USER MOD reduce.3.24.130724 H: found=0, std=0, add=728, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 730 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 379 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 431 GLN : amide:sc= -0.497 X(o=-0.5,f=0) USER MOD Single : A 372 SER OG : rot 180:sc= 0 USER MOD Single : A 376 THR OG1 : rot 180:sc= -0.339 USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 385 HIS : no HD1:sc= 0 X(o=0,f=-0.0075) USER MOD Single : A 389 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 391 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 403 LYS NZ :NH3+ -109:sc= -0.0942 (180deg=-2.21!) USER MOD Single : A 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot 180:sc= -0.526 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 30:sc= 0 USER MOD Single : A 415 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 417 THR OG1 : rot 100:sc= 1.12 USER MOD Single : A 418 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.169) USER MOD Single : A 425 SER OG : rot -64:sc= 1.21 USER MOD Single : A 428 THR OG1 : rot 167:sc= 0.0513 USER MOD Single : A 433 SER OG : rot 140:sc= -0.343 USER MOD Single : A 436 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot 180:sc= -0.0162 USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.353 X(o=-0.35,f=-0.021) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 455 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.022) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 371 -6.076 30.977 -25.117 1.00 0.00 N ATOM 2 CA GLY A 371 -6.635 29.907 -24.246 1.00 0.00 C ATOM 3 C GLY A 371 -6.918 30.393 -22.838 1.00 0.00 C ATOM 4 O GLY A 371 -7.034 31.596 -22.602 1.00 0.00 O ATOM 0 HA2 GLY A 371 -7.556 29.528 -24.688 1.00 0.00 H new ATOM 0 HA3 GLY A 371 -5.934 29.073 -24.205 1.00 0.00 H new ATOM 10 N SER A 372 -7.028 29.457 -21.901 1.00 0.00 N ATOM 11 CA SER A 372 -7.299 29.796 -20.509 1.00 0.00 C ATOM 12 C SER A 372 -6.018 30.216 -19.793 1.00 0.00 C ATOM 13 O SER A 372 -4.934 29.721 -20.103 1.00 0.00 O ATOM 14 CB SER A 372 -7.935 28.608 -19.787 1.00 0.00 C ATOM 15 OG SER A 372 -9.241 28.352 -20.276 1.00 0.00 O ATOM 0 H SER A 372 -6.934 28.457 -22.081 1.00 0.00 H new ATOM 0 HA SER A 372 -7.995 30.635 -20.494 1.00 0.00 H new ATOM 0 HB2 SER A 372 -7.314 27.723 -19.920 1.00 0.00 H new ATOM 0 HB3 SER A 372 -7.977 28.809 -18.717 1.00 0.00 H new ATOM 0 HG SER A 372 -9.625 27.587 -19.799 1.00 0.00 H new ATOM 21 N PRO A 373 -6.125 31.139 -18.821 1.00 0.00 N ATOM 22 CA PRO A 373 -4.968 31.623 -18.060 1.00 0.00 C ATOM 23 C PRO A 373 -4.164 30.487 -17.442 1.00 0.00 C ATOM 24 O PRO A 373 -2.945 30.416 -17.597 1.00 0.00 O ATOM 25 CB PRO A 373 -5.594 32.491 -16.967 1.00 0.00 C ATOM 26 CG PRO A 373 -6.907 32.920 -17.527 1.00 0.00 C ATOM 27 CD PRO A 373 -7.379 31.782 -18.386 1.00 0.00 C ATOM 0 HA PRO A 373 -4.262 32.159 -18.694 1.00 0.00 H new ATOM 0 HB2 PRO A 373 -5.723 31.930 -16.042 1.00 0.00 H new ATOM 0 HB3 PRO A 373 -4.964 33.349 -16.734 1.00 0.00 H new ATOM 0 HG2 PRO A 373 -7.621 33.131 -16.731 1.00 0.00 H new ATOM 0 HG3 PRO A 373 -6.803 33.834 -18.112 1.00 0.00 H new ATOM 0 HD2 PRO A 373 -8.011 31.092 -17.827 1.00 0.00 H new ATOM 0 HD3 PRO A 373 -7.965 32.135 -19.235 1.00 0.00 H new ATOM 35 N GLU A 374 -4.858 29.601 -16.740 1.00 0.00 N ATOM 36 CA GLU A 374 -4.214 28.464 -16.091 1.00 0.00 C ATOM 37 C GLU A 374 -3.177 28.933 -15.077 1.00 0.00 C ATOM 38 O GLU A 374 -2.129 29.463 -15.447 1.00 0.00 O ATOM 39 CB GLU A 374 -3.555 27.560 -17.135 1.00 0.00 C ATOM 40 CG GLU A 374 -4.548 26.754 -17.957 1.00 0.00 C ATOM 41 CD GLU A 374 -4.103 26.574 -19.395 1.00 0.00 C ATOM 42 OE1 GLU A 374 -3.162 25.787 -19.632 1.00 0.00 O ATOM 43 OE2 GLU A 374 -4.697 27.218 -20.285 1.00 0.00 O ATOM 0 H GLU A 374 -5.868 29.647 -16.605 1.00 0.00 H new ATOM 0 HA GLU A 374 -4.980 27.896 -15.563 1.00 0.00 H new ATOM 0 HB2 GLU A 374 -2.954 28.173 -17.806 1.00 0.00 H new ATOM 0 HB3 GLU A 374 -2.873 26.875 -16.631 1.00 0.00 H new ATOM 0 HG2 GLU A 374 -4.685 25.775 -17.497 1.00 0.00 H new ATOM 0 HG3 GLU A 374 -5.517 27.252 -17.940 1.00 0.00 H new ATOM 50 N PHE A 375 -3.477 28.737 -13.797 1.00 0.00 N ATOM 51 CA PHE A 375 -2.569 29.145 -12.730 1.00 0.00 C ATOM 52 C PHE A 375 -1.637 28.003 -12.334 1.00 0.00 C ATOM 53 O PHE A 375 -0.460 27.999 -12.693 1.00 0.00 O ATOM 54 CB PHE A 375 -3.364 29.619 -11.511 1.00 0.00 C ATOM 55 CG PHE A 375 -4.161 30.867 -11.765 1.00 0.00 C ATOM 56 CD1 PHE A 375 -3.574 31.971 -12.362 1.00 0.00 C ATOM 57 CD2 PHE A 375 -5.499 30.935 -11.407 1.00 0.00 C ATOM 58 CE1 PHE A 375 -4.305 33.119 -12.597 1.00 0.00 C ATOM 59 CE2 PHE A 375 -6.235 32.081 -11.639 1.00 0.00 C ATOM 60 CZ PHE A 375 -5.638 33.175 -12.236 1.00 0.00 C ATOM 0 H PHE A 375 -4.340 28.299 -13.474 1.00 0.00 H new ATOM 0 HA PHE A 375 -1.960 29.969 -13.102 1.00 0.00 H new ATOM 0 HB2 PHE A 375 -4.039 28.824 -11.196 1.00 0.00 H new ATOM 0 HB3 PHE A 375 -2.676 29.799 -10.685 1.00 0.00 H new ATOM 0 HD1 PHE A 375 -2.533 31.933 -12.647 1.00 0.00 H new ATOM 0 HD2 PHE A 375 -5.971 30.082 -10.942 1.00 0.00 H new ATOM 0 HE1 PHE A 375 -3.835 33.973 -13.063 1.00 0.00 H new ATOM 0 HE2 PHE A 375 -7.276 32.122 -11.354 1.00 0.00 H new ATOM 0 HZ PHE A 375 -6.212 34.071 -12.420 1.00 0.00 H new ATOM 70 N THR A 376 -2.169 27.037 -11.591 1.00 0.00 N ATOM 71 CA THR A 376 -1.378 25.895 -11.147 1.00 0.00 C ATOM 72 C THR A 376 -0.202 26.355 -10.287 1.00 0.00 C ATOM 73 O THR A 376 0.840 26.751 -10.810 1.00 0.00 O ATOM 74 CB THR A 376 -0.863 25.103 -12.352 1.00 0.00 C ATOM 75 OG1 THR A 376 -1.598 25.429 -13.519 1.00 0.00 O ATOM 76 CG2 THR A 376 -0.945 23.604 -12.163 1.00 0.00 C ATOM 0 H THR A 376 -3.142 27.022 -11.285 1.00 0.00 H new ATOM 0 HA THR A 376 -2.019 25.250 -10.546 1.00 0.00 H new ATOM 0 HB THR A 376 0.185 25.384 -12.454 1.00 0.00 H new ATOM 0 HG1 THR A 376 -1.253 24.914 -14.278 1.00 0.00 H new ATOM 0 HG21 THR A 376 -0.564 23.104 -13.053 1.00 0.00 H new ATOM 0 HG22 THR A 376 -0.347 23.313 -11.300 1.00 0.00 H new ATOM 0 HG23 THR A 376 -1.983 23.314 -12.000 1.00 0.00 H new ATOM 84 N PRO A 377 -0.353 26.317 -8.951 1.00 0.00 N ATOM 85 CA PRO A 377 0.705 26.740 -8.023 1.00 0.00 C ATOM 86 C PRO A 377 1.987 25.931 -8.200 1.00 0.00 C ATOM 87 O PRO A 377 1.956 24.806 -8.698 1.00 0.00 O ATOM 88 CB PRO A 377 0.089 26.496 -6.641 1.00 0.00 C ATOM 89 CG PRO A 377 -1.380 26.505 -6.887 1.00 0.00 C ATOM 90 CD PRO A 377 -1.556 25.869 -8.232 1.00 0.00 C ATOM 0 HA PRO A 377 1.004 27.775 -8.186 1.00 0.00 H new ATOM 0 HB2 PRO A 377 0.416 25.545 -6.222 1.00 0.00 H new ATOM 0 HB3 PRO A 377 0.379 27.273 -5.933 1.00 0.00 H new ATOM 0 HG2 PRO A 377 -1.912 25.948 -6.115 1.00 0.00 H new ATOM 0 HG3 PRO A 377 -1.775 27.521 -6.877 1.00 0.00 H new ATOM 0 HD2 PRO A 377 -1.608 24.782 -8.164 1.00 0.00 H new ATOM 0 HD3 PRO A 377 -2.471 26.202 -8.723 1.00 0.00 H new ATOM 98 N PRO A 378 3.140 26.501 -7.806 1.00 0.00 N ATOM 99 CA PRO A 378 4.439 25.841 -7.937 1.00 0.00 C ATOM 100 C PRO A 378 4.698 24.793 -6.855 1.00 0.00 C ATOM 101 O PRO A 378 5.662 24.033 -6.946 1.00 0.00 O ATOM 102 CB PRO A 378 5.453 26.992 -7.809 1.00 0.00 C ATOM 103 CG PRO A 378 4.646 28.249 -7.692 1.00 0.00 C ATOM 104 CD PRO A 378 3.282 27.838 -7.224 1.00 0.00 C ATOM 0 HA PRO A 378 4.503 25.293 -8.877 1.00 0.00 H new ATOM 0 HB2 PRO A 378 6.089 26.855 -6.934 1.00 0.00 H new ATOM 0 HB3 PRO A 378 6.110 27.031 -8.678 1.00 0.00 H new ATOM 0 HG2 PRO A 378 5.106 28.941 -6.986 1.00 0.00 H new ATOM 0 HG3 PRO A 378 4.588 28.763 -8.651 1.00 0.00 H new ATOM 0 HD2 PRO A 378 3.215 27.817 -6.136 1.00 0.00 H new ATOM 0 HD3 PRO A 378 2.508 28.520 -7.578 1.00 0.00 H new ATOM 112 N SER A 379 3.853 24.754 -5.827 1.00 0.00 N ATOM 113 CA SER A 379 4.040 23.790 -4.744 1.00 0.00 C ATOM 114 C SER A 379 2.909 22.779 -4.680 1.00 0.00 C ATOM 115 O SER A 379 3.112 21.642 -4.252 1.00 0.00 O ATOM 116 CB SER A 379 4.190 24.505 -3.401 1.00 0.00 C ATOM 117 OG SER A 379 2.924 24.822 -2.847 1.00 0.00 O ATOM 0 H SER A 379 3.045 25.367 -5.721 1.00 0.00 H new ATOM 0 HA SER A 379 4.958 23.243 -4.957 1.00 0.00 H new ATOM 0 HB2 SER A 379 4.745 23.872 -2.709 1.00 0.00 H new ATOM 0 HB3 SER A 379 4.771 25.418 -3.534 1.00 0.00 H new ATOM 0 HG SER A 379 3.048 25.277 -1.988 1.00 0.00 H new ATOM 123 N ILE A 380 1.731 23.174 -5.127 1.00 0.00 N ATOM 124 CA ILE A 380 0.599 22.271 -5.136 1.00 0.00 C ATOM 125 C ILE A 380 0.935 21.044 -5.976 1.00 0.00 C ATOM 126 O ILE A 380 0.439 19.948 -5.723 1.00 0.00 O ATOM 127 CB ILE A 380 -0.671 22.961 -5.673 1.00 0.00 C ATOM 128 CG1 ILE A 380 -1.109 24.051 -4.697 1.00 0.00 C ATOM 129 CG2 ILE A 380 -1.792 21.949 -5.880 1.00 0.00 C ATOM 130 CD1 ILE A 380 -1.430 23.529 -3.314 1.00 0.00 C ATOM 0 H ILE A 380 1.535 24.108 -5.486 1.00 0.00 H new ATOM 0 HA ILE A 380 0.394 21.965 -4.110 1.00 0.00 H new ATOM 0 HB ILE A 380 -0.446 23.412 -6.639 1.00 0.00 H new ATOM 0 HG12 ILE A 380 -0.319 24.798 -4.620 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -1.987 24.556 -5.099 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -2.677 22.459 -6.259 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -1.473 21.194 -6.599 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -2.029 21.469 -4.930 1.00 0.00 H new ATOM 0 HD11 ILE A 380 -1.734 24.357 -2.674 1.00 0.00 H new ATOM 0 HD12 ILE A 380 -2.241 22.804 -3.378 1.00 0.00 H new ATOM 0 HD13 ILE A 380 -0.547 23.049 -2.892 1.00 0.00 H new ATOM 142 N LYS A 381 1.793 21.243 -6.975 1.00 0.00 N ATOM 143 CA LYS A 381 2.206 20.154 -7.854 1.00 0.00 C ATOM 144 C LYS A 381 2.871 19.037 -7.057 1.00 0.00 C ATOM 145 O LYS A 381 2.750 17.860 -7.401 1.00 0.00 O ATOM 146 CB LYS A 381 3.165 20.673 -8.928 1.00 0.00 C ATOM 147 CG LYS A 381 2.657 21.912 -9.649 1.00 0.00 C ATOM 148 CD LYS A 381 3.312 22.070 -11.012 1.00 0.00 C ATOM 149 CE LYS A 381 3.356 23.527 -11.443 1.00 0.00 C ATOM 150 NZ LYS A 381 4.437 23.781 -12.434 1.00 0.00 N ATOM 0 H LYS A 381 2.214 22.146 -7.194 1.00 0.00 H new ATOM 0 HA LYS A 381 1.316 19.751 -8.337 1.00 0.00 H new ATOM 0 HB2 LYS A 381 4.126 20.900 -8.466 1.00 0.00 H new ATOM 0 HB3 LYS A 381 3.341 19.884 -9.659 1.00 0.00 H new ATOM 0 HG2 LYS A 381 1.576 21.847 -9.769 1.00 0.00 H new ATOM 0 HG3 LYS A 381 2.858 22.795 -9.043 1.00 0.00 H new ATOM 0 HD2 LYS A 381 4.325 21.668 -10.979 1.00 0.00 H new ATOM 0 HD3 LYS A 381 2.762 21.487 -11.751 1.00 0.00 H new ATOM 0 HE2 LYS A 381 2.395 23.807 -11.875 1.00 0.00 H new ATOM 0 HE3 LYS A 381 3.509 24.160 -10.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 4.433 24.786 -12.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 5.357 23.538 -12.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 4.277 23.197 -13.279 1.00 0.00 H new ATOM 164 N LYS A 382 3.574 19.409 -5.992 1.00 0.00 N ATOM 165 CA LYS A 382 4.253 18.432 -5.150 1.00 0.00 C ATOM 166 C LYS A 382 3.249 17.577 -4.402 1.00 0.00 C ATOM 167 O LYS A 382 3.435 16.372 -4.236 1.00 0.00 O ATOM 168 CB LYS A 382 5.200 19.126 -4.167 1.00 0.00 C ATOM 169 CG LYS A 382 6.651 19.132 -4.620 1.00 0.00 C ATOM 170 CD LYS A 382 7.604 19.116 -3.436 1.00 0.00 C ATOM 171 CE LYS A 382 8.813 20.005 -3.682 1.00 0.00 C ATOM 172 NZ LYS A 382 9.731 20.030 -2.510 1.00 0.00 N ATOM 0 H LYS A 382 3.688 20.377 -5.693 1.00 0.00 H new ATOM 0 HA LYS A 382 4.844 17.783 -5.797 1.00 0.00 H new ATOM 0 HB2 LYS A 382 4.869 20.154 -4.022 1.00 0.00 H new ATOM 0 HB3 LYS A 382 5.133 18.630 -3.199 1.00 0.00 H new ATOM 0 HG2 LYS A 382 6.840 18.264 -5.252 1.00 0.00 H new ATOM 0 HG3 LYS A 382 6.840 20.016 -5.228 1.00 0.00 H new ATOM 0 HD2 LYS A 382 7.080 19.452 -2.541 1.00 0.00 H new ATOM 0 HD3 LYS A 382 7.934 18.095 -3.247 1.00 0.00 H new ATOM 0 HE2 LYS A 382 9.353 19.649 -4.559 1.00 0.00 H new ATOM 0 HE3 LYS A 382 8.479 21.019 -3.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 10.542 20.647 -2.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 9.223 20.394 -1.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 10.070 19.067 -2.314 1.00 0.00 H new ATOM 186 N ILE A 383 2.175 18.209 -3.971 1.00 0.00 N ATOM 187 CA ILE A 383 1.116 17.510 -3.257 1.00 0.00 C ATOM 188 C ILE A 383 0.533 16.424 -4.150 1.00 0.00 C ATOM 189 O ILE A 383 0.155 15.350 -3.685 1.00 0.00 O ATOM 190 CB ILE A 383 -0.008 18.471 -2.818 1.00 0.00 C ATOM 191 CG1 ILE A 383 0.575 19.647 -2.034 1.00 0.00 C ATOM 192 CG2 ILE A 383 -1.040 17.731 -1.981 1.00 0.00 C ATOM 193 CD1 ILE A 383 1.269 19.236 -0.755 1.00 0.00 C ATOM 0 H ILE A 383 2.009 19.207 -4.101 1.00 0.00 H new ATOM 0 HA ILE A 383 1.551 17.069 -2.360 1.00 0.00 H new ATOM 0 HB ILE A 383 -0.501 18.860 -3.709 1.00 0.00 H new ATOM 0 HG12 ILE A 383 1.284 20.180 -2.668 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -0.226 20.346 -1.795 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -1.827 18.422 -1.679 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -1.474 16.922 -2.569 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -0.560 17.317 -1.094 1.00 0.00 H new ATOM 0 HD11 ILE A 383 1.658 20.121 -0.251 1.00 0.00 H new ATOM 0 HD12 ILE A 383 0.558 18.730 -0.102 1.00 0.00 H new ATOM 0 HD13 ILE A 383 2.092 18.560 -0.988 1.00 0.00 H new ATOM 205 N ILE A 384 0.500 16.712 -5.446 1.00 0.00 N ATOM 206 CA ILE A 384 0.004 15.760 -6.437 1.00 0.00 C ATOM 207 C ILE A 384 1.041 14.679 -6.650 1.00 0.00 C ATOM 208 O ILE A 384 0.729 13.489 -6.699 1.00 0.00 O ATOM 209 CB ILE A 384 -0.270 16.428 -7.805 1.00 0.00 C ATOM 210 CG1 ILE A 384 -0.429 17.935 -7.654 1.00 0.00 C ATOM 211 CG2 ILE A 384 -1.504 15.829 -8.456 1.00 0.00 C ATOM 212 CD1 ILE A 384 -1.509 18.326 -6.668 1.00 0.00 C ATOM 0 H ILE A 384 0.812 17.601 -5.838 1.00 0.00 H new ATOM 0 HA ILE A 384 -0.932 15.353 -6.054 1.00 0.00 H new ATOM 0 HB ILE A 384 0.589 16.239 -8.449 1.00 0.00 H new ATOM 0 HG12 ILE A 384 0.520 18.363 -7.332 1.00 0.00 H new ATOM 0 HG13 ILE A 384 -0.660 18.369 -8.627 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -1.679 16.313 -9.417 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -1.352 14.761 -8.610 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -2.368 15.983 -7.809 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -1.570 19.413 -6.608 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -2.467 17.926 -7.000 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -1.268 17.921 -5.685 1.00 0.00 H new ATOM 224 N HIS A 385 2.286 15.119 -6.769 1.00 0.00 N ATOM 225 CA HIS A 385 3.405 14.207 -6.972 1.00 0.00 C ATOM 226 C HIS A 385 3.471 13.176 -5.849 1.00 0.00 C ATOM 227 O HIS A 385 3.630 11.981 -6.098 1.00 0.00 O ATOM 228 CB HIS A 385 4.720 14.987 -7.045 1.00 0.00 C ATOM 229 CG HIS A 385 5.665 14.470 -8.084 1.00 0.00 C ATOM 230 ND1 HIS A 385 6.757 13.708 -7.744 1.00 0.00 N ATOM 231 CD2 HIS A 385 5.640 14.632 -9.429 1.00 0.00 C ATOM 232 CE1 HIS A 385 7.368 13.424 -8.881 1.00 0.00 C ATOM 233 NE2 HIS A 385 6.727 13.963 -9.930 1.00 0.00 N ATOM 0 H HIS A 385 2.548 16.104 -6.728 1.00 0.00 H new ATOM 0 HA HIS A 385 3.251 13.683 -7.915 1.00 0.00 H new ATOM 0 HB2 HIS A 385 4.501 16.034 -7.254 1.00 0.00 H new ATOM 0 HB3 HIS A 385 5.209 14.952 -6.071 1.00 0.00 H new ATOM 0 HD2 HIS A 385 4.905 15.182 -9.997 1.00 0.00 H new ATOM 0 HE1 HIS A 385 8.269 12.833 -8.957 1.00 0.00 H new ATOM 0 HE2 HIS A 385 6.997 13.889 -10.911 1.00 0.00 H new ATOM 241 N VAL A 386 3.338 13.647 -4.613 1.00 0.00 N ATOM 242 CA VAL A 386 3.376 12.765 -3.452 1.00 0.00 C ATOM 243 C VAL A 386 2.135 11.877 -3.401 1.00 0.00 C ATOM 244 O VAL A 386 2.229 10.677 -3.143 1.00 0.00 O ATOM 245 CB VAL A 386 3.491 13.564 -2.137 1.00 0.00 C ATOM 246 CG1 VAL A 386 2.271 14.450 -1.932 1.00 0.00 C ATOM 247 CG2 VAL A 386 3.683 12.625 -0.955 1.00 0.00 C ATOM 0 H VAL A 386 3.203 14.633 -4.390 1.00 0.00 H new ATOM 0 HA VAL A 386 4.262 12.138 -3.556 1.00 0.00 H new ATOM 0 HB VAL A 386 4.367 14.209 -2.206 1.00 0.00 H new ATOM 0 HG11 VAL A 386 2.376 15.003 -0.999 1.00 0.00 H new ATOM 0 HG12 VAL A 386 2.187 15.152 -2.762 1.00 0.00 H new ATOM 0 HG13 VAL A 386 1.375 13.831 -1.888 1.00 0.00 H new ATOM 0 HG21 VAL A 386 3.762 13.207 -0.037 1.00 0.00 H new ATOM 0 HG22 VAL A 386 2.830 11.950 -0.884 1.00 0.00 H new ATOM 0 HG23 VAL A 386 4.595 12.044 -1.096 1.00 0.00 H new ATOM 257 N LEU A 387 0.971 12.474 -3.649 1.00 0.00 N ATOM 258 CA LEU A 387 -0.282 11.735 -3.633 1.00 0.00 C ATOM 259 C LEU A 387 -0.323 10.718 -4.766 1.00 0.00 C ATOM 260 O LEU A 387 -0.858 9.623 -4.611 1.00 0.00 O ATOM 261 CB LEU A 387 -1.463 12.702 -3.739 1.00 0.00 C ATOM 262 CG LEU A 387 -2.706 12.312 -2.939 1.00 0.00 C ATOM 263 CD1 LEU A 387 -3.417 11.138 -3.592 1.00 0.00 C ATOM 264 CD2 LEU A 387 -2.338 11.984 -1.498 1.00 0.00 C ATOM 0 H LEU A 387 0.873 13.467 -3.863 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.354 11.194 -2.689 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.134 13.687 -3.409 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.742 12.794 -4.789 1.00 0.00 H new ATOM 0 HG LEU A 387 -3.387 13.163 -2.931 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -4.299 10.876 -3.007 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -3.720 11.412 -4.602 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -2.743 10.283 -3.635 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -3.237 11.709 -0.946 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -1.634 11.152 -1.483 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -1.879 12.856 -1.032 1.00 0.00 H new ATOM 276 N GLU A 388 0.265 11.076 -5.899 1.00 0.00 N ATOM 277 CA GLU A 388 0.312 10.177 -7.041 1.00 0.00 C ATOM 278 C GLU A 388 1.107 8.930 -6.675 1.00 0.00 C ATOM 279 O GLU A 388 0.798 7.821 -7.116 1.00 0.00 O ATOM 280 CB GLU A 388 0.945 10.874 -8.247 1.00 0.00 C ATOM 281 CG GLU A 388 -0.071 11.388 -9.255 1.00 0.00 C ATOM 282 CD GLU A 388 -0.125 10.543 -10.511 1.00 0.00 C ATOM 283 OE1 GLU A 388 -0.228 9.303 -10.389 1.00 0.00 O ATOM 284 OE2 GLU A 388 -0.065 11.118 -11.618 1.00 0.00 O ATOM 0 H GLU A 388 0.714 11.979 -6.051 1.00 0.00 H new ATOM 0 HA GLU A 388 -0.705 9.890 -7.308 1.00 0.00 H new ATOM 0 HB2 GLU A 388 1.551 11.709 -7.897 1.00 0.00 H new ATOM 0 HB3 GLU A 388 1.619 10.178 -8.746 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -1.058 11.408 -8.793 1.00 0.00 H new ATOM 0 HG3 GLU A 388 0.176 12.415 -9.523 1.00 0.00 H new ATOM 291 N LYS A 389 2.132 9.127 -5.850 1.00 0.00 N ATOM 292 CA LYS A 389 2.979 8.029 -5.403 1.00 0.00 C ATOM 293 C LYS A 389 2.195 7.078 -4.506 1.00 0.00 C ATOM 294 O LYS A 389 2.335 5.859 -4.606 1.00 0.00 O ATOM 295 CB LYS A 389 4.197 8.574 -4.652 1.00 0.00 C ATOM 296 CG LYS A 389 5.284 7.536 -4.424 1.00 0.00 C ATOM 297 CD LYS A 389 6.664 8.090 -4.747 1.00 0.00 C ATOM 298 CE LYS A 389 7.762 7.255 -4.108 1.00 0.00 C ATOM 299 NZ LYS A 389 9.111 7.838 -4.344 1.00 0.00 N ATOM 0 H LYS A 389 2.395 10.039 -5.478 1.00 0.00 H new ATOM 0 HA LYS A 389 3.320 7.478 -6.279 1.00 0.00 H new ATOM 0 HB2 LYS A 389 4.616 9.410 -5.213 1.00 0.00 H new ATOM 0 HB3 LYS A 389 3.873 8.967 -3.688 1.00 0.00 H new ATOM 0 HG2 LYS A 389 5.259 7.204 -3.386 1.00 0.00 H new ATOM 0 HG3 LYS A 389 5.088 6.661 -5.044 1.00 0.00 H new ATOM 0 HD2 LYS A 389 6.805 8.113 -5.828 1.00 0.00 H new ATOM 0 HD3 LYS A 389 6.736 9.119 -4.395 1.00 0.00 H new ATOM 0 HE2 LYS A 389 7.582 7.178 -3.036 1.00 0.00 H new ATOM 0 HE3 LYS A 389 7.729 6.242 -4.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 9.832 7.239 -3.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 9.294 7.888 -5.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 9.152 8.795 -3.938 1.00 0.00 H new ATOM 313 N VAL A 390 1.367 7.643 -3.632 1.00 0.00 N ATOM 314 CA VAL A 390 0.559 6.844 -2.723 1.00 0.00 C ATOM 315 C VAL A 390 -0.428 5.971 -3.498 1.00 0.00 C ATOM 316 O VAL A 390 -0.715 4.841 -3.104 1.00 0.00 O ATOM 317 CB VAL A 390 -0.189 7.724 -1.687 1.00 0.00 C ATOM 318 CG1 VAL A 390 -1.418 8.407 -2.282 1.00 0.00 C ATOM 319 CG2 VAL A 390 -0.573 6.896 -0.470 1.00 0.00 C ATOM 0 H VAL A 390 1.240 8.650 -3.536 1.00 0.00 H new ATOM 0 HA VAL A 390 1.240 6.196 -2.171 1.00 0.00 H new ATOM 0 HB VAL A 390 0.496 8.515 -1.381 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -1.905 9.010 -1.516 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -1.113 9.048 -3.110 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -2.114 7.651 -2.646 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -1.097 7.526 0.248 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -1.224 6.078 -0.777 1.00 0.00 H new ATOM 0 HG23 VAL A 390 0.327 6.490 -0.008 1.00 0.00 H new ATOM 329 N GLN A 391 -0.939 6.507 -4.602 1.00 0.00 N ATOM 330 CA GLN A 391 -1.888 5.787 -5.438 1.00 0.00 C ATOM 331 C GLN A 391 -1.248 4.535 -6.030 1.00 0.00 C ATOM 332 O GLN A 391 -1.872 3.475 -6.094 1.00 0.00 O ATOM 333 CB GLN A 391 -2.392 6.700 -6.556 1.00 0.00 C ATOM 334 CG GLN A 391 -3.890 6.947 -6.514 1.00 0.00 C ATOM 335 CD GLN A 391 -4.325 8.023 -7.481 1.00 0.00 C ATOM 336 OE1 GLN A 391 -4.575 7.759 -8.657 1.00 0.00 O ATOM 337 NE2 GLN A 391 -4.418 9.250 -6.986 1.00 0.00 N ATOM 0 H GLN A 391 -0.709 7.442 -4.938 1.00 0.00 H new ATOM 0 HA GLN A 391 -2.731 5.479 -4.819 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -1.873 7.657 -6.494 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -2.132 6.259 -7.518 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -4.415 6.020 -6.746 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -4.180 7.233 -5.503 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -4.201 9.422 -6.004 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -4.707 10.022 -7.587 1.00 0.00 H new ATOM 346 N TYR A 392 0.002 4.666 -6.459 1.00 0.00 N ATOM 347 CA TYR A 392 0.730 3.546 -7.043 1.00 0.00 C ATOM 348 C TYR A 392 0.939 2.441 -6.013 1.00 0.00 C ATOM 349 O TYR A 392 0.742 1.261 -6.302 1.00 0.00 O ATOM 350 CB TYR A 392 2.081 4.015 -7.587 1.00 0.00 C ATOM 351 CG TYR A 392 2.646 3.116 -8.663 1.00 0.00 C ATOM 352 CD1 TYR A 392 3.014 1.807 -8.379 1.00 0.00 C ATOM 353 CD2 TYR A 392 2.810 3.577 -9.964 1.00 0.00 C ATOM 354 CE1 TYR A 392 3.531 0.983 -9.361 1.00 0.00 C ATOM 355 CE2 TYR A 392 3.326 2.758 -10.951 1.00 0.00 C ATOM 356 CZ TYR A 392 3.684 1.462 -10.644 1.00 0.00 C ATOM 357 OH TYR A 392 4.198 0.644 -11.623 1.00 0.00 O ATOM 0 H TYR A 392 0.532 5.536 -6.413 1.00 0.00 H new ATOM 0 HA TYR A 392 0.136 3.146 -7.865 1.00 0.00 H new ATOM 0 HB2 TYR A 392 1.972 5.023 -7.988 1.00 0.00 H new ATOM 0 HB3 TYR A 392 2.793 4.075 -6.764 1.00 0.00 H new ATOM 0 HD1 TYR A 392 2.894 1.427 -7.375 1.00 0.00 H new ATOM 0 HD2 TYR A 392 2.530 4.591 -10.208 1.00 0.00 H new ATOM 0 HE1 TYR A 392 3.814 -0.032 -9.124 1.00 0.00 H new ATOM 0 HE2 TYR A 392 3.448 3.131 -11.957 1.00 0.00 H new ATOM 0 HH TYR A 392 4.239 1.134 -12.470 1.00 0.00 H new ATOM 367 N LEU A 393 1.342 2.834 -4.808 1.00 0.00 N ATOM 368 CA LEU A 393 1.579 1.881 -3.730 1.00 0.00 C ATOM 369 C LEU A 393 0.318 1.077 -3.424 1.00 0.00 C ATOM 370 O LEU A 393 0.380 -0.128 -3.183 1.00 0.00 O ATOM 371 CB LEU A 393 2.051 2.613 -2.472 1.00 0.00 C ATOM 372 CG LEU A 393 3.279 2.004 -1.792 1.00 0.00 C ATOM 373 CD1 LEU A 393 4.550 2.686 -2.274 1.00 0.00 C ATOM 374 CD2 LEU A 393 3.157 2.109 -0.279 1.00 0.00 C ATOM 0 H LEU A 393 1.511 3.807 -4.554 1.00 0.00 H new ATOM 0 HA LEU A 393 2.356 1.189 -4.054 1.00 0.00 H new ATOM 0 HB2 LEU A 393 2.275 3.647 -2.734 1.00 0.00 H new ATOM 0 HB3 LEU A 393 1.231 2.636 -1.754 1.00 0.00 H new ATOM 0 HG LEU A 393 3.333 0.949 -2.061 1.00 0.00 H new ATOM 0 HD11 LEU A 393 5.413 2.239 -1.779 1.00 0.00 H new ATOM 0 HD12 LEU A 393 4.644 2.559 -3.352 1.00 0.00 H new ATOM 0 HD13 LEU A 393 4.505 3.749 -2.036 1.00 0.00 H new ATOM 0 HD21 LEU A 393 4.039 1.671 0.188 1.00 0.00 H new ATOM 0 HD22 LEU A 393 3.077 3.158 0.008 1.00 0.00 H new ATOM 0 HD23 LEU A 393 2.267 1.574 0.052 1.00 0.00 H new ATOM 386 N GLU A 394 -0.826 1.755 -3.434 1.00 0.00 N ATOM 387 CA GLU A 394 -2.101 1.105 -3.157 1.00 0.00 C ATOM 388 C GLU A 394 -2.379 -0.004 -4.168 1.00 0.00 C ATOM 389 O GLU A 394 -2.891 -1.065 -3.815 1.00 0.00 O ATOM 390 CB GLU A 394 -3.236 2.132 -3.184 1.00 0.00 C ATOM 391 CG GLU A 394 -4.604 1.537 -2.896 1.00 0.00 C ATOM 392 CD GLU A 394 -5.736 2.407 -3.408 1.00 0.00 C ATOM 393 OE1 GLU A 394 -5.941 2.450 -4.639 1.00 0.00 O ATOM 394 OE2 GLU A 394 -6.418 3.043 -2.578 1.00 0.00 O ATOM 0 H GLU A 394 -0.895 2.753 -3.631 1.00 0.00 H new ATOM 0 HA GLU A 394 -2.045 0.660 -2.164 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -3.027 2.911 -2.451 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -3.257 2.612 -4.162 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -4.672 0.551 -3.356 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -4.716 1.396 -1.821 1.00 0.00 H new ATOM 401 N GLN A 395 -2.039 0.252 -5.427 1.00 0.00 N ATOM 402 CA GLN A 395 -2.252 -0.724 -6.489 1.00 0.00 C ATOM 403 C GLN A 395 -1.431 -1.987 -6.248 1.00 0.00 C ATOM 404 O GLN A 395 -1.877 -3.096 -6.547 1.00 0.00 O ATOM 405 CB GLN A 395 -1.889 -0.120 -7.847 1.00 0.00 C ATOM 406 CG GLN A 395 -2.340 -0.963 -9.028 1.00 0.00 C ATOM 407 CD GLN A 395 -1.179 -1.498 -9.844 1.00 0.00 C ATOM 408 OE1 GLN A 395 -0.895 -2.696 -9.828 1.00 0.00 O ATOM 409 NE2 GLN A 395 -0.500 -0.610 -10.561 1.00 0.00 N ATOM 0 H GLN A 395 -1.615 1.127 -5.736 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.308 -0.995 -6.488 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -2.337 0.870 -7.926 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -0.808 0.014 -7.899 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -2.939 -1.798 -8.665 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -2.985 -0.364 -9.671 1.00 0.00 H new ATOM 0 HE21 GLN A 395 -0.771 0.373 -10.544 1.00 0.00 H new ATOM 0 HE22 GLN A 395 0.292 -0.911 -11.128 1.00 0.00 H new ATOM 418 N GLU A 396 -0.228 -1.813 -5.709 1.00 0.00 N ATOM 419 CA GLU A 396 0.655 -2.941 -5.433 1.00 0.00 C ATOM 420 C GLU A 396 0.089 -3.823 -4.323 1.00 0.00 C ATOM 421 O GLU A 396 0.155 -5.049 -4.399 1.00 0.00 O ATOM 422 CB GLU A 396 2.048 -2.443 -5.044 1.00 0.00 C ATOM 423 CG GLU A 396 3.174 -3.322 -5.561 1.00 0.00 C ATOM 424 CD GLU A 396 4.368 -2.519 -6.041 1.00 0.00 C ATOM 425 OE1 GLU A 396 4.195 -1.685 -6.953 1.00 0.00 O ATOM 426 OE2 GLU A 396 5.477 -2.725 -5.504 1.00 0.00 O ATOM 0 H GLU A 396 0.157 -0.903 -5.455 1.00 0.00 H new ATOM 0 HA GLU A 396 0.730 -3.538 -6.342 1.00 0.00 H new ATOM 0 HB2 GLU A 396 2.183 -1.431 -5.427 1.00 0.00 H new ATOM 0 HB3 GLU A 396 2.114 -2.384 -3.958 1.00 0.00 H new ATOM 0 HG2 GLU A 396 3.492 -4.001 -4.770 1.00 0.00 H new ATOM 0 HG3 GLU A 396 2.802 -3.938 -6.380 1.00 0.00 H new ATOM 433 N VAL A 397 -0.469 -3.192 -3.295 1.00 0.00 N ATOM 434 CA VAL A 397 -1.047 -3.924 -2.174 1.00 0.00 C ATOM 435 C VAL A 397 -2.186 -4.824 -2.640 1.00 0.00 C ATOM 436 O VAL A 397 -2.331 -5.951 -2.168 1.00 0.00 O ATOM 437 CB VAL A 397 -1.576 -2.967 -1.089 1.00 0.00 C ATOM 438 CG1 VAL A 397 -1.961 -3.740 0.164 1.00 0.00 C ATOM 439 CG2 VAL A 397 -0.541 -1.899 -0.769 1.00 0.00 C ATOM 0 H VAL A 397 -0.533 -2.177 -3.215 1.00 0.00 H new ATOM 0 HA VAL A 397 -0.251 -4.535 -1.750 1.00 0.00 H new ATOM 0 HB VAL A 397 -2.469 -2.472 -1.471 1.00 0.00 H new ATOM 0 HG11 VAL A 397 -2.332 -3.047 0.919 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -2.740 -4.463 -0.079 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -1.087 -4.264 0.551 1.00 0.00 H new ATOM 0 HG21 VAL A 397 -0.932 -1.232 -0.001 1.00 0.00 H new ATOM 0 HG22 VAL A 397 0.371 -2.373 -0.408 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -0.320 -1.325 -1.669 1.00 0.00 H new ATOM 449 N GLU A 398 -2.990 -4.324 -3.576 1.00 0.00 N ATOM 450 CA GLU A 398 -4.111 -5.091 -4.109 1.00 0.00 C ATOM 451 C GLU A 398 -3.623 -6.418 -4.680 1.00 0.00 C ATOM 452 O GLU A 398 -4.258 -7.457 -4.500 1.00 0.00 O ATOM 453 CB GLU A 398 -4.840 -4.290 -5.191 1.00 0.00 C ATOM 454 CG GLU A 398 -6.354 -4.385 -5.102 1.00 0.00 C ATOM 455 CD GLU A 398 -6.908 -5.587 -5.841 1.00 0.00 C ATOM 456 OE1 GLU A 398 -6.781 -5.631 -7.083 1.00 0.00 O ATOM 457 OE2 GLU A 398 -7.469 -6.485 -5.179 1.00 0.00 O ATOM 0 H GLU A 398 -2.886 -3.393 -3.980 1.00 0.00 H new ATOM 0 HA GLU A 398 -4.807 -5.294 -3.295 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -4.545 -3.243 -5.117 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -4.519 -4.643 -6.171 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -6.650 -4.439 -4.054 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -6.796 -3.476 -5.511 1.00 0.00 H new ATOM 464 N GLU A 399 -2.483 -6.372 -5.360 1.00 0.00 N ATOM 465 CA GLU A 399 -1.890 -7.565 -5.950 1.00 0.00 C ATOM 466 C GLU A 399 -1.202 -8.396 -4.875 1.00 0.00 C ATOM 467 O GLU A 399 -1.486 -9.581 -4.711 1.00 0.00 O ATOM 468 CB GLU A 399 -0.877 -7.172 -7.024 1.00 0.00 C ATOM 469 CG GLU A 399 -0.614 -8.270 -8.040 1.00 0.00 C ATOM 470 CD GLU A 399 0.168 -7.778 -9.241 1.00 0.00 C ATOM 471 OE1 GLU A 399 -0.432 -7.103 -10.105 1.00 0.00 O ATOM 472 OE2 GLU A 399 1.380 -8.067 -9.320 1.00 0.00 O ATOM 0 H GLU A 399 -1.949 -5.517 -5.516 1.00 0.00 H new ATOM 0 HA GLU A 399 -2.682 -8.159 -6.406 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -1.237 -6.285 -7.545 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.063 -6.900 -6.544 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -0.064 -9.080 -7.560 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -1.565 -8.685 -8.375 1.00 0.00 H new ATOM 479 N PHE A 400 -0.292 -7.741 -4.152 1.00 0.00 N ATOM 480 CA PHE A 400 0.482 -8.352 -3.070 1.00 0.00 C ATOM 481 C PHE A 400 -0.036 -9.719 -2.650 1.00 0.00 C ATOM 482 O PHE A 400 -1.099 -9.836 -2.040 1.00 0.00 O ATOM 483 CB PHE A 400 0.479 -7.431 -1.857 1.00 0.00 C ATOM 484 CG PHE A 400 1.434 -7.840 -0.782 1.00 0.00 C ATOM 485 CD1 PHE A 400 2.795 -7.829 -1.019 1.00 0.00 C ATOM 486 CD2 PHE A 400 0.974 -8.218 0.466 1.00 0.00 C ATOM 487 CE1 PHE A 400 3.686 -8.193 -0.028 1.00 0.00 C ATOM 488 CE2 PHE A 400 1.857 -8.581 1.463 1.00 0.00 C ATOM 489 CZ PHE A 400 3.216 -8.568 1.216 1.00 0.00 C ATOM 0 H PHE A 400 -0.069 -6.757 -4.304 1.00 0.00 H new ATOM 0 HA PHE A 400 1.491 -8.495 -3.456 1.00 0.00 H new ATOM 0 HB2 PHE A 400 0.724 -6.419 -2.181 1.00 0.00 H new ATOM 0 HB3 PHE A 400 -0.528 -7.398 -1.441 1.00 0.00 H new ATOM 0 HD1 PHE A 400 3.166 -7.533 -1.989 1.00 0.00 H new ATOM 0 HD2 PHE A 400 -0.088 -8.229 0.663 1.00 0.00 H new ATOM 0 HE1 PHE A 400 4.748 -8.184 -0.225 1.00 0.00 H new ATOM 0 HE2 PHE A 400 1.486 -8.875 2.434 1.00 0.00 H new ATOM 0 HZ PHE A 400 3.910 -8.850 1.994 1.00 0.00 H new ATOM 499 N VAL A 401 0.745 -10.743 -2.950 1.00 0.00 N ATOM 500 CA VAL A 401 0.394 -12.097 -2.575 1.00 0.00 C ATOM 501 C VAL A 401 1.246 -12.534 -1.389 1.00 0.00 C ATOM 502 O VAL A 401 1.483 -13.723 -1.183 1.00 0.00 O ATOM 503 CB VAL A 401 0.594 -13.081 -3.746 1.00 0.00 C ATOM 504 CG1 VAL A 401 2.057 -13.143 -4.158 1.00 0.00 C ATOM 505 CG2 VAL A 401 0.076 -14.464 -3.378 1.00 0.00 C ATOM 0 H VAL A 401 1.628 -10.659 -3.454 1.00 0.00 H new ATOM 0 HA VAL A 401 -0.661 -12.109 -2.303 1.00 0.00 H new ATOM 0 HB VAL A 401 0.020 -12.717 -4.598 1.00 0.00 H new ATOM 0 HG11 VAL A 401 2.173 -13.843 -4.985 1.00 0.00 H new ATOM 0 HG12 VAL A 401 2.389 -12.153 -4.471 1.00 0.00 H new ATOM 0 HG13 VAL A 401 2.659 -13.477 -3.313 1.00 0.00 H new ATOM 0 HG21 VAL A 401 0.226 -15.144 -4.217 1.00 0.00 H new ATOM 0 HG22 VAL A 401 0.618 -14.836 -2.508 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -0.987 -14.404 -3.145 1.00 0.00 H new ATOM 515 N GLY A 402 1.718 -11.552 -0.615 1.00 0.00 N ATOM 516 CA GLY A 402 2.547 -11.853 0.526 1.00 0.00 C ATOM 517 C GLY A 402 1.819 -12.640 1.589 1.00 0.00 C ATOM 518 O GLY A 402 0.713 -13.133 1.369 1.00 0.00 O ATOM 0 H GLY A 402 1.536 -10.560 -0.765 1.00 0.00 H new ATOM 0 HA2 GLY A 402 3.419 -12.417 0.196 1.00 0.00 H new ATOM 0 HA3 GLY A 402 2.914 -10.922 0.958 1.00 0.00 H new ATOM 522 N LYS A 403 2.450 -12.749 2.743 1.00 0.00 N ATOM 523 CA LYS A 403 1.873 -13.480 3.872 1.00 0.00 C ATOM 524 C LYS A 403 2.000 -12.687 5.166 1.00 0.00 C ATOM 525 O LYS A 403 3.000 -12.012 5.392 1.00 0.00 O ATOM 526 CB LYS A 403 2.551 -14.842 4.028 1.00 0.00 C ATOM 527 CG LYS A 403 2.013 -15.900 3.079 1.00 0.00 C ATOM 528 CD LYS A 403 2.748 -15.881 1.749 1.00 0.00 C ATOM 529 CE LYS A 403 4.056 -16.653 1.822 1.00 0.00 C ATOM 530 NZ LYS A 403 5.239 -15.751 1.752 1.00 0.00 N ATOM 0 H LYS A 403 3.366 -12.341 2.930 1.00 0.00 H new ATOM 0 HA LYS A 403 0.813 -13.629 3.665 1.00 0.00 H new ATOM 0 HB2 LYS A 403 3.622 -14.727 3.861 1.00 0.00 H new ATOM 0 HB3 LYS A 403 2.423 -15.187 5.054 1.00 0.00 H new ATOM 0 HG2 LYS A 403 2.112 -16.884 3.536 1.00 0.00 H new ATOM 0 HG3 LYS A 403 0.949 -15.732 2.910 1.00 0.00 H new ATOM 0 HD2 LYS A 403 2.113 -16.312 0.975 1.00 0.00 H new ATOM 0 HD3 LYS A 403 2.949 -14.850 1.458 1.00 0.00 H new ATOM 0 HE2 LYS A 403 4.089 -17.224 2.750 1.00 0.00 H new ATOM 0 HE3 LYS A 403 4.099 -17.372 1.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 5.714 -15.872 0.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 4.929 -14.764 1.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 5.901 -15.987 2.518 1.00 0.00 H new ATOM 544 N LYS A 404 0.987 -12.783 6.020 1.00 0.00 N ATOM 545 CA LYS A 404 0.991 -12.073 7.297 1.00 0.00 C ATOM 546 C LYS A 404 2.262 -12.355 8.099 1.00 0.00 C ATOM 547 O LYS A 404 2.651 -11.558 8.954 1.00 0.00 O ATOM 548 CB LYS A 404 -0.240 -12.459 8.120 1.00 0.00 C ATOM 549 CG LYS A 404 -0.250 -13.914 8.554 1.00 0.00 C ATOM 550 CD LYS A 404 0.574 -14.129 9.816 1.00 0.00 C ATOM 551 CE LYS A 404 -0.284 -14.619 10.974 1.00 0.00 C ATOM 552 NZ LYS A 404 -0.133 -13.758 12.179 1.00 0.00 N ATOM 0 H LYS A 404 0.152 -13.345 5.853 1.00 0.00 H new ATOM 0 HA LYS A 404 0.963 -11.005 7.079 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -0.289 -11.824 9.005 1.00 0.00 H new ATOM 0 HB3 LYS A 404 -1.136 -12.257 7.534 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -1.277 -14.234 8.730 1.00 0.00 H new ATOM 0 HG3 LYS A 404 0.145 -14.536 7.751 1.00 0.00 H new ATOM 0 HD2 LYS A 404 1.363 -14.854 9.616 1.00 0.00 H new ATOM 0 HD3 LYS A 404 1.062 -13.195 10.095 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -1.330 -14.636 10.669 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -0.007 -15.644 11.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -0.733 -14.125 12.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 0.861 -13.761 12.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -0.421 -12.785 11.949 1.00 0.00 H new ATOM 566 N THR A 405 2.900 -13.491 7.831 1.00 0.00 N ATOM 567 CA THR A 405 4.119 -13.867 8.544 1.00 0.00 C ATOM 568 C THR A 405 5.367 -13.678 7.679 1.00 0.00 C ATOM 569 O THR A 405 6.488 -13.860 8.155 1.00 0.00 O ATOM 570 CB THR A 405 4.029 -15.320 9.018 1.00 0.00 C ATOM 571 OG1 THR A 405 2.959 -15.992 8.378 1.00 0.00 O ATOM 572 CG2 THR A 405 3.824 -15.450 10.512 1.00 0.00 C ATOM 0 H THR A 405 2.596 -14.165 7.129 1.00 0.00 H new ATOM 0 HA THR A 405 4.209 -13.207 9.407 1.00 0.00 H new ATOM 0 HB THR A 405 4.988 -15.768 8.758 1.00 0.00 H new ATOM 0 HG1 THR A 405 2.920 -16.919 8.693 1.00 0.00 H new ATOM 0 HG21 THR A 405 3.769 -16.505 10.781 1.00 0.00 H new ATOM 0 HG22 THR A 405 4.659 -14.985 11.036 1.00 0.00 H new ATOM 0 HG23 THR A 405 2.896 -14.954 10.796 1.00 0.00 H new ATOM 580 N ASP A 406 5.177 -13.315 6.414 1.00 0.00 N ATOM 581 CA ASP A 406 6.302 -13.109 5.508 1.00 0.00 C ATOM 582 C ASP A 406 6.967 -11.763 5.769 1.00 0.00 C ATOM 583 O ASP A 406 6.341 -10.840 6.291 1.00 0.00 O ATOM 584 CB ASP A 406 5.837 -13.186 4.053 1.00 0.00 C ATOM 585 CG ASP A 406 6.972 -12.972 3.069 1.00 0.00 C ATOM 586 OD1 ASP A 406 8.028 -13.618 3.231 1.00 0.00 O ATOM 587 OD2 ASP A 406 6.803 -12.158 2.136 1.00 0.00 O ATOM 0 H ASP A 406 4.260 -13.158 5.995 1.00 0.00 H new ATOM 0 HA ASP A 406 7.031 -13.899 5.690 1.00 0.00 H new ATOM 0 HB2 ASP A 406 5.382 -14.159 3.871 1.00 0.00 H new ATOM 0 HB3 ASP A 406 5.065 -12.436 3.881 1.00 0.00 H new ATOM 592 N LYS A 407 8.237 -11.654 5.394 1.00 0.00 N ATOM 593 CA LYS A 407 8.979 -10.415 5.582 1.00 0.00 C ATOM 594 C LYS A 407 8.444 -9.336 4.659 1.00 0.00 C ATOM 595 O LYS A 407 8.429 -8.154 5.007 1.00 0.00 O ATOM 596 CB LYS A 407 10.470 -10.640 5.324 1.00 0.00 C ATOM 597 CG LYS A 407 11.110 -11.629 6.286 1.00 0.00 C ATOM 598 CD LYS A 407 12.613 -11.420 6.380 1.00 0.00 C ATOM 599 CE LYS A 407 13.338 -12.054 5.204 1.00 0.00 C ATOM 600 NZ LYS A 407 14.806 -12.142 5.438 1.00 0.00 N ATOM 0 H LYS A 407 8.772 -12.406 4.960 1.00 0.00 H new ATOM 0 HA LYS A 407 8.851 -10.088 6.614 1.00 0.00 H new ATOM 0 HB2 LYS A 407 10.604 -10.999 4.304 1.00 0.00 H new ATOM 0 HB3 LYS A 407 10.991 -9.685 5.397 1.00 0.00 H new ATOM 0 HG2 LYS A 407 10.663 -11.518 7.274 1.00 0.00 H new ATOM 0 HG3 LYS A 407 10.903 -12.647 5.955 1.00 0.00 H new ATOM 0 HD2 LYS A 407 12.832 -10.353 6.411 1.00 0.00 H new ATOM 0 HD3 LYS A 407 12.984 -11.849 7.311 1.00 0.00 H new ATOM 0 HE2 LYS A 407 12.938 -13.052 5.027 1.00 0.00 H new ATOM 0 HE3 LYS A 407 13.148 -11.470 4.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 15.263 -12.580 4.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 15.192 -11.187 5.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 14.989 -12.720 6.283 1.00 0.00 H new ATOM 614 N ALA A 408 7.987 -9.752 3.490 1.00 0.00 N ATOM 615 CA ALA A 408 7.427 -8.828 2.524 1.00 0.00 C ATOM 616 C ALA A 408 6.181 -8.163 3.093 1.00 0.00 C ATOM 617 O ALA A 408 5.846 -7.039 2.726 1.00 0.00 O ATOM 618 CB ALA A 408 7.102 -9.549 1.225 1.00 0.00 C ATOM 0 H ALA A 408 7.994 -10.726 3.188 1.00 0.00 H new ATOM 0 HA ALA A 408 8.166 -8.056 2.311 1.00 0.00 H new ATOM 0 HB1 ALA A 408 6.682 -8.841 0.511 1.00 0.00 H new ATOM 0 HB2 ALA A 408 8.012 -9.984 0.813 1.00 0.00 H new ATOM 0 HB3 ALA A 408 6.378 -10.340 1.419 1.00 0.00 H new ATOM 624 N TYR A 409 5.482 -8.874 3.980 1.00 0.00 N ATOM 625 CA TYR A 409 4.261 -8.347 4.577 1.00 0.00 C ATOM 626 C TYR A 409 4.530 -7.096 5.408 1.00 0.00 C ATOM 627 O TYR A 409 3.814 -6.105 5.265 1.00 0.00 O ATOM 628 CB TYR A 409 3.584 -9.422 5.427 1.00 0.00 C ATOM 629 CG TYR A 409 2.536 -8.895 6.384 1.00 0.00 C ATOM 630 CD1 TYR A 409 2.880 -8.498 7.670 1.00 0.00 C ATOM 631 CD2 TYR A 409 1.204 -8.800 6.001 1.00 0.00 C ATOM 632 CE1 TYR A 409 1.926 -8.020 8.547 1.00 0.00 C ATOM 633 CE2 TYR A 409 0.243 -8.323 6.871 1.00 0.00 C ATOM 634 CZ TYR A 409 0.609 -7.935 8.143 1.00 0.00 C ATOM 635 OH TYR A 409 -0.345 -7.459 9.014 1.00 0.00 O ATOM 0 H TYR A 409 5.741 -9.809 4.297 1.00 0.00 H new ATOM 0 HA TYR A 409 3.591 -8.060 3.766 1.00 0.00 H new ATOM 0 HB2 TYR A 409 3.119 -10.152 4.765 1.00 0.00 H new ATOM 0 HB3 TYR A 409 4.347 -9.950 5.998 1.00 0.00 H new ATOM 0 HD1 TYR A 409 3.910 -8.564 7.989 1.00 0.00 H new ATOM 0 HD2 TYR A 409 0.915 -9.104 5.006 1.00 0.00 H new ATOM 0 HE1 TYR A 409 2.209 -7.714 9.543 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.788 -8.254 6.557 1.00 0.00 H new ATOM 0 HH TYR A 409 0.065 -6.816 9.629 1.00 0.00 H new ATOM 645 N TRP A 410 5.573 -7.100 6.245 1.00 0.00 N ATOM 646 CA TRP A 410 5.865 -5.894 7.006 1.00 0.00 C ATOM 647 C TRP A 410 6.443 -4.850 6.064 1.00 0.00 C ATOM 648 O TRP A 410 6.265 -3.653 6.264 1.00 0.00 O ATOM 649 CB TRP A 410 6.774 -6.115 8.227 1.00 0.00 C ATOM 650 CG TRP A 410 7.747 -7.244 8.160 1.00 0.00 C ATOM 651 CD1 TRP A 410 7.514 -8.548 8.481 1.00 0.00 C ATOM 652 CD2 TRP A 410 9.132 -7.150 7.821 1.00 0.00 C ATOM 653 NE1 TRP A 410 8.669 -9.275 8.357 1.00 0.00 N ATOM 654 CE2 TRP A 410 9.678 -8.440 7.943 1.00 0.00 C ATOM 655 CE3 TRP A 410 9.961 -6.101 7.415 1.00 0.00 C ATOM 656 CZ2 TRP A 410 11.019 -8.708 7.678 1.00 0.00 C ATOM 657 CZ3 TRP A 410 11.291 -6.369 7.151 1.00 0.00 C ATOM 658 CH2 TRP A 410 11.809 -7.663 7.283 1.00 0.00 C ATOM 0 H TRP A 410 6.200 -7.888 6.405 1.00 0.00 H new ATOM 0 HA TRP A 410 4.924 -5.545 7.432 1.00 0.00 H new ATOM 0 HB2 TRP A 410 7.335 -5.196 8.401 1.00 0.00 H new ATOM 0 HB3 TRP A 410 6.137 -6.270 9.098 1.00 0.00 H new ATOM 0 HD1 TRP A 410 6.559 -8.949 8.788 1.00 0.00 H new ATOM 0 HE1 TRP A 410 8.764 -10.274 8.542 1.00 0.00 H new ATOM 0 HE3 TRP A 410 9.570 -5.100 7.309 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 11.421 -9.705 7.781 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 11.942 -5.566 6.837 1.00 0.00 H new ATOM 0 HH2 TRP A 410 12.853 -7.840 7.069 1.00 0.00 H new ATOM 669 N LEU A 411 7.091 -5.334 5.005 1.00 0.00 N ATOM 670 CA LEU A 411 7.654 -4.479 3.976 1.00 0.00 C ATOM 671 C LEU A 411 6.514 -3.787 3.245 1.00 0.00 C ATOM 672 O LEU A 411 6.578 -2.595 2.953 1.00 0.00 O ATOM 673 CB LEU A 411 8.476 -5.313 2.987 1.00 0.00 C ATOM 674 CG LEU A 411 9.992 -5.199 3.139 1.00 0.00 C ATOM 675 CD1 LEU A 411 10.482 -6.072 4.282 1.00 0.00 C ATOM 676 CD2 LEU A 411 10.686 -5.581 1.840 1.00 0.00 C ATOM 0 H LEU A 411 7.237 -6.330 4.842 1.00 0.00 H new ATOM 0 HA LEU A 411 8.311 -3.738 4.432 1.00 0.00 H new ATOM 0 HB2 LEU A 411 8.194 -6.360 3.098 1.00 0.00 H new ATOM 0 HB3 LEU A 411 8.206 -5.016 1.974 1.00 0.00 H new ATOM 0 HG LEU A 411 10.238 -4.163 3.370 1.00 0.00 H new ATOM 0 HD11 LEU A 411 11.564 -5.977 4.374 1.00 0.00 H new ATOM 0 HD12 LEU A 411 10.009 -5.754 5.211 1.00 0.00 H new ATOM 0 HD13 LEU A 411 10.225 -7.112 4.082 1.00 0.00 H new ATOM 0 HD21 LEU A 411 11.765 -5.494 1.965 1.00 0.00 H new ATOM 0 HD22 LEU A 411 10.432 -6.609 1.580 1.00 0.00 H new ATOM 0 HD23 LEU A 411 10.359 -4.914 1.043 1.00 0.00 H new ATOM 688 N LEU A 412 5.452 -4.553 2.976 1.00 0.00 N ATOM 689 CA LEU A 412 4.279 -4.015 2.304 1.00 0.00 C ATOM 690 C LEU A 412 3.704 -2.885 3.144 1.00 0.00 C ATOM 691 O LEU A 412 3.419 -1.795 2.646 1.00 0.00 O ATOM 692 CB LEU A 412 3.229 -5.108 2.100 1.00 0.00 C ATOM 693 CG LEU A 412 2.457 -5.021 0.782 1.00 0.00 C ATOM 694 CD1 LEU A 412 1.555 -3.797 0.772 1.00 0.00 C ATOM 695 CD2 LEU A 412 3.419 -4.984 -0.395 1.00 0.00 C ATOM 0 H LEU A 412 5.386 -5.543 3.215 1.00 0.00 H new ATOM 0 HA LEU A 412 4.567 -3.635 1.324 1.00 0.00 H new ATOM 0 HB2 LEU A 412 3.721 -6.079 2.152 1.00 0.00 H new ATOM 0 HB3 LEU A 412 2.517 -5.066 2.925 1.00 0.00 H new ATOM 0 HG LEU A 412 1.832 -5.909 0.689 1.00 0.00 H new ATOM 0 HD11 LEU A 412 1.014 -3.752 -0.173 1.00 0.00 H new ATOM 0 HD12 LEU A 412 0.843 -3.863 1.595 1.00 0.00 H new ATOM 0 HD13 LEU A 412 2.160 -2.898 0.887 1.00 0.00 H new ATOM 0 HD21 LEU A 412 2.854 -4.922 -1.325 1.00 0.00 H new ATOM 0 HD22 LEU A 412 4.069 -4.113 -0.307 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.025 -5.890 -0.398 1.00 0.00 H new ATOM 707 N GLU A 413 3.580 -3.155 4.438 1.00 0.00 N ATOM 708 CA GLU A 413 3.090 -2.177 5.397 1.00 0.00 C ATOM 709 C GLU A 413 4.132 -1.081 5.587 1.00 0.00 C ATOM 710 O GLU A 413 3.802 0.074 5.854 1.00 0.00 O ATOM 711 CB GLU A 413 2.788 -2.850 6.738 1.00 0.00 C ATOM 712 CG GLU A 413 2.242 -1.895 7.788 1.00 0.00 C ATOM 713 CD GLU A 413 3.152 -1.770 8.995 1.00 0.00 C ATOM 714 OE1 GLU A 413 3.709 -2.800 9.428 1.00 0.00 O ATOM 715 OE2 GLU A 413 3.308 -0.641 9.507 1.00 0.00 O ATOM 0 H GLU A 413 3.816 -4.058 4.850 1.00 0.00 H new ATOM 0 HA GLU A 413 2.169 -1.737 5.015 1.00 0.00 H new ATOM 0 HB2 GLU A 413 2.067 -3.652 6.579 1.00 0.00 H new ATOM 0 HB3 GLU A 413 3.700 -3.311 7.117 1.00 0.00 H new ATOM 0 HG2 GLU A 413 2.102 -0.911 7.340 1.00 0.00 H new ATOM 0 HG3 GLU A 413 1.260 -2.241 8.112 1.00 0.00 H new ATOM 722 N GLU A 414 5.398 -1.472 5.463 1.00 0.00 N ATOM 723 CA GLU A 414 6.518 -0.560 5.633 1.00 0.00 C ATOM 724 C GLU A 414 6.505 0.541 4.572 1.00 0.00 C ATOM 725 O GLU A 414 6.747 1.708 4.878 1.00 0.00 O ATOM 726 CB GLU A 414 7.833 -1.347 5.563 1.00 0.00 C ATOM 727 CG GLU A 414 8.651 -1.280 6.843 1.00 0.00 C ATOM 728 CD GLU A 414 9.428 -2.555 7.104 1.00 0.00 C ATOM 729 OE1 GLU A 414 10.032 -3.089 6.151 1.00 0.00 O ATOM 730 OE2 GLU A 414 9.432 -3.020 8.265 1.00 0.00 O ATOM 0 H GLU A 414 5.672 -2.429 5.242 1.00 0.00 H new ATOM 0 HA GLU A 414 6.429 -0.082 6.608 1.00 0.00 H new ATOM 0 HB2 GLU A 414 7.611 -2.390 5.338 1.00 0.00 H new ATOM 0 HB3 GLU A 414 8.433 -0.963 4.738 1.00 0.00 H new ATOM 0 HG2 GLU A 414 9.345 -0.442 6.783 1.00 0.00 H new ATOM 0 HG3 GLU A 414 7.987 -1.085 7.685 1.00 0.00 H new ATOM 737 N MET A 415 6.215 0.171 3.329 1.00 0.00 N ATOM 738 CA MET A 415 6.167 1.143 2.240 1.00 0.00 C ATOM 739 C MET A 415 4.970 2.070 2.401 1.00 0.00 C ATOM 740 O MET A 415 5.080 3.285 2.234 1.00 0.00 O ATOM 741 CB MET A 415 6.091 0.433 0.888 1.00 0.00 C ATOM 742 CG MET A 415 7.108 -0.682 0.733 1.00 0.00 C ATOM 743 SD MET A 415 8.607 -0.142 -0.109 1.00 0.00 S ATOM 744 CE MET A 415 9.299 -1.716 -0.613 1.00 0.00 C ATOM 0 H MET A 415 6.011 -0.789 3.050 1.00 0.00 H new ATOM 0 HA MET A 415 7.081 1.736 2.277 1.00 0.00 H new ATOM 0 HB2 MET A 415 5.090 0.022 0.758 1.00 0.00 H new ATOM 0 HB3 MET A 415 6.241 1.164 0.094 1.00 0.00 H new ATOM 0 HG2 MET A 415 7.369 -1.070 1.718 1.00 0.00 H new ATOM 0 HG3 MET A 415 6.659 -1.504 0.175 1.00 0.00 H new ATOM 0 HE1 MET A 415 10.233 -1.548 -1.149 1.00 0.00 H new ATOM 0 HE2 MET A 415 9.491 -2.328 0.268 1.00 0.00 H new ATOM 0 HE3 MET A 415 8.594 -2.231 -1.266 1.00 0.00 H new ATOM 754 N LEU A 416 3.825 1.484 2.728 1.00 0.00 N ATOM 755 CA LEU A 416 2.598 2.250 2.915 1.00 0.00 C ATOM 756 C LEU A 416 2.749 3.247 4.057 1.00 0.00 C ATOM 757 O LEU A 416 2.347 4.405 3.943 1.00 0.00 O ATOM 758 CB LEU A 416 1.424 1.315 3.201 1.00 0.00 C ATOM 759 CG LEU A 416 1.015 0.416 2.035 1.00 0.00 C ATOM 760 CD1 LEU A 416 0.634 -0.963 2.542 1.00 0.00 C ATOM 761 CD2 LEU A 416 -0.134 1.041 1.258 1.00 0.00 C ATOM 0 H LEU A 416 3.720 0.479 2.869 1.00 0.00 H new ATOM 0 HA LEU A 416 2.402 2.800 1.994 1.00 0.00 H new ATOM 0 HB2 LEU A 416 1.680 0.685 4.053 1.00 0.00 H new ATOM 0 HB3 LEU A 416 0.564 1.916 3.496 1.00 0.00 H new ATOM 0 HG LEU A 416 1.865 0.312 1.360 1.00 0.00 H new ATOM 0 HD11 LEU A 416 0.345 -1.593 1.701 1.00 0.00 H new ATOM 0 HD12 LEU A 416 1.486 -1.410 3.054 1.00 0.00 H new ATOM 0 HD13 LEU A 416 -0.203 -0.877 3.236 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -0.412 0.387 0.431 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -0.990 1.174 1.919 1.00 0.00 H new ATOM 0 HD23 LEU A 416 0.176 2.010 0.866 1.00 0.00 H new ATOM 773 N THR A 417 3.331 2.789 5.160 1.00 0.00 N ATOM 774 CA THR A 417 3.533 3.643 6.324 1.00 0.00 C ATOM 775 C THR A 417 4.456 4.808 5.986 1.00 0.00 C ATOM 776 O THR A 417 4.332 5.894 6.553 1.00 0.00 O ATOM 777 CB THR A 417 4.116 2.832 7.484 1.00 0.00 C ATOM 778 OG1 THR A 417 3.355 1.659 7.709 1.00 0.00 O ATOM 779 CG2 THR A 417 4.166 3.601 8.786 1.00 0.00 C ATOM 0 H THR A 417 3.670 1.834 5.272 1.00 0.00 H new ATOM 0 HA THR A 417 2.565 4.044 6.624 1.00 0.00 H new ATOM 0 HB THR A 417 5.135 2.590 7.183 1.00 0.00 H new ATOM 0 HG1 THR A 417 3.807 0.892 7.299 1.00 0.00 H new ATOM 0 HG21 THR A 417 4.589 2.968 9.566 1.00 0.00 H new ATOM 0 HG22 THR A 417 4.787 4.488 8.661 1.00 0.00 H new ATOM 0 HG23 THR A 417 3.157 3.901 9.070 1.00 0.00 H new ATOM 787 N LYS A 418 5.376 4.582 5.052 1.00 0.00 N ATOM 788 CA LYS A 418 6.308 5.624 4.635 1.00 0.00 C ATOM 789 C LYS A 418 5.554 6.774 3.976 1.00 0.00 C ATOM 790 O LYS A 418 5.822 7.944 4.243 1.00 0.00 O ATOM 791 CB LYS A 418 7.349 5.055 3.669 1.00 0.00 C ATOM 792 CG LYS A 418 8.612 4.560 4.358 1.00 0.00 C ATOM 793 CD LYS A 418 9.266 3.432 3.577 1.00 0.00 C ATOM 794 CE LYS A 418 10.120 2.553 4.476 1.00 0.00 C ATOM 795 NZ LYS A 418 10.151 1.140 4.005 1.00 0.00 N ATOM 0 H LYS A 418 5.495 3.690 4.572 1.00 0.00 H new ATOM 0 HA LYS A 418 6.823 6.001 5.519 1.00 0.00 H new ATOM 0 HB2 LYS A 418 6.903 4.232 3.111 1.00 0.00 H new ATOM 0 HB3 LYS A 418 7.618 5.823 2.944 1.00 0.00 H new ATOM 0 HG2 LYS A 418 9.316 5.385 4.466 1.00 0.00 H new ATOM 0 HG3 LYS A 418 8.368 4.215 5.363 1.00 0.00 H new ATOM 0 HD2 LYS A 418 8.497 2.826 3.099 1.00 0.00 H new ATOM 0 HD3 LYS A 418 9.884 3.849 2.782 1.00 0.00 H new ATOM 0 HE2 LYS A 418 11.136 2.947 4.510 1.00 0.00 H new ATOM 0 HE3 LYS A 418 9.731 2.588 5.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 10.536 0.532 4.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 9.186 0.831 3.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 10.753 1.069 3.160 1.00 0.00 H new ATOM 809 N GLU A 419 4.599 6.430 3.121 1.00 0.00 N ATOM 810 CA GLU A 419 3.792 7.433 2.437 1.00 0.00 C ATOM 811 C GLU A 419 2.813 8.069 3.415 1.00 0.00 C ATOM 812 O GLU A 419 2.542 9.268 3.357 1.00 0.00 O ATOM 813 CB GLU A 419 3.025 6.809 1.264 1.00 0.00 C ATOM 814 CG GLU A 419 3.764 5.671 0.575 1.00 0.00 C ATOM 815 CD GLU A 419 5.192 6.034 0.216 1.00 0.00 C ATOM 816 OE1 GLU A 419 6.085 5.846 1.067 1.00 0.00 O ATOM 817 OE2 GLU A 419 5.417 6.507 -0.919 1.00 0.00 O ATOM 0 H GLU A 419 4.364 5.466 2.885 1.00 0.00 H new ATOM 0 HA GLU A 419 4.459 8.200 2.044 1.00 0.00 H new ATOM 0 HB2 GLU A 419 2.066 6.439 1.627 1.00 0.00 H new ATOM 0 HB3 GLU A 419 2.810 7.586 0.530 1.00 0.00 H new ATOM 0 HG2 GLU A 419 3.768 4.798 1.228 1.00 0.00 H new ATOM 0 HG3 GLU A 419 3.226 5.389 -0.330 1.00 0.00 H new ATOM 824 N LEU A 420 2.284 7.242 4.312 1.00 0.00 N ATOM 825 CA LEU A 420 1.327 7.694 5.315 1.00 0.00 C ATOM 826 C LEU A 420 1.977 8.647 6.315 1.00 0.00 C ATOM 827 O LEU A 420 1.456 9.729 6.582 1.00 0.00 O ATOM 828 CB LEU A 420 0.731 6.481 6.044 1.00 0.00 C ATOM 829 CG LEU A 420 0.179 6.750 7.447 1.00 0.00 C ATOM 830 CD1 LEU A 420 -0.993 5.828 7.746 1.00 0.00 C ATOM 831 CD2 LEU A 420 1.272 6.581 8.491 1.00 0.00 C ATOM 0 H LEU A 420 2.505 6.248 4.364 1.00 0.00 H new ATOM 0 HA LEU A 420 0.531 8.240 4.808 1.00 0.00 H new ATOM 0 HB2 LEU A 420 -0.072 6.071 5.431 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.500 5.712 6.118 1.00 0.00 H new ATOM 0 HG LEU A 420 -0.177 7.780 7.485 1.00 0.00 H new ATOM 0 HD11 LEU A 420 -1.372 6.034 8.747 1.00 0.00 H new ATOM 0 HD12 LEU A 420 -1.785 5.998 7.016 1.00 0.00 H new ATOM 0 HD13 LEU A 420 -0.664 4.791 7.689 1.00 0.00 H new ATOM 0 HD21 LEU A 420 0.862 6.776 9.482 1.00 0.00 H new ATOM 0 HD22 LEU A 420 1.658 5.562 8.452 1.00 0.00 H new ATOM 0 HD23 LEU A 420 2.080 7.283 8.288 1.00 0.00 H new ATOM 843 N LEU A 421 3.113 8.237 6.873 1.00 0.00 N ATOM 844 CA LEU A 421 3.818 9.059 7.849 1.00 0.00 C ATOM 845 C LEU A 421 4.441 10.287 7.183 1.00 0.00 C ATOM 846 O LEU A 421 4.559 11.345 7.803 1.00 0.00 O ATOM 847 CB LEU A 421 4.859 8.216 8.618 1.00 0.00 C ATOM 848 CG LEU A 421 6.342 8.461 8.299 1.00 0.00 C ATOM 849 CD1 LEU A 421 6.620 8.238 6.823 1.00 0.00 C ATOM 850 CD2 LEU A 421 6.771 9.857 8.731 1.00 0.00 C ATOM 0 H LEU A 421 3.562 7.345 6.667 1.00 0.00 H new ATOM 0 HA LEU A 421 3.098 9.428 8.580 1.00 0.00 H new ATOM 0 HB2 LEU A 421 4.711 8.388 9.684 1.00 0.00 H new ATOM 0 HB3 LEU A 421 4.644 7.164 8.432 1.00 0.00 H new ATOM 0 HG LEU A 421 6.932 7.741 8.866 1.00 0.00 H new ATOM 0 HD11 LEU A 421 7.676 8.417 6.621 1.00 0.00 H new ATOM 0 HD12 LEU A 421 6.368 7.211 6.556 1.00 0.00 H new ATOM 0 HD13 LEU A 421 6.015 8.925 6.231 1.00 0.00 H new ATOM 0 HD21 LEU A 421 7.825 10.004 8.494 1.00 0.00 H new ATOM 0 HD22 LEU A 421 6.173 10.601 8.204 1.00 0.00 H new ATOM 0 HD23 LEU A 421 6.622 9.967 9.805 1.00 0.00 H new ATOM 862 N GLU A 422 4.838 10.144 5.922 1.00 0.00 N ATOM 863 CA GLU A 422 5.446 11.248 5.185 1.00 0.00 C ATOM 864 C GLU A 422 4.492 12.435 5.099 1.00 0.00 C ATOM 865 O GLU A 422 4.885 13.578 5.336 1.00 0.00 O ATOM 866 CB GLU A 422 5.844 10.795 3.777 1.00 0.00 C ATOM 867 CG GLU A 422 6.464 11.899 2.935 1.00 0.00 C ATOM 868 CD GLU A 422 7.890 11.588 2.522 1.00 0.00 C ATOM 869 OE1 GLU A 422 8.697 11.225 3.403 1.00 0.00 O ATOM 870 OE2 GLU A 422 8.198 11.708 1.317 1.00 0.00 O ATOM 0 H GLU A 422 4.750 9.278 5.390 1.00 0.00 H new ATOM 0 HA GLU A 422 6.340 11.561 5.724 1.00 0.00 H new ATOM 0 HB2 GLU A 422 6.551 9.969 3.856 1.00 0.00 H new ATOM 0 HB3 GLU A 422 4.962 10.411 3.265 1.00 0.00 H new ATOM 0 HG2 GLU A 422 5.857 12.054 2.043 1.00 0.00 H new ATOM 0 HG3 GLU A 422 6.448 12.832 3.498 1.00 0.00 H new ATOM 877 N LEU A 423 3.238 12.157 4.757 1.00 0.00 N ATOM 878 CA LEU A 423 2.229 13.202 4.640 1.00 0.00 C ATOM 879 C LEU A 423 1.949 13.845 5.994 1.00 0.00 C ATOM 880 O LEU A 423 1.615 15.027 6.074 1.00 0.00 O ATOM 881 CB LEU A 423 0.937 12.628 4.057 1.00 0.00 C ATOM 882 CG LEU A 423 0.845 12.663 2.531 1.00 0.00 C ATOM 883 CD1 LEU A 423 0.908 14.097 2.023 1.00 0.00 C ATOM 884 CD2 LEU A 423 1.952 11.824 1.912 1.00 0.00 C ATOM 0 H LEU A 423 2.897 11.217 4.556 1.00 0.00 H new ATOM 0 HA LEU A 423 2.614 13.969 3.968 1.00 0.00 H new ATOM 0 HB2 LEU A 423 0.834 11.595 4.389 1.00 0.00 H new ATOM 0 HB3 LEU A 423 0.093 13.181 4.470 1.00 0.00 H new ATOM 0 HG LEU A 423 -0.114 12.239 2.234 1.00 0.00 H new ATOM 0 HD11 LEU A 423 0.841 14.101 0.935 1.00 0.00 H new ATOM 0 HD12 LEU A 423 0.078 14.667 2.440 1.00 0.00 H new ATOM 0 HD13 LEU A 423 1.850 14.551 2.330 1.00 0.00 H new ATOM 0 HD21 LEU A 423 1.872 11.860 0.826 1.00 0.00 H new ATOM 0 HD22 LEU A 423 2.921 12.218 2.217 1.00 0.00 H new ATOM 0 HD23 LEU A 423 1.858 10.792 2.249 1.00 0.00 H new ATOM 896 N ASP A 424 2.086 13.058 7.056 1.00 0.00 N ATOM 897 CA ASP A 424 1.847 13.552 8.407 1.00 0.00 C ATOM 898 C ASP A 424 3.057 14.315 8.948 1.00 0.00 C ATOM 899 O ASP A 424 3.030 14.817 10.071 1.00 0.00 O ATOM 900 CB ASP A 424 1.508 12.390 9.342 1.00 0.00 C ATOM 901 CG ASP A 424 1.043 12.862 10.706 1.00 0.00 C ATOM 902 OD1 ASP A 424 0.134 13.718 10.759 1.00 0.00 O ATOM 903 OD2 ASP A 424 1.586 12.376 11.720 1.00 0.00 O ATOM 0 H ASP A 424 2.361 12.077 7.007 1.00 0.00 H new ATOM 0 HA ASP A 424 1.004 14.241 8.363 1.00 0.00 H new ATOM 0 HB2 ASP A 424 0.729 11.777 8.888 1.00 0.00 H new ATOM 0 HB3 ASP A 424 2.386 11.754 9.460 1.00 0.00 H new ATOM 908 N SER A 425 4.118 14.400 8.147 1.00 0.00 N ATOM 909 CA SER A 425 5.327 15.104 8.558 1.00 0.00 C ATOM 910 C SER A 425 5.163 16.611 8.395 1.00 0.00 C ATOM 911 O SER A 425 5.653 17.391 9.212 1.00 0.00 O ATOM 912 CB SER A 425 6.527 14.617 7.744 1.00 0.00 C ATOM 913 OG SER A 425 6.522 15.177 6.442 1.00 0.00 O ATOM 0 H SER A 425 4.163 13.991 7.214 1.00 0.00 H new ATOM 0 HA SER A 425 5.501 14.890 9.612 1.00 0.00 H new ATOM 0 HB2 SER A 425 7.451 14.887 8.256 1.00 0.00 H new ATOM 0 HB3 SER A 425 6.506 13.529 7.675 1.00 0.00 H new ATOM 0 HG SER A 425 5.733 14.863 5.954 1.00 0.00 H new ATOM 919 N VAL A 426 4.473 17.014 7.333 1.00 0.00 N ATOM 920 CA VAL A 426 4.246 18.429 7.062 1.00 0.00 C ATOM 921 C VAL A 426 3.205 19.011 8.011 1.00 0.00 C ATOM 922 O VAL A 426 2.149 18.418 8.231 1.00 0.00 O ATOM 923 CB VAL A 426 3.784 18.658 5.611 1.00 0.00 C ATOM 924 CG1 VAL A 426 4.876 18.254 4.633 1.00 0.00 C ATOM 925 CG2 VAL A 426 2.496 17.895 5.334 1.00 0.00 C ATOM 0 H VAL A 426 4.062 16.381 6.647 1.00 0.00 H new ATOM 0 HA VAL A 426 5.199 18.935 7.216 1.00 0.00 H new ATOM 0 HB VAL A 426 3.584 19.721 5.475 1.00 0.00 H new ATOM 0 HG11 VAL A 426 4.531 18.423 3.613 1.00 0.00 H new ATOM 0 HG12 VAL A 426 5.769 18.851 4.818 1.00 0.00 H new ATOM 0 HG13 VAL A 426 5.111 17.198 4.766 1.00 0.00 H new ATOM 0 HG21 VAL A 426 2.185 18.069 4.304 1.00 0.00 H new ATOM 0 HG22 VAL A 426 2.664 16.829 5.487 1.00 0.00 H new ATOM 0 HG23 VAL A 426 1.716 18.240 6.012 1.00 0.00 H new ATOM 935 N GLU A 427 3.509 20.177 8.569 1.00 0.00 N ATOM 936 CA GLU A 427 2.598 20.842 9.494 1.00 0.00 C ATOM 937 C GLU A 427 1.589 21.709 8.743 1.00 0.00 C ATOM 938 O GLU A 427 0.517 22.016 9.265 1.00 0.00 O ATOM 939 CB GLU A 427 3.386 21.697 10.489 1.00 0.00 C ATOM 940 CG GLU A 427 3.692 20.983 11.794 1.00 0.00 C ATOM 941 CD GLU A 427 2.569 21.108 12.804 1.00 0.00 C ATOM 942 OE1 GLU A 427 2.556 22.105 13.557 1.00 0.00 O ATOM 943 OE2 GLU A 427 1.702 20.210 12.843 1.00 0.00 O ATOM 0 H GLU A 427 4.379 20.682 8.397 1.00 0.00 H new ATOM 0 HA GLU A 427 2.049 20.074 10.039 1.00 0.00 H new ATOM 0 HB2 GLU A 427 4.323 22.008 10.026 1.00 0.00 H new ATOM 0 HB3 GLU A 427 2.820 22.604 10.704 1.00 0.00 H new ATOM 0 HG2 GLU A 427 3.878 19.928 11.592 1.00 0.00 H new ATOM 0 HG3 GLU A 427 4.607 21.392 12.222 1.00 0.00 H new ATOM 950 N THR A 428 1.939 22.098 7.517 1.00 0.00 N ATOM 951 CA THR A 428 1.068 22.930 6.685 1.00 0.00 C ATOM 952 C THR A 428 0.442 24.067 7.491 1.00 0.00 C ATOM 953 O THR A 428 -0.674 23.944 7.995 1.00 0.00 O ATOM 954 CB THR A 428 -0.029 22.082 6.035 1.00 0.00 C ATOM 955 OG1 THR A 428 -0.989 22.908 5.398 1.00 0.00 O ATOM 956 CG2 THR A 428 -0.768 21.191 7.011 1.00 0.00 C ATOM 0 H THR A 428 2.824 21.849 7.076 1.00 0.00 H new ATOM 0 HA THR A 428 1.687 23.370 5.903 1.00 0.00 H new ATOM 0 HB THR A 428 0.491 21.447 5.317 1.00 0.00 H new ATOM 0 HG1 THR A 428 -1.562 22.359 4.823 1.00 0.00 H new ATOM 0 HG21 THR A 428 -1.529 20.621 6.479 1.00 0.00 H new ATOM 0 HG22 THR A 428 -0.064 20.505 7.482 1.00 0.00 H new ATOM 0 HG23 THR A 428 -1.243 21.805 7.776 1.00 0.00 H new ATOM 964 N GLY A 429 1.170 25.172 7.608 1.00 0.00 N ATOM 965 CA GLY A 429 0.671 26.314 8.353 1.00 0.00 C ATOM 966 C GLY A 429 0.042 27.361 7.455 1.00 0.00 C ATOM 967 O GLY A 429 0.324 28.553 7.588 1.00 0.00 O ATOM 0 H GLY A 429 2.097 25.298 7.201 1.00 0.00 H new ATOM 0 HA2 GLY A 429 -0.065 25.975 9.082 1.00 0.00 H new ATOM 0 HA3 GLY A 429 1.490 26.765 8.913 1.00 0.00 H new ATOM 971 N GLY A 430 -0.813 26.917 6.539 1.00 0.00 N ATOM 972 CA GLY A 430 -1.470 27.837 5.630 1.00 0.00 C ATOM 973 C GLY A 430 -1.676 27.241 4.251 1.00 0.00 C ATOM 974 O GLY A 430 -1.291 27.839 3.246 1.00 0.00 O ATOM 0 H GLY A 430 -1.062 25.936 6.410 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -2.435 28.126 6.045 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -0.875 28.746 5.544 1.00 0.00 H new ATOM 978 N GLN A 431 -2.284 26.061 4.203 1.00 0.00 N ATOM 979 CA GLN A 431 -2.541 25.383 2.937 1.00 0.00 C ATOM 980 C GLN A 431 -3.570 24.271 3.114 1.00 0.00 C ATOM 981 O GLN A 431 -3.230 23.151 3.494 1.00 0.00 O ATOM 982 CB GLN A 431 -1.241 24.808 2.371 1.00 0.00 C ATOM 983 CG GLN A 431 -1.100 24.987 0.868 1.00 0.00 C ATOM 984 CD GLN A 431 0.256 25.536 0.471 1.00 0.00 C ATOM 985 OE1 GLN A 431 0.502 26.739 0.560 1.00 0.00 O ATOM 986 NE2 GLN A 431 1.145 24.655 0.029 1.00 0.00 N ATOM 0 H GLN A 431 -2.608 25.554 5.026 1.00 0.00 H new ATOM 0 HA GLN A 431 -2.942 26.114 2.236 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -0.396 25.286 2.866 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -1.190 23.745 2.608 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -1.258 24.028 0.375 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -1.879 25.661 0.511 1.00 0.00 H new ATOM 0 HE21 GLN A 431 0.899 23.667 -0.028 1.00 0.00 H new ATOM 0 HE22 GLN A 431 2.075 24.966 -0.253 1.00 0.00 H new ATOM 995 N ASP A 432 -4.830 24.589 2.835 1.00 0.00 N ATOM 996 CA ASP A 432 -5.910 23.618 2.963 1.00 0.00 C ATOM 997 C ASP A 432 -5.748 22.488 1.950 1.00 0.00 C ATOM 998 O ASP A 432 -6.092 21.339 2.228 1.00 0.00 O ATOM 999 CB ASP A 432 -7.264 24.303 2.769 1.00 0.00 C ATOM 1000 CG ASP A 432 -8.352 23.689 3.628 1.00 0.00 C ATOM 1001 OD1 ASP A 432 -8.257 23.793 4.870 1.00 0.00 O ATOM 1002 OD2 ASP A 432 -9.297 23.104 3.061 1.00 0.00 O ATOM 0 H ASP A 432 -5.128 25.512 2.519 1.00 0.00 H new ATOM 0 HA ASP A 432 -5.866 23.192 3.965 1.00 0.00 H new ATOM 0 HB2 ASP A 432 -7.170 25.362 3.009 1.00 0.00 H new ATOM 0 HB3 ASP A 432 -7.554 24.239 1.720 1.00 0.00 H new ATOM 1007 N SER A 433 -5.223 22.822 0.777 1.00 0.00 N ATOM 1008 CA SER A 433 -5.014 21.836 -0.277 1.00 0.00 C ATOM 1009 C SER A 433 -4.091 20.719 0.199 1.00 0.00 C ATOM 1010 O SER A 433 -4.283 19.553 -0.146 1.00 0.00 O ATOM 1011 CB SER A 433 -4.428 22.505 -1.522 1.00 0.00 C ATOM 1012 OG SER A 433 -4.037 21.538 -2.483 1.00 0.00 O ATOM 0 H SER A 433 -4.934 23.769 0.531 1.00 0.00 H new ATOM 0 HA SER A 433 -5.981 21.400 -0.530 1.00 0.00 H new ATOM 0 HB2 SER A 433 -5.166 23.179 -1.958 1.00 0.00 H new ATOM 0 HB3 SER A 433 -3.568 23.113 -1.242 1.00 0.00 H new ATOM 0 HG SER A 433 -4.274 21.854 -3.380 1.00 0.00 H new ATOM 1018 N VAL A 434 -3.088 21.084 0.991 1.00 0.00 N ATOM 1019 CA VAL A 434 -2.136 20.113 1.514 1.00 0.00 C ATOM 1020 C VAL A 434 -2.760 19.277 2.626 1.00 0.00 C ATOM 1021 O VAL A 434 -2.562 18.065 2.691 1.00 0.00 O ATOM 1022 CB VAL A 434 -0.867 20.802 2.053 1.00 0.00 C ATOM 1023 CG1 VAL A 434 0.175 19.768 2.455 1.00 0.00 C ATOM 1024 CG2 VAL A 434 -0.301 21.765 1.020 1.00 0.00 C ATOM 0 H VAL A 434 -2.914 22.045 1.284 1.00 0.00 H new ATOM 0 HA VAL A 434 -1.860 19.462 0.684 1.00 0.00 H new ATOM 0 HB VAL A 434 -1.138 21.375 2.940 1.00 0.00 H new ATOM 0 HG11 VAL A 434 1.063 20.274 2.833 1.00 0.00 H new ATOM 0 HG12 VAL A 434 -0.234 19.123 3.233 1.00 0.00 H new ATOM 0 HG13 VAL A 434 0.443 19.165 1.587 1.00 0.00 H new ATOM 0 HG21 VAL A 434 0.594 22.242 1.419 1.00 0.00 H new ATOM 0 HG22 VAL A 434 -0.047 21.217 0.113 1.00 0.00 H new ATOM 0 HG23 VAL A 434 -1.045 22.527 0.787 1.00 0.00 H new ATOM 1034 N ARG A 435 -3.515 19.936 3.500 1.00 0.00 N ATOM 1035 CA ARG A 435 -4.169 19.255 4.611 1.00 0.00 C ATOM 1036 C ARG A 435 -5.120 18.175 4.105 1.00 0.00 C ATOM 1037 O ARG A 435 -5.147 17.063 4.631 1.00 0.00 O ATOM 1038 CB ARG A 435 -4.932 20.264 5.472 1.00 0.00 C ATOM 1039 CG ARG A 435 -4.658 20.123 6.961 1.00 0.00 C ATOM 1040 CD ARG A 435 -5.037 21.385 7.720 1.00 0.00 C ATOM 1041 NE ARG A 435 -5.872 21.093 8.883 1.00 0.00 N ATOM 1042 CZ ARG A 435 -6.627 21.999 9.499 1.00 0.00 C ATOM 1043 NH1 ARG A 435 -6.656 23.254 9.069 1.00 0.00 N ATOM 1044 NH2 ARG A 435 -7.357 21.648 10.550 1.00 0.00 N ATOM 0 H ARG A 435 -3.689 20.940 3.460 1.00 0.00 H new ATOM 0 HA ARG A 435 -3.400 18.777 5.218 1.00 0.00 H new ATOM 0 HB2 ARG A 435 -4.667 21.273 5.156 1.00 0.00 H new ATOM 0 HB3 ARG A 435 -6.001 20.145 5.295 1.00 0.00 H new ATOM 0 HG2 ARG A 435 -5.220 19.277 7.357 1.00 0.00 H new ATOM 0 HG3 ARG A 435 -3.602 19.906 7.119 1.00 0.00 H new ATOM 0 HD2 ARG A 435 -4.132 21.900 8.043 1.00 0.00 H new ATOM 0 HD3 ARG A 435 -5.569 22.064 7.053 1.00 0.00 H new ATOM 0 HE ARG A 435 -5.876 20.139 9.244 1.00 0.00 H new ATOM 0 HH11 ARG A 435 -6.097 23.529 8.261 1.00 0.00 H new ATOM 0 HH12 ARG A 435 -7.237 23.943 9.546 1.00 0.00 H new ATOM 0 HH21 ARG A 435 -7.339 20.685 10.885 1.00 0.00 H new ATOM 0 HH22 ARG A 435 -7.936 22.342 11.023 1.00 0.00 H new ATOM 1058 N GLN A 436 -5.898 18.510 3.082 1.00 0.00 N ATOM 1059 CA GLN A 436 -6.852 17.571 2.505 1.00 0.00 C ATOM 1060 C GLN A 436 -6.134 16.418 1.810 1.00 0.00 C ATOM 1061 O GLN A 436 -6.601 15.280 1.834 1.00 0.00 O ATOM 1062 CB GLN A 436 -7.767 18.289 1.513 1.00 0.00 C ATOM 1063 CG GLN A 436 -8.914 17.429 1.008 1.00 0.00 C ATOM 1064 CD GLN A 436 -9.235 17.682 -0.452 1.00 0.00 C ATOM 1065 OE1 GLN A 436 -8.805 16.937 -1.332 1.00 0.00 O ATOM 1066 NE2 GLN A 436 -9.994 18.740 -0.717 1.00 0.00 N ATOM 0 H GLN A 436 -5.886 19.427 2.635 1.00 0.00 H new ATOM 0 HA GLN A 436 -7.454 17.161 3.316 1.00 0.00 H new ATOM 0 HB2 GLN A 436 -8.175 19.181 1.988 1.00 0.00 H new ATOM 0 HB3 GLN A 436 -7.174 18.624 0.662 1.00 0.00 H new ATOM 0 HG2 GLN A 436 -8.661 16.377 1.143 1.00 0.00 H new ATOM 0 HG3 GLN A 436 -9.801 17.624 1.610 1.00 0.00 H new ATOM 0 HE21 GLN A 436 -10.329 19.331 0.044 1.00 0.00 H new ATOM 0 HE22 GLN A 436 -10.242 18.961 -1.681 1.00 0.00 H new ATOM 1075 N ALA A 437 -4.999 16.721 1.187 1.00 0.00 N ATOM 1076 CA ALA A 437 -4.221 15.709 0.481 1.00 0.00 C ATOM 1077 C ALA A 437 -3.507 14.775 1.453 1.00 0.00 C ATOM 1078 O ALA A 437 -3.515 13.557 1.274 1.00 0.00 O ATOM 1079 CB ALA A 437 -3.217 16.372 -0.448 1.00 0.00 C ATOM 0 H ALA A 437 -4.598 17.658 1.157 1.00 0.00 H new ATOM 0 HA ALA A 437 -4.912 15.108 -0.111 1.00 0.00 H new ATOM 0 HB1 ALA A 437 -2.643 15.606 -0.969 1.00 0.00 H new ATOM 0 HB2 ALA A 437 -3.746 16.987 -1.176 1.00 0.00 H new ATOM 0 HB3 ALA A 437 -2.542 16.999 0.134 1.00 0.00 H new ATOM 1085 N ARG A 438 -2.887 15.350 2.480 1.00 0.00 N ATOM 1086 CA ARG A 438 -2.167 14.560 3.471 1.00 0.00 C ATOM 1087 C ARG A 438 -3.125 13.685 4.271 1.00 0.00 C ATOM 1088 O ARG A 438 -2.823 12.530 4.570 1.00 0.00 O ATOM 1089 CB ARG A 438 -1.378 15.474 4.413 1.00 0.00 C ATOM 1090 CG ARG A 438 -2.256 16.385 5.255 1.00 0.00 C ATOM 1091 CD ARG A 438 -1.421 17.346 6.089 1.00 0.00 C ATOM 1092 NE ARG A 438 -1.765 17.275 7.509 1.00 0.00 N ATOM 1093 CZ ARG A 438 -0.935 16.850 8.462 1.00 0.00 C ATOM 1094 NH1 ARG A 438 0.295 16.451 8.162 1.00 0.00 N ATOM 1095 NH2 ARG A 438 -1.341 16.822 9.724 1.00 0.00 N ATOM 0 H ARG A 438 -2.869 16.356 2.646 1.00 0.00 H new ATOM 0 HA ARG A 438 -1.469 13.911 2.942 1.00 0.00 H new ATOM 0 HB2 ARG A 438 -0.767 14.860 5.074 1.00 0.00 H new ATOM 0 HB3 ARG A 438 -0.694 16.085 3.824 1.00 0.00 H new ATOM 0 HG2 ARG A 438 -2.924 16.951 4.606 1.00 0.00 H new ATOM 0 HG3 ARG A 438 -2.884 15.783 5.911 1.00 0.00 H new ATOM 0 HD2 ARG A 438 -0.364 17.115 5.959 1.00 0.00 H new ATOM 0 HD3 ARG A 438 -1.571 18.364 5.729 1.00 0.00 H new ATOM 0 HE ARG A 438 -2.701 17.570 7.788 1.00 0.00 H new ATOM 0 HH11 ARG A 438 0.614 16.467 7.193 1.00 0.00 H new ATOM 0 HH12 ARG A 438 0.921 16.128 8.900 1.00 0.00 H new ATOM 0 HH21 ARG A 438 -2.285 17.125 9.963 1.00 0.00 H new ATOM 0 HH22 ARG A 438 -0.709 16.498 10.456 1.00 0.00 H new ATOM 1109 N LYS A 439 -4.283 14.239 4.613 1.00 0.00 N ATOM 1110 CA LYS A 439 -5.284 13.502 5.374 1.00 0.00 C ATOM 1111 C LYS A 439 -5.838 12.341 4.554 1.00 0.00 C ATOM 1112 O LYS A 439 -6.127 11.272 5.090 1.00 0.00 O ATOM 1113 CB LYS A 439 -6.422 14.431 5.799 1.00 0.00 C ATOM 1114 CG LYS A 439 -7.034 14.068 7.143 1.00 0.00 C ATOM 1115 CD LYS A 439 -8.358 13.340 6.975 1.00 0.00 C ATOM 1116 CE LYS A 439 -9.344 13.717 8.069 1.00 0.00 C ATOM 1117 NZ LYS A 439 -10.220 12.574 8.447 1.00 0.00 N ATOM 0 H LYS A 439 -4.551 15.194 4.376 1.00 0.00 H new ATOM 0 HA LYS A 439 -4.804 13.100 6.266 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -6.048 15.454 5.844 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -7.201 14.410 5.037 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -6.341 13.439 7.702 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -7.188 14.973 7.730 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -8.785 13.579 6.001 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -8.187 12.264 6.993 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -8.797 14.061 8.947 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -9.960 14.550 7.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -10.877 12.873 9.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -10.761 12.262 7.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -9.634 11.788 8.794 1.00 0.00 H new ATOM 1131 N GLU A 440 -5.978 12.560 3.251 1.00 0.00 N ATOM 1132 CA GLU A 440 -6.492 11.532 2.355 1.00 0.00 C ATOM 1133 C GLU A 440 -5.452 10.439 2.131 1.00 0.00 C ATOM 1134 O GLU A 440 -5.775 9.250 2.137 1.00 0.00 O ATOM 1135 CB GLU A 440 -6.900 12.152 1.015 1.00 0.00 C ATOM 1136 CG GLU A 440 -8.369 11.958 0.677 1.00 0.00 C ATOM 1137 CD GLU A 440 -9.287 12.695 1.632 1.00 0.00 C ATOM 1138 OE1 GLU A 440 -9.649 12.112 2.676 1.00 0.00 O ATOM 1139 OE2 GLU A 440 -9.645 13.855 1.337 1.00 0.00 O ATOM 0 H GLU A 440 -5.743 13.440 2.792 1.00 0.00 H new ATOM 0 HA GLU A 440 -7.370 11.082 2.820 1.00 0.00 H new ATOM 0 HB2 GLU A 440 -6.678 13.219 1.035 1.00 0.00 H new ATOM 0 HB3 GLU A 440 -6.293 11.715 0.222 1.00 0.00 H new ATOM 0 HG2 GLU A 440 -8.553 12.305 -0.340 1.00 0.00 H new ATOM 0 HG3 GLU A 440 -8.606 10.894 0.699 1.00 0.00 H new ATOM 1146 N ALA A 441 -4.203 10.848 1.935 1.00 0.00 N ATOM 1147 CA ALA A 441 -3.117 9.903 1.710 1.00 0.00 C ATOM 1148 C ALA A 441 -2.929 8.989 2.915 1.00 0.00 C ATOM 1149 O ALA A 441 -2.788 7.776 2.769 1.00 0.00 O ATOM 1150 CB ALA A 441 -1.825 10.645 1.397 1.00 0.00 C ATOM 0 H ALA A 441 -3.918 11.827 1.928 1.00 0.00 H new ATOM 0 HA ALA A 441 -3.380 9.282 0.854 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -1.023 9.925 1.231 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -1.961 11.250 0.500 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -1.565 11.292 2.235 1.00 0.00 H new ATOM 1156 N VAL A 442 -2.931 9.577 4.107 1.00 0.00 N ATOM 1157 CA VAL A 442 -2.764 8.810 5.335 1.00 0.00 C ATOM 1158 C VAL A 442 -3.940 7.862 5.546 1.00 0.00 C ATOM 1159 O VAL A 442 -3.757 6.686 5.863 1.00 0.00 O ATOM 1160 CB VAL A 442 -2.636 9.734 6.561 1.00 0.00 C ATOM 1161 CG1 VAL A 442 -2.361 8.926 7.823 1.00 0.00 C ATOM 1162 CG2 VAL A 442 -1.548 10.773 6.334 1.00 0.00 C ATOM 0 H VAL A 442 -3.046 10.581 4.248 1.00 0.00 H new ATOM 0 HA VAL A 442 -1.845 8.233 5.230 1.00 0.00 H new ATOM 0 HB VAL A 442 -3.583 10.255 6.697 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -2.275 9.600 8.675 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -3.181 8.228 7.994 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.431 8.371 7.704 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -1.471 11.417 7.210 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -0.595 10.271 6.168 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -1.797 11.376 5.461 1.00 0.00 H new ATOM 1172 N CYS A 443 -5.150 8.381 5.362 1.00 0.00 N ATOM 1173 CA CYS A 443 -6.358 7.582 5.526 1.00 0.00 C ATOM 1174 C CYS A 443 -6.379 6.433 4.524 1.00 0.00 C ATOM 1175 O CYS A 443 -6.853 5.338 4.826 1.00 0.00 O ATOM 1176 CB CYS A 443 -7.603 8.453 5.349 1.00 0.00 C ATOM 1177 SG CYS A 443 -8.103 9.336 6.845 1.00 0.00 S ATOM 0 H CYS A 443 -5.319 9.352 5.099 1.00 0.00 H new ATOM 0 HA CYS A 443 -6.359 7.168 6.534 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -7.417 9.178 4.557 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -8.429 7.824 5.018 1.00 0.00 H new ATOM 0 HG CYS A 443 -9.163 10.047 6.596 1.00 0.00 H new ATOM 1183 N LYS A 444 -5.855 6.690 3.331 1.00 0.00 N ATOM 1184 CA LYS A 444 -5.806 5.677 2.287 1.00 0.00 C ATOM 1185 C LYS A 444 -4.932 4.507 2.723 1.00 0.00 C ATOM 1186 O LYS A 444 -5.238 3.350 2.442 1.00 0.00 O ATOM 1187 CB LYS A 444 -5.273 6.279 0.984 1.00 0.00 C ATOM 1188 CG LYS A 444 -6.183 6.045 -0.211 1.00 0.00 C ATOM 1189 CD LYS A 444 -7.049 7.262 -0.498 1.00 0.00 C ATOM 1190 CE LYS A 444 -8.214 6.917 -1.413 1.00 0.00 C ATOM 1191 NZ LYS A 444 -8.105 7.599 -2.732 1.00 0.00 N ATOM 0 H LYS A 444 -5.459 7.591 3.064 1.00 0.00 H new ATOM 0 HA LYS A 444 -6.818 5.311 2.113 1.00 0.00 H new ATOM 0 HB2 LYS A 444 -5.133 7.352 1.119 1.00 0.00 H new ATOM 0 HB3 LYS A 444 -4.292 5.854 0.772 1.00 0.00 H new ATOM 0 HG2 LYS A 444 -5.580 5.811 -1.088 1.00 0.00 H new ATOM 0 HG3 LYS A 444 -6.819 5.181 -0.021 1.00 0.00 H new ATOM 0 HD2 LYS A 444 -7.430 7.668 0.439 1.00 0.00 H new ATOM 0 HD3 LYS A 444 -6.442 8.041 -0.959 1.00 0.00 H new ATOM 0 HE2 LYS A 444 -8.250 5.838 -1.564 1.00 0.00 H new ATOM 0 HE3 LYS A 444 -9.150 7.203 -0.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 -8.918 7.338 -3.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 -8.096 8.629 -2.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 -7.225 7.307 -3.202 1.00 0.00 H new ATOM 1205 N ILE A 445 -3.842 4.820 3.417 1.00 0.00 N ATOM 1206 CA ILE A 445 -2.920 3.799 3.899 1.00 0.00 C ATOM 1207 C ILE A 445 -3.583 2.936 4.967 1.00 0.00 C ATOM 1208 O ILE A 445 -3.281 1.751 5.102 1.00 0.00 O ATOM 1209 CB ILE A 445 -1.622 4.435 4.457 1.00 0.00 C ATOM 1210 CG1 ILE A 445 -0.591 4.619 3.340 1.00 0.00 C ATOM 1211 CG2 ILE A 445 -1.029 3.592 5.581 1.00 0.00 C ATOM 1212 CD1 ILE A 445 -1.117 5.371 2.136 1.00 0.00 C ATOM 0 H ILE A 445 -3.576 5.775 3.658 1.00 0.00 H new ATOM 0 HA ILE A 445 -2.654 3.167 3.052 1.00 0.00 H new ATOM 0 HB ILE A 445 -1.882 5.412 4.865 1.00 0.00 H new ATOM 0 HG12 ILE A 445 0.272 5.152 3.740 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -0.240 3.639 3.018 1.00 0.00 H new ATOM 0 HG21 ILE A 445 -0.120 4.066 5.950 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -1.751 3.509 6.394 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -0.792 2.597 5.204 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -0.328 5.460 1.389 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -1.961 4.829 1.709 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -1.441 6.366 2.442 1.00 0.00 H new ATOM 1224 N GLN A 446 -4.488 3.542 5.719 1.00 0.00 N ATOM 1225 CA GLN A 446 -5.201 2.848 6.772 1.00 0.00 C ATOM 1226 C GLN A 446 -6.052 1.720 6.195 1.00 0.00 C ATOM 1227 O GLN A 446 -6.049 0.601 6.710 1.00 0.00 O ATOM 1228 CB GLN A 446 -6.069 3.854 7.517 1.00 0.00 C ATOM 1229 CG GLN A 446 -6.986 3.239 8.545 1.00 0.00 C ATOM 1230 CD GLN A 446 -6.256 2.816 9.805 1.00 0.00 C ATOM 1231 OE1 GLN A 446 -6.392 1.681 10.263 1.00 0.00 O ATOM 1232 NE2 GLN A 446 -5.473 3.727 10.373 1.00 0.00 N ATOM 0 H GLN A 446 -4.746 4.523 5.615 1.00 0.00 H new ATOM 0 HA GLN A 446 -4.488 2.399 7.463 1.00 0.00 H new ATOM 0 HB2 GLN A 446 -5.422 4.579 8.011 1.00 0.00 H new ATOM 0 HB3 GLN A 446 -6.670 4.404 6.793 1.00 0.00 H new ATOM 0 HG2 GLN A 446 -7.765 3.955 8.805 1.00 0.00 H new ATOM 0 HG3 GLN A 446 -7.483 2.372 8.110 1.00 0.00 H new ATOM 0 HE21 GLN A 446 -5.389 4.656 9.960 1.00 0.00 H new ATOM 0 HE22 GLN A 446 -4.956 3.497 11.222 1.00 0.00 H new ATOM 1241 N ALA A 447 -6.773 2.021 5.120 1.00 0.00 N ATOM 1242 CA ALA A 447 -7.623 1.029 4.470 1.00 0.00 C ATOM 1243 C ALA A 447 -6.784 -0.079 3.845 1.00 0.00 C ATOM 1244 O ALA A 447 -7.162 -1.250 3.872 1.00 0.00 O ATOM 1245 CB ALA A 447 -8.497 1.694 3.416 1.00 0.00 C ATOM 0 H ALA A 447 -6.786 2.942 4.681 1.00 0.00 H new ATOM 0 HA ALA A 447 -8.267 0.580 5.227 1.00 0.00 H new ATOM 0 HB1 ALA A 447 -9.126 0.943 2.939 1.00 0.00 H new ATOM 0 HB2 ALA A 447 -9.127 2.448 3.888 1.00 0.00 H new ATOM 0 HB3 ALA A 447 -7.865 2.168 2.665 1.00 0.00 H new ATOM 1251 N ILE A 448 -5.639 0.300 3.286 1.00 0.00 N ATOM 1252 CA ILE A 448 -4.735 -0.656 2.657 1.00 0.00 C ATOM 1253 C ILE A 448 -4.072 -1.541 3.702 1.00 0.00 C ATOM 1254 O ILE A 448 -3.837 -2.726 3.471 1.00 0.00 O ATOM 1255 CB ILE A 448 -3.641 0.053 1.836 1.00 0.00 C ATOM 1256 CG1 ILE A 448 -4.267 1.092 0.910 1.00 0.00 C ATOM 1257 CG2 ILE A 448 -2.834 -0.960 1.038 1.00 0.00 C ATOM 1258 CD1 ILE A 448 -3.348 2.250 0.589 1.00 0.00 C ATOM 0 H ILE A 448 -5.315 1.267 3.256 1.00 0.00 H new ATOM 0 HA ILE A 448 -5.338 -1.268 1.986 1.00 0.00 H new ATOM 0 HB ILE A 448 -2.965 0.563 2.522 1.00 0.00 H new ATOM 0 HG12 ILE A 448 -4.564 0.606 -0.020 1.00 0.00 H new ATOM 0 HG13 ILE A 448 -5.176 1.478 1.372 1.00 0.00 H new ATOM 0 HG21 ILE A 448 -2.066 -0.442 0.464 1.00 0.00 H new ATOM 0 HG22 ILE A 448 -2.362 -1.668 1.720 1.00 0.00 H new ATOM 0 HG23 ILE A 448 -3.495 -1.497 0.358 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -3.860 2.948 -0.073 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -3.071 2.761 1.511 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -2.450 1.876 0.098 1.00 0.00 H new ATOM 1270 N LEU A 449 -3.767 -0.949 4.850 1.00 0.00 N ATOM 1271 CA LEU A 449 -3.123 -1.677 5.938 1.00 0.00 C ATOM 1272 C LEU A 449 -3.961 -2.884 6.347 1.00 0.00 C ATOM 1273 O LEU A 449 -3.453 -4.002 6.435 1.00 0.00 O ATOM 1274 CB LEU A 449 -2.911 -0.756 7.140 1.00 0.00 C ATOM 1275 CG LEU A 449 -1.695 0.167 7.041 1.00 0.00 C ATOM 1276 CD1 LEU A 449 -1.836 1.338 8.000 1.00 0.00 C ATOM 1277 CD2 LEU A 449 -0.417 -0.606 7.324 1.00 0.00 C ATOM 0 H LEU A 449 -3.955 0.033 5.052 1.00 0.00 H new ATOM 0 HA LEU A 449 -2.153 -2.030 5.587 1.00 0.00 H new ATOM 0 HB2 LEU A 449 -3.803 -0.144 7.271 1.00 0.00 H new ATOM 0 HB3 LEU A 449 -2.811 -1.369 8.035 1.00 0.00 H new ATOM 0 HG LEU A 449 -1.641 0.560 6.026 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -0.962 1.984 7.916 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -2.732 1.906 7.751 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -1.915 0.965 9.021 1.00 0.00 H new ATOM 0 HD21 LEU A 449 0.438 0.065 7.249 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -0.461 -1.027 8.328 1.00 0.00 H new ATOM 0 HD23 LEU A 449 -0.310 -1.411 6.597 1.00 0.00 H new ATOM 1289 N GLU A 450 -5.248 -2.658 6.585 1.00 0.00 N ATOM 1290 CA GLU A 450 -6.146 -3.739 6.968 1.00 0.00 C ATOM 1291 C GLU A 450 -6.365 -4.678 5.793 1.00 0.00 C ATOM 1292 O GLU A 450 -6.352 -5.898 5.950 1.00 0.00 O ATOM 1293 CB GLU A 450 -7.484 -3.182 7.459 1.00 0.00 C ATOM 1294 CG GLU A 450 -8.211 -2.340 6.424 1.00 0.00 C ATOM 1295 CD GLU A 450 -9.472 -1.702 6.973 1.00 0.00 C ATOM 1296 OE1 GLU A 450 -9.525 -1.446 8.194 1.00 0.00 O ATOM 1297 OE2 GLU A 450 -10.406 -1.456 6.182 1.00 0.00 O ATOM 0 H GLU A 450 -5.690 -1.741 6.520 1.00 0.00 H new ATOM 0 HA GLU A 450 -5.687 -4.297 7.784 1.00 0.00 H new ATOM 0 HB2 GLU A 450 -8.126 -4.011 7.756 1.00 0.00 H new ATOM 0 HB3 GLU A 450 -7.311 -2.578 8.350 1.00 0.00 H new ATOM 0 HG2 GLU A 450 -7.542 -1.560 6.061 1.00 0.00 H new ATOM 0 HG3 GLU A 450 -8.467 -2.964 5.568 1.00 0.00 H new ATOM 1304 N LYS A 451 -6.537 -4.103 4.606 1.00 0.00 N ATOM 1305 CA LYS A 451 -6.724 -4.899 3.402 1.00 0.00 C ATOM 1306 C LYS A 451 -5.531 -5.829 3.215 1.00 0.00 C ATOM 1307 O LYS A 451 -5.657 -6.926 2.672 1.00 0.00 O ATOM 1308 CB LYS A 451 -6.888 -3.994 2.177 1.00 0.00 C ATOM 1309 CG LYS A 451 -8.229 -4.151 1.480 1.00 0.00 C ATOM 1310 CD LYS A 451 -8.247 -3.431 0.141 1.00 0.00 C ATOM 1311 CE LYS A 451 -8.076 -1.929 0.313 1.00 0.00 C ATOM 1312 NZ LYS A 451 -9.005 -1.162 -0.562 1.00 0.00 N ATOM 0 H LYS A 451 -6.550 -3.094 4.455 1.00 0.00 H new ATOM 0 HA LYS A 451 -7.631 -5.494 3.509 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -6.767 -2.955 2.484 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -6.091 -4.211 1.466 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -8.440 -5.210 1.328 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -9.020 -3.756 2.117 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -7.449 -3.819 -0.493 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -9.188 -3.635 -0.370 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -8.253 -1.660 1.354 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -7.047 -1.652 0.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -8.858 -0.143 -0.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -8.820 -1.399 -1.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -9.987 -1.407 -0.325 1.00 0.00 H new ATOM 1326 N LEU A 452 -4.371 -5.376 3.690 1.00 0.00 N ATOM 1327 CA LEU A 452 -3.148 -6.155 3.601 1.00 0.00 C ATOM 1328 C LEU A 452 -3.204 -7.339 4.558 1.00 0.00 C ATOM 1329 O LEU A 452 -2.722 -8.427 4.242 1.00 0.00 O ATOM 1330 CB LEU A 452 -1.937 -5.278 3.924 1.00 0.00 C ATOM 1331 CG LEU A 452 -0.589 -5.992 3.862 1.00 0.00 C ATOM 1332 CD1 LEU A 452 -0.078 -6.044 2.431 1.00 0.00 C ATOM 1333 CD2 LEU A 452 0.422 -5.302 4.767 1.00 0.00 C ATOM 0 H LEU A 452 -4.258 -4.468 4.142 1.00 0.00 H new ATOM 0 HA LEU A 452 -3.050 -6.531 2.583 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -1.919 -4.439 3.229 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -2.065 -4.861 4.923 1.00 0.00 H new ATOM 0 HG LEU A 452 -0.724 -7.014 4.215 1.00 0.00 H new ATOM 0 HD11 LEU A 452 0.884 -6.556 2.406 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -0.792 -6.583 1.809 1.00 0.00 H new ATOM 0 HD13 LEU A 452 0.042 -5.030 2.050 1.00 0.00 H new ATOM 0 HD21 LEU A 452 1.377 -5.824 4.710 1.00 0.00 H new ATOM 0 HD22 LEU A 452 0.554 -4.269 4.445 1.00 0.00 H new ATOM 0 HD23 LEU A 452 0.060 -5.318 5.795 1.00 0.00 H new ATOM 1345 N GLU A 453 -3.807 -7.127 5.728 1.00 0.00 N ATOM 1346 CA GLU A 453 -3.932 -8.189 6.720 1.00 0.00 C ATOM 1347 C GLU A 453 -4.639 -9.401 6.122 1.00 0.00 C ATOM 1348 O GLU A 453 -4.387 -10.539 6.518 1.00 0.00 O ATOM 1349 CB GLU A 453 -4.698 -7.686 7.946 1.00 0.00 C ATOM 1350 CG GLU A 453 -4.024 -6.519 8.647 1.00 0.00 C ATOM 1351 CD GLU A 453 -4.541 -6.309 10.058 1.00 0.00 C ATOM 1352 OE1 GLU A 453 -5.777 -6.265 10.235 1.00 0.00 O ATOM 1353 OE2 GLU A 453 -3.711 -6.191 10.983 1.00 0.00 O ATOM 0 H GLU A 453 -4.213 -6.235 6.009 1.00 0.00 H new ATOM 0 HA GLU A 453 -2.930 -8.488 7.029 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -5.700 -7.386 7.640 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -4.814 -8.507 8.654 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -2.948 -6.692 8.680 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -4.183 -5.610 8.067 1.00 0.00 H new ATOM 1360 N LYS A 454 -5.521 -9.146 5.160 1.00 0.00 N ATOM 1361 CA LYS A 454 -6.262 -10.213 4.498 1.00 0.00 C ATOM 1362 C LYS A 454 -5.504 -10.725 3.274 1.00 0.00 C ATOM 1363 O LYS A 454 -5.786 -11.813 2.770 1.00 0.00 O ATOM 1364 CB LYS A 454 -7.648 -9.718 4.083 1.00 0.00 C ATOM 1365 CG LYS A 454 -8.478 -9.190 5.243 1.00 0.00 C ATOM 1366 CD LYS A 454 -8.722 -10.264 6.290 1.00 0.00 C ATOM 1367 CE LYS A 454 -7.655 -10.240 7.373 1.00 0.00 C ATOM 1368 NZ LYS A 454 -8.227 -10.511 8.721 1.00 0.00 N ATOM 0 H LYS A 454 -5.740 -8.209 4.822 1.00 0.00 H new ATOM 0 HA LYS A 454 -6.374 -11.036 5.204 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -7.535 -8.929 3.339 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -8.188 -10.534 3.603 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -7.967 -8.343 5.701 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -9.433 -8.821 4.870 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -9.703 -10.117 6.741 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -8.734 -11.243 5.812 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -6.891 -10.984 7.147 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -7.163 -9.268 7.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -7.468 -10.486 9.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -8.938 -9.787 8.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -8.675 -11.450 8.726 1.00 0.00 H new ATOM 1382 N LYS A 455 -4.538 -9.940 2.804 1.00 0.00 N ATOM 1383 CA LYS A 455 -3.740 -10.322 1.646 1.00 0.00 C ATOM 1384 C LYS A 455 -2.608 -11.259 2.056 1.00 0.00 C ATOM 1385 O LYS A 455 -2.086 -12.014 1.235 1.00 0.00 O ATOM 1386 CB LYS A 455 -3.170 -9.078 0.958 1.00 0.00 C ATOM 1387 CG LYS A 455 -3.790 -8.798 -0.402 1.00 0.00 C ATOM 1388 CD LYS A 455 -4.835 -7.693 -0.327 1.00 0.00 C ATOM 1389 CE LYS A 455 -6.241 -8.239 -0.512 1.00 0.00 C ATOM 1390 NZ LYS A 455 -7.251 -7.151 -0.621 1.00 0.00 N ATOM 0 H LYS A 455 -4.290 -9.037 3.208 1.00 0.00 H new ATOM 0 HA LYS A 455 -4.387 -10.848 0.944 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -3.324 -8.213 1.603 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -2.093 -9.200 0.839 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -3.009 -8.513 -1.107 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -4.250 -9.708 -0.787 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -4.764 -7.189 0.637 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -4.631 -6.946 -1.094 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -6.275 -8.857 -1.409 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -6.493 -8.885 0.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -8.207 -7.559 -0.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -7.124 -6.479 0.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -7.129 -6.654 -1.526 1.00 0.00 H new ATOM 1404 N GLY A 456 -2.235 -11.210 3.333 1.00 0.00 N ATOM 1405 CA GLY A 456 -1.172 -12.064 3.826 1.00 0.00 C ATOM 1406 C GLY A 456 -1.617 -13.504 3.970 1.00 0.00 C ATOM 1407 O GLY A 456 -1.361 -14.332 3.095 1.00 0.00 O ATOM 0 H GLY A 456 -2.650 -10.595 4.032 1.00 0.00 H new ATOM 0 HA2 GLY A 456 -0.323 -12.014 3.145 1.00 0.00 H new ATOM 0 HA3 GLY A 456 -0.828 -11.693 4.792 1.00 0.00 H new ATOM 1411 N LEU A 457 -2.288 -13.803 5.076 1.00 0.00 N ATOM 1412 CA LEU A 457 -2.774 -15.153 5.332 1.00 0.00 C ATOM 1413 C LEU A 457 -3.997 -15.464 4.475 1.00 0.00 C ATOM 1414 O LEU A 457 -4.247 -14.715 3.508 1.00 0.00 O ATOM 1415 CB LEU A 457 -3.116 -15.323 6.812 1.00 0.00 C ATOM 1416 CG LEU A 457 -4.130 -14.316 7.359 1.00 0.00 C ATOM 1417 CD1 LEU A 457 -5.522 -14.927 7.402 1.00 0.00 C ATOM 1418 CD2 LEU A 457 -3.716 -13.836 8.742 1.00 0.00 C ATOM 1419 OXT LEU A 457 -4.694 -16.455 4.777 1.00 0.00 O ATOM 0 H LEU A 457 -2.508 -13.129 5.809 1.00 0.00 H new ATOM 0 HA LEU A 457 -1.981 -15.853 5.068 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -3.506 -16.329 6.967 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -2.197 -15.244 7.394 1.00 0.00 H new ATOM 0 HG LEU A 457 -4.153 -13.456 6.689 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -6.229 -14.195 7.794 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -5.822 -15.219 6.396 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -5.514 -15.805 8.047 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -4.450 -13.121 9.114 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -3.662 -14.687 9.421 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -2.739 -13.356 8.683 1.00 0.00 H new TER 1431 LEU A 457