C ATOM 1548 O THR A 95 -15.443 24.022 -8.944 1.00 0.00 O ATOM 1549 CB THR A 95 -14.360 22.279 -6.282 1.00 0.00 C ATOM 1550 OG1 THR A 95 -14.975 23.469 -5.797 1.00 0.00 O ATOM 1551 CG2 THR A 95 -13.172 22.063 -5.342 1.00 0.00 C ATOM 0 H THR A 95 -13.564 24.669 -7.339 1.00 0.00 H new ATOM 0 HA THR A 95 -13.378 21.789 -8.116 1.00 0.00 H new ATOM 0 HB THR A 95 -14.972 21.377 -6.307 1.00 0.00 H new ATOM 0 HG1 THR A 95 -15.947 23.398 -5.895 1.00 0.00 H new ATOM 0 HG21 THR A 95 -13.537 21.811 -4.346 1.00 0.00 H new ATOM 0 HG22 THR A 95 -12.553 21.249 -5.719 1.00 0.00 H new ATOM 0 HG23 THR A 95 -12.578 22.976 -5.290 1.00 0.00 H new ATOM 1559 N GLU A 96 -15.672 21.779 -9.123 1.00 0.00 N ATOM 1560 CA GLU A 96 -16.798 21.855 -10.038 1.00 0.00 C ATOM 1561 C GLU A 96 -17.976 22.569 -9.372 1.00 0.00 C ATOM 1562 O GLU A 96 -18.426 23.610 -9.849 1.00 0.00 O ATOM 1563 CB GLU A 96 -17.205 20.462 -10.524 1.00 0.00 C ATOM 1564 CG GLU A 96 -16.153 19.884 -11.472 1.00 0.00 C ATOM 1565 CD GLU A 96 -16.681 19.826 -12.907 1.00 0.00 C ATOM 1566 OE1 GLU A 96 -16.776 20.911 -13.521 1.00 0.00 O ATOM 1567 OE2 GLU A 96 -16.978 18.698 -13.358 1.00 0.00 O ATOM 0 H GLU A 96 -15.381 20.831 -8.883 1.00 0.00 H new ATOM 0 HA GLU A 96 -16.494 22.434 -10.910 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -17.334 19.798 -9.669 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -18.167 20.517 -11.033 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -15.251 20.496 -11.437 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -15.872 18.883 -11.143 1.00 0.00 H new ATOM 1574 N ASN A 97 -18.442 21.981 -8.280 1.00 0.00 N ATOM 1575 CA ASN A 97 -19.559 22.549 -7.543 1.00 0.00 C ATOM 1576 C ASN A 97 -19.043 23.182 -6.250 1.00 0.00 C ATOM 1577 O ASN A 97 -17.835 23.313 -6.058 1.00 0.00 O ATOM 1578 CB ASN A 97 -20.576 21.469 -7.168 1.00 0.00 C ATOM 1579 CG ASN A 97 -20.899 20.578 -8.370 1.00 0.00 C ATOM 1580 OD1 ASN A 97 -20.321 19.521 -8.564 1.00 0.00 O ATOM 1581 ND2 ASN A 97 -21.851 21.062 -9.162 1.00 0.00 N ATOM 0 H ASN A 97 -18.067 21.117 -7.888 1.00 0.00 H new ATOM 0 HA ASN A 97 -20.040 23.293 -8.179 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -20.181 20.860 -6.355 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -21.490 21.937 -6.802 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -22.138 20.541 -9.991 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -22.294 21.954 -8.941 1.00 0.00 H new ATOM 1588 N THR A 98 -19.984 23.557 -5.396 1.00 0.00 N ATOM 1589 CA THR A 98 -19.639 24.173 -4.126 1.00 0.00 C ATOM 1590 C THR A 98 -19.468 23.105 -3.044 1.00 0.00 C ATOM 1591 O THR A 98 -18.539 23.174 -2.240 1.00 0.00 O ATOM 1592 CB THR A 98 -20.717 25.207 -3.794 1.00 0.00 C ATOM 1593 OG1 THR A 98 -20.080 26.089 -2.873 1.00 0.00 O ATOM 1594 CG2 THR A 98 -21.877 24.608 -2.995 1.00 0.00 C ATOM 0 H THR A 98 -20.985 23.446 -5.559 1.00 0.00 H new ATOM 0 HA THR A 98 -18.680 24.688 -4.184 1.00 0.00 H new ATOM 0 HB THR A 98 -21.099 25.642 -4.717 1.00 0.00 H new ATOM 0 HG1 THR A 98 -20.708 26.792 -2.606 1.00 0.00 H new ATOM 0 HG21 THR A 98 -22.614 25.384 -2.786 1.00 0.00 H new ATOM 0 HG22 THR A 98 -22.344 23.811 -3.573 1.00 0.00 H new ATOM 0 HG23 THR A 98 -21.501 24.202 -2.056 1.00 0.00 H new ATOM 1602 N GLU A 99 -20.378 22.142 -3.058 1.00 0.00 N ATOM 1603 CA GLU A 99 -20.340 21.061 -2.088 1.00 0.00 C ATOM 1604 C GLU A 99 -18.945 20.434 -2.047 1.00 0.00 C ATOM 1605 O GLU A 99 -18.233 20.561 -1.052 1.00 0.00 O ATOM 1606 CB GLU A 99 -21.405 20.008 -2.399 1.00 0.00 C ATOM 1607 CG GLU A 99 -21.190 18.747 -1.559 1.00 0.00 C ATOM 1608 CD GLU A 99 -22.468 17.908 -1.494 1.00 0.00 C ATOM 1609 OE1 GLU A 99 -23.087 17.731 -2.565 1.00 0.00 O ATOM 1610 OE2 GLU A 99 -22.798 17.463 -0.373 1.00 0.00 O ATOM 0 H GLU A 99 -21.147 22.088 -3.726 1.00 0.00 H new ATOM 0 HA GLU A 99 -20.561 21.474 -1.104 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -22.395 20.417 -2.200 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -21.372 19.754 -3.458 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -20.382 18.154 -1.987 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -20.881 19.025 -0.551 1.00 0.00 H new ATOM 1617 N SER A 100 -18.596 19.773 -3.141 1.00 0.00 N ATOM 1618 CA SER A 100 -17.298 19.126 -3.242 1.00 0.00 C ATOM 1619 C SER A 100 -16.197 20.091 -2.801 1.00 0.00 C ATOM 1620 O SER A 100 -15.142 19.664 -2.333 1.00 0.00 O ATOM 1621 CB SER A 100 -17.036 18.638 -4.668 1.00 0.00 C ATOM 1622 OG SER A 100 -17.345 19.634 -5.639 1.00 0.00 O ATOM 0 H SER A 100 -19.189 19.671 -3.965 1.00 0.00 H new ATOM 0 HA SER A 100 -17.296 18.258 -2.583 1.00 0.00 H new ATOM 0 HB2 SER A 100 -15.990 18.349 -4.766 1.00 0.00 H new ATOM 0 HB3 SER A 100 -17.632 17.746 -4.861 1.00 0.00 H new ATOM 0 HG SER A 100 -17.163 19.284 -6.536 1.00 0.00 H new ATOM 1628 N GLY A 101 -16.478 21.376 -2.965 1.00 0.00 N ATOM 1629 CA GLY A 101 -15.524 22.405 -2.589 1.00 0.00 C ATOM 1630 C GLY A 101 -15.115 22.264 -1.122 1.00 0.00 C ATOM 1631 O GLY A 101 -13.931 22.137 -0.813 1.00 0.00 O ATOM 0 H GLY A 101 -17.353 21.727 -3.353 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -14.641 22.337 -3.224 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -15.961 23.390 -2.755 1.00 0.00 H new ATOM 1635 N GLU A 102 -16.118 22.292 -0.256 1.00 0.00 N ATOM 1636 CA GLU A 102 -15.878 22.169 1.172 1.00 0.00 C ATOM 1637 C GLU A 102 -15.261 20.805 1.491 1.00 0.00 C ATOM 1638 O GLU A 102 -14.418 20.694 2.380 1.00 0.00 O ATOM 1639 CB GLU A 102 -17.167 22.386 1.966 1.00 0.00 C ATOM 1640 CG GLU A 102 -17.401 23.874 2.236 1.00 0.00 C ATOM 1641 CD GLU A 102 -18.495 24.431 1.324 1.00 0.00 C ATOM 1642 OE1 GLU A 102 -19.679 24.268 1.692 1.00 0.00 O ATOM 1643 OE2 GLU A 102 -18.124 25.009 0.279 1.00 0.00 O ATOM 0 H GLU A 102 -17.099 22.398 -0.516 1.00 0.00 H new ATOM 0 HA GLU A 102 -15.172 22.944 1.470 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -18.012 21.976 1.413 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -17.112 21.846 2.911 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -17.684 24.018 3.279 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -16.475 24.426 2.078 1.00 0.00 H new ATOM 1650 N GLU A 103 -15.704 19.802 0.747 1.00 0.00 N ATOM 1651 CA GLU A 103 -15.206 18.451 0.940 1.00 0.00 C ATOM 1652 C GLU A 103 -13.678 18.454 1.013 1.00 0.00 C ATOM 1653 O GLU A 103 -13.100 18.048 2.021 1.00 0.00 O ATOM 1654 CB GLU A 103 -15.699 17.521 -0.171 1.00 0.00 C ATOM 1655 CG GLU A 103 -16.446 16.320 0.411 1.00 0.00 C ATOM 1656 CD GLU A 103 -16.773 15.297 -0.679 1.00 0.00 C ATOM 1657 OE1 GLU A 103 -17.307 15.731 -1.723 1.00 0.00 O ATOM 1658 OE2 GLU A 103 -16.483 14.104 -0.443 1.00 0.00 O ATOM 0 H GLU A 103 -16.402 19.898 0.010 1.00 0.00 H new ATOM 0 HA GLU A 103 -15.595 18.073 1.885 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -16.356 18.070 -0.845 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -14.852 17.175 -0.763 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -15.839 15.850 1.185 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -17.367 16.656 0.887 1.00 0.00 H new ATOM 1665 N TRP A 104 -13.066 18.917 -0.067 1.00 0.00 N ATOM 1666 CA TRP A 104 -11.616 18.978 -0.137 1.00 0.00 C ATOM 1667 C TRP A 104 -11.126 19.893 0.987 1.00 0.00 C ATOM 1668 O TRP A 104 -10.433 19.446 1.899 1.00 0.00 O ATOM 1669 CB TRP A 104 -11.152 19.433 -1.523 1.00 0.00 C ATOM 1670 CG TRP A 104 -11.206 18.336 -2.588 1.00 0.00 C ATOM 1671 CD1 TRP A 104 -12.203 18.061 -3.440 1.00 0.00 C ATOM 1672 CD2 TRP A 104 -10.173 17.371 -2.881 1.00 0.00 C ATOM 1673 NE1 TRP A 104 -11.889 16.995 -4.258 1.00 0.00 N ATOM 1674 CE2 TRP A 104 -10.616 16.562 -3.907 1.00 0.00 C ATOM 1675 CE3 TRP A 104 -8.907 17.189 -2.298 1.00 0.00 C ATOM 1676 CZ2 TRP A 104 -9.855 15.514 -4.440 1.00 0.00 C ATOM 1677 CZ3 TRP A 104 -8.158 16.138 -2.842 1.00 0.00 C ATOM 1678 CH2 TRP A 104 -8.590 15.314 -3.875 1.00 0.00 C ATOM 0 H TRP A 104 -13.548 19.253 -0.901 1.00 0.00 H new ATOM 0 HA TRP A 104 -11.182 17.988 0.005 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -11.772 20.270 -1.846 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -10.130 19.804 -1.449 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -13.135 18.605 -3.481 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -12.482 16.598 -4.986 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -8.541 17.810 -1.494 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -10.224 14.894 -5.243 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -7.176 15.955 -2.430 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -7.952 14.523 -4.240 1.00 0.00 H new ATOM 1689 N ARG A 105 -11.506 21.158 0.884 1.00 0.00 N ATOM 1690 CA ARG A 105 -11.114 22.140 1.881 1.00 0.00 C ATOM 1691 C ARG A 105 -11.125 21.514 3.277 1.00 0.00 C ATOM 1692 O ARG A 105 -10.129 21.573 3.996 1.00 0.00 O ATOM 1693 CB ARG A 105 -12.054 23.348 1.864 1.00 0.00 C ATOM 1694 CG ARG A 105 -11.298 24.636 2.194 1.00 0.00 C ATOM 1695 CD ARG A 105 -12.262 25.815 2.341 1.00 0.00 C ATOM 1696 NE ARG A 105 -12.173 26.375 3.708 1.00 0.00 N ATOM 1697 CZ ARG A 105 -12.908 27.405 4.147 1.00 0.00 C ATOM 1698 NH1 ARG A 105 -13.791 27.995 3.330 1.00 0.00 N ATOM 1699 NH2 ARG A 105 -12.761 27.846 5.404 1.00 0.00 N ATOM 0 H ARG A 105 -12.081 21.526 0.126 1.00 0.00 H new ATOM 0 HA ARG A 105 -10.106 22.475 1.637 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -12.520 23.437 0.883 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -12.857 23.198 2.586 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -10.735 24.505 3.118 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -10.574 24.849 1.407 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -12.022 26.585 1.608 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -13.282 25.489 2.139 1.00 0.00 H new ATOM 0 HE ARG A 105 -11.510 25.950 4.357 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -13.904 27.660 2.373 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -14.351 28.779 3.665 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -12.089 27.397 6.027 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -13.321 28.630 5.738 1.00 0.00 H new ATOM 1713 N GLY A 106 -12.264 20.928 3.619 1.00 0.00 N ATOM 1714 CA GLY A 106 -12.418 20.291 4.915 1.00 0.00 C ATOM 1715 C GLY A 106 -11.377 19.187 5.111 1.00 0.00 C ATOM 1716 O GLY A 106 -10.614 19.211 6.076 1.00 0.00 O ATOM 0 H GLY A 106 -13.088 20.881 3.020 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -12.316 21.036 5.704 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -13.420 19.870 5.001 1.00 0.00 H new ATOM 1720 N PHE A 107 -11.379 18.244 4.180 1.00 0.00 N ATOM 1721 CA PHE A 107 -10.444 17.133 4.237 1.00 0.00 C ATOM 1722 C PHE A 107 -9.001 17.634 4.322 1.00 0.00 C ATOM 1723 O PHE A 107 -8.191 17.083 5.066 1.00 0.00 O ATOM 1724 CB PHE A 107 -10.619 16.334 2.945 1.00 0.00 C ATOM 1725 CG PHE A 107 -11.529 15.112 3.087 1.00 0.00 C ATOM 1726 CD1 PHE A 107 -11.356 14.253 4.127 1.00 0.00 C ATOM 1727 CD2 PHE A 107 -12.511 14.885 2.173 1.00 0.00 C ATOM 1728 CE1 PHE A 107 -12.201 13.119 4.258 1.00 0.00 C ATOM 1729 CE2 PHE A 107 -13.356 13.751 2.305 1.00 0.00 C ATOM 1730 CZ PHE A 107 -13.183 12.892 3.345 1.00 0.00 C ATOM 0 H PHE A 107 -12.014 18.227 3.382 1.00 0.00 H new ATOM 0 HA PHE A 107 -10.642 16.526 5.120 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -11.027 16.991 2.176 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -9.639 16.006 2.597 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -10.577 14.433 4.853 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -12.648 15.567 1.347 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -12.064 12.436 5.083 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -14.136 13.571 1.580 1.00 0.00 H new ATOM 0 HZ PHE A 107 -13.825 12.030 3.446 1.00 0.00 H new ATOM 1740 N ILE A 108 -8.723 18.674 3.549 1.00 0.00 N ATOM 1741 CA ILE A 108 -7.392 19.256 3.527 1.00 0.00 C ATOM 1742 C ILE A 108 -7.081 19.859 4.898 1.00 0.00 C ATOM 1743 O ILE A 108 -6.100 19.483 5.538 1.00 0.00 O ATOM 1744 CB ILE A 108 -7.262 20.251 2.373 1.00 0.00 C ATOM 1745 CG1 ILE A 108 -7.102 19.524 1.036 1.00 0.00 C ATOM 1746 CG2 ILE A 108 -6.121 21.239 2.627 1.00 0.00 C ATOM 1747 CD1 ILE A 108 -8.366 19.659 0.184 1.00 0.00 C ATOM 0 H ILE A 108 -9.397 19.128 2.933 1.00 0.00 H new ATOM 0 HA ILE A 108 -6.643 18.487 3.340 1.00 0.00 H new ATOM 0 HB ILE A 108 -8.184 20.830 2.317 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -6.249 19.934 0.495 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -6.890 18.470 1.214 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -6.050 21.935 1.792 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -6.317 21.793 3.545 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -5.182 20.693 2.725 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -8.226 19.134 -0.761 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -9.212 19.227 0.718 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.561 20.713 -0.013 1.00 0.00 H new ATOM 1759 N LEU A 109 -7.935 20.785 5.309 1.00 0.00 N ATOM 1760 CA LEU A 109 -7.764 21.445 6.592 1.00 0.00 C ATOM 1761 C LEU A 109 -7.435 20.398 7.658 1.00 0.00 C ATOM 1762 O LEU A 109 -6.774 20.703 8.650 1.00 0.00 O ATOM 1763 CB LEU A 109 -8.990 22.296 6.925 1.00 0.00 C ATOM 1764 CG LEU A 109 -9.138 23.597 6.133 1.00 0.00 C ATOM 1765 CD1 LEU A 109 -10.525 24.210 6.339 1.00 0.00 C ATOM 1766 CD2 LEU A 109 -8.019 24.581 6.481 1.00 0.00 C ATOM 0 H LEU A 109 -8.748 21.094 4.776 1.00 0.00 H new ATOM 0 HA LEU A 109 -6.924 22.139 6.554 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.882 21.691 6.763 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -8.960 22.541 7.987 1.00 0.00 H new ATOM 0 HG LEU A 109 -9.044 23.364 5.072 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.604 25.133 5.765 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -11.287 23.507 6.002 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -10.674 24.426 7.397 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -8.148 25.497 5.904 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -8.057 24.814 7.545 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -7.054 24.134 6.242 1.00 0.00 H new ATOM 1778 N THR A 110 -7.910 19.185 7.418 1.00 0.00 N ATOM 1779 CA THR A 110 -7.674 18.091 8.345 1.00 0.00 C ATOM 1780 C THR A 110 -6.263 17.531 8.161 1.00 0.00 C ATOM 1781 O THR A 110 -5.575 17.237 9.138 1.00 0.00 O ATOM 1782 CB THR A 110 -8.774 17.048 8.135 1.00 0.00 C ATOM 1783 OG1 THR A 110 -9.983 17.768 8.363 1.00 0.00 O ATOM 1784 CG2 THR A 110 -8.773 15.970 9.221 1.00 0.00 C ATOM 0 H THR A 110 -8.458 18.935 6.594 1.00 0.00 H new ATOM 0 HA THR A 110 -7.722 18.432 9.379 1.00 0.00 H new ATOM 0 HB THR A 110 -8.649 16.580 7.158 1.00 0.00 H new ATOM 0 HG1 THR A 110 -10.239 18.244 7.546 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.572 15.255 9.025 1.00 0.00 H new ATOM 0 HG22 THR A 110 -7.814 15.452 9.218 1.00 0.00 H new ATOM 0 HG23 THR A 110 -8.932 16.434 10.194 1.00 0.00 H new ATOM 1792 N VAL A 111 -5.872 17.399 6.902 1.00 0.00 N ATOM 1793 CA VAL A 111 -4.555 16.879 6.577 1.00 0.00 C ATOM 1794 C VAL A 111 -3.564 18.040 6.474 1.00 0.00 C ATOM 1795 O VAL A 111 -2.598 17.972 5.716 1.00 0.00 O ATOM 1796 CB VAL A 111 -4.624 16.038 5.301 1.00 0.00 C ATOM 1797 CG1 VAL A 111 -5.573 14.851 5.477 1.00 0.00 C ATOM 1798 CG2 VAL A 111 -5.035 16.895 4.101 1.00 0.00 C ATOM 0 H VAL A 111 -6.445 17.643 6.094 1.00 0.00 H new ATOM 0 HA VAL A 111 -4.201 16.218 7.368 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.627 15.644 5.106 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -5.604 14.270 4.555 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -5.219 14.220 6.292 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -6.573 15.216 5.709 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.076 16.273 3.207 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.017 17.332 4.285 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -4.305 17.691 3.956 1.00 0.00 H new ATOM 1808 N THR A 112 -3.838 19.080 7.249 1.00 0.00 N ATOM 1809 CA THR A 112 -2.982 20.255 7.255 1.00 0.00 C ATOM 1810 C THR A 112 -2.938 20.875 8.652 1.00 0.00 C ATOM 1811 O THR A 112 -1.867 21.225 9.146 1.00 0.00 O ATOM 1812 CB THR A 112 -3.492 21.216 6.179 1.00 0.00 C ATOM 1813 OG1 THR A 112 -4.887 21.327 6.445 1.00 0.00 O ATOM 1814 CG2 THR A 112 -3.427 20.611 4.775 1.00 0.00 C ATOM 0 H THR A 112 -4.640 19.133 7.877 1.00 0.00 H new ATOM 0 HA THR A 112 -1.951 19.995 7.017 1.00 0.00 H new ATOM 0 HB THR A 112 -2.906 22.134 6.206 1.00 0.00 H new ATOM 0 HG1 THR A 112 -5.341 20.507 6.160 1.00 0.00 H new ATOM 0 HG21 THR A 112 -3.800 21.334 4.050 1.00 0.00 H new ATOM 0 HG22 THR A 112 -2.394 20.357 4.536 1.00 0.00 H new ATOM 0 HG23 THR A 112 -4.040 19.710 4.738 1.00 0.00 H new ATOM 1822 N GLU A 113 -4.114 20.992 9.250 1.00 0.00 N ATOM 1823 CA GLU A 113 -4.223 21.564 10.582 1.00 0.00 C ATOM 1824 C GLU A 113 -4.065 20.474 11.643 1.00 0.00 C ATOM 1825 O GLU A 113 -3.831 20.771 12.813 1.00 0.00 O ATOM 1826 CB GLU A 113 -5.550 22.307 10.752 1.00 0.00 C ATOM 1827 CG GLU A 113 -5.743 23.346 9.645 1.00 0.00 C ATOM 1828 CD GLU A 113 -6.273 24.663 10.215 1.00 0.00 C ATOM 1829 OE1 GLU A 113 -7.513 24.777 10.323 1.00 0.00 O ATOM 1830 OE2 GLU A 113 -5.426 25.526 10.531 1.00 0.00 O ATOM 0 H GLU A 113 -5.000 20.701 8.837 1.00 0.00 H new ATOM 0 HA GLU A 113 -3.419 22.288 10.712 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -6.375 21.594 10.734 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -5.574 22.798 11.725 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -4.795 23.521 9.137 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -6.439 22.962 8.899 1.00 0.00 H new ATOM 1837 N LEU A 114 -4.200 19.234 11.196 1.00 0.00 N ATOM 1838 CA LEU A 114 -4.075 18.097 12.092 1.00 0.00 C ATOM 1839 C LEU A 114 -5.285 18.056 13.028 1.00 0.00 C ATOM 1840 O LEU A 114 -5.214 17.484 14.115 1.00 0.00 O ATOM 1841 CB LEU A 114 -2.732 18.137 12.824 1.00 0.00 C ATOM 1842 CG LEU A 114 -1.652 17.191 12.297 1.00 0.00 C ATOM 1843 CD1 LEU A 114 -2.056 15.729 12.502 1.00 0.00 C ATOM 1844 CD2 LEU A 114 -1.324 17.495 10.834 1.00 0.00 C ATOM 0 H LEU A 114 -4.395 18.992 10.225 1.00 0.00 H new ATOM 0 HA LEU A 114 -4.076 17.165 11.527 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -2.347 19.156 12.780 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -2.907 17.907 13.875 1.00 0.00 H new ATOM 0 HG LEU A 114 -0.741 17.357 12.873 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -1.271 15.077 12.119 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -2.200 15.537 13.565 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -2.985 15.530 11.968 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -0.553 16.808 10.484 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -2.221 17.374 10.227 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -0.963 18.520 10.747 1.00 0.00 H new ATOM 1856 N SER A 115 -6.367 18.669 12.572 1.00 0.00 N ATOM 1857 CA SER A 115 -7.590 18.710 13.354 1.00 0.00 C ATOM 1858 C SER A 115 -8.804 18.554 12.436 1.00 0.00 C ATOM 1859 O SER A 115 -8.667 18.149 11.283 1.00 0.00 O ATOM 1860 CB SER A 115 -7.692 20.012 14.151 1.00 0.00 C ATOM 1861 OG SER A 115 -8.464 19.853 15.338 1.00 0.00 O ATOM 0 H SER A 115 -6.422 19.142 11.670 1.00 0.00 H new ATOM 0 HA SER A 115 -7.569 17.882 14.063 1.00 0.00 H new ATOM 0 HB2 SER A 115 -6.691 20.356 14.413 1.00 0.00 H new ATOM 0 HB3 SER A 115 -8.141 20.785 13.527 1.00 0.00 H new ATOM 0 HG SER A 115 -8.504 20.706 15.819 1.00 0.00 H new ATOM 1867 N VAL A 116 -9.966 18.884 12.983 1.00 0.00 N ATOM 1868 CA VAL A 116 -11.203 18.785 12.227 1.00 0.00 C ATOM 1869 C VAL A 116 -11.989 20.090 12.372 1.00 0.00 C ATOM 1870 O VAL A 116 -12.274 20.527 13.486 1.00 0.00 O ATOM 1871 CB VAL A 116 -11.995 17.557 12.678 1.00 0.00 C ATOM 1872 CG1 VAL A 116 -13.275 17.397 11.855 1.00 0.00 C ATOM 1873 CG2 VAL A 116 -11.136 16.293 12.607 1.00 0.00 C ATOM 0 H VAL A 116 -10.076 19.220 13.940 1.00 0.00 H new ATOM 0 HA VAL A 116 -10.993 18.648 11.166 1.00 0.00 H new ATOM 0 HB VAL A 116 -12.282 17.708 13.718 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -13.819 16.516 12.196 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -13.900 18.281 11.980 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -13.018 17.280 10.802 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -11.724 15.435 12.933 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -10.803 16.136 11.581 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -10.268 16.406 13.256 1.00 0.00 H new ATOM 1883 N PRO A 117 -12.326 20.691 11.199 1.00 0.00 N ATOM 1884 CA PRO A 117 -13.074 21.937 11.185 1.00 0.00 C ATOM 1885 C PRO A 117 -14.546 21.697 11.525 1.00 0.00 C ATOM 1886 O PRO A 117 -15.250 21.002 10.794 1.00 0.00 O ATOM 1887 CB PRO A 117 -12.871 22.501 9.788 1.00 0.00 C ATOM 1888 CG PRO A 117 -12.408 21.335 8.930 1.00 0.00 C ATOM 1889 CD PRO A 117 -12.005 20.202 9.861 1.00 0.00 C ATOM 0 HA PRO A 117 -12.729 22.644 11.940 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -13.796 22.927 9.401 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -12.130 23.300 9.794 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -13.206 21.013 8.260 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -11.567 21.632 8.304 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -12.552 19.287 9.632 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -10.944 19.971 9.768 1.00 0.00 H new ATOM 1897 N GLN A 118 -14.967 22.285 12.635 1.00 0.00 N ATOM 1898 CA GLN A 118 -16.343 22.144 13.080 1.00 0.00 C ATOM 1899 C GLN A 118 -17.198 23.288 12.533 1.00 0.00 C ATOM 1900 O GLN A 118 -18.423 23.186 12.488 1.00 0.00 O ATOM 1901 CB GLN A 118 -16.421 22.083 14.607 1.00 0.00 C ATOM 1902 CG GLN A 118 -16.776 20.672 15.082 1.00 0.00 C ATOM 1903 CD GLN A 118 -18.293 20.484 15.153 1.00 0.00 C ATOM 1904 OE1 GLN A 118 -19.054 21.421 15.328 1.00 0.00 O ATOM 1905 NE2 GLN A 118 -18.689 19.222 15.009 1.00 0.00 N ATOM 0 H GLN A 118 -14.380 22.860 13.239 1.00 0.00 H new ATOM 0 HA GLN A 118 -16.736 21.205 12.690 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -15.466 22.385 15.036 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -17.169 22.790 14.965 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -16.346 19.936 14.402 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -16.337 20.494 16.064 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -17.999 18.484 14.865 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -19.682 18.992 15.042 1.00 0.00 H new ATOM 1914 N ASN A 119 -16.519 24.352 12.130 1.00 0.00 N ATOM 1915 CA ASN A 119 -17.202 25.515 11.588 1.00 0.00 C ATOM 1916 C ASN A 119 -17.349 25.354 10.074 1.00 0.00 C ATOM 1917 O ASN A 119 -17.615 26.323 9.366 1.00 0.00 O ATOM 1918 CB ASN A 119 -16.405 26.794 11.852 1.00 0.00 C ATOM 1919 CG ASN A 119 -17.031 27.605 12.988 1.00 0.00 C ATOM 1920 OD1 ASN A 119 -16.842 27.327 14.161 1.00 0.00 O ATOM 1921 ND2 ASN A 119 -17.785 28.620 12.576 1.00 0.00 N ATOM 0 H ASN A 119 -15.503 24.433 12.168 1.00 0.00 H new ATOM 0 HA ASN A 119 -18.176 25.591 12.072 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -15.376 26.540 12.106 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -16.369 27.398 10.946 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -18.247 29.222 13.258 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -17.901 28.797 11.578 1.00 0.00 H new ATOM 1928 N VAL A 120 -17.169 24.121 9.622 1.00 0.00 N ATOM 1929 CA VAL A 120 -17.279 23.821 8.204 1.00 0.00 C ATOM 1930 C VAL A 120 -18.748 23.894 7.784 1.00 0.00 C ATOM 1931 O VAL A 120 -19.597 24.334 8.557 1.00 0.00 O ATOM 1932 CB VAL A 120 -16.638 22.463 7.906 1.00 0.00 C ATOM 1933 CG1 VAL A 120 -17.660 21.333 8.047 1.00 0.00 C ATOM 1934 CG2 VAL A 120 -15.996 22.453 6.517 1.00 0.00 C ATOM 0 H VAL A 120 -16.948 23.319 10.212 1.00 0.00 H new ATOM 0 HA VAL A 120 -16.736 24.559 7.614 1.00 0.00 H new ATOM 0 HB VAL A 120 -15.850 22.295 8.640 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -17.180 20.379 7.830 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -18.050 21.320 9.065 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -18.480 21.494 7.347 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -15.548 21.477 6.330 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -16.757 22.653 5.763 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -15.225 23.222 6.467 1.00 0.00 H new ATOM 1944 N SER A 121 -19.002 23.456 6.559 1.00 0.00 N ATOM 1945 CA SER A 121 -20.354 23.466 6.027 1.00 0.00 C ATOM 1946 C SER A 121 -20.812 22.037 5.732 1.00 0.00 C ATOM 1947 O SER A 121 -21.999 21.730 5.823 1.00 0.00 O ATOM 1948 CB SER A 121 -20.442 24.323 4.763 1.00 0.00 C ATOM 1949 OG SER A 121 -21.629 25.111 4.732 1.00 0.00 O ATOM 0 H SER A 121 -18.295 23.092 5.920 1.00 0.00 H new ATOM 0 HA SER A 121 -21.013 23.904 6.777 1.00 0.00 H new ATOM 0 HB2 SER A 121 -19.572 24.977 4.707 1.00 0.00 H new ATOM 0 HB3 SER A 121 -20.413 23.678 3.885 1.00 0.00 H new ATOM 0 HG SER A 121 -21.646 25.645 3.910 1.00 0.00 H new ATOM 1955 N LEU A 122 -19.845 21.200 5.385 1.00 0.00 N ATOM 1956 CA LEU A 122 -20.133 19.810 5.075 1.00 0.00 C ATOM 1957 C LEU A 122 -21.170 19.276 6.066 1.00 0.00 C ATOM 1958 O LEU A 122 -21.353 19.841 7.143 1.00 0.00 O ATOM 1959 CB LEU A 122 -18.842 18.990 5.036 1.00 0.00 C ATOM 1960 CG LEU A 122 -18.598 18.182 3.760 1.00 0.00 C ATOM 1961 CD1 LEU A 122 -18.938 19.006 2.516 1.00 0.00 C ATOM 1962 CD2 LEU A 122 -17.168 17.642 3.718 1.00 0.00 C ATOM 0 H LEU A 122 -18.861 21.458 5.312 1.00 0.00 H new ATOM 0 HA LEU A 122 -20.568 19.724 4.079 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -18.000 19.668 5.180 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -18.846 18.303 5.882 1.00 0.00 H new ATOM 0 HG LEU A 122 -19.266 17.321 3.768 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -18.756 18.408 1.623 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -19.988 19.299 2.549 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -18.313 19.899 2.489 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -17.021 17.072 2.801 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -16.464 18.474 3.745 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -16.998 16.995 4.579 1.00 0.00 H new ATOM 1974 N LEU A 123 -21.821 18.194 5.666 1.00 0.00 N ATOM 1975 CA LEU A 123 -22.835 17.578 6.505 1.00 0.00 C ATOM 1976 C LEU A 123 -22.177 17.030 7.773 1.00 0.00 C ATOM 1977 O LEU A 123 -20.952 16.977 7.868 1.00 0.00 O ATOM 1978 CB LEU A 123 -23.618 16.527 5.715 1.00 0.00 C ATOM 1979 CG LEU A 123 -24.705 17.062 4.781 1.00 0.00 C ATOM 1980 CD1 LEU A 123 -25.408 18.274 5.396 1.00 0.00 C ATOM 1981 CD2 LEU A 123 -24.135 17.372 3.396 1.00 0.00 C ATOM 0 H LEU A 123 -21.666 17.728 4.772 1.00 0.00 H new ATOM 0 HA LEU A 123 -23.570 18.319 6.821 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -22.911 15.946 5.122 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -24.081 15.840 6.423 1.00 0.00 H new ATOM 0 HG LEU A 123 -25.457 16.284 4.652 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -26.176 18.635 4.712 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -25.870 17.986 6.341 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -24.680 19.065 5.574 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -24.929 17.751 2.752 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -23.351 18.124 3.485 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -23.719 16.463 2.962 1.00 0.00 H new ATOM 1993 N PRO A 124 -23.043 16.627 8.741 1.00 0.00 N ATOM 1994 CA PRO A 124 -22.559 16.085 10.000 1.00 0.00 C ATOM 1995 C PRO A 124 -22.042 14.657 9.819 1.00 0.00 C ATOM 1996 O PRO A 124 -21.465 14.081 10.740 1.00 0.00 O ATOM 1997 CB PRO A 124 -23.745 16.172 10.947 1.00 0.00 C ATOM 1998 CG PRO A 124 -24.973 16.324 10.065 1.00 0.00 C ATOM 1999 CD PRO A 124 -24.500 16.676 8.664 1.00 0.00 C ATOM 0 HA PRO A 124 -21.708 16.638 10.397 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -23.817 15.278 11.566 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -23.643 17.020 11.624 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -25.550 15.400 10.052 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -25.628 17.104 10.454 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -24.882 15.968 7.928 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -24.848 17.665 8.366 1.00 0.00 H new ATOM 2007 N GLY A 125 -22.267 14.126 8.626 1.00 0.00 N ATOM 2008 CA GLY A 125 -21.831 12.776 8.313 1.00 0.00 C ATOM 2009 C GLY A 125 -20.492 12.791 7.573 1.00 0.00 C ATOM 2010 O GLY A 125 -19.663 11.902 7.765 1.00 0.00 O ATOM 0 H GLY A 125 -22.746 14.607 7.864 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -21.736 12.198 9.232 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -22.584 12.280 7.701 1.00 0.00 H new ATOM 2014 N GLN A 126 -20.322 13.809 6.743 1.00 0.00 N ATOM 2015 CA GLN A 126 -19.097 13.951 5.973 1.00 0.00 C ATOM 2016 C GLN A 126 -17.945 14.382 6.883 1.00 0.00 C ATOM 2017 O GLN A 126 -16.828 13.883 6.755 1.00 0.00 O ATOM 2018 CB GLN A 126 -19.285 14.939 4.821 1.00 0.00 C ATOM 2019 CG GLN A 126 -20.229 14.371 3.759 1.00 0.00 C ATOM 2020 CD GLN A 126 -19.444 13.795 2.579 1.00 0.00 C ATOM 2021 OE1 GLN A 126 -19.199 12.604 2.485 1.00 0.00 O ATOM 2022 NE2 GLN A 126 -19.063 14.706 1.687 1.00 0.00 N ATOM 0 H GLN A 126 -21.012 14.544 6.586 1.00 0.00 H new ATOM 0 HA GLN A 126 -18.849 12.982 5.540 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -19.686 15.878 5.204 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -18.319 15.165 4.370 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -20.852 13.593 4.200 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -20.899 15.155 3.406 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -19.302 15.688 1.827 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -18.532 14.423 0.863 1.00 0.00 H new ATOM 2031 N VAL A 127 -18.257 15.304 7.782 1.00 0.00 N ATOM 2032 CA VAL A 127 -17.261 15.808 8.713 1.00 0.00 C ATOM 2033 C VAL A 127 -16.571 14.629 9.401 1.00 0.00 C ATOM 2034 O VAL A 127 -15.381 14.695 9.708 1.00 0.00 O ATOM 2035 CB VAL A 127 -17.912 16.779 9.699 1.00 0.00 C ATOM 2036 CG1 VAL A 127 -17.197 16.748 11.052 1.00 0.00 C ATOM 2037 CG2 VAL A 127 -17.945 18.199 9.130 1.00 0.00 C ATOM 0 H VAL A 127 -19.185 15.715 7.886 1.00 0.00 H new ATOM 0 HA VAL A 127 -16.492 16.371 8.184 1.00 0.00 H new ATOM 0 HB VAL A 127 -18.941 16.457 9.856 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -17.680 17.447 11.735 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -17.248 15.742 11.468 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -16.153 17.033 10.919 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -18.413 18.869 9.851 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -16.927 18.535 8.930 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -18.518 18.206 8.203 1.00 0.00 H new ATOM 2047 N ILE A 128 -17.346 13.579 9.625 1.00 0.00 N ATOM 2048 CA ILE A 128 -16.824 12.387 10.272 1.00 0.00 C ATOM 2049 C ILE A 128 -15.532 11.957 9.573 1.00 0.00 C ATOM 2050 O ILE A 128 -14.533 11.671 10.230 1.00 0.00 O ATOM 2051 CB ILE A 128 -17.891 11.292 10.320 1.00 0.00 C ATOM 2052 CG1 ILE A 128 -19.049 11.694 11.235 1.00 0.00 C ATOM 2053 CG2 ILE A 128 -17.281 9.949 10.724 1.00 0.00 C ATOM 2054 CD1 ILE A 128 -20.349 11.009 10.809 1.00 0.00 C ATOM 0 H ILE A 128 -18.332 13.528 9.370 1.00 0.00 H new ATOM 0 HA ILE A 128 -16.570 12.598 11.311 1.00 0.00 H new ATOM 0 HB ILE A 128 -18.301 11.171 9.317 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -18.813 11.426 12.265 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -19.179 12.776 11.209 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -18.061 9.188 10.750 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -16.519 9.663 9.999 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -16.827 10.038 11.711 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -21.156 11.312 11.476 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -20.595 11.298 9.787 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -20.224 9.927 10.859 1.00 0.00 H new ATOM 2066 N LYS A 129 -15.595 11.925 8.250 1.00 0.00 N ATOM 2067 CA LYS A 129 -14.443 11.535 7.455 1.00 0.00 C ATOM 2068 C LYS A 129 -13.196 12.239 7.993 1.00 0.00 C ATOM 2069 O LYS A 129 -12.208 11.588 8.331 1.00 0.00 O ATOM 2070 CB LYS A 129 -14.704 11.796 5.970 1.00 0.00 C ATOM 2071 CG LYS A 129 -15.898 10.979 5.472 1.00 0.00 C ATOM 2072 CD LYS A 129 -15.534 9.499 5.341 1.00 0.00 C ATOM 2073 CE LYS A 129 -14.838 9.221 4.008 1.00 0.00 C ATOM 2074 NZ LYS A 129 -15.819 8.769 2.996 1.00 0.00 N ATOM 0 H LYS A 129 -16.426 12.163 7.709 1.00 0.00 H new ATOM 0 HA LYS A 129 -14.266 10.463 7.540 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -14.894 12.858 5.811 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -13.817 11.541 5.391 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -16.734 11.092 6.163 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -16.228 11.363 4.507 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -14.881 9.207 6.164 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -16.435 8.891 5.418 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -14.335 10.123 3.658 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -14.070 8.460 4.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -15.330 8.585 2.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -16.280 7.897 3.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -16.537 9.508 2.854 1.00 0.00 H new ATOM 2088 N LEU A 130 -13.281 13.560 8.057 1.00 0.00 N ATOM 2089 CA LEU A 130 -12.172 14.359 8.548 1.00 0.00 C ATOM 2090 C LEU A 130 -11.638 13.741 9.843 1.00 0.00 C ATOM 2091 O LEU A 130 -10.428 13.618 10.023 1.00 0.00 O ATOM 2092 CB LEU A 130 -12.589 15.824 8.692 1.00 0.00 C ATOM 2093 CG LEU A 130 -13.450 16.390 7.561 1.00 0.00 C ATOM 2094 CD1 LEU A 130 -13.562 17.912 7.668 1.00 0.00 C ATOM 2095 CD2 LEU A 130 -12.920 15.948 6.195 1.00 0.00 C ATOM 0 H LEU A 130 -14.102 14.097 7.777 1.00 0.00 H new ATOM 0 HA LEU A 130 -11.352 14.355 7.830 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -13.135 15.935 9.629 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -11.688 16.431 8.775 1.00 0.00 H new ATOM 0 HG LEU A 130 -14.457 15.985 7.661 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -14.179 18.290 6.853 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -14.019 18.177 8.622 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -12.568 18.355 7.606 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -13.550 16.364 5.408 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -11.898 16.305 6.068 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.934 14.860 6.134 1.00 0.00 H new ATOM 2107 N HIS A 131 -12.568 13.370 10.711 1.00 0.00 N ATOM 2108 CA HIS A 131 -12.206 12.768 11.983 1.00 0.00 C ATOM 2109 C HIS A 131 -11.408 11.487 11.736 1.00 0.00 C ATOM 2110 O HIS A 131 -10.399 11.243 12.396 1.00 0.00 O ATOM 2111 CB HIS A 131 -13.447 12.537 12.847 1.00 0.00 C ATOM 2112 CG HIS A 131 -13.582 13.502 14.000 1.00 0.00 C ATOM 2113 ND1 HIS A 131 -12.562 13.733 14.907 1.00 0.00 N ATOM 2114 CD2 HIS A 131 -14.625 14.293 14.384 1.00 0.00 C ATOM 2115 CE1 HIS A 131 -12.984 14.624 15.793 1.00 0.00 C ATOM 2116 NE2 HIS A 131 -14.263 14.969 15.467 1.00 0.00 N ATOM 0 H HIS A 131 -13.571 13.475 10.558 1.00 0.00 H new ATOM 0 HA HIS A 131 -11.567 13.450 12.543 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -14.334 12.612 12.218 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -13.420 11.520 13.239 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -15.583 14.358 13.890 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -12.415 15.009 16.626 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -14.845 15.637 15.973 1.00 0.00 H new ATOM 2124 N GLU A 132 -11.890 10.702 10.784 1.00 0.00 N ATOM 2125 CA GLU A 132 -11.234 9.451 10.442 1.00 0.00 C ATOM 2126 C GLU A 132 -9.914 9.725 9.718 1.00 0.00 C ATOM 2127 O GLU A 132 -8.864 9.229 10.125 1.00 0.00 O ATOM 2128 CB GLU A 132 -12.150 8.565 9.595 1.00 0.00 C ATOM 2129 CG GLU A 132 -13.308 8.016 10.432 1.00 0.00 C ATOM 2130 CD GLU A 132 -14.096 6.962 9.652 1.00 0.00 C ATOM 2131 OE1 GLU A 132 -14.666 7.339 8.606 1.00 0.00 O ATOM 2132 OE2 GLU A 132 -14.110 5.803 10.120 1.00 0.00 O ATOM 0 H GLU A 132 -12.727 10.908 10.239 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.015 8.914 11.365 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.543 9.139 8.756 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -11.576 7.739 9.175 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.921 7.579 11.352 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.971 8.831 10.721 1.00 0.00 H new ATOM 2139 N VAL A 133 -10.010 10.512 8.657 1.00 0.00 N ATOM 2140 CA VAL A 133 -8.837 10.858 7.873 1.00 0.00 C ATOM 2141 C VAL A 133 -7.745 11.388 8.803 1.00 0.00 C ATOM 2142 O VAL A 133 -6.565 11.095 8.613 1.00 0.00 O ATOM 2143 CB VAL A 133 -9.217 11.849 6.771 1.00 0.00 C ATOM 2144 CG1 VAL A 133 -7.970 12.462 6.131 1.00 0.00 C ATOM 2145 CG2 VAL A 133 -10.104 11.184 5.717 1.00 0.00 C ATOM 0 H VAL A 133 -10.883 10.920 8.322 1.00 0.00 H new ATOM 0 HA VAL A 133 -8.438 9.975 7.374 1.00 0.00 H new ATOM 0 HB VAL A 133 -9.789 12.656 7.229 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -8.268 13.163 5.351 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -7.393 12.989 6.891 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -7.359 11.672 5.695 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -10.359 11.910 4.946 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -9.569 10.348 5.266 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -11.017 10.819 6.188 1.00 0.00 H new ATOM 2155 N LEU A 134 -8.176 12.159 9.791 1.00 0.00 N ATOM 2156 CA LEU A 134 -7.249 12.733 10.752 1.00 0.00 C ATOM 2157 C LEU A 134 -6.513 11.607 11.479 1.00 0.00 C ATOM 2158 O LEU A 134 -5.326 11.384 11.246 1.00 0.00 O ATOM 2159 CB LEU A 134 -7.979 13.697 11.690 1.00 0.00 C ATOM 2160 CG LEU A 134 -7.171 14.211 12.883 1.00 0.00 C ATOM 2161 CD1 LEU A 134 -5.721 14.491 12.485 1.00 0.00 C ATOM 2162 CD2 LEU A 134 -7.840 15.436 13.510 1.00 0.00 C ATOM 0 H LEU A 134 -9.155 12.400 9.947 1.00 0.00 H new ATOM 0 HA LEU A 134 -6.493 13.331 10.243 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.315 14.555 11.108 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.872 13.199 12.068 1.00 0.00 H new ATOM 0 HG LEU A 134 -7.150 13.430 13.643 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -5.170 14.855 13.352 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -5.260 13.573 12.121 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -5.699 15.245 11.698 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -7.246 15.782 14.356 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -7.912 16.231 12.768 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -8.839 15.169 13.854 1.00 0.00 H new ATOM 2174 N GLU A 135 -7.248 10.926 12.346 1.00 0.00 N ATOM 2175 CA GLU A 135 -6.679 9.827 13.109 1.00 0.00 C ATOM 2176 C GLU A 135 -5.764 8.982 12.221 1.00 0.00 C ATOM 2177 O GLU A 135 -4.789 8.405 12.700 1.00 0.00 O ATOM 2178 CB GLU A 135 -7.779 8.969 13.738 1.00 0.00 C ATOM 2179 CG GLU A 135 -8.603 9.781 14.739 1.00 0.00 C ATOM 2180 CD GLU A 135 -9.574 8.882 15.507 1.00 0.00 C ATOM 2181 OE1 GLU A 135 -9.132 8.313 16.529 1.00 0.00 O ATOM 2182 OE2 GLU A 135 -10.735 8.784 15.055 1.00 0.00 O ATOM 0 H GLU A 135 -8.232 11.114 12.537 1.00 0.00 H new ATOM 0 HA GLU A 135 -6.081 10.244 13.920 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -8.431 8.578 12.957 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -7.333 8.111 14.240 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -7.937 10.285 15.439 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -9.159 10.557 14.213 1.00 0.00 H new ATOM 2189 N ARG A 136 -6.111 8.935 10.943 1.00 0.00 N ATOM 2190 CA ARG A 136 -5.333 8.170 9.984 1.00 0.00 C ATOM 2191 C ARG A 136 -3.929 8.761 9.847 1.00 0.00 C ATOM 2192 O ARG A 136 -2.935 8.048 9.975 1.00 0.00 O ATOM 2193 CB ARG A 136 -6.010 8.156 8.612 1.00 0.00 C ATOM 2194 CG ARG A 136 -6.631 6.788 8.321 1.00 0.00 C ATOM 2195 CD ARG A 136 -5.650 5.890 7.564 1.00 0.00 C ATOM 2196 NE ARG A 136 -6.388 4.998 6.642 1.00 0.00 N ATOM 2197 CZ ARG A 136 -5.919 3.825 6.196 1.00 0.00 C ATOM 2198 NH1 ARG A 136 -4.711 3.395 6.584 1.00 0.00 N ATOM 2199 NH2 ARG A 136 -6.659 3.081 5.362 1.00 0.00 N ATOM 0 H ARG A 136 -6.921 9.415 10.550 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.265 7.147 10.353 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.782 8.925 8.575 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -5.280 8.400 7.840 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.920 6.309 9.257 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -7.541 6.915 7.734 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -4.943 6.501 7.003 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -5.069 5.297 8.270 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.311 5.295 6.326 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -4.148 3.961 7.219 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -4.354 2.502 6.244 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -7.579 3.408 5.067 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -6.302 2.188 5.022 1.00 0.00 H new ATOM 2213 N GLU A 137 -3.892 10.060 9.587 1.00 0.00 N ATOM 2214 CA GLU A 137 -2.626 10.756 9.431 1.00 0.00 C ATOM 2215 C GLU A 137 -1.921 10.886 10.782 1.00 0.00 C ATOM 2216 O GLU A 137 -0.694 10.951 10.843 1.00 0.00 O ATOM 2217 CB GLU A 137 -2.830 12.128 8.785 1.00 0.00 C ATOM 2218 CG GLU A 137 -3.697 13.026 9.669 1.00 0.00 C ATOM 2219 CD GLU A 137 -3.243 14.485 9.582 1.00 0.00 C ATOM 2220 OE1 GLU A 137 -2.030 14.689 9.360 1.00 0.00 O ATOM 2221 OE2 GLU A 137 -4.119 15.363 9.739 1.00 0.00 O ATOM 0 H GLU A 137 -4.718 10.648 9.481 1.00 0.00 H new ATOM 0 HA GLU A 137 -1.991 10.169 8.767 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -1.863 12.602 8.616 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -3.301 12.008 7.809 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -4.740 12.947 9.362 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -3.643 12.686 10.703 1.00 0.00 H new ATOM 2228 N LYS A 138 -2.727 10.920 11.833 1.00 0.00 N ATOM 2229 CA LYS A 138 -2.196 11.041 13.180 1.00 0.00 C ATOM 2230 C LYS A 138 -1.154 9.946 13.413 1.00 0.00 C ATOM 2231 O LYS A 138 -0.075 10.213 13.940 1.00 0.00 O ATOM 2232 CB LYS A 138 -3.332 11.037 14.206 1.00 0.00 C ATOM 2233 CG LYS A 138 -3.934 12.435 14.363 1.00 0.00 C ATOM 2234 CD LYS A 138 -5.155 12.406 15.284 1.00 0.00 C ATOM 2235 CE LYS A 138 -5.353 13.756 15.975 1.00 0.00 C ATOM 2236 NZ LYS A 138 -4.906 13.688 17.384 1.00 0.00 N ATOM 0 H LYS A 138 -3.744 10.866 11.779 1.00 0.00 H new ATOM 0 HA LYS A 138 -1.688 11.997 13.305 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -4.107 10.337 13.894 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -2.957 10.689 15.168 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -3.184 13.114 14.769 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -4.220 12.823 13.386 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -6.045 12.155 14.706 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -5.031 11.625 16.034 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -4.793 14.527 15.446 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -6.404 14.041 15.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -5.047 14.613 17.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -5.459 12.966 17.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -3.897 13.437 17.416 1.00 0.00 H new ATOM 2250 N LYS A 139 -1.512 8.736 13.009 1.00 0.00 N ATOM 2251 CA LYS A 139 -0.621 7.599 13.167 1.00 0.00 C ATOM 2252 C LYS A 139 0.714 7.905 12.485 1.00 0.00 C ATOM 2253 O LYS A 139 1.772 7.520 12.982 1.00 0.00 O ATOM 2254 CB LYS A 139 -1.290 6.319 12.662 1.00 0.00 C ATOM 2255 CG LYS A 139 -2.155 5.685 13.754 1.00 0.00 C ATOM 2256 CD LYS A 139 -3.637 5.989 13.525 1.00 0.00 C ATOM 2257 CE LYS A 139 -4.506 4.782 13.885 1.00 0.00 C ATOM 2258 NZ LYS A 139 -5.917 5.193 14.059 1.00 0.00 N ATOM 0 H LYS A 139 -2.408 8.518 12.572 1.00 0.00 H new ATOM 0 HA LYS A 139 -0.409 7.425 14.222 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -1.905 6.545 11.791 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -0.528 5.609 12.339 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -1.999 4.606 13.766 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -1.849 6.062 14.730 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -3.933 6.848 14.128 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -3.799 6.260 12.482 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -4.435 4.028 13.101 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -4.139 4.323 14.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -6.493 4.362 14.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -5.982 5.896 14.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -6.269 5.610 13.174 1.00 0.00 H new ATOM 2272 N ARG A 140 0.622 8.595 11.358 1.00 0.00 N ATOM 2273 CA ARG A 140 1.810 8.957 10.603 1.00 0.00 C ATOM 2274 C ARG A 140 2.572 10.076 11.317 1.00 0.00 C ATOM 2275 O ARG A 140 3.780 10.224 11.135 1.00 0.00 O ATOM 2276 CB ARG A 140 1.446 9.418 9.191 1.00 0.00 C ATOM 2277 CG ARG A 140 1.190 8.222 8.272 1.00 0.00 C ATOM 2278 CD ARG A 140 1.035 8.671 6.818 1.00 0.00 C ATOM 2279 NE ARG A 140 -0.168 9.521 6.676 1.00 0.00 N ATOM 2280 CZ ARG A 140 -0.162 10.856 6.791 1.00 0.00 C ATOM 2281 NH1 ARG A 140 0.984 11.501 7.050 1.00 0.00 N ATOM 2282 NH2 ARG A 140 -1.301 11.546 6.647 1.00 0.00 N ATOM 0 H ARG A 140 -0.257 8.913 10.949 1.00 0.00 H new ATOM 0 HA ARG A 140 2.441 8.071 10.532 1.00 0.00 H new ATOM 0 HB2 ARG A 140 0.558 10.049 9.228 1.00 0.00 H new ATOM 0 HB3 ARG A 140 2.253 10.027 8.784 1.00 0.00 H new ATOM 0 HG2 ARG A 140 2.015 7.514 8.352 1.00 0.00 H new ATOM 0 HG3 ARG A 140 0.289 7.699 8.593 1.00 0.00 H new ATOM 0 HD2 ARG A 140 1.920 9.224 6.503 1.00 0.00 H new ATOM 0 HD3 ARG A 140 0.954 7.801 6.167 1.00 0.00 H new ATOM 0 HE ARG A 140 -1.057 9.062 6.478 1.00 0.00 H new ATOM 0 HH11 ARG A 140 1.851 10.976 7.160 1.00 0.00 H new ATOM 0 HH12 ARG A 140 0.989 12.517 7.138 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -2.173 11.055 6.450 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -1.296 12.562 6.735 1.00 0.00 H new