USER MOD reduce.3.24.130724 H: found=0, std=0, add=809, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 810 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 466 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 534 THR OG1 : rot -6:sc= -0.122 USER MOD Single : A 450 SER OG : rot 180:sc= 0 USER MOD Single : A 451 TYR OH : rot 180:sc= 0 USER MOD Single : A 452 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 453 THR OG1 : rot 180:sc= 0 USER MOD Single : A 454 LYS NZ :NH3+ -103:sc= -1.08 (180deg=-3.46!) USER MOD Single : A 455 LYS NZ :NH3+ -158:sc= 1.09 (180deg=0.566) USER MOD Single : A 458 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0447) USER MOD Single : A 461 ASN : amide:sc= -0.0454 X(o=-0.045,f=-0.11) USER MOD Single : A 463 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 465 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 468 THR OG1 : rot 180:sc= 0 USER MOD Single : A 474 SER OG : rot 180:sc= 0 USER MOD Single : A 476 THR OG1 : rot 150:sc= -0.189 USER MOD Single : A 477 SER OG : rot 77:sc= 0.683 USER MOD Single : A 481 THR OG1 : rot 180:sc= 0 USER MOD Single : A 485 SER OG : rot 130:sc= -0.541 USER MOD Single : A 489 TYR OH : rot 180:sc= 0.624 USER MOD Single : A 491 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 492 ASN : amide:sc= -0.206 K(o=-0.21,f=-2.8!) USER MOD Single : A 501 GLN : amide:sc= -0.168 K(o=-0.17,f=-2!) USER MOD Single : A 506 LYS NZ :NH3+ -114:sc= 0.343 (180deg=0) USER MOD Single : A 515 ASN : amide:sc= -1.75 X(o=-1.8,f=-1.8) USER MOD Single : A 522 LYS NZ :NH3+ -150:sc= -0.694 (180deg=-3.14!) USER MOD Single : A 523 SER OG : rot -63:sc= 0.36 USER MOD Single : A 524 GLN :FLIP amide:sc= -2.38 F(o=-5.5!,f=-2.4) USER MOD Single : A 529 SER OG : rot 83:sc= 1.29 USER MOD Single : A 533 SER OG : rot 87:sc= 1.22 USER MOD Single : A 535 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 536 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 539 THR OG1 : rot 74:sc= 0.931 USER MOD Single : A 541 SER OG : rot 180:sc= 0 USER MOD Single : A 547 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 449 -5.781 -17.099 -9.143 1.00 71.32 N ATOM 2 CA GLY A 449 -7.101 -17.298 -9.739 1.00 24.13 C ATOM 3 C GLY A 449 -8.132 -16.486 -9.013 1.00 10.12 C ATOM 4 O GLY A 449 -7.867 -15.996 -7.910 1.00 64.54 O ATOM 0 HA2 GLY A 449 -7.079 -17.012 -10.791 1.00 24.13 H new ATOM 0 HA3 GLY A 449 -7.368 -18.354 -9.701 1.00 24.13 H new ATOM 8 N SER A 450 -9.299 -16.330 -9.600 1.00 2.30 N ATOM 9 CA SER A 450 -10.339 -15.525 -8.999 1.00 54.53 C ATOM 10 C SER A 450 -11.332 -16.377 -8.199 1.00 54.25 C ATOM 11 O SER A 450 -12.282 -15.845 -7.618 1.00 41.14 O ATOM 12 CB SER A 450 -11.033 -14.707 -10.074 1.00 14.45 C ATOM 13 OG SER A 450 -10.081 -13.898 -10.770 1.00 2.43 O ATOM 0 H SER A 450 -9.551 -16.751 -10.494 1.00 2.30 H new ATOM 0 HA SER A 450 -9.881 -14.843 -8.283 1.00 54.53 H new ATOM 0 HB2 SER A 450 -11.540 -15.370 -10.775 1.00 14.45 H new ATOM 0 HB3 SER A 450 -11.798 -14.075 -9.623 1.00 14.45 H new ATOM 0 HG SER A 450 -10.539 -13.376 -11.462 1.00 2.43 H new ATOM 19 N TYR A 451 -11.090 -17.700 -8.181 1.00 1.43 N ATOM 20 CA TYR A 451 -11.866 -18.692 -7.396 1.00 33.31 C ATOM 21 C TYR A 451 -13.326 -18.844 -7.858 1.00 73.32 C ATOM 22 O TYR A 451 -13.951 -17.894 -8.360 1.00 31.03 O ATOM 23 CB TYR A 451 -11.813 -18.382 -5.881 1.00 34.15 C ATOM 24 CG TYR A 451 -10.413 -18.360 -5.293 1.00 41.43 C ATOM 25 CD1 TYR A 451 -9.798 -19.527 -4.870 1.00 1.23 C ATOM 26 CD2 TYR A 451 -9.706 -17.166 -5.167 1.00 72.20 C ATOM 27 CE1 TYR A 451 -8.523 -19.510 -4.337 1.00 13.34 C ATOM 28 CE2 TYR A 451 -8.431 -17.141 -4.636 1.00 73.22 C ATOM 29 CZ TYR A 451 -7.845 -18.315 -4.226 1.00 63.13 C ATOM 30 OH TYR A 451 -6.569 -18.298 -3.699 1.00 51.53 O ATOM 0 H TYR A 451 -10.335 -18.124 -8.721 1.00 1.43 H new ATOM 0 HA TYR A 451 -11.379 -19.649 -7.582 1.00 33.31 H new ATOM 0 HB2 TYR A 451 -12.283 -17.415 -5.704 1.00 34.15 H new ATOM 0 HB3 TYR A 451 -12.405 -19.127 -5.349 1.00 34.15 H new ATOM 0 HD1 TYR A 451 -10.324 -20.466 -4.958 1.00 1.23 H new ATOM 0 HD2 TYR A 451 -10.163 -16.243 -5.491 1.00 72.20 H new ATOM 0 HE1 TYR A 451 -8.060 -20.429 -4.009 1.00 13.34 H new ATOM 0 HE2 TYR A 451 -7.898 -16.206 -4.544 1.00 73.22 H new ATOM 0 HH TYR A 451 -6.231 -17.378 -3.691 1.00 51.53 H new ATOM 40 N ASN A 452 -13.863 -20.042 -7.708 1.00 71.34 N ATOM 41 CA ASN A 452 -15.270 -20.282 -8.016 1.00 20.00 C ATOM 42 C ASN A 452 -16.094 -19.935 -6.809 1.00 63.24 C ATOM 43 O ASN A 452 -16.876 -18.988 -6.830 1.00 2.32 O ATOM 44 CB ASN A 452 -15.554 -21.742 -8.432 1.00 24.33 C ATOM 45 CG ASN A 452 -14.875 -22.156 -9.717 1.00 61.01 C ATOM 46 OD1 ASN A 452 -13.762 -22.660 -9.704 1.00 44.33 O ATOM 47 ND2 ASN A 452 -15.539 -21.960 -10.833 1.00 61.51 N ATOM 0 H ASN A 452 -13.354 -20.862 -7.377 1.00 71.34 H new ATOM 0 HA ASN A 452 -15.534 -19.654 -8.867 1.00 20.00 H new ATOM 0 HB2 ASN A 452 -15.231 -22.407 -7.631 1.00 24.33 H new ATOM 0 HB3 ASN A 452 -16.630 -21.875 -8.542 1.00 24.33 H new ATOM 0 HD21 ASN A 452 -15.127 -22.231 -11.726 1.00 61.51 H new ATOM 0 HD22 ASN A 452 -16.467 -21.537 -10.807 1.00 61.51 H new ATOM 54 N THR A 453 -15.901 -20.678 -5.752 1.00 22.23 N ATOM 55 CA THR A 453 -16.586 -20.434 -4.525 1.00 21.21 C ATOM 56 C THR A 453 -15.634 -19.810 -3.527 1.00 51.24 C ATOM 57 O THR A 453 -14.472 -20.248 -3.408 1.00 45.20 O ATOM 58 CB THR A 453 -17.194 -21.727 -3.946 1.00 13.54 C ATOM 59 OG1 THR A 453 -16.174 -22.727 -3.803 1.00 62.04 O ATOM 60 CG2 THR A 453 -18.295 -22.250 -4.846 1.00 11.32 C ATOM 0 H THR A 453 -15.260 -21.471 -5.725 1.00 22.23 H new ATOM 0 HA THR A 453 -17.408 -19.747 -4.726 1.00 21.21 H new ATOM 0 HB THR A 453 -17.619 -21.499 -2.969 1.00 13.54 H new ATOM 0 HG1 THR A 453 -16.567 -23.545 -3.433 1.00 62.04 H new ATOM 0 HG21 THR A 453 -18.711 -23.163 -4.419 1.00 11.32 H new ATOM 0 HG22 THR A 453 -19.081 -21.500 -4.933 1.00 11.32 H new ATOM 0 HG23 THR A 453 -17.887 -22.464 -5.834 1.00 11.32 H new ATOM 68 N LYS A 454 -16.118 -18.785 -2.847 1.00 11.40 N ATOM 69 CA LYS A 454 -15.368 -18.030 -1.856 1.00 22.54 C ATOM 70 C LYS A 454 -14.196 -17.339 -2.515 1.00 5.42 C ATOM 71 O LYS A 454 -13.090 -17.896 -2.616 1.00 21.35 O ATOM 72 CB LYS A 454 -14.887 -18.900 -0.689 1.00 52.31 C ATOM 73 CG LYS A 454 -14.272 -18.112 0.466 1.00 34.02 C ATOM 74 CD LYS A 454 -13.672 -18.999 1.582 1.00 62.32 C ATOM 75 CE LYS A 454 -14.683 -19.950 2.276 1.00 73.13 C ATOM 76 NZ LYS A 454 -15.152 -21.076 1.412 1.00 44.10 N ATOM 0 H LYS A 454 -17.071 -18.445 -2.972 1.00 11.40 H new ATOM 0 HA LYS A 454 -16.045 -17.286 -1.435 1.00 22.54 H new ATOM 0 HB2 LYS A 454 -15.729 -19.480 -0.311 1.00 52.31 H new ATOM 0 HB3 LYS A 454 -14.151 -19.613 -1.061 1.00 52.31 H new ATOM 0 HG2 LYS A 454 -13.491 -17.461 0.073 1.00 34.02 H new ATOM 0 HG3 LYS A 454 -15.036 -17.467 0.900 1.00 34.02 H new ATOM 0 HD2 LYS A 454 -12.866 -19.597 1.157 1.00 62.32 H new ATOM 0 HD3 LYS A 454 -13.225 -18.353 2.338 1.00 62.32 H new ATOM 0 HE2 LYS A 454 -14.221 -20.362 3.173 1.00 73.13 H new ATOM 0 HE3 LYS A 454 -15.547 -19.370 2.600 1.00 73.13 H new ATOM 0 HZ1 LYS A 454 -16.110 -20.871 1.064 1.00 44.10 H new ATOM 0 HZ2 LYS A 454 -14.506 -21.186 0.604 1.00 44.10 H new ATOM 0 HZ3 LYS A 454 -15.166 -21.956 1.966 1.00 44.10 H new ATOM 90 N LYS A 455 -14.448 -16.173 -3.022 1.00 34.20 N ATOM 91 CA LYS A 455 -13.418 -15.421 -3.658 1.00 74.14 C ATOM 92 C LYS A 455 -12.573 -14.762 -2.611 1.00 35.11 C ATOM 93 O LYS A 455 -13.045 -13.911 -1.849 1.00 43.00 O ATOM 94 CB LYS A 455 -14.020 -14.413 -4.625 1.00 14.23 C ATOM 95 CG LYS A 455 -14.770 -15.076 -5.770 1.00 3.31 C ATOM 96 CD LYS A 455 -15.420 -14.060 -6.673 1.00 70.13 C ATOM 97 CE LYS A 455 -16.081 -14.726 -7.870 1.00 60.24 C ATOM 98 NZ LYS A 455 -15.094 -15.390 -8.751 1.00 44.14 N ATOM 0 H LYS A 455 -15.363 -15.722 -3.007 1.00 34.20 H new ATOM 0 HA LYS A 455 -12.780 -16.082 -4.244 1.00 74.14 H new ATOM 0 HB2 LYS A 455 -14.700 -13.756 -4.082 1.00 14.23 H new ATOM 0 HB3 LYS A 455 -13.226 -13.786 -5.031 1.00 14.23 H new ATOM 0 HG2 LYS A 455 -14.080 -15.690 -6.350 1.00 3.31 H new ATOM 0 HG3 LYS A 455 -15.531 -15.745 -5.368 1.00 3.31 H new ATOM 0 HD2 LYS A 455 -16.164 -13.495 -6.112 1.00 70.13 H new ATOM 0 HD3 LYS A 455 -14.672 -13.346 -7.018 1.00 70.13 H new ATOM 0 HE2 LYS A 455 -16.807 -15.460 -7.521 1.00 60.24 H new ATOM 0 HE3 LYS A 455 -16.632 -13.979 -8.441 1.00 60.24 H new ATOM 0 HZ1 LYS A 455 -15.497 -15.500 -9.703 1.00 44.14 H new ATOM 0 HZ2 LYS A 455 -14.232 -14.811 -8.805 1.00 44.14 H new ATOM 0 HZ3 LYS A 455 -14.859 -16.327 -8.365 1.00 44.14 H new ATOM 112 N ILE A 456 -11.340 -15.161 -2.557 1.00 15.22 N ATOM 113 CA ILE A 456 -10.446 -14.678 -1.562 1.00 15.13 C ATOM 114 C ILE A 456 -9.789 -13.391 -2.009 1.00 25.22 C ATOM 115 O ILE A 456 -8.803 -13.400 -2.760 1.00 75.05 O ATOM 116 CB ILE A 456 -9.370 -15.737 -1.185 1.00 45.13 C ATOM 117 CG1 ILE A 456 -10.052 -17.033 -0.701 1.00 72.34 C ATOM 118 CG2 ILE A 456 -8.429 -15.192 -0.106 1.00 22.23 C ATOM 119 CD1 ILE A 456 -9.091 -18.155 -0.349 1.00 12.31 C ATOM 0 H ILE A 456 -10.928 -15.832 -3.205 1.00 15.22 H new ATOM 0 HA ILE A 456 -11.036 -14.477 -0.668 1.00 15.13 H new ATOM 0 HB ILE A 456 -8.777 -15.961 -2.071 1.00 45.13 H new ATOM 0 HG12 ILE A 456 -10.660 -16.804 0.174 1.00 72.34 H new ATOM 0 HG13 ILE A 456 -10.731 -17.383 -1.478 1.00 72.34 H new ATOM 0 HG21 ILE A 456 -7.684 -15.948 0.143 1.00 22.23 H new ATOM 0 HG22 ILE A 456 -7.928 -14.298 -0.478 1.00 22.23 H new ATOM 0 HG23 ILE A 456 -9.004 -14.942 0.785 1.00 22.23 H new ATOM 0 HD11 ILE A 456 -9.655 -19.027 -0.019 1.00 12.31 H new ATOM 0 HD12 ILE A 456 -8.500 -18.416 -1.227 1.00 12.31 H new ATOM 0 HD13 ILE A 456 -8.427 -17.828 0.451 1.00 12.31 H new ATOM 131 N GLY A 457 -10.386 -12.293 -1.627 1.00 73.44 N ATOM 132 CA GLY A 457 -9.789 -11.032 -1.871 1.00 11.15 C ATOM 133 C GLY A 457 -10.368 -10.287 -3.041 1.00 22.32 C ATOM 134 O GLY A 457 -10.842 -10.883 -4.013 1.00 40.41 O ATOM 0 H GLY A 457 -11.285 -12.259 -1.146 1.00 73.44 H new ATOM 0 HA2 GLY A 457 -9.891 -10.416 -0.977 1.00 11.15 H new ATOM 0 HA3 GLY A 457 -8.722 -11.175 -2.039 1.00 11.15 H new ATOM 138 N LYS A 458 -10.344 -8.991 -2.928 1.00 31.15 N ATOM 139 CA LYS A 458 -10.749 -8.095 -3.980 1.00 13.34 C ATOM 140 C LYS A 458 -9.705 -7.080 -4.192 1.00 13.33 C ATOM 141 O LYS A 458 -9.009 -6.690 -3.251 1.00 4.25 O ATOM 142 CB LYS A 458 -11.990 -7.301 -3.648 1.00 52.41 C ATOM 143 CG LYS A 458 -13.300 -8.024 -3.620 1.00 72.33 C ATOM 144 CD LYS A 458 -14.416 -7.035 -3.326 1.00 12.21 C ATOM 145 CE LYS A 458 -14.458 -5.912 -4.379 1.00 43.04 C ATOM 146 NZ LYS A 458 -14.766 -6.425 -5.732 1.00 34.32 N ATOM 0 H LYS A 458 -10.035 -8.513 -2.082 1.00 31.15 H new ATOM 0 HA LYS A 458 -10.930 -8.732 -4.846 1.00 13.34 H new ATOM 0 HB2 LYS A 458 -11.841 -6.842 -2.671 1.00 52.41 H new ATOM 0 HB3 LYS A 458 -12.071 -6.490 -4.372 1.00 52.41 H new ATOM 0 HG2 LYS A 458 -13.477 -8.515 -4.577 1.00 72.33 H new ATOM 0 HG3 LYS A 458 -13.281 -8.805 -2.859 1.00 72.33 H new ATOM 0 HD2 LYS A 458 -15.373 -7.557 -3.309 1.00 12.21 H new ATOM 0 HD3 LYS A 458 -14.271 -6.603 -2.336 1.00 12.21 H new ATOM 0 HE2 LYS A 458 -15.208 -5.175 -4.092 1.00 43.04 H new ATOM 0 HE3 LYS A 458 -13.497 -5.398 -4.397 1.00 43.04 H new ATOM 0 HZ1 LYS A 458 -14.901 -5.626 -6.384 1.00 34.32 H new ATOM 0 HZ2 LYS A 458 -13.978 -7.016 -6.067 1.00 34.32 H new ATOM 0 HZ3 LYS A 458 -15.636 -6.994 -5.698 1.00 34.32 H new ATOM 160 N ARG A 459 -9.589 -6.645 -5.392 1.00 35.23 N ATOM 161 CA ARG A 459 -8.756 -5.551 -5.706 1.00 40.15 C ATOM 162 C ARG A 459 -9.612 -4.373 -6.104 1.00 52.30 C ATOM 163 O ARG A 459 -10.524 -4.491 -6.941 1.00 2.32 O ATOM 164 CB ARG A 459 -7.777 -5.909 -6.781 1.00 33.14 C ATOM 165 CG ARG A 459 -6.791 -6.963 -6.358 1.00 71.41 C ATOM 166 CD ARG A 459 -5.916 -7.333 -7.502 1.00 44.44 C ATOM 167 NE ARG A 459 -6.683 -7.990 -8.565 1.00 50.22 N ATOM 168 CZ ARG A 459 -6.290 -8.132 -9.833 1.00 64.02 C ATOM 169 NH1 ARG A 459 -5.119 -7.648 -10.235 1.00 13.24 N ATOM 170 NH2 ARG A 459 -7.064 -8.776 -10.695 1.00 21.14 N ATOM 0 H ARG A 459 -10.078 -7.046 -6.193 1.00 35.23 H new ATOM 0 HA ARG A 459 -8.172 -5.279 -4.827 1.00 40.15 H new ATOM 0 HB2 ARG A 459 -8.322 -6.261 -7.657 1.00 33.14 H new ATOM 0 HB3 ARG A 459 -7.234 -5.013 -7.082 1.00 33.14 H new ATOM 0 HG2 ARG A 459 -6.185 -6.594 -5.531 1.00 71.41 H new ATOM 0 HG3 ARG A 459 -7.321 -7.844 -5.996 1.00 71.41 H new ATOM 0 HD2 ARG A 459 -5.433 -6.440 -7.898 1.00 44.44 H new ATOM 0 HD3 ARG A 459 -5.124 -7.998 -7.157 1.00 44.44 H new ATOM 0 HE ARG A 459 -7.595 -8.371 -8.314 1.00 50.22 H new ATOM 0 HH11 ARG A 459 -4.513 -7.164 -9.573 1.00 13.24 H new ATOM 0 HH12 ARG A 459 -4.827 -7.761 -11.206 1.00 13.24 H new ATOM 0 HH21 ARG A 459 -7.957 -9.162 -10.389 1.00 21.14 H new ATOM 0 HH22 ARG A 459 -6.766 -8.886 -11.664 1.00 21.14 H new ATOM 184 N LEU A 460 -9.349 -3.277 -5.487 1.00 74.21 N ATOM 185 CA LEU A 460 -10.091 -2.047 -5.699 1.00 4.00 C ATOM 186 C LEU A 460 -9.159 -0.987 -6.219 1.00 45.31 C ATOM 187 O LEU A 460 -8.094 -0.776 -5.656 1.00 71.33 O ATOM 188 CB LEU A 460 -10.729 -1.515 -4.388 1.00 20.45 C ATOM 189 CG LEU A 460 -11.719 -2.415 -3.613 1.00 63.33 C ATOM 190 CD1 LEU A 460 -12.826 -2.927 -4.501 1.00 65.04 C ATOM 191 CD2 LEU A 460 -11.018 -3.548 -2.876 1.00 12.10 C ATOM 0 H LEU A 460 -8.599 -3.189 -4.802 1.00 74.21 H new ATOM 0 HA LEU A 460 -10.886 -2.268 -6.411 1.00 4.00 H new ATOM 0 HB2 LEU A 460 -9.917 -1.259 -3.708 1.00 20.45 H new ATOM 0 HB3 LEU A 460 -11.248 -0.587 -4.628 1.00 20.45 H new ATOM 0 HG LEU A 460 -12.180 -1.785 -2.852 1.00 63.33 H new ATOM 0 HD11 LEU A 460 -13.499 -3.555 -3.918 1.00 65.04 H new ATOM 0 HD12 LEU A 460 -13.381 -2.084 -4.913 1.00 65.04 H new ATOM 0 HD13 LEU A 460 -12.398 -3.512 -5.315 1.00 65.04 H new ATOM 0 HD21 LEU A 460 -11.757 -4.151 -2.348 1.00 12.10 H new ATOM 0 HD22 LEU A 460 -10.485 -4.173 -3.592 1.00 12.10 H new ATOM 0 HD23 LEU A 460 -10.309 -3.132 -2.159 1.00 12.10 H new ATOM 203 N ASN A 461 -9.545 -0.347 -7.281 1.00 44.45 N ATOM 204 CA ASN A 461 -8.761 0.739 -7.847 1.00 64.13 C ATOM 205 C ASN A 461 -9.307 2.063 -7.341 1.00 2.24 C ATOM 206 O ASN A 461 -10.494 2.359 -7.491 1.00 73.42 O ATOM 207 CB ASN A 461 -8.719 0.667 -9.392 1.00 55.04 C ATOM 208 CG ASN A 461 -10.090 0.686 -10.046 1.00 12.40 C ATOM 209 OD1 ASN A 461 -10.714 -0.371 -10.230 1.00 43.35 O ATOM 210 ND2 ASN A 461 -10.552 1.848 -10.432 1.00 40.04 N ATOM 0 H ASN A 461 -10.407 -0.552 -7.787 1.00 44.45 H new ATOM 0 HA ASN A 461 -7.726 0.646 -7.519 1.00 64.13 H new ATOM 0 HB2 ASN A 461 -8.135 1.507 -9.769 1.00 55.04 H new ATOM 0 HB3 ASN A 461 -8.198 -0.243 -9.690 1.00 55.04 H new ATOM 0 HD21 ASN A 461 -11.455 1.907 -10.902 1.00 40.04 H new ATOM 0 HD22 ASN A 461 -10.009 2.695 -10.262 1.00 40.04 H new ATOM 217 N ILE A 462 -8.461 2.818 -6.711 1.00 34.00 N ATOM 218 CA ILE A 462 -8.829 4.056 -6.057 1.00 14.33 C ATOM 219 C ILE A 462 -7.919 5.192 -6.538 1.00 74.51 C ATOM 220 O ILE A 462 -6.754 4.978 -6.752 1.00 71.25 O ATOM 221 CB ILE A 462 -8.621 3.896 -4.526 1.00 11.35 C ATOM 222 CG1 ILE A 462 -9.458 2.732 -3.965 1.00 32.04 C ATOM 223 CG2 ILE A 462 -8.957 5.175 -3.810 1.00 10.12 C ATOM 224 CD1 ILE A 462 -9.304 2.532 -2.469 1.00 45.34 C ATOM 0 H ILE A 462 -7.469 2.594 -6.630 1.00 34.00 H new ATOM 0 HA ILE A 462 -9.869 4.286 -6.290 1.00 14.33 H new ATOM 0 HB ILE A 462 -7.569 3.666 -4.357 1.00 11.35 H new ATOM 0 HG12 ILE A 462 -10.509 2.910 -4.192 1.00 32.04 H new ATOM 0 HG13 ILE A 462 -9.173 1.812 -4.476 1.00 32.04 H new ATOM 0 HG21 ILE A 462 -8.805 5.043 -2.739 1.00 10.12 H new ATOM 0 HG22 ILE A 462 -8.311 5.975 -4.172 1.00 10.12 H new ATOM 0 HG23 ILE A 462 -9.998 5.435 -3.999 1.00 10.12 H new ATOM 0 HD11 ILE A 462 -9.924 1.695 -2.148 1.00 45.34 H new ATOM 0 HD12 ILE A 462 -8.260 2.321 -2.236 1.00 45.34 H new ATOM 0 HD13 ILE A 462 -9.617 3.436 -1.947 1.00 45.34 H new ATOM 236 N GLN A 463 -8.447 6.387 -6.710 1.00 10.05 N ATOM 237 CA GLN A 463 -7.597 7.509 -7.099 1.00 62.30 C ATOM 238 C GLN A 463 -7.505 8.603 -6.038 1.00 24.51 C ATOM 239 O GLN A 463 -8.522 9.091 -5.529 1.00 12.04 O ATOM 240 CB GLN A 463 -7.959 8.074 -8.464 1.00 41.45 C ATOM 241 CG GLN A 463 -7.630 7.134 -9.606 1.00 55.32 C ATOM 242 CD GLN A 463 -7.949 7.706 -10.962 1.00 62.42 C ATOM 243 OE1 GLN A 463 -7.875 8.921 -11.181 1.00 53.21 O ATOM 244 NE2 GLN A 463 -8.315 6.853 -11.878 1.00 54.00 N ATOM 0 H GLN A 463 -9.435 6.610 -6.592 1.00 10.05 H new ATOM 0 HA GLN A 463 -6.595 7.087 -7.183 1.00 62.30 H new ATOM 0 HB2 GLN A 463 -9.025 8.301 -8.485 1.00 41.45 H new ATOM 0 HB3 GLN A 463 -7.429 9.015 -8.613 1.00 41.45 H new ATOM 0 HG2 GLN A 463 -6.570 6.883 -9.566 1.00 55.32 H new ATOM 0 HG3 GLN A 463 -8.183 6.204 -9.473 1.00 55.32 H new ATOM 0 HE21 GLN A 463 -8.364 5.858 -11.658 1.00 54.00 H new ATOM 0 HE22 GLN A 463 -8.553 7.181 -12.814 1.00 54.00 H new ATOM 253 N LEU A 464 -6.275 8.957 -5.704 1.00 71.55 N ATOM 254 CA LEU A 464 -5.947 10.003 -4.743 1.00 71.42 C ATOM 255 C LEU A 464 -5.208 11.108 -5.449 1.00 54.01 C ATOM 256 O LEU A 464 -4.296 10.836 -6.219 1.00 60.14 O ATOM 257 CB LEU A 464 -5.052 9.447 -3.628 1.00 54.10 C ATOM 258 CG LEU A 464 -5.712 8.636 -2.490 1.00 20.04 C ATOM 259 CD1 LEU A 464 -6.639 9.507 -1.668 1.00 22.21 C ATOM 260 CD2 LEU A 464 -6.455 7.418 -2.977 1.00 75.44 C ATOM 0 H LEU A 464 -5.450 8.512 -6.106 1.00 71.55 H new ATOM 0 HA LEU A 464 -6.872 10.380 -4.306 1.00 71.42 H new ATOM 0 HB2 LEU A 464 -4.298 8.812 -4.093 1.00 54.10 H new ATOM 0 HB3 LEU A 464 -4.526 10.287 -3.175 1.00 54.10 H new ATOM 0 HG LEU A 464 -4.892 8.283 -1.865 1.00 20.04 H new ATOM 0 HD11 LEU A 464 -7.090 8.911 -0.874 1.00 22.21 H new ATOM 0 HD12 LEU A 464 -6.072 10.328 -1.228 1.00 22.21 H new ATOM 0 HD13 LEU A 464 -7.423 9.910 -2.309 1.00 22.21 H new ATOM 0 HD21 LEU A 464 -6.894 6.895 -2.127 1.00 75.44 H new ATOM 0 HD22 LEU A 464 -7.246 7.724 -3.662 1.00 75.44 H new ATOM 0 HD23 LEU A 464 -5.764 6.753 -3.495 1.00 75.44 H new ATOM 272 N LYS A 465 -5.574 12.333 -5.196 1.00 23.43 N ATOM 273 CA LYS A 465 -4.973 13.429 -5.851 1.00 22.43 C ATOM 274 C LYS A 465 -4.104 14.204 -4.921 1.00 53.35 C ATOM 275 O LYS A 465 -4.468 14.477 -3.778 1.00 41.45 O ATOM 276 CB LYS A 465 -6.036 14.332 -6.432 1.00 31.35 C ATOM 277 CG LYS A 465 -5.486 15.543 -7.178 1.00 24.04 C ATOM 278 CD LYS A 465 -6.600 16.399 -7.724 1.00 34.32 C ATOM 279 CE LYS A 465 -7.465 15.601 -8.663 1.00 62.10 C ATOM 280 NZ LYS A 465 -8.572 16.407 -9.210 1.00 43.10 N ATOM 0 H LYS A 465 -6.300 12.586 -4.526 1.00 23.43 H new ATOM 0 HA LYS A 465 -4.349 13.039 -6.655 1.00 22.43 H new ATOM 0 HB2 LYS A 465 -6.658 13.751 -7.113 1.00 31.35 H new ATOM 0 HB3 LYS A 465 -6.683 14.678 -5.626 1.00 31.35 H new ATOM 0 HG2 LYS A 465 -4.864 16.135 -6.507 1.00 24.04 H new ATOM 0 HG3 LYS A 465 -4.846 15.210 -7.995 1.00 24.04 H new ATOM 0 HD2 LYS A 465 -7.204 16.787 -6.904 1.00 34.32 H new ATOM 0 HD3 LYS A 465 -6.183 17.260 -8.247 1.00 34.32 H new ATOM 0 HE2 LYS A 465 -6.855 15.219 -9.482 1.00 62.10 H new ATOM 0 HE3 LYS A 465 -7.871 14.737 -8.137 1.00 62.10 H new ATOM 0 HZ1 LYS A 465 -9.144 15.821 -9.852 1.00 43.10 H new ATOM 0 HZ2 LYS A 465 -9.169 16.751 -8.431 1.00 43.10 H new ATOM 0 HZ3 LYS A 465 -8.185 17.218 -9.734 1.00 43.10 H new ATOM 294 N LYS A 466 -2.965 14.544 -5.399 1.00 41.52 N ATOM 295 CA LYS A 466 -2.069 15.392 -4.651 1.00 34.32 C ATOM 296 C LYS A 466 -2.569 16.815 -4.629 1.00 51.15 C ATOM 297 O LYS A 466 -2.434 17.548 -5.609 1.00 52.31 O ATOM 298 CB LYS A 466 -0.611 15.356 -5.121 1.00 22.54 C ATOM 299 CG LYS A 466 0.104 14.052 -4.914 1.00 32.14 C ATOM 300 CD LYS A 466 1.620 14.261 -4.837 1.00 13.13 C ATOM 301 CE LYS A 466 2.183 15.070 -6.008 1.00 62.40 C ATOM 302 NZ LYS A 466 3.647 15.230 -5.901 1.00 2.13 N ATOM 0 H LYS A 466 -2.615 14.253 -6.312 1.00 41.52 H new ATOM 0 HA LYS A 466 -2.068 14.979 -3.642 1.00 34.32 H new ATOM 0 HB2 LYS A 466 -0.584 15.600 -6.183 1.00 22.54 H new ATOM 0 HB3 LYS A 466 -0.060 16.139 -4.600 1.00 22.54 H new ATOM 0 HG2 LYS A 466 -0.249 13.582 -3.996 1.00 32.14 H new ATOM 0 HG3 LYS A 466 -0.131 13.371 -5.732 1.00 32.14 H new ATOM 0 HD2 LYS A 466 1.862 14.770 -3.904 1.00 13.13 H new ATOM 0 HD3 LYS A 466 2.112 13.289 -4.807 1.00 13.13 H new ATOM 0 HE2 LYS A 466 1.938 14.573 -6.946 1.00 62.40 H new ATOM 0 HE3 LYS A 466 1.710 16.051 -6.034 1.00 62.40 H new ATOM 0 HZ1 LYS A 466 3.996 15.783 -6.710 1.00 2.13 H new ATOM 0 HZ2 LYS A 466 3.878 15.727 -5.017 1.00 2.13 H new ATOM 0 HZ3 LYS A 466 4.099 14.294 -5.901 1.00 2.13 H new ATOM 316 N GLY A 467 -3.180 17.180 -3.535 1.00 64.14 N ATOM 317 CA GLY A 467 -3.683 18.515 -3.394 1.00 61.23 C ATOM 318 C GLY A 467 -2.869 19.328 -2.424 1.00 15.24 C ATOM 319 O GLY A 467 -1.786 19.811 -2.768 1.00 63.33 O ATOM 0 H GLY A 467 -3.340 16.572 -2.732 1.00 64.14 H new ATOM 0 HA2 GLY A 467 -3.683 19.006 -4.367 1.00 61.23 H new ATOM 0 HA3 GLY A 467 -4.718 18.478 -3.055 1.00 61.23 H new ATOM 323 N THR A 468 -3.374 19.477 -1.212 1.00 32.41 N ATOM 324 CA THR A 468 -2.700 20.262 -0.200 1.00 55.31 C ATOM 325 C THR A 468 -1.355 19.612 0.250 1.00 44.34 C ATOM 326 O THR A 468 -0.278 20.116 -0.081 1.00 24.02 O ATOM 327 CB THR A 468 -3.659 20.618 1.004 1.00 33.53 C ATOM 328 OG1 THR A 468 -2.979 21.380 1.991 1.00 14.52 O ATOM 329 CG2 THR A 468 -4.301 19.383 1.649 1.00 11.21 C ATOM 0 H THR A 468 -4.254 19.061 -0.906 1.00 32.41 H new ATOM 0 HA THR A 468 -2.427 21.214 -0.656 1.00 55.31 H new ATOM 0 HB THR A 468 -4.465 21.215 0.577 1.00 33.53 H new ATOM 0 HG1 THR A 468 -3.594 21.589 2.724 1.00 14.52 H new ATOM 0 HG21 THR A 468 -4.948 19.695 2.469 1.00 11.21 H new ATOM 0 HG22 THR A 468 -4.891 18.849 0.904 1.00 11.21 H new ATOM 0 HG23 THR A 468 -3.521 18.726 2.033 1.00 11.21 H new ATOM 337 N GLU A 469 -1.416 18.494 0.955 1.00 62.33 N ATOM 338 CA GLU A 469 -0.203 17.805 1.389 1.00 31.33 C ATOM 339 C GLU A 469 0.093 16.674 0.433 1.00 32.24 C ATOM 340 O GLU A 469 1.210 16.162 0.366 1.00 24.43 O ATOM 341 CB GLU A 469 -0.381 17.254 2.798 1.00 65.21 C ATOM 342 CG GLU A 469 -0.703 18.301 3.847 1.00 62.30 C ATOM 343 CD GLU A 469 0.396 19.315 4.021 1.00 70.53 C ATOM 344 OE1 GLU A 469 1.400 19.008 4.684 1.00 51.34 O ATOM 345 OE2 GLU A 469 0.261 20.437 3.534 1.00 2.33 O ATOM 0 H GLU A 469 -2.286 18.043 1.240 1.00 62.33 H new ATOM 0 HA GLU A 469 0.627 18.511 1.395 1.00 31.33 H new ATOM 0 HB2 GLU A 469 -1.180 16.512 2.786 1.00 65.21 H new ATOM 0 HB3 GLU A 469 0.532 16.735 3.089 1.00 65.21 H new ATOM 0 HG2 GLU A 469 -1.623 18.815 3.569 1.00 62.30 H new ATOM 0 HG3 GLU A 469 -0.889 17.807 4.801 1.00 62.30 H new ATOM 352 N GLY A 470 -0.928 16.301 -0.309 1.00 74.20 N ATOM 353 CA GLY A 470 -0.836 15.224 -1.247 1.00 12.41 C ATOM 354 C GLY A 470 -0.695 13.888 -0.590 1.00 3.14 C ATOM 355 O GLY A 470 -1.169 13.715 0.511 1.00 70.11 O ATOM 0 H GLY A 470 -1.846 16.744 -0.272 1.00 74.20 H new ATOM 0 HA2 GLY A 470 -1.726 15.221 -1.877 1.00 12.41 H new ATOM 0 HA3 GLY A 470 0.018 15.392 -1.903 1.00 12.41 H new ATOM 359 N LEU A 471 -0.022 12.959 -1.248 1.00 1.40 N ATOM 360 CA LEU A 471 0.015 11.540 -0.832 1.00 65.43 C ATOM 361 C LEU A 471 0.402 11.345 0.634 1.00 62.03 C ATOM 362 O LEU A 471 1.573 11.315 0.994 1.00 14.44 O ATOM 363 CB LEU A 471 0.904 10.716 -1.759 1.00 74.11 C ATOM 364 CG LEU A 471 0.617 10.886 -3.258 1.00 12.45 C ATOM 365 CD1 LEU A 471 1.496 9.981 -4.077 1.00 12.33 C ATOM 366 CD2 LEU A 471 -0.862 10.660 -3.579 1.00 74.32 C ATOM 0 H LEU A 471 0.520 13.154 -2.090 1.00 1.40 H new ATOM 0 HA LEU A 471 -1.007 11.172 -0.921 1.00 65.43 H new ATOM 0 HB2 LEU A 471 1.944 10.983 -1.572 1.00 74.11 H new ATOM 0 HB3 LEU A 471 0.794 9.663 -1.501 1.00 74.11 H new ATOM 0 HG LEU A 471 0.851 11.917 -3.524 1.00 12.45 H new ATOM 0 HD11 LEU A 471 1.275 10.119 -5.135 1.00 12.33 H new ATOM 0 HD12 LEU A 471 2.542 10.224 -3.890 1.00 12.33 H new ATOM 0 HD13 LEU A 471 1.309 8.944 -3.800 1.00 12.33 H new ATOM 0 HD21 LEU A 471 -1.026 10.789 -4.649 1.00 74.32 H new ATOM 0 HD22 LEU A 471 -1.147 9.649 -3.287 1.00 74.32 H new ATOM 0 HD23 LEU A 471 -1.468 11.381 -3.030 1.00 74.32 H new ATOM 378 N GLY A 472 -0.621 11.216 1.460 1.00 3.13 N ATOM 379 CA GLY A 472 -0.446 11.097 2.873 1.00 42.31 C ATOM 380 C GLY A 472 -0.727 9.713 3.348 1.00 4.14 C ATOM 381 O GLY A 472 -1.583 9.497 4.193 1.00 10.30 O ATOM 0 H GLY A 472 -1.594 11.192 1.156 1.00 3.13 H new ATOM 0 HA2 GLY A 472 0.575 11.372 3.138 1.00 42.31 H new ATOM 0 HA3 GLY A 472 -1.108 11.798 3.382 1.00 42.31 H new ATOM 385 N PHE A 473 -0.037 8.794 2.781 1.00 45.24 N ATOM 386 CA PHE A 473 -0.107 7.425 3.150 1.00 20.42 C ATOM 387 C PHE A 473 1.238 6.784 3.003 1.00 74.42 C ATOM 388 O PHE A 473 2.001 7.119 2.097 1.00 51.12 O ATOM 389 CB PHE A 473 -1.217 6.666 2.393 1.00 45.42 C ATOM 390 CG PHE A 473 -1.177 6.728 0.884 1.00 25.11 C ATOM 391 CD1 PHE A 473 -1.697 7.830 0.221 1.00 75.53 C ATOM 392 CD2 PHE A 473 -0.668 5.675 0.132 1.00 54.44 C ATOM 393 CE1 PHE A 473 -1.701 7.895 -1.149 1.00 1.01 C ATOM 394 CE2 PHE A 473 -0.680 5.736 -1.252 1.00 5.13 C ATOM 395 CZ PHE A 473 -1.197 6.851 -1.888 1.00 41.34 C ATOM 0 H PHE A 473 0.616 8.979 2.020 1.00 45.24 H new ATOM 0 HA PHE A 473 -0.390 7.370 4.201 1.00 20.42 H new ATOM 0 HB2 PHE A 473 -1.176 5.618 2.691 1.00 45.42 H new ATOM 0 HB3 PHE A 473 -2.180 7.054 2.724 1.00 45.42 H new ATOM 0 HD1 PHE A 473 -2.105 8.650 0.793 1.00 75.53 H new ATOM 0 HD2 PHE A 473 -0.262 4.806 0.629 1.00 54.44 H new ATOM 0 HE1 PHE A 473 -2.100 8.766 -1.647 1.00 1.01 H new ATOM 0 HE2 PHE A 473 -0.287 4.915 -1.833 1.00 5.13 H new ATOM 0 HZ PHE A 473 -1.205 6.901 -2.967 1.00 41.34 H new ATOM 405 N SER A 474 1.539 5.911 3.910 1.00 62.22 N ATOM 406 CA SER A 474 2.799 5.228 3.923 1.00 13.52 C ATOM 407 C SER A 474 2.576 3.743 3.801 1.00 32.43 C ATOM 408 O SER A 474 1.465 3.257 4.046 1.00 4.33 O ATOM 409 CB SER A 474 3.539 5.541 5.217 1.00 41.12 C ATOM 410 OG SER A 474 3.756 6.941 5.347 1.00 2.41 O ATOM 0 H SER A 474 0.913 5.647 4.671 1.00 62.22 H new ATOM 0 HA SER A 474 3.401 5.565 3.079 1.00 13.52 H new ATOM 0 HB2 SER A 474 2.963 5.177 6.068 1.00 41.12 H new ATOM 0 HB3 SER A 474 4.495 5.017 5.231 1.00 41.12 H new ATOM 0 HG SER A 474 4.231 7.122 6.185 1.00 2.41 H new ATOM 416 N ILE A 475 3.606 3.027 3.446 1.00 1.51 N ATOM 417 CA ILE A 475 3.526 1.600 3.289 1.00 1.41 C ATOM 418 C ILE A 475 4.436 0.882 4.253 1.00 10.52 C ATOM 419 O ILE A 475 5.399 1.454 4.766 1.00 2.41 O ATOM 420 CB ILE A 475 3.854 1.146 1.861 1.00 71.32 C ATOM 421 CG1 ILE A 475 5.175 1.769 1.390 1.00 43.22 C ATOM 422 CG2 ILE A 475 2.694 1.437 0.911 1.00 53.04 C ATOM 423 CD1 ILE A 475 5.636 1.280 0.053 1.00 3.12 C ATOM 0 H ILE A 475 4.529 3.418 3.256 1.00 1.51 H new ATOM 0 HA ILE A 475 2.490 1.339 3.505 1.00 1.41 H new ATOM 0 HB ILE A 475 3.990 0.065 1.859 1.00 71.32 H new ATOM 0 HG12 ILE A 475 5.060 2.852 1.349 1.00 43.22 H new ATOM 0 HG13 ILE A 475 5.948 1.558 2.129 1.00 43.22 H new ATOM 0 HG21 ILE A 475 2.955 1.105 -0.094 1.00 53.04 H new ATOM 0 HG22 ILE A 475 1.804 0.906 1.250 1.00 53.04 H new ATOM 0 HG23 ILE A 475 2.494 2.508 0.898 1.00 53.04 H new ATOM 0 HD11 ILE A 475 6.575 1.767 -0.209 1.00 3.12 H new ATOM 0 HD12 ILE A 475 5.785 0.201 0.092 1.00 3.12 H new ATOM 0 HD13 ILE A 475 4.883 1.515 -0.700 1.00 3.12 H new ATOM 435 N THR A 476 4.121 -0.348 4.496 1.00 53.40 N ATOM 436 CA THR A 476 4.879 -1.191 5.355 1.00 75.52 C ATOM 437 C THR A 476 4.765 -2.620 4.857 1.00 3.53 C ATOM 438 O THR A 476 3.870 -2.938 4.062 1.00 33.34 O ATOM 439 CB THR A 476 4.371 -1.102 6.825 1.00 4.23 C ATOM 440 OG1 THR A 476 5.182 -1.905 7.681 1.00 52.01 O ATOM 441 CG2 THR A 476 2.915 -1.553 6.941 1.00 73.55 C ATOM 0 H THR A 476 3.305 -0.805 4.089 1.00 53.40 H new ATOM 0 HA THR A 476 5.919 -0.866 5.342 1.00 75.52 H new ATOM 0 HB THR A 476 4.437 -0.058 7.131 1.00 4.23 H new ATOM 0 HG1 THR A 476 5.200 -1.511 8.578 1.00 52.01 H new ATOM 0 HG21 THR A 476 2.593 -1.478 7.980 1.00 73.55 H new ATOM 0 HG22 THR A 476 2.286 -0.916 6.319 1.00 73.55 H new ATOM 0 HG23 THR A 476 2.827 -2.587 6.607 1.00 73.55 H new ATOM 449 N SER A 477 5.678 -3.441 5.255 1.00 45.54 N ATOM 450 CA SER A 477 5.629 -4.819 4.954 1.00 65.41 C ATOM 451 C SER A 477 6.112 -5.567 6.188 1.00 62.43 C ATOM 452 O SER A 477 6.892 -5.020 6.987 1.00 62.22 O ATOM 453 CB SER A 477 6.489 -5.138 3.718 1.00 14.24 C ATOM 454 OG SER A 477 6.363 -6.493 3.348 1.00 52.21 O ATOM 0 H SER A 477 6.489 -3.162 5.807 1.00 45.54 H new ATOM 0 HA SER A 477 4.613 -5.128 4.707 1.00 65.41 H new ATOM 0 HB2 SER A 477 6.187 -4.501 2.887 1.00 14.24 H new ATOM 0 HB3 SER A 477 7.534 -4.911 3.930 1.00 14.24 H new ATOM 0 HG SER A 477 5.511 -6.627 2.883 1.00 52.21 H new ATOM 460 N ARG A 478 5.626 -6.761 6.398 1.00 5.51 N ATOM 461 CA ARG A 478 6.052 -7.539 7.539 1.00 32.24 C ATOM 462 C ARG A 478 7.165 -8.460 7.099 1.00 50.53 C ATOM 463 O ARG A 478 8.329 -8.281 7.484 1.00 20.20 O ATOM 464 CB ARG A 478 4.887 -8.362 8.137 1.00 4.23 C ATOM 465 CG ARG A 478 3.657 -7.561 8.615 1.00 32.33 C ATOM 466 CD ARG A 478 3.965 -6.591 9.766 1.00 3.01 C ATOM 467 NE ARG A 478 4.842 -5.487 9.364 1.00 21.35 N ATOM 468 CZ ARG A 478 5.355 -4.565 10.183 1.00 53.51 C ATOM 469 NH1 ARG A 478 5.084 -4.582 11.483 1.00 25.44 N ATOM 470 NH2 ARG A 478 6.131 -3.626 9.689 1.00 34.15 N ATOM 0 H ARG A 478 4.938 -7.218 5.799 1.00 5.51 H new ATOM 0 HA ARG A 478 6.401 -6.861 8.318 1.00 32.24 H new ATOM 0 HB2 ARG A 478 4.556 -9.081 7.388 1.00 4.23 H new ATOM 0 HB3 ARG A 478 5.271 -8.935 8.981 1.00 4.23 H new ATOM 0 HG2 ARG A 478 3.252 -6.998 7.775 1.00 32.33 H new ATOM 0 HG3 ARG A 478 2.882 -8.258 8.935 1.00 32.33 H new ATOM 0 HD2 ARG A 478 3.030 -6.184 10.151 1.00 3.01 H new ATOM 0 HD3 ARG A 478 4.433 -7.141 10.582 1.00 3.01 H new ATOM 0 HE ARG A 478 5.081 -5.417 8.375 1.00 21.35 H new ATOM 0 HH11 ARG A 478 4.477 -5.306 11.868 1.00 25.44 H new ATOM 0 HH12 ARG A 478 5.483 -3.871 12.096 1.00 25.44 H new ATOM 0 HH21 ARG A 478 6.336 -3.607 8.690 1.00 34.15 H new ATOM 0 HH22 ARG A 478 6.528 -2.917 10.305 1.00 34.15 H new ATOM 484 N ASP A 479 6.793 -9.415 6.273 1.00 74.14 N ATOM 485 CA ASP A 479 7.674 -10.413 5.687 1.00 21.20 C ATOM 486 C ASP A 479 6.756 -11.409 5.025 1.00 55.43 C ATOM 487 O ASP A 479 5.622 -11.568 5.465 1.00 53.43 O ATOM 488 CB ASP A 479 8.515 -11.135 6.762 1.00 33.54 C ATOM 489 CG ASP A 479 9.610 -11.993 6.174 1.00 15.04 C ATOM 490 OD1 ASP A 479 9.373 -13.166 5.890 1.00 20.54 O ATOM 491 OD2 ASP A 479 10.730 -11.493 5.985 1.00 1.25 O ATOM 0 H ASP A 479 5.824 -9.525 5.976 1.00 74.14 H new ATOM 0 HA ASP A 479 8.377 -9.949 4.995 1.00 21.20 H new ATOM 0 HB2 ASP A 479 8.959 -10.394 7.427 1.00 33.54 H new ATOM 0 HB3 ASP A 479 7.860 -11.758 7.371 1.00 33.54 H new ATOM 496 N VAL A 480 7.193 -12.056 3.992 1.00 2.50 N ATOM 497 CA VAL A 480 6.321 -12.996 3.297 1.00 21.13 C ATOM 498 C VAL A 480 6.423 -14.409 3.921 1.00 51.35 C ATOM 499 O VAL A 480 5.544 -15.269 3.719 1.00 30.31 O ATOM 500 CB VAL A 480 6.643 -13.026 1.775 1.00 53.52 C ATOM 501 CG1 VAL A 480 8.052 -13.502 1.504 1.00 24.42 C ATOM 502 CG2 VAL A 480 5.618 -13.824 0.993 1.00 50.43 C ATOM 0 H VAL A 480 8.131 -11.965 3.603 1.00 2.50 H new ATOM 0 HA VAL A 480 5.292 -12.656 3.413 1.00 21.13 H new ATOM 0 HB VAL A 480 6.582 -11.997 1.421 1.00 53.52 H new ATOM 0 HG11 VAL A 480 8.234 -13.507 0.429 1.00 24.42 H new ATOM 0 HG12 VAL A 480 8.762 -12.832 1.989 1.00 24.42 H new ATOM 0 HG13 VAL A 480 8.178 -14.510 1.898 1.00 24.42 H new ATOM 0 HG21 VAL A 480 5.882 -13.818 -0.065 1.00 50.43 H new ATOM 0 HG22 VAL A 480 5.602 -14.851 1.357 1.00 50.43 H new ATOM 0 HG23 VAL A 480 4.632 -13.377 1.123 1.00 50.43 H new ATOM 512 N THR A 481 7.476 -14.606 4.706 1.00 62.04 N ATOM 513 CA THR A 481 7.802 -15.858 5.351 1.00 53.44 C ATOM 514 C THR A 481 7.854 -17.009 4.341 1.00 45.10 C ATOM 515 O THR A 481 6.952 -17.846 4.274 1.00 3.40 O ATOM 516 CB THR A 481 6.873 -16.170 6.557 1.00 21.13 C ATOM 517 OG1 THR A 481 6.883 -15.037 7.459 1.00 24.32 O ATOM 518 CG2 THR A 481 7.373 -17.390 7.320 1.00 33.32 C ATOM 0 H THR A 481 8.147 -13.866 4.914 1.00 62.04 H new ATOM 0 HA THR A 481 8.803 -15.749 5.769 1.00 53.44 H new ATOM 0 HB THR A 481 5.868 -16.366 6.183 1.00 21.13 H new ATOM 0 HG1 THR A 481 6.298 -15.222 8.223 1.00 24.32 H new ATOM 0 HG21 THR A 481 6.708 -17.591 8.160 1.00 33.32 H new ATOM 0 HG22 THR A 481 7.389 -18.254 6.655 1.00 33.32 H new ATOM 0 HG23 THR A 481 8.380 -17.199 7.691 1.00 33.32 H new ATOM 526 N ILE A 482 8.883 -16.965 3.504 1.00 51.22 N ATOM 527 CA ILE A 482 9.139 -17.951 2.465 1.00 52.23 C ATOM 528 C ILE A 482 10.306 -17.464 1.592 1.00 33.32 C ATOM 529 O ILE A 482 11.006 -18.253 0.967 1.00 24.30 O ATOM 530 CB ILE A 482 7.882 -18.226 1.560 1.00 62.12 C ATOM 531 CG1 ILE A 482 8.162 -19.350 0.564 1.00 44.40 C ATOM 532 CG2 ILE A 482 7.423 -16.967 0.829 1.00 11.13 C ATOM 533 CD1 ILE A 482 6.995 -19.674 -0.321 1.00 12.24 C ATOM 0 H ILE A 482 9.581 -16.222 3.531 1.00 51.22 H new ATOM 0 HA ILE A 482 9.386 -18.891 2.958 1.00 52.23 H new ATOM 0 HB ILE A 482 7.073 -18.539 2.220 1.00 62.12 H new ATOM 0 HG12 ILE A 482 9.012 -19.069 -0.058 1.00 44.40 H new ATOM 0 HG13 ILE A 482 8.451 -20.246 1.113 1.00 44.40 H new ATOM 0 HG21 ILE A 482 6.553 -17.200 0.215 1.00 11.13 H new ATOM 0 HG22 ILE A 482 7.159 -16.200 1.557 1.00 11.13 H new ATOM 0 HG23 ILE A 482 8.229 -16.602 0.193 1.00 11.13 H new ATOM 0 HD11 ILE A 482 7.267 -20.481 -1.002 1.00 12.24 H new ATOM 0 HD12 ILE A 482 6.149 -19.986 0.292 1.00 12.24 H new ATOM 0 HD13 ILE A 482 6.719 -18.791 -0.897 1.00 12.24 H new ATOM 545 N GLY A 483 10.526 -16.162 1.590 1.00 32.31 N ATOM 546 CA GLY A 483 11.558 -15.588 0.778 1.00 22.20 C ATOM 547 C GLY A 483 10.988 -15.129 -0.530 1.00 3.03 C ATOM 548 O GLY A 483 10.759 -15.944 -1.431 1.00 54.23 O ATOM 0 H GLY A 483 9.998 -15.490 2.146 1.00 32.31 H new ATOM 0 HA2 GLY A 483 12.016 -14.747 1.299 1.00 22.20 H new ATOM 0 HA3 GLY A 483 12.345 -16.322 0.603 1.00 22.20 H new ATOM 552 N GLY A 484 10.719 -13.851 -0.635 1.00 13.35 N ATOM 553 CA GLY A 484 10.151 -13.340 -1.838 1.00 64.01 C ATOM 554 C GLY A 484 10.083 -11.835 -1.865 1.00 1.24 C ATOM 555 O GLY A 484 10.950 -11.147 -1.312 1.00 55.03 O ATOM 0 H GLY A 484 10.885 -13.159 0.095 1.00 13.35 H new ATOM 0 HA2 GLY A 484 10.740 -13.687 -2.687 1.00 64.01 H new ATOM 0 HA3 GLY A 484 9.147 -13.746 -1.960 1.00 64.01 H new ATOM 559 N SER A 485 9.035 -11.336 -2.476 1.00 44.44 N ATOM 560 CA SER A 485 8.848 -9.924 -2.712 1.00 33.02 C ATOM 561 C SER A 485 8.415 -9.177 -1.450 1.00 52.43 C ATOM 562 O SER A 485 8.834 -8.027 -1.238 1.00 45.20 O ATOM 563 CB SER A 485 7.809 -9.759 -3.802 1.00 44.22 C ATOM 564 OG SER A 485 8.163 -10.551 -4.936 1.00 4.33 O ATOM 0 H SER A 485 8.272 -11.913 -2.831 1.00 44.44 H new ATOM 0 HA SER A 485 9.801 -9.492 -3.018 1.00 33.02 H new ATOM 0 HB2 SER A 485 6.829 -10.058 -3.430 1.00 44.22 H new ATOM 0 HB3 SER A 485 7.734 -8.710 -4.089 1.00 44.22 H new ATOM 0 HG SER A 485 7.392 -11.090 -5.212 1.00 4.33 H new ATOM 570 N ALA A 486 7.598 -9.857 -0.622 1.00 2.22 N ATOM 571 CA ALA A 486 7.018 -9.310 0.620 1.00 50.51 C ATOM 572 C ALA A 486 5.843 -8.369 0.319 1.00 63.33 C ATOM 573 O ALA A 486 6.027 -7.291 -0.242 1.00 42.42 O ATOM 574 CB ALA A 486 8.068 -8.660 1.539 1.00 1.42 C ATOM 0 H ALA A 486 7.317 -10.821 -0.802 1.00 2.22 H new ATOM 0 HA ALA A 486 6.623 -10.157 1.181 1.00 50.51 H new ATOM 0 HB1 ALA A 486 7.580 -8.277 2.435 1.00 1.42 H new ATOM 0 HB2 ALA A 486 8.814 -9.403 1.822 1.00 1.42 H new ATOM 0 HB3 ALA A 486 8.555 -7.839 1.012 1.00 1.42 H new ATOM 580 N PRO A 487 4.596 -8.802 0.673 1.00 71.23 N ATOM 581 CA PRO A 487 3.371 -8.022 0.428 1.00 3.31 C ATOM 582 C PRO A 487 3.440 -6.606 1.007 1.00 2.53 C ATOM 583 O PRO A 487 3.876 -6.400 2.148 1.00 73.12 O ATOM 584 CB PRO A 487 2.281 -8.833 1.131 1.00 54.32 C ATOM 585 CG PRO A 487 2.808 -10.222 1.165 1.00 64.53 C ATOM 586 CD PRO A 487 4.295 -10.092 1.325 1.00 41.52 C ATOM 0 HA PRO A 487 3.197 -7.879 -0.638 1.00 3.31 H new ATOM 0 HB2 PRO A 487 2.093 -8.456 2.136 1.00 54.32 H new ATOM 0 HB3 PRO A 487 1.337 -8.781 0.589 1.00 54.32 H new ATOM 0 HG2 PRO A 487 2.374 -10.785 1.991 1.00 64.53 H new ATOM 0 HG3 PRO A 487 2.559 -10.757 0.249 1.00 64.53 H new ATOM 0 HD2 PRO A 487 4.588 -10.090 2.375 1.00 41.52 H new ATOM 0 HD3 PRO A 487 4.824 -10.917 0.848 1.00 41.52 H new ATOM 594 N ILE A 488 2.998 -5.655 0.218 1.00 51.31 N ATOM 595 CA ILE A 488 3.045 -4.246 0.559 1.00 74.51 C ATOM 596 C ILE A 488 1.710 -3.851 1.227 1.00 24.22 C ATOM 597 O ILE A 488 0.655 -4.128 0.685 1.00 35.03 O ATOM 598 CB ILE A 488 3.200 -3.419 -0.750 1.00 3.45 C ATOM 599 CG1 ILE A 488 4.322 -4.000 -1.659 1.00 42.04 C ATOM 600 CG2 ILE A 488 3.469 -1.952 -0.438 1.00 2.02 C ATOM 601 CD1 ILE A 488 5.720 -4.004 -1.068 1.00 50.40 C ATOM 0 H ILE A 488 2.587 -5.839 -0.697 1.00 51.31 H new ATOM 0 HA ILE A 488 3.880 -4.053 1.233 1.00 74.51 H new ATOM 0 HB ILE A 488 2.259 -3.487 -1.295 1.00 3.45 H new ATOM 0 HG12 ILE A 488 4.056 -5.024 -1.921 1.00 42.04 H new ATOM 0 HG13 ILE A 488 4.343 -3.429 -2.587 1.00 42.04 H new ATOM 0 HG21 ILE A 488 3.573 -1.395 -1.369 1.00 2.02 H new ATOM 0 HG22 ILE A 488 2.638 -1.544 0.137 1.00 2.02 H new ATOM 0 HG23 ILE A 488 4.388 -1.866 0.141 1.00 2.02 H new ATOM 0 HD11 ILE A 488 6.418 -4.430 -1.788 1.00 50.40 H new ATOM 0 HD12 ILE A 488 6.019 -2.982 -0.834 1.00 50.40 H new ATOM 0 HD13 ILE A 488 5.728 -4.602 -0.157 1.00 50.40 H new ATOM 613 N TYR A 489 1.754 -3.218 2.377 1.00 53.23 N ATOM 614 CA TYR A 489 0.529 -2.838 3.085 1.00 61.55 C ATOM 615 C TYR A 489 0.533 -1.379 3.448 1.00 22.02 C ATOM 616 O TYR A 489 1.591 -0.759 3.503 1.00 1.03 O ATOM 617 CB TYR A 489 0.335 -3.672 4.360 1.00 61.53 C ATOM 618 CG TYR A 489 0.161 -5.137 4.099 1.00 74.44 C ATOM 619 CD1 TYR A 489 -0.976 -5.594 3.480 1.00 32.12 C ATOM 620 CD2 TYR A 489 1.131 -6.060 4.459 1.00 44.13 C ATOM 621 CE1 TYR A 489 -1.158 -6.921 3.216 1.00 4.52 C ATOM 622 CE2 TYR A 489 0.952 -7.402 4.200 1.00 70.04 C ATOM 623 CZ TYR A 489 -0.200 -7.822 3.576 1.00 62.35 C ATOM 624 OH TYR A 489 -0.391 -9.149 3.301 1.00 33.10 O ATOM 0 H TYR A 489 2.617 -2.951 2.850 1.00 53.23 H new ATOM 0 HA TYR A 489 -0.298 -3.033 2.402 1.00 61.55 H new ATOM 0 HB2 TYR A 489 1.196 -3.528 5.013 1.00 61.53 H new ATOM 0 HB3 TYR A 489 -0.538 -3.301 4.897 1.00 61.53 H new ATOM 0 HD1 TYR A 489 -1.743 -4.889 3.196 1.00 32.12 H new ATOM 0 HD2 TYR A 489 2.034 -5.725 4.946 1.00 44.13 H new ATOM 0 HE1 TYR A 489 -2.059 -7.256 2.723 1.00 4.52 H new ATOM 0 HE2 TYR A 489 1.709 -8.117 4.484 1.00 70.04 H new ATOM 0 HH TYR A 489 0.381 -9.663 3.618 1.00 33.10 H new ATOM 634 N VAL A 490 -0.649 -0.833 3.682 1.00 65.11 N ATOM 635 CA VAL A 490 -0.779 0.543 4.123 1.00 50.45 C ATOM 636 C VAL A 490 -0.363 0.615 5.587 1.00 75.10 C ATOM 637 O VAL A 490 -0.833 -0.182 6.413 1.00 72.45 O ATOM 638 CB VAL A 490 -2.240 1.072 4.022 1.00 11.32 C ATOM 639 CG1 VAL A 490 -2.288 2.565 4.309 1.00 41.04 C ATOM 640 CG2 VAL A 490 -2.878 0.764 2.682 1.00 43.15 C ATOM 0 H VAL A 490 -1.535 -1.326 3.573 1.00 65.11 H new ATOM 0 HA VAL A 490 -0.151 1.156 3.477 1.00 50.45 H new ATOM 0 HB VAL A 490 -2.823 0.546 4.778 1.00 11.32 H new ATOM 0 HG11 VAL A 490 -3.317 2.917 4.234 1.00 41.04 H new ATOM 0 HG12 VAL A 490 -1.912 2.754 5.314 1.00 41.04 H new ATOM 0 HG13 VAL A 490 -1.669 3.095 3.585 1.00 41.04 H new ATOM 0 HG21 VAL A 490 -3.895 1.155 2.665 1.00 43.15 H new ATOM 0 HG22 VAL A 490 -2.297 1.231 1.887 1.00 43.15 H new ATOM 0 HG23 VAL A 490 -2.901 -0.315 2.529 1.00 43.15 H new ATOM 650 N LYS A 491 0.506 1.532 5.892 1.00 53.20 N ATOM 651 CA LYS A 491 0.979 1.725 7.238 1.00 11.53 C ATOM 652 C LYS A 491 0.151 2.772 7.946 1.00 61.12 C ATOM 653 O LYS A 491 -0.506 2.491 8.941 1.00 54.13 O ATOM 654 CB LYS A 491 2.453 2.162 7.223 1.00 35.04 C ATOM 655 CG LYS A 491 3.053 2.450 8.550 1.00 13.42 C ATOM 656 CD LYS A 491 2.997 1.232 9.424 1.00 71.33 C ATOM 657 CE LYS A 491 3.860 1.429 10.596 1.00 74.33 C ATOM 658 NZ LYS A 491 3.846 0.269 11.506 1.00 54.15 N ATOM 0 H LYS A 491 0.912 2.174 5.211 1.00 53.20 H new ATOM 0 HA LYS A 491 0.887 0.779 7.772 1.00 11.53 H new ATOM 0 HB2 LYS A 491 3.040 1.380 6.742 1.00 35.04 H new ATOM 0 HB3 LYS A 491 2.542 3.054 6.603 1.00 35.04 H new ATOM 0 HG2 LYS A 491 4.088 2.770 8.427 1.00 13.42 H new ATOM 0 HG3 LYS A 491 2.520 3.272 9.027 1.00 13.42 H new ATOM 0 HD2 LYS A 491 1.971 1.046 9.742 1.00 71.33 H new ATOM 0 HD3 LYS A 491 3.321 0.355 8.864 1.00 71.33 H new ATOM 0 HE2 LYS A 491 4.882 1.615 10.264 1.00 74.33 H new ATOM 0 HE3 LYS A 491 3.534 2.317 11.138 1.00 74.33 H new ATOM 0 HZ1 LYS A 491 4.470 0.456 12.317 1.00 54.15 H new ATOM 0 HZ2 LYS A 491 2.877 0.106 11.845 1.00 54.15 H new ATOM 0 HZ3 LYS A 491 4.182 -0.574 10.999 1.00 54.15 H new ATOM 672 N ASN A 492 0.170 3.960 7.418 1.00 23.12 N ATOM 673 CA ASN A 492 -0.480 5.082 8.063 1.00 75.41 C ATOM 674 C ASN A 492 -1.139 5.953 7.042 1.00 64.42 C ATOM 675 O ASN A 492 -0.675 6.047 5.896 1.00 62.30 O ATOM 676 CB ASN A 492 0.557 5.918 8.812 1.00 13.04 C ATOM 677 CG ASN A 492 -0.030 7.080 9.612 1.00 25.21 C ATOM 678 OD1 ASN A 492 -0.163 8.190 9.109 1.00 61.13 O ATOM 679 ND2 ASN A 492 -0.367 6.839 10.848 1.00 1.12 N ATOM 0 H ASN A 492 0.630 4.186 6.536 1.00 23.12 H new ATOM 0 HA ASN A 492 -1.227 4.696 8.757 1.00 75.41 H new ATOM 0 HB2 ASN A 492 1.109 5.268 9.490 1.00 13.04 H new ATOM 0 HB3 ASN A 492 1.275 6.313 8.094 1.00 13.04 H new ATOM 0 HD21 ASN A 492 -0.754 7.585 11.426 1.00 1.12 H new ATOM 0 HD22 ASN A 492 -0.244 5.904 11.237 1.00 1.12 H new ATOM 686 N ILE A 493 -2.203 6.555 7.453 1.00 52.52 N ATOM 687 CA ILE A 493 -2.946 7.499 6.679 1.00 34.21 C ATOM 688 C ILE A 493 -2.914 8.827 7.426 1.00 13.32 C ATOM 689 O ILE A 493 -3.555 8.983 8.476 1.00 42.02 O ATOM 690 CB ILE A 493 -4.413 7.000 6.517 1.00 64.31 C ATOM 691 CG1 ILE A 493 -4.462 5.713 5.709 1.00 31.25 C ATOM 692 CG2 ILE A 493 -5.333 8.041 5.916 1.00 54.34 C ATOM 693 CD1 ILE A 493 -4.002 5.843 4.280 1.00 43.11 C ATOM 0 H ILE A 493 -2.599 6.397 8.380 1.00 52.52 H new ATOM 0 HA ILE A 493 -2.516 7.616 5.684 1.00 34.21 H new ATOM 0 HB ILE A 493 -4.781 6.803 7.524 1.00 64.31 H new ATOM 0 HG12 ILE A 493 -3.846 4.965 6.207 1.00 31.25 H new ATOM 0 HG13 ILE A 493 -5.485 5.337 5.713 1.00 31.25 H new ATOM 0 HG21 ILE A 493 -6.339 7.631 5.830 1.00 54.34 H new ATOM 0 HG22 ILE A 493 -5.354 8.922 6.557 1.00 54.34 H new ATOM 0 HG23 ILE A 493 -4.969 8.321 4.927 1.00 54.34 H new ATOM 0 HD11 ILE A 493 -4.073 4.874 3.785 1.00 43.11 H new ATOM 0 HD12 ILE A 493 -4.632 6.564 3.759 1.00 43.11 H new ATOM 0 HD13 ILE A 493 -2.967 6.185 4.261 1.00 43.11 H new ATOM 705 N LEU A 494 -2.105 9.730 6.925 1.00 42.30 N ATOM 706 CA LEU A 494 -1.932 11.067 7.488 1.00 45.32 C ATOM 707 C LEU A 494 -3.263 11.829 7.632 1.00 65.05 C ATOM 708 O LEU A 494 -4.203 11.618 6.863 1.00 44.45 O ATOM 709 CB LEU A 494 -0.898 11.896 6.672 1.00 53.13 C ATOM 710 CG LEU A 494 0.606 11.543 6.845 1.00 70.11 C ATOM 711 CD1 LEU A 494 0.934 10.113 6.430 1.00 21.40 C ATOM 712 CD2 LEU A 494 1.467 12.527 6.076 1.00 5.45 C ATOM 0 H LEU A 494 -1.533 9.562 6.098 1.00 42.30 H new ATOM 0 HA LEU A 494 -1.539 10.929 8.495 1.00 45.32 H new ATOM 0 HB2 LEU A 494 -1.147 11.797 5.615 1.00 53.13 H new ATOM 0 HB3 LEU A 494 -1.029 12.946 6.933 1.00 53.13 H new ATOM 0 HG LEU A 494 0.827 11.617 7.910 1.00 70.11 H new ATOM 0 HD11 LEU A 494 1.998 9.927 6.574 1.00 21.40 H new ATOM 0 HD12 LEU A 494 0.359 9.416 7.039 1.00 21.40 H new ATOM 0 HD13 LEU A 494 0.680 9.972 5.380 1.00 21.40 H new ATOM 0 HD21 LEU A 494 2.518 12.269 6.205 1.00 5.45 H new ATOM 0 HD22 LEU A 494 1.210 12.485 5.017 1.00 5.45 H new ATOM 0 HD23 LEU A 494 1.292 13.535 6.452 1.00 5.45 H new ATOM 724 N PRO A 495 -3.337 12.757 8.611 1.00 70.01 N ATOM 725 CA PRO A 495 -4.579 13.530 8.954 1.00 24.54 C ATOM 726 C PRO A 495 -4.828 14.654 7.968 1.00 2.21 C ATOM 727 O PRO A 495 -5.804 15.380 8.064 1.00 51.51 O ATOM 728 CB PRO A 495 -4.147 14.181 10.252 1.00 4.24 C ATOM 729 CG PRO A 495 -2.742 14.495 9.939 1.00 33.41 C ATOM 730 CD PRO A 495 -2.214 13.193 9.482 1.00 73.24 C ATOM 0 HA PRO A 495 -5.475 12.909 8.975 1.00 24.54 H new ATOM 0 HB2 PRO A 495 -4.730 15.073 10.483 1.00 4.24 H new ATOM 0 HB3 PRO A 495 -4.242 13.509 11.105 1.00 4.24 H new ATOM 0 HG2 PRO A 495 -2.660 15.259 9.166 1.00 33.41 H new ATOM 0 HG3 PRO A 495 -2.205 14.866 10.812 1.00 33.41 H new ATOM 0 HD2 PRO A 495 -1.276 13.291 8.936 1.00 73.24 H new ATOM 0 HD3 PRO A 495 -2.033 12.503 10.306 1.00 73.24 H new ATOM 738 N ARG A 496 -3.919 14.792 7.063 1.00 14.11 N ATOM 739 CA ARG A 496 -3.896 15.835 6.092 1.00 24.10 C ATOM 740 C ARG A 496 -3.064 15.424 4.941 1.00 1.55 C ATOM 741 O ARG A 496 -1.856 15.240 5.035 1.00 54.11 O ATOM 742 CB ARG A 496 -3.416 17.156 6.659 1.00 72.05 C ATOM 743 CG ARG A 496 -4.436 17.935 7.466 1.00 64.12 C ATOM 744 CD ARG A 496 -3.864 19.229 7.967 1.00 22.21 C ATOM 745 NE ARG A 496 -4.829 19.980 8.771 1.00 24.52 N ATOM 746 CZ ARG A 496 -4.525 21.000 9.581 1.00 32.01 C ATOM 747 NH1 ARG A 496 -3.260 21.408 9.700 1.00 53.21 N ATOM 748 NH2 ARG A 496 -5.483 21.610 10.263 1.00 65.03 N ATOM 0 H ARG A 496 -3.132 14.149 6.976 1.00 14.11 H new ATOM 0 HA ARG A 496 -4.922 15.999 5.763 1.00 24.10 H new ATOM 0 HB2 ARG A 496 -2.549 16.965 7.291 1.00 72.05 H new ATOM 0 HB3 ARG A 496 -3.077 17.783 5.834 1.00 72.05 H new ATOM 0 HG2 ARG A 496 -5.312 18.137 6.850 1.00 64.12 H new ATOM 0 HG3 ARG A 496 -4.772 17.333 8.310 1.00 64.12 H new ATOM 0 HD2 ARG A 496 -2.975 19.025 8.564 1.00 22.21 H new ATOM 0 HD3 ARG A 496 -3.547 19.837 7.120 1.00 22.21 H new ATOM 0 HE ARG A 496 -5.809 19.704 8.709 1.00 24.52 H new ATOM 0 HH11 ARG A 496 -2.522 20.942 9.172 1.00 53.21 H new ATOM 0 HH12 ARG A 496 -3.031 22.186 10.318 1.00 53.21 H new ATOM 0 HH21 ARG A 496 -6.451 21.302 10.170 1.00 65.03 H new ATOM 0 HH22 ARG A 496 -5.253 22.388 10.881 1.00 65.03 H new ATOM 762 N GLY A 497 -3.727 15.227 3.915 1.00 73.44 N ATOM 763 CA GLY A 497 -3.151 14.849 2.654 1.00 24.15 C ATOM 764 C GLY A 497 -4.183 14.243 1.747 1.00 23.04 C ATOM 765 O GLY A 497 -5.356 14.279 2.066 1.00 72.21 O ATOM 0 H GLY A 497 -4.742 15.319 3.886 1.00 73.44 H new ATOM 0 HA2 GLY A 497 -2.711 15.724 2.175 1.00 24.15 H new ATOM 0 HA3 GLY A 497 -2.344 14.136 2.819 1.00 24.15 H new ATOM 769 N ALA A 498 -3.736 13.644 0.656 1.00 42.11 N ATOM 770 CA ALA A 498 -4.569 13.114 -0.372 1.00 40.23 C ATOM 771 C ALA A 498 -5.520 12.104 0.191 1.00 34.33 C ATOM 772 O ALA A 498 -6.721 12.169 -0.042 1.00 41.31 O ATOM 773 CB ALA A 498 -3.716 12.454 -1.441 1.00 54.13 C ATOM 0 H ALA A 498 -2.741 13.516 0.470 1.00 42.11 H new ATOM 0 HA ALA A 498 -5.138 13.935 -0.810 1.00 40.23 H new ATOM 0 HB1 ALA A 498 -4.360 12.051 -2.223 1.00 54.13 H new ATOM 0 HB2 ALA A 498 -3.039 13.191 -1.872 1.00 54.13 H new ATOM 0 HB3 ALA A 498 -3.136 11.645 -0.996 1.00 54.13 H new ATOM 779 N ALA A 499 -4.965 11.196 1.007 1.00 53.33 N ATOM 780 CA ALA A 499 -5.713 10.091 1.561 1.00 1.14 C ATOM 781 C ALA A 499 -6.918 10.562 2.339 1.00 2.51 C ATOM 782 O ALA A 499 -7.986 10.001 2.201 1.00 31.13 O ATOM 783 CB ALA A 499 -4.817 9.225 2.425 1.00 65.14 C ATOM 0 H ALA A 499 -3.986 11.219 1.293 1.00 53.33 H new ATOM 0 HA ALA A 499 -6.081 9.491 0.729 1.00 1.14 H new ATOM 0 HB1 ALA A 499 -5.396 8.397 2.835 1.00 65.14 H new ATOM 0 HB2 ALA A 499 -3.999 8.832 1.821 1.00 65.14 H new ATOM 0 HB3 ALA A 499 -4.411 9.822 3.241 1.00 65.14 H new ATOM 789 N ILE A 500 -6.742 11.579 3.149 1.00 24.41 N ATOM 790 CA ILE A 500 -7.841 12.112 3.926 1.00 65.54 C ATOM 791 C ILE A 500 -8.742 13.063 3.122 1.00 33.43 C ATOM 792 O ILE A 500 -9.960 13.050 3.291 1.00 61.43 O ATOM 793 CB ILE A 500 -7.373 12.756 5.238 1.00 44.34 C ATOM 794 CG1 ILE A 500 -8.558 13.138 6.115 1.00 64.45 C ATOM 795 CG2 ILE A 500 -6.514 13.963 4.963 1.00 23.22 C ATOM 796 CD1 ILE A 500 -8.158 13.679 7.454 1.00 23.22 C ATOM 0 H ILE A 500 -5.851 12.055 3.289 1.00 24.41 H new ATOM 0 HA ILE A 500 -8.455 11.251 4.189 1.00 65.54 H new ATOM 0 HB ILE A 500 -6.776 12.020 5.776 1.00 44.34 H new ATOM 0 HG12 ILE A 500 -9.160 13.884 5.595 1.00 64.45 H new ATOM 0 HG13 ILE A 500 -9.191 12.262 6.260 1.00 64.45 H new ATOM 0 HG21 ILE A 500 -6.193 14.404 5.907 1.00 23.22 H new ATOM 0 HG22 ILE A 500 -5.639 13.663 4.387 1.00 23.22 H new ATOM 0 HG23 ILE A 500 -7.088 14.696 4.396 1.00 23.22 H new ATOM 0 HD11 ILE A 500 -9.051 13.931 8.026 1.00 23.22 H new ATOM 0 HD12 ILE A 500 -7.582 12.927 7.993 1.00 23.22 H new ATOM 0 HD13 ILE A 500 -7.550 14.574 7.318 1.00 23.22 H new ATOM 808 N GLN A 501 -8.148 13.876 2.242 1.00 44.33 N ATOM 809 CA GLN A 501 -8.922 14.834 1.465 1.00 64.01 C ATOM 810 C GLN A 501 -9.869 14.126 0.536 1.00 35.01 C ATOM 811 O GLN A 501 -11.033 14.513 0.403 1.00 42.13 O ATOM 812 CB GLN A 501 -8.035 15.812 0.696 1.00 73.43 C ATOM 813 CG GLN A 501 -7.170 16.705 1.575 1.00 3.53 C ATOM 814 CD GLN A 501 -7.973 17.503 2.577 1.00 41.12 C ATOM 815 OE1 GLN A 501 -8.197 17.064 3.703 1.00 35.31 O ATOM 816 NE2 GLN A 501 -8.412 18.665 2.182 1.00 1.33 N ATOM 0 H GLN A 501 -7.145 13.886 2.055 1.00 44.33 H new ATOM 0 HA GLN A 501 -9.504 15.423 2.174 1.00 64.01 H new ATOM 0 HB2 GLN A 501 -7.388 15.246 0.026 1.00 73.43 H new ATOM 0 HB3 GLN A 501 -8.668 16.442 0.071 1.00 73.43 H new ATOM 0 HG2 GLN A 501 -6.445 16.089 2.107 1.00 3.53 H new ATOM 0 HG3 GLN A 501 -6.604 17.390 0.943 1.00 3.53 H new ATOM 0 HE21 GLN A 501 -8.205 18.995 1.239 1.00 1.33 H new ATOM 0 HE22 GLN A 501 -8.962 19.245 2.816 1.00 1.33 H new ATOM 825 N ASP A 502 -9.395 13.074 -0.085 1.00 0.51 N ATOM 826 CA ASP A 502 -10.246 12.292 -0.949 1.00 42.42 C ATOM 827 C ASP A 502 -10.994 11.293 -0.115 1.00 21.14 C ATOM 828 O ASP A 502 -12.142 10.954 -0.422 1.00 34.24 O ATOM 829 CB ASP A 502 -9.474 11.588 -2.069 1.00 20.53 C ATOM 830 CG ASP A 502 -8.830 12.538 -3.073 1.00 13.11 C ATOM 831 OD1 ASP A 502 -9.554 13.080 -3.948 1.00 31.25 O ATOM 832 OD2 ASP A 502 -7.604 12.756 -3.008 1.00 15.33 O ATOM 0 H ASP A 502 -8.434 12.741 -0.010 1.00 0.51 H new ATOM 0 HA ASP A 502 -10.940 12.972 -1.442 1.00 42.42 H new ATOM 0 HB2 ASP A 502 -8.698 10.965 -1.625 1.00 20.53 H new ATOM 0 HB3 ASP A 502 -10.153 10.921 -2.600 1.00 20.53 H new ATOM 837 N GLY A 503 -10.342 10.835 0.970 1.00 44.21 N ATOM 838 CA GLY A 503 -10.962 9.919 1.897 1.00 65.35 C ATOM 839 C GLY A 503 -11.356 8.608 1.283 1.00 14.45 C ATOM 840 O GLY A 503 -12.462 8.106 1.514 1.00 41.22 O ATOM 0 H GLY A 503 -9.386 11.095 1.211 1.00 44.21 H new ATOM 0 HA2 GLY A 503 -10.275 9.731 2.722 1.00 65.35 H new ATOM 0 HA3 GLY A 503 -11.848 10.391 2.322 1.00 65.35 H new ATOM 844 N ARG A 504 -10.476 8.043 0.523 1.00 24.32 N ATOM 845 CA ARG A 504 -10.778 6.809 -0.167 1.00 54.11 C ATOM 846 C ARG A 504 -9.918 5.657 0.317 1.00 62.15 C ATOM 847 O ARG A 504 -10.330 4.506 0.286 1.00 61.10 O ATOM 848 CB ARG A 504 -10.623 7.014 -1.655 1.00 52.35 C ATOM 849 CG ARG A 504 -11.601 8.008 -2.222 1.00 54.42 C ATOM 850 CD ARG A 504 -11.336 8.299 -3.679 1.00 42.34 C ATOM 851 NE ARG A 504 -12.338 9.205 -4.225 1.00 55.22 N ATOM 852 CZ ARG A 504 -12.227 9.902 -5.359 1.00 15.30 C ATOM 853 NH1 ARG A 504 -11.102 9.893 -6.051 1.00 42.10 N ATOM 854 NH2 ARG A 504 -13.239 10.625 -5.782 1.00 14.41 N ATOM 0 H ARG A 504 -9.538 8.408 0.357 1.00 24.32 H new ATOM 0 HA ARG A 504 -11.810 6.539 0.055 1.00 54.11 H new ATOM 0 HB2 ARG A 504 -9.608 7.352 -1.865 1.00 52.35 H new ATOM 0 HB3 ARG A 504 -10.751 6.058 -2.162 1.00 52.35 H new ATOM 0 HG2 ARG A 504 -12.615 7.624 -2.108 1.00 54.42 H new ATOM 0 HG3 ARG A 504 -11.546 8.935 -1.652 1.00 54.42 H new ATOM 0 HD2 ARG A 504 -10.345 8.739 -3.791 1.00 42.34 H new ATOM 0 HD3 ARG A 504 -11.337 7.367 -4.245 1.00 42.34 H new ATOM 0 HE ARG A 504 -13.201 9.317 -3.694 1.00 55.22 H new ATOM 0 HH11 ARG A 504 -10.305 9.349 -5.721 1.00 42.10 H new ATOM 0 HH12 ARG A 504 -11.031 10.430 -6.915 1.00 42.10 H new ATOM 0 HH21 ARG A 504 -14.106 10.653 -5.245 1.00 14.41 H new ATOM 0 HH22 ARG A 504 -13.158 11.159 -6.647 1.00 14.41 H new ATOM 868 N LEU A 505 -8.748 5.970 0.783 1.00 62.24 N ATOM 869 CA LEU A 505 -7.829 4.959 1.237 1.00 52.44 C ATOM 870 C LEU A 505 -7.773 4.982 2.749 1.00 13.41 C ATOM 871 O LEU A 505 -7.922 6.049 3.363 1.00 2.31 O ATOM 872 CB LEU A 505 -6.436 5.228 0.645 1.00 44.22 C ATOM 873 CG LEU A 505 -5.330 4.220 0.985 1.00 11.11 C ATOM 874 CD1 LEU A 505 -5.681 2.836 0.484 1.00 63.04 C ATOM 875 CD2 LEU A 505 -4.016 4.668 0.401 1.00 14.01 C ATOM 0 H LEU A 505 -8.400 6.926 0.861 1.00 62.24 H new ATOM 0 HA LEU A 505 -8.165 3.976 0.908 1.00 52.44 H new ATOM 0 HB2 LEU A 505 -6.532 5.273 -0.440 1.00 44.22 H new ATOM 0 HB3 LEU A 505 -6.111 6.214 0.978 1.00 44.22 H new ATOM 0 HG LEU A 505 -5.237 4.174 2.070 1.00 11.11 H new ATOM 0 HD11 LEU A 505 -4.880 2.143 0.739 1.00 63.04 H new ATOM 0 HD12 LEU A 505 -6.609 2.505 0.950 1.00 63.04 H new ATOM 0 HD13 LEU A 505 -5.808 2.862 -0.598 1.00 63.04 H new ATOM 0 HD21 LEU A 505 -3.241 3.943 0.650 1.00 14.01 H new ATOM 0 HD22 LEU A 505 -4.107 4.744 -0.683 1.00 14.01 H new ATOM 0 HD23 LEU A 505 -3.748 5.641 0.812 1.00 14.01 H new ATOM 887 N LYS A 506 -7.586 3.831 3.351 1.00 34.43 N ATOM 888 CA LYS A 506 -7.449 3.751 4.779 1.00 31.32 C ATOM 889 C LYS A 506 -6.352 2.763 5.112 1.00 31.25 C ATOM 890 O LYS A 506 -5.960 1.953 4.260 1.00 24.34 O ATOM 891 CB LYS A 506 -8.781 3.410 5.513 1.00 2.54 C ATOM 892 CG LYS A 506 -9.332 1.981 5.354 1.00 50.42 C ATOM 893 CD LYS A 506 -9.677 1.597 3.920 1.00 64.13 C ATOM 894 CE LYS A 506 -10.814 2.415 3.328 1.00 63.21 C ATOM 895 NZ LYS A 506 -11.116 1.990 1.936 1.00 5.35 N ATOM 0 H LYS A 506 -7.526 2.935 2.868 1.00 34.43 H new ATOM 0 HA LYS A 506 -7.176 4.740 5.146 1.00 31.32 H new ATOM 0 HB2 LYS A 506 -8.637 3.599 6.577 1.00 2.54 H new ATOM 0 HB3 LYS A 506 -9.545 4.106 5.166 1.00 2.54 H new ATOM 0 HG2 LYS A 506 -8.596 1.276 5.739 1.00 50.42 H new ATOM 0 HG3 LYS A 506 -10.225 1.878 5.970 1.00 50.42 H new ATOM 0 HD2 LYS A 506 -8.791 1.718 3.297 1.00 64.13 H new ATOM 0 HD3 LYS A 506 -9.946 0.541 3.890 1.00 64.13 H new ATOM 0 HE2 LYS A 506 -11.705 2.304 3.946 1.00 63.21 H new ATOM 0 HE3 LYS A 506 -10.548 3.472 3.338 1.00 63.21 H new ATOM 0 HZ1 LYS A 506 -10.884 2.762 1.279 1.00 5.35 H new ATOM 0 HZ2 LYS A 506 -10.549 1.151 1.698 1.00 5.35 H new ATOM 0 HZ3 LYS A 506 -12.127 1.759 1.855 1.00 5.35 H new ATOM 909 N ALA A 507 -5.847 2.825 6.311 1.00 25.14 N ATOM 910 CA ALA A 507 -4.742 1.985 6.696 1.00 14.43 C ATOM 911 C ALA A 507 -5.215 0.615 7.127 1.00 11.21 C ATOM 912 O ALA A 507 -6.004 0.482 8.060 1.00 15.22 O ATOM 913 CB ALA A 507 -3.897 2.646 7.771 1.00 71.34 C ATOM 0 H ALA A 507 -6.182 3.450 7.044 1.00 25.14 H new ATOM 0 HA ALA A 507 -4.109 1.849 5.819 1.00 14.43 H new ATOM 0 HB1 ALA A 507 -3.071 1.988 8.041 1.00 71.34 H new ATOM 0 HB2 ALA A 507 -3.501 3.589 7.394 1.00 71.34 H new ATOM 0 HB3 ALA A 507 -4.511 2.836 8.651 1.00 71.34 H new ATOM 919 N GLY A 508 -4.737 -0.399 6.434 1.00 45.12 N ATOM 920 CA GLY A 508 -5.117 -1.753 6.745 1.00 30.20 C ATOM 921 C GLY A 508 -5.219 -2.618 5.506 1.00 5.24 C ATOM 922 O GLY A 508 -5.321 -3.848 5.603 1.00 40.42 O ATOM 0 H GLY A 508 -4.086 -0.307 5.654 1.00 45.12 H new ATOM 0 HA2 GLY A 508 -4.387 -2.186 7.429 1.00 30.20 H new ATOM 0 HA3 GLY A 508 -6.076 -1.749 7.263 1.00 30.20 H new ATOM 926 N ASP A 509 -5.204 -1.994 4.345 1.00 25.14 N ATOM 927 CA ASP A 509 -5.293 -2.747 3.080 1.00 44.40 C ATOM 928 C ASP A 509 -3.927 -3.051 2.503 1.00 52.13 C ATOM 929 O ASP A 509 -2.895 -2.573 3.012 1.00 3.22 O ATOM 930 CB ASP A 509 -6.146 -2.030 2.016 1.00 1.42 C ATOM 931 CG ASP A 509 -7.611 -1.957 2.360 1.00 72.24 C ATOM 932 OD1 ASP A 509 -8.318 -2.947 2.176 1.00 53.24 O ATOM 933 OD2 ASP A 509 -8.076 -0.899 2.820 1.00 22.50 O ATOM 0 H ASP A 509 -5.133 -0.982 4.236 1.00 25.14 H new ATOM 0 HA ASP A 509 -5.787 -3.683 3.339 1.00 44.40 H new ATOM 0 HB2 ASP A 509 -5.764 -1.019 1.878 1.00 1.42 H new ATOM 0 HB3 ASP A 509 -6.031 -2.547 1.063 1.00 1.42 H new ATOM 938 N ARG A 510 -3.916 -3.848 1.449 1.00 14.24 N ATOM 939 CA ARG A 510 -2.692 -4.211 0.764 1.00 51.35 C ATOM 940 C ARG A 510 -2.555 -3.422 -0.515 1.00 52.12 C ATOM 941 O ARG A 510 -3.517 -3.251 -1.241 1.00 2.54 O ATOM 942 CB ARG A 510 -2.660 -5.709 0.416 1.00 52.25 C ATOM 943 CG ARG A 510 -1.387 -6.124 -0.317 1.00 72.44 C ATOM 944 CD ARG A 510 -1.399 -7.555 -0.803 1.00 22.13 C ATOM 945 NE ARG A 510 -1.456 -8.524 0.294 1.00 51.23 N ATOM 946 CZ ARG A 510 -1.595 -9.851 0.151 1.00 30.13 C ATOM 947 NH1 ARG A 510 -1.678 -10.399 -1.064 1.00 41.24 N ATOM 948 NH2 ARG A 510 -1.623 -10.625 1.226 1.00 45.21 N ATOM 0 H ARG A 510 -4.757 -4.261 1.045 1.00 14.24 H new ATOM 0 HA ARG A 510 -1.867 -3.986 1.440 1.00 51.35 H new ATOM 0 HB2 ARG A 510 -2.751 -6.291 1.333 1.00 52.25 H new ATOM 0 HB3 ARG A 510 -3.524 -5.951 -0.203 1.00 52.25 H new ATOM 0 HG2 ARG A 510 -1.239 -5.462 -1.170 1.00 72.44 H new ATOM 0 HG3 ARG A 510 -0.535 -5.983 0.348 1.00 72.44 H new ATOM 0 HD2 ARG A 510 -2.256 -7.704 -1.459 1.00 22.13 H new ATOM 0 HD3 ARG A 510 -0.505 -7.739 -1.399 1.00 22.13 H new ATOM 0 HE ARG A 510 -1.384 -8.160 1.244 1.00 51.23 H new ATOM 0 HH11 ARG A 510 -1.636 -9.808 -1.894 1.00 41.24 H new ATOM 0 HH12 ARG A 510 -1.784 -11.409 -1.162 1.00 41.24 H new ATOM 0 HH21 ARG A 510 -1.539 -10.211 2.155 1.00 45.21 H new ATOM 0 HH22 ARG A 510 -1.728 -11.634 1.125 1.00 45.21 H new ATOM 962 N LEU A 511 -1.375 -2.966 -0.774 1.00 24.42 N ATOM 963 CA LEU A 511 -1.052 -2.270 -1.994 1.00 74.40 C ATOM 964 C LEU A 511 -0.680 -3.265 -3.095 1.00 74.41 C ATOM 965 O LEU A 511 0.269 -4.039 -2.942 1.00 72.31 O ATOM 966 CB LEU A 511 0.120 -1.302 -1.771 1.00 2.30 C ATOM 967 CG LEU A 511 -0.152 0.064 -1.167 1.00 72.34 C ATOM 968 CD1 LEU A 511 -1.038 0.871 -2.091 1.00 32.44 C ATOM 969 CD2 LEU A 511 -0.741 -0.038 0.207 1.00 52.42 C ATOM 0 H LEU A 511 -0.585 -3.064 -0.136 1.00 24.42 H new ATOM 0 HA LEU A 511 -1.932 -1.704 -2.300 1.00 74.40 H new ATOM 0 HB2 LEU A 511 0.844 -1.806 -1.130 1.00 2.30 H new ATOM 0 HB3 LEU A 511 0.603 -1.144 -2.735 1.00 2.30 H new ATOM 0 HG LEU A 511 0.801 0.582 -1.058 1.00 72.34 H new ATOM 0 HD11 LEU A 511 -1.228 1.849 -1.650 1.00 32.44 H new ATOM 0 HD12 LEU A 511 -0.541 0.997 -3.053 1.00 32.44 H new ATOM 0 HD13 LEU A 511 -1.984 0.349 -2.236 1.00 32.44 H new ATOM 0 HD21 LEU A 511 -0.920 0.962 0.601 1.00 52.42 H new ATOM 0 HD22 LEU A 511 -1.684 -0.583 0.159 1.00 52.42 H new ATOM 0 HD23 LEU A 511 -0.049 -0.568 0.861 1.00 52.42 H new ATOM 981 N ILE A 512 -1.436 -3.267 -4.177 1.00 40.24 N ATOM 982 CA ILE A 512 -1.124 -4.125 -5.327 1.00 73.52 C ATOM 983 C ILE A 512 -0.399 -3.340 -6.394 1.00 40.00 C ATOM 984 O ILE A 512 0.618 -3.795 -6.919 1.00 51.11 O ATOM 985 CB ILE A 512 -2.374 -4.823 -5.923 1.00 23.20 C ATOM 986 CG1 ILE A 512 -3.040 -5.723 -4.881 1.00 4.22 C ATOM 987 CG2 ILE A 512 -2.006 -5.640 -7.162 1.00 64.31 C ATOM 988 CD1 ILE A 512 -2.156 -6.853 -4.375 1.00 72.02 C ATOM 0 H ILE A 512 -2.269 -2.690 -4.293 1.00 40.24 H new ATOM 0 HA ILE A 512 -0.473 -4.916 -4.955 1.00 73.52 H new ATOM 0 HB ILE A 512 -3.080 -4.046 -6.218 1.00 23.20 H new ATOM 0 HG12 ILE A 512 -3.349 -5.111 -4.033 1.00 4.22 H new ATOM 0 HG13 ILE A 512 -3.945 -6.150 -5.312 1.00 4.22 H new ATOM 0 HG21 ILE A 512 -2.900 -6.119 -7.561 1.00 64.31 H new ATOM 0 HG22 ILE A 512 -1.579 -4.981 -7.919 1.00 64.31 H new ATOM 0 HG23 ILE A 512 -1.276 -6.403 -6.891 1.00 64.31 H new ATOM 0 HD11 ILE A 512 -2.704 -7.443 -3.640 1.00 72.02 H new ATOM 0 HD12 ILE A 512 -1.868 -7.491 -5.210 1.00 72.02 H new ATOM 0 HD13 ILE A 512 -1.262 -6.436 -3.912 1.00 72.02 H new ATOM 1000 N GLU A 513 -0.909 -2.181 -6.712 1.00 24.32 N ATOM 1001 CA GLU A 513 -0.255 -1.308 -7.648 1.00 4.34 C ATOM 1002 C GLU A 513 -0.553 0.120 -7.289 1.00 40.21 C ATOM 1003 O GLU A 513 -1.616 0.421 -6.732 1.00 64.43 O ATOM 1004 CB GLU A 513 -0.643 -1.587 -9.120 1.00 34.32 C ATOM 1005 CG GLU A 513 -2.088 -1.359 -9.456 1.00 54.24 C ATOM 1006 CD GLU A 513 -2.369 -1.457 -10.924 1.00 3.32 C ATOM 1007 OE1 GLU A 513 -2.545 -2.584 -11.448 1.00 60.13 O ATOM 1008 OE2 GLU A 513 -2.445 -0.405 -11.586 1.00 4.41 O ATOM 0 H GLU A 513 -1.783 -1.817 -6.333 1.00 24.32 H new ATOM 0 HA GLU A 513 0.815 -1.501 -7.576 1.00 4.34 H new ATOM 0 HB2 GLU A 513 -0.033 -0.955 -9.765 1.00 34.32 H new ATOM 0 HB3 GLU A 513 -0.391 -2.621 -9.355 1.00 34.32 H new ATOM 0 HG2 GLU A 513 -2.699 -2.089 -8.925 1.00 54.24 H new ATOM 0 HG3 GLU A 513 -2.387 -0.374 -9.099 1.00 54.24 H new ATOM 1015 N VAL A 514 0.370 0.978 -7.566 1.00 31.23 N ATOM 1016 CA VAL A 514 0.195 2.363 -7.360 1.00 55.51 C ATOM 1017 C VAL A 514 0.642 3.111 -8.595 1.00 43.52 C ATOM 1018 O VAL A 514 1.772 2.976 -9.066 1.00 53.20 O ATOM 1019 CB VAL A 514 0.847 2.904 -6.033 1.00 64.40 C ATOM 1020 CG1 VAL A 514 2.266 2.516 -5.928 1.00 31.40 C ATOM 1021 CG2 VAL A 514 0.744 4.400 -5.930 1.00 4.23 C ATOM 0 H VAL A 514 1.281 0.725 -7.949 1.00 31.23 H new ATOM 0 HA VAL A 514 -0.869 2.545 -7.207 1.00 55.51 H new ATOM 0 HB VAL A 514 0.288 2.451 -5.214 1.00 64.40 H new ATOM 0 HG11 VAL A 514 2.682 2.907 -5.000 1.00 31.40 H new ATOM 0 HG12 VAL A 514 2.347 1.429 -5.933 1.00 31.40 H new ATOM 0 HG13 VAL A 514 2.819 2.925 -6.774 1.00 31.40 H new ATOM 0 HG21 VAL A 514 1.205 4.733 -5.000 1.00 4.23 H new ATOM 0 HG22 VAL A 514 1.257 4.859 -6.775 1.00 4.23 H new ATOM 0 HG23 VAL A 514 -0.306 4.694 -5.940 1.00 4.23 H new ATOM 1031 N ASN A 515 -0.299 3.807 -9.146 1.00 73.20 N ATOM 1032 CA ASN A 515 -0.174 4.629 -10.335 1.00 20.22 C ATOM 1033 C ASN A 515 0.119 3.789 -11.585 1.00 31.25 C ATOM 1034 O ASN A 515 0.647 4.292 -12.570 1.00 12.05 O ATOM 1035 CB ASN A 515 0.859 5.745 -10.148 1.00 22.30 C ATOM 1036 CG ASN A 515 0.329 7.083 -10.653 1.00 62.30 C ATOM 1037 OD1 ASN A 515 0.680 8.126 -10.138 1.00 75.31 O ATOM 1038 ND2 ASN A 515 -0.515 7.059 -11.655 1.00 31.12 N ATOM 0 H ASN A 515 -1.244 3.826 -8.762 1.00 73.20 H new ATOM 0 HA ASN A 515 -1.141 5.108 -10.492 1.00 20.22 H new ATOM 0 HB2 ASN A 515 1.119 5.830 -9.093 1.00 22.30 H new ATOM 0 HB3 ASN A 515 1.774 5.489 -10.682 1.00 22.30 H new ATOM 0 HD21 ASN A 515 -0.895 7.931 -12.022 1.00 31.12 H new ATOM 0 HD22 ASN A 515 -0.792 6.168 -12.068 1.00 31.12 H new ATOM 1045 N GLY A 516 -0.257 2.517 -11.547 1.00 53.12 N ATOM 1046 CA GLY A 516 -0.119 1.672 -12.721 1.00 25.41 C ATOM 1047 C GLY A 516 0.976 0.638 -12.607 1.00 74.45 C ATOM 1048 O GLY A 516 0.982 -0.349 -13.352 1.00 5.35 O ATOM 0 H GLY A 516 -0.654 2.055 -10.729 1.00 53.12 H new ATOM 0 HA2 GLY A 516 -1.066 1.165 -12.905 1.00 25.41 H new ATOM 0 HA3 GLY A 516 0.079 2.302 -13.588 1.00 25.41 H new ATOM 1052 N VAL A 517 1.890 0.843 -11.687 1.00 1.34 N ATOM 1053 CA VAL A 517 3.017 -0.070 -11.518 1.00 45.03 C ATOM 1054 C VAL A 517 2.714 -1.060 -10.407 1.00 64.34 C ATOM 1055 O VAL A 517 2.257 -0.655 -9.338 1.00 61.30 O ATOM 1056 CB VAL A 517 4.317 0.706 -11.200 1.00 22.14 C ATOM 1057 CG1 VAL A 517 5.497 -0.235 -11.022 1.00 44.02 C ATOM 1058 CG2 VAL A 517 4.606 1.703 -12.298 1.00 62.20 C ATOM 0 H VAL A 517 1.883 1.631 -11.040 1.00 1.34 H new ATOM 0 HA VAL A 517 3.166 -0.610 -12.453 1.00 45.03 H new ATOM 0 HB VAL A 517 4.170 1.238 -10.260 1.00 22.14 H new ATOM 0 HG11 VAL A 517 6.394 0.344 -10.800 1.00 44.02 H new ATOM 0 HG12 VAL A 517 5.295 -0.921 -10.199 1.00 44.02 H new ATOM 0 HG13 VAL A 517 5.650 -0.804 -11.939 1.00 44.02 H new ATOM 0 HG21 VAL A 517 5.523 2.245 -12.066 1.00 62.20 H new ATOM 0 HG22 VAL A 517 4.726 1.177 -13.245 1.00 62.20 H new ATOM 0 HG23 VAL A 517 3.778 2.408 -12.377 1.00 62.20 H new ATOM 1068 N ASP A 518 2.993 -2.345 -10.648 1.00 42.31 N ATOM 1069 CA ASP A 518 2.638 -3.398 -9.696 1.00 5.12 C ATOM 1070 C ASP A 518 3.708 -3.514 -8.649 1.00 52.24 C ATOM 1071 O ASP A 518 4.903 -3.353 -8.935 1.00 12.21 O ATOM 1072 CB ASP A 518 2.377 -4.761 -10.373 1.00 3.24 C ATOM 1073 CG ASP A 518 3.615 -5.434 -10.922 1.00 63.13 C ATOM 1074 OD1 ASP A 518 4.205 -4.929 -11.887 1.00 34.55 O ATOM 1075 OD2 ASP A 518 4.004 -6.492 -10.389 1.00 5.05 O ATOM 0 H ASP A 518 3.461 -2.678 -11.491 1.00 42.31 H new ATOM 0 HA ASP A 518 1.697 -3.110 -9.227 1.00 5.12 H new ATOM 0 HB2 ASP A 518 1.906 -5.428 -9.650 1.00 3.24 H new ATOM 0 HB3 ASP A 518 1.665 -4.619 -11.186 1.00 3.24 H new ATOM 1080 N LEU A 519 3.287 -3.775 -7.447 1.00 22.14 N ATOM 1081 CA LEU A 519 4.168 -3.731 -6.300 1.00 53.33 C ATOM 1082 C LEU A 519 4.555 -5.085 -5.837 1.00 60.45 C ATOM 1083 O LEU A 519 5.688 -5.303 -5.445 1.00 73.41 O ATOM 1084 CB LEU A 519 3.450 -3.058 -5.178 1.00 71.22 C ATOM 1085 CG LEU A 519 2.701 -1.825 -5.568 1.00 62.14 C ATOM 1086 CD1 LEU A 519 2.012 -1.259 -4.382 1.00 22.21 C ATOM 1087 CD2 LEU A 519 3.601 -0.834 -6.246 1.00 11.55 C ATOM 0 H LEU A 519 2.323 -4.026 -7.226 1.00 22.14 H new ATOM 0 HA LEU A 519 5.070 -3.195 -6.595 1.00 53.33 H new ATOM 0 HB2 LEU A 519 2.751 -3.767 -4.735 1.00 71.22 H new ATOM 0 HB3 LEU A 519 4.173 -2.798 -4.405 1.00 71.22 H new ATOM 0 HG LEU A 519 1.936 -2.086 -6.299 1.00 62.14 H new ATOM 0 HD11 LEU A 519 1.468 -0.360 -4.672 1.00 22.21 H new ATOM 0 HD12 LEU A 519 1.313 -1.994 -3.982 1.00 22.21 H new ATOM 0 HD13 LEU A 519 2.749 -1.007 -3.619 1.00 22.21 H new ATOM 0 HD21 LEU A 519 3.027 0.052 -6.518 1.00 11.55 H new ATOM 0 HD22 LEU A 519 4.407 -0.551 -5.568 1.00 11.55 H new ATOM 0 HD23 LEU A 519 4.024 -1.282 -7.145 1.00 11.55 H new ATOM 1099 N VAL A 520 3.620 -5.996 -5.856 1.00 44.00 N ATOM 1100 CA VAL A 520 3.884 -7.315 -5.370 1.00 21.25 C ATOM 1101 C VAL A 520 4.737 -8.067 -6.381 1.00 11.33 C ATOM 1102 O VAL A 520 4.235 -8.676 -7.332 1.00 22.32 O ATOM 1103 CB VAL A 520 2.595 -8.083 -5.014 1.00 72.41 C ATOM 1104 CG1 VAL A 520 2.934 -9.421 -4.372 1.00 61.12 C ATOM 1105 CG2 VAL A 520 1.723 -7.238 -4.081 1.00 10.24 C ATOM 0 H VAL A 520 2.672 -5.846 -6.203 1.00 44.00 H new ATOM 0 HA VAL A 520 4.439 -7.230 -4.436 1.00 21.25 H new ATOM 0 HB VAL A 520 2.036 -8.278 -5.929 1.00 72.41 H new ATOM 0 HG11 VAL A 520 2.013 -9.951 -4.127 1.00 61.12 H new ATOM 0 HG12 VAL A 520 3.523 -10.019 -5.067 1.00 61.12 H new ATOM 0 HG13 VAL A 520 3.509 -9.252 -3.462 1.00 61.12 H new ATOM 0 HG21 VAL A 520 0.815 -7.788 -3.835 1.00 10.24 H new ATOM 0 HG22 VAL A 520 2.274 -7.020 -3.166 1.00 10.24 H new ATOM 0 HG23 VAL A 520 1.458 -6.304 -4.577 1.00 10.24 H new ATOM 1115 N GLY A 521 6.019 -7.932 -6.190 1.00 52.55 N ATOM 1116 CA GLY A 521 7.021 -8.471 -7.056 1.00 41.51 C ATOM 1117 C GLY A 521 8.263 -7.633 -6.920 1.00 70.22 C ATOM 1118 O GLY A 521 9.385 -8.113 -7.079 1.00 54.22 O ATOM 0 H GLY A 521 6.406 -7.423 -5.395 1.00 52.55 H new ATOM 0 HA2 GLY A 521 7.232 -9.508 -6.794 1.00 41.51 H new ATOM 0 HA3 GLY A 521 6.672 -8.468 -8.089 1.00 41.51 H new ATOM 1122 N LYS A 522 8.052 -6.370 -6.591 1.00 23.40 N ATOM 1123 CA LYS A 522 9.131 -5.455 -6.336 1.00 25.45 C ATOM 1124 C LYS A 522 9.253 -5.200 -4.836 1.00 71.53 C ATOM 1125 O LYS A 522 8.482 -5.745 -4.048 1.00 25.32 O ATOM 1126 CB LYS A 522 8.973 -4.125 -7.102 1.00 45.11 C ATOM 1127 CG LYS A 522 7.672 -3.351 -6.865 1.00 63.14 C ATOM 1128 CD LYS A 522 7.739 -1.885 -7.354 1.00 64.42 C ATOM 1129 CE LYS A 522 7.875 -1.700 -8.880 1.00 42.54 C ATOM 1130 NZ LYS A 522 9.086 -2.325 -9.475 1.00 12.23 N ATOM 0 H LYS A 522 7.124 -5.958 -6.495 1.00 23.40 H new ATOM 0 HA LYS A 522 10.047 -5.920 -6.702 1.00 25.45 H new ATOM 0 HB2 LYS A 522 9.809 -3.477 -6.837 1.00 45.11 H new ATOM 0 HB3 LYS A 522 9.057 -4.333 -8.169 1.00 45.11 H new ATOM 0 HG2 LYS A 522 6.855 -3.861 -7.376 1.00 63.14 H new ATOM 0 HG3 LYS A 522 7.439 -3.362 -5.800 1.00 63.14 H new ATOM 0 HD2 LYS A 522 6.839 -1.368 -7.022 1.00 64.42 H new ATOM 0 HD3 LYS A 522 8.585 -1.397 -6.869 1.00 64.42 H new ATOM 0 HE2 LYS A 522 6.992 -2.118 -9.363 1.00 42.54 H new ATOM 0 HE3 LYS A 522 7.886 -0.633 -9.104 1.00 42.54 H new ATOM 0 HZ1 LYS A 522 9.384 -1.780 -10.309 1.00 12.23 H new ATOM 0 HZ2 LYS A 522 9.854 -2.331 -8.773 1.00 12.23 H new ATOM 0 HZ3 LYS A 522 8.869 -3.301 -9.759 1.00 12.23 H new ATOM 1144 N SER A 523 10.219 -4.397 -4.449 1.00 1.30 N ATOM 1145 CA SER A 523 10.446 -4.104 -3.046 1.00 61.12 C ATOM 1146 C SER A 523 9.775 -2.811 -2.605 1.00 4.03 C ATOM 1147 O SER A 523 9.410 -1.966 -3.441 1.00 72.22 O ATOM 1148 CB SER A 523 11.944 -4.018 -2.757 1.00 3.03 C ATOM 1149 OG SER A 523 12.583 -3.052 -3.590 1.00 53.33 O ATOM 0 H SER A 523 10.864 -3.932 -5.087 1.00 1.30 H new ATOM 0 HA SER A 523 10.001 -4.922 -2.479 1.00 61.12 H new ATOM 0 HB2 SER A 523 12.099 -3.757 -1.710 1.00 3.03 H new ATOM 0 HB3 SER A 523 12.402 -4.995 -2.913 1.00 3.03 H new ATOM 0 HG SER A 523 12.500 -3.323 -4.528 1.00 53.33 H new ATOM 1155 N GLN A 524 9.666 -2.653 -1.281 1.00 3.42 N ATOM 1156 CA GLN A 524 9.135 -1.454 -0.624 1.00 53.34 C ATOM 1157 C GLN A 524 9.786 -0.194 -1.160 1.00 64.23 C ATOM 1158 O GLN A 524 9.113 0.775 -1.445 1.00 14.43 O ATOM 1159 CB GLN A 524 9.453 -1.535 0.863 1.00 35.14 C ATOM 1160 CG GLN A 524 8.641 -2.523 1.670 1.00 35.25 C ATOM 1161 CD GLN A 524 7.335 -1.940 2.169 1.00 35.12 C ATOM 1162 OE1 GLN A 524 6.284 -2.141 1.456 1.00 52.43 O flip ATOM 1163 NE2 GLN A 524 7.283 -1.347 3.238 1.00 52.14 N flip ATOM 0 H GLN A 524 9.952 -3.375 -0.620 1.00 3.42 H new ATOM 0 HA GLN A 524 8.062 -1.412 -0.812 1.00 53.34 H new ATOM 0 HB2 GLN A 524 10.507 -1.788 0.974 1.00 35.14 H new ATOM 0 HB3 GLN A 524 9.315 -0.544 1.297 1.00 35.14 H new ATOM 0 HG2 GLN A 524 8.432 -3.400 1.058 1.00 35.25 H new ATOM 0 HG3 GLN A 524 9.231 -2.862 2.521 1.00 35.25 H new ATOM 0 HE21 GLN A 524 8.133 -1.202 3.783 1.00 52.14 H new ATOM 0 HE22 GLN A 524 6.390 -0.998 3.585 1.00 52.14 H new ATOM 1172 N GLU A 525 11.093 -0.239 -1.334 1.00 2.42 N ATOM 1173 CA GLU A 525 11.861 0.939 -1.740 1.00 3.13 C ATOM 1174 C GLU A 525 11.487 1.407 -3.129 1.00 32.31 C ATOM 1175 O GLU A 525 11.439 2.607 -3.412 1.00 11.10 O ATOM 1176 CB GLU A 525 13.324 0.639 -1.652 1.00 42.22 C ATOM 1177 CG GLU A 525 13.749 0.315 -0.252 1.00 13.04 C ATOM 1178 CD GLU A 525 15.173 -0.112 -0.176 1.00 61.14 C ATOM 1179 OE1 GLU A 525 15.440 -1.322 -0.346 1.00 42.32 O ATOM 1180 OE2 GLU A 525 16.045 0.745 0.043 1.00 5.31 O ATOM 0 H GLU A 525 11.654 -1.080 -1.201 1.00 2.42 H new ATOM 0 HA GLU A 525 11.620 1.754 -1.058 1.00 3.13 H new ATOM 0 HB2 GLU A 525 13.562 -0.200 -2.306 1.00 42.22 H new ATOM 0 HB3 GLU A 525 13.892 1.496 -2.014 1.00 42.22 H new ATOM 0 HG2 GLU A 525 13.600 1.189 0.382 1.00 13.04 H new ATOM 0 HG3 GLU A 525 13.113 -0.477 0.144 1.00 13.04 H new ATOM 1187 N GLU A 526 11.197 0.468 -3.980 1.00 41.04 N ATOM 1188 CA GLU A 526 10.778 0.765 -5.320 1.00 75.34 C ATOM 1189 C GLU A 526 9.395 1.380 -5.293 1.00 12.42 C ATOM 1190 O GLU A 526 9.094 2.289 -6.058 1.00 3.52 O ATOM 1191 CB GLU A 526 10.741 -0.496 -6.122 1.00 23.11 C ATOM 1192 CG GLU A 526 12.077 -1.180 -6.288 1.00 73.31 C ATOM 1193 CD GLU A 526 11.932 -2.479 -7.011 1.00 14.20 C ATOM 1194 OE1 GLU A 526 11.653 -2.463 -8.236 1.00 70.35 O ATOM 1195 OE2 GLU A 526 12.028 -3.546 -6.358 1.00 32.42 O ATOM 0 H GLU A 526 11.244 -0.528 -3.765 1.00 41.04 H new ATOM 0 HA GLU A 526 11.481 1.465 -5.771 1.00 75.34 H new ATOM 0 HB2 GLU A 526 10.049 -1.192 -5.647 1.00 23.11 H new ATOM 0 HB3 GLU A 526 10.339 -0.270 -7.110 1.00 23.11 H new ATOM 0 HG2 GLU A 526 12.756 -0.529 -6.838 1.00 73.31 H new ATOM 0 HG3 GLU A 526 12.524 -1.353 -5.309 1.00 73.31 H new ATOM 1202 N VAL A 527 8.564 0.880 -4.386 1.00 64.40 N ATOM 1203 CA VAL A 527 7.200 1.364 -4.237 1.00 15.13 C ATOM 1204 C VAL A 527 7.219 2.770 -3.651 1.00 22.32 C ATOM 1205 O VAL A 527 6.467 3.642 -4.088 1.00 41.04 O ATOM 1206 CB VAL A 527 6.351 0.464 -3.291 1.00 12.53 C ATOM 1207 CG1 VAL A 527 4.894 0.907 -3.269 1.00 33.55 C ATOM 1208 CG2 VAL A 527 6.475 -1.018 -3.623 1.00 33.21 C ATOM 0 H VAL A 527 8.816 0.133 -3.738 1.00 64.40 H new ATOM 0 HA VAL A 527 6.749 1.350 -5.229 1.00 15.13 H new ATOM 0 HB VAL A 527 6.759 0.592 -2.289 1.00 12.53 H new ATOM 0 HG11 VAL A 527 4.327 0.260 -2.600 1.00 33.55 H new ATOM 0 HG12 VAL A 527 4.832 1.937 -2.917 1.00 33.55 H new ATOM 0 HG13 VAL A 527 4.479 0.842 -4.275 1.00 33.55 H new ATOM 0 HG21 VAL A 527 5.863 -1.598 -2.932 1.00 33.21 H new ATOM 0 HG22 VAL A 527 6.135 -1.192 -4.644 1.00 33.21 H new ATOM 0 HG23 VAL A 527 7.517 -1.326 -3.531 1.00 33.21 H new ATOM 1218 N VAL A 528 8.094 2.996 -2.665 1.00 42.32 N ATOM 1219 CA VAL A 528 8.159 4.309 -2.034 1.00 63.44 C ATOM 1220 C VAL A 528 8.613 5.347 -3.040 1.00 51.24 C ATOM 1221 O VAL A 528 8.012 6.393 -3.148 1.00 43.14 O ATOM 1222 CB VAL A 528 9.026 4.379 -0.717 1.00 4.33 C ATOM 1223 CG1 VAL A 528 8.615 3.331 0.304 1.00 41.42 C ATOM 1224 CG2 VAL A 528 10.527 4.355 -0.963 1.00 53.14 C ATOM 0 H VAL A 528 8.748 2.305 -2.298 1.00 42.32 H new ATOM 0 HA VAL A 528 7.143 4.525 -1.703 1.00 63.44 H new ATOM 0 HB VAL A 528 8.808 5.359 -0.293 1.00 4.33 H new ATOM 0 HG11 VAL A 528 9.242 3.422 1.191 1.00 41.42 H new ATOM 0 HG12 VAL A 528 7.571 3.482 0.580 1.00 41.42 H new ATOM 0 HG13 VAL A 528 8.737 2.337 -0.126 1.00 41.42 H new ATOM 0 HG21 VAL A 528 11.053 4.406 -0.010 1.00 53.14 H new ATOM 0 HG22 VAL A 528 10.797 3.432 -1.477 1.00 53.14 H new ATOM 0 HG23 VAL A 528 10.808 5.209 -1.579 1.00 53.14 H new ATOM 1234 N SER A 529 9.635 5.008 -3.817 1.00 31.50 N ATOM 1235 CA SER A 529 10.165 5.884 -4.862 1.00 33.23 C ATOM 1236 C SER A 529 9.058 6.242 -5.868 1.00 51.22 C ATOM 1237 O SER A 529 8.928 7.394 -6.304 1.00 52.34 O ATOM 1238 CB SER A 529 11.328 5.184 -5.571 1.00 21.12 C ATOM 1239 OG SER A 529 12.365 4.839 -4.641 1.00 2.42 O ATOM 0 H SER A 529 10.123 4.115 -3.742 1.00 31.50 H new ATOM 0 HA SER A 529 10.527 6.808 -4.410 1.00 33.23 H new ATOM 0 HB2 SER A 529 10.967 4.284 -6.068 1.00 21.12 H new ATOM 0 HB3 SER A 529 11.732 5.836 -6.346 1.00 21.12 H new ATOM 0 HG SER A 529 12.144 3.990 -4.204 1.00 2.42 H new ATOM 1245 N LEU A 530 8.251 5.253 -6.182 1.00 21.00 N ATOM 1246 CA LEU A 530 7.134 5.368 -7.066 1.00 32.21 C ATOM 1247 C LEU A 530 6.100 6.348 -6.479 1.00 74.11 C ATOM 1248 O LEU A 530 5.638 7.271 -7.164 1.00 31.32 O ATOM 1249 CB LEU A 530 6.571 3.954 -7.231 1.00 72.54 C ATOM 1250 CG LEU A 530 5.290 3.761 -8.000 1.00 10.21 C ATOM 1251 CD1 LEU A 530 5.410 4.267 -9.417 1.00 14.44 C ATOM 1252 CD2 LEU A 530 4.919 2.297 -8.004 1.00 2.15 C ATOM 0 H LEU A 530 8.368 4.311 -5.808 1.00 21.00 H new ATOM 0 HA LEU A 530 7.415 5.770 -8.040 1.00 32.21 H new ATOM 0 HB2 LEU A 530 7.338 3.349 -7.714 1.00 72.54 H new ATOM 0 HB3 LEU A 530 6.421 3.542 -6.233 1.00 72.54 H new ATOM 0 HG LEU A 530 4.508 4.339 -7.508 1.00 10.21 H new ATOM 0 HD11 LEU A 530 4.467 4.111 -9.940 1.00 14.44 H new ATOM 0 HD12 LEU A 530 5.646 5.331 -9.405 1.00 14.44 H new ATOM 0 HD13 LEU A 530 6.204 3.725 -9.931 1.00 14.44 H new ATOM 0 HD21 LEU A 530 3.992 2.158 -8.560 1.00 2.15 H new ATOM 0 HD22 LEU A 530 5.715 1.721 -8.476 1.00 2.15 H new ATOM 0 HD23 LEU A 530 4.781 1.954 -6.979 1.00 2.15 H new ATOM 1264 N LEU A 531 5.794 6.169 -5.204 1.00 32.34 N ATOM 1265 CA LEU A 531 4.841 7.006 -4.498 1.00 62.13 C ATOM 1266 C LEU A 531 5.366 8.457 -4.392 1.00 61.11 C ATOM 1267 O LEU A 531 4.631 9.420 -4.641 1.00 21.13 O ATOM 1268 CB LEU A 531 4.609 6.430 -3.089 1.00 4.44 C ATOM 1269 CG LEU A 531 3.513 7.089 -2.267 1.00 3.20 C ATOM 1270 CD1 LEU A 531 2.166 6.832 -2.901 1.00 42.22 C ATOM 1271 CD2 LEU A 531 3.530 6.598 -0.825 1.00 64.25 C ATOM 0 H LEU A 531 6.203 5.434 -4.627 1.00 32.34 H new ATOM 0 HA LEU A 531 3.902 7.020 -5.051 1.00 62.13 H new ATOM 0 HB2 LEU A 531 4.374 5.370 -3.187 1.00 4.44 H new ATOM 0 HB3 LEU A 531 5.544 6.499 -2.532 1.00 4.44 H new ATOM 0 HG LEU A 531 3.698 8.163 -2.251 1.00 3.20 H new ATOM 0 HD11 LEU A 531 1.387 7.308 -2.305 1.00 42.22 H new ATOM 0 HD12 LEU A 531 2.154 7.244 -3.910 1.00 42.22 H new ATOM 0 HD13 LEU A 531 1.984 5.758 -2.946 1.00 42.22 H new ATOM 0 HD21 LEU A 531 2.734 7.088 -0.264 1.00 64.25 H new ATOM 0 HD22 LEU A 531 3.375 5.519 -0.806 1.00 64.25 H new ATOM 0 HD23 LEU A 531 4.492 6.835 -0.371 1.00 64.25 H new ATOM 1283 N ARG A 532 6.650 8.594 -4.051 1.00 52.20 N ATOM 1284 CA ARG A 532 7.304 9.905 -3.881 1.00 63.21 C ATOM 1285 C ARG A 532 7.300 10.688 -5.191 1.00 2.40 C ATOM 1286 O ARG A 532 7.211 11.921 -5.194 1.00 0.21 O ATOM 1287 CB ARG A 532 8.757 9.743 -3.404 1.00 5.24 C ATOM 1288 CG ARG A 532 8.981 8.939 -2.110 1.00 25.24 C ATOM 1289 CD ARG A 532 8.417 9.569 -0.834 1.00 21.24 C ATOM 1290 NE ARG A 532 6.942 9.696 -0.796 1.00 33.31 N ATOM 1291 CZ ARG A 532 6.165 9.269 0.220 1.00 32.21 C ATOM 1292 NH1 ARG A 532 6.681 8.537 1.195 1.00 43.23 N ATOM 1293 NH2 ARG A 532 4.866 9.556 0.233 1.00 30.41 N ATOM 0 H ARG A 532 7.270 7.802 -3.884 1.00 52.20 H new ATOM 0 HA ARG A 532 6.737 10.452 -3.127 1.00 63.21 H new ATOM 0 HB2 ARG A 532 9.325 9.265 -4.203 1.00 5.24 H new ATOM 0 HB3 ARG A 532 9.180 10.737 -3.263 1.00 5.24 H new ATOM 0 HG2 ARG A 532 8.535 7.952 -2.235 1.00 25.24 H new ATOM 0 HG3 ARG A 532 10.053 8.790 -1.977 1.00 25.24 H new ATOM 0 HD2 ARG A 532 8.737 8.972 0.020 1.00 21.24 H new ATOM 0 HD3 ARG A 532 8.855 10.560 -0.712 1.00 21.24 H new ATOM 0 HE ARG A 532 6.482 10.137 -1.593 1.00 33.31 H new ATOM 0 HH11 ARG A 532 7.671 8.293 1.180 1.00 43.23 H new ATOM 0 HH12 ARG A 532 6.088 8.217 1.961 1.00 43.23 H new ATOM 0 HH21 ARG A 532 4.456 10.100 -0.526 1.00 30.41 H new ATOM 0 HH22 ARG A 532 4.280 9.232 1.002 1.00 30.41 H new ATOM 1307 N SER A 533 7.404 9.973 -6.292 1.00 62.41 N ATOM 1308 CA SER A 533 7.402 10.583 -7.600 1.00 33.41 C ATOM 1309 C SER A 533 5.997 11.015 -7.995 1.00 62.44 C ATOM 1310 O SER A 533 5.809 12.103 -8.552 1.00 41.55 O ATOM 1311 CB SER A 533 7.964 9.609 -8.625 1.00 3.14 C ATOM 1312 OG SER A 533 9.291 9.242 -8.288 1.00 62.34 O ATOM 0 H SER A 533 7.492 8.957 -6.303 1.00 62.41 H new ATOM 0 HA SER A 533 8.032 11.472 -7.569 1.00 33.41 H new ATOM 0 HB2 SER A 533 7.336 8.720 -8.672 1.00 3.14 H new ATOM 0 HB3 SER A 533 7.947 10.064 -9.615 1.00 3.14 H new ATOM 0 HG SER A 533 9.273 8.475 -7.679 1.00 62.34 H new ATOM 1318 N THR A 534 5.022 10.167 -7.687 1.00 73.25 N ATOM 1319 CA THR A 534 3.633 10.403 -8.013 1.00 72.41 C ATOM 1320 C THR A 534 3.434 10.372 -9.544 1.00 23.23 C ATOM 1321 O THR A 534 3.296 9.305 -10.117 1.00 61.44 O ATOM 1322 CB THR A 534 3.107 11.737 -7.395 1.00 14.41 C ATOM 1323 OG1 THR A 534 3.375 11.747 -5.979 1.00 53.21 O ATOM 1324 CG2 THR A 534 1.607 11.911 -7.630 1.00 41.12 C ATOM 0 H THR A 534 5.183 9.287 -7.198 1.00 73.25 H new ATOM 0 HA THR A 534 3.042 9.601 -7.571 1.00 72.41 H new ATOM 0 HB THR A 534 3.624 12.563 -7.883 1.00 14.41 H new ATOM 0 HG1 THR A 534 3.744 10.880 -5.710 1.00 53.21 H new ATOM 0 HG21 THR A 534 1.276 12.850 -7.186 1.00 41.12 H new ATOM 0 HG22 THR A 534 1.406 11.925 -8.701 1.00 41.12 H new ATOM 0 HG23 THR A 534 1.068 11.083 -7.170 1.00 41.12 H new ATOM 1332 N LYS A 535 3.509 11.543 -10.181 1.00 71.11 N ATOM 1333 CA LYS A 535 3.371 11.727 -11.619 1.00 24.05 C ATOM 1334 C LYS A 535 3.286 13.221 -11.874 1.00 14.34 C ATOM 1335 O LYS A 535 3.179 13.996 -10.919 1.00 74.11 O ATOM 1336 CB LYS A 535 2.117 11.012 -12.200 1.00 30.12 C ATOM 1337 CG LYS A 535 0.775 11.518 -11.694 1.00 44.11 C ATOM 1338 CD LYS A 535 -0.383 10.741 -12.318 1.00 53.34 C ATOM 1339 CE LYS A 535 -0.403 10.857 -13.843 1.00 22.43 C ATOM 1340 NZ LYS A 535 -1.556 10.148 -14.448 1.00 61.12 N ATOM 0 H LYS A 535 3.674 12.420 -9.686 1.00 71.11 H new ATOM 0 HA LYS A 535 4.231 11.281 -12.119 1.00 24.05 H new ATOM 0 HB2 LYS A 535 2.136 11.111 -13.285 1.00 30.12 H new ATOM 0 HB3 LYS A 535 2.191 9.948 -11.975 1.00 30.12 H new ATOM 0 HG2 LYS A 535 0.735 11.425 -10.609 1.00 44.11 H new ATOM 0 HG3 LYS A 535 0.672 12.578 -11.927 1.00 44.11 H new ATOM 0 HD2 LYS A 535 -0.307 9.691 -12.036 1.00 53.34 H new ATOM 0 HD3 LYS A 535 -1.326 11.111 -11.915 1.00 53.34 H new ATOM 0 HE2 LYS A 535 -0.439 11.909 -14.124 1.00 22.43 H new ATOM 0 HE3 LYS A 535 0.524 10.450 -14.248 1.00 22.43 H new ATOM 0 HZ1 LYS A 535 -1.526 10.255 -15.482 1.00 61.12 H new ATOM 0 HZ2 LYS A 535 -1.510 9.138 -14.203 1.00 61.12 H new ATOM 0 HZ3 LYS A 535 -2.442 10.552 -14.084 1.00 61.12 H new ATOM 1354 N MET A 536 3.322 13.627 -13.128 1.00 13.30 N ATOM 1355 CA MET A 536 3.269 15.049 -13.485 1.00 45.32 C ATOM 1356 C MET A 536 1.917 15.677 -13.109 1.00 1.41 C ATOM 1357 O MET A 536 1.864 16.822 -12.641 1.00 74.25 O ATOM 1358 CB MET A 536 3.554 15.241 -14.986 1.00 71.14 C ATOM 1359 CG MET A 536 3.512 16.692 -15.462 1.00 64.33 C ATOM 1360 SD MET A 536 3.793 16.842 -17.246 1.00 14.44 S ATOM 1361 CE MET A 536 3.708 18.620 -17.460 1.00 75.23 C ATOM 0 H MET A 536 3.388 12.996 -13.927 1.00 13.30 H new ATOM 0 HA MET A 536 4.042 15.561 -12.913 1.00 45.32 H new ATOM 0 HB2 MET A 536 4.537 14.827 -15.211 1.00 71.14 H new ATOM 0 HB3 MET A 536 2.827 14.664 -15.557 1.00 71.14 H new ATOM 0 HG2 MET A 536 2.544 17.126 -15.212 1.00 64.33 H new ATOM 0 HG3 MET A 536 4.267 17.269 -14.928 1.00 64.33 H new ATOM 0 HE1 MET A 536 3.863 18.868 -18.510 1.00 75.23 H new ATOM 0 HE2 MET A 536 2.729 18.978 -17.143 1.00 75.23 H new ATOM 0 HE3 MET A 536 4.481 19.096 -16.857 1.00 75.23 H new ATOM 1371 N GLU A 537 0.837 14.920 -13.300 1.00 21.44 N ATOM 1372 CA GLU A 537 -0.503 15.415 -13.009 1.00 34.13 C ATOM 1373 C GLU A 537 -0.727 15.502 -11.485 1.00 63.40 C ATOM 1374 O GLU A 537 -0.602 16.577 -10.903 1.00 64.25 O ATOM 1375 CB GLU A 537 -1.573 14.551 -13.736 1.00 22.31 C ATOM 1376 CG GLU A 537 -3.019 15.106 -13.766 1.00 53.01 C ATOM 1377 CD GLU A 537 -3.708 15.170 -12.425 1.00 11.45 C ATOM 1378 OE1 GLU A 537 -4.220 14.126 -11.971 1.00 75.41 O ATOM 1379 OE2 GLU A 537 -3.756 16.249 -11.813 1.00 2.55 O ATOM 0 H GLU A 537 0.866 13.964 -13.654 1.00 21.44 H new ATOM 0 HA GLU A 537 -0.607 16.428 -13.397 1.00 34.13 H new ATOM 0 HB2 GLU A 537 -1.246 14.401 -14.765 1.00 22.31 H new ATOM 0 HB3 GLU A 537 -1.596 13.570 -13.262 1.00 22.31 H new ATOM 0 HG2 GLU A 537 -2.998 16.108 -14.195 1.00 53.01 H new ATOM 0 HG3 GLU A 537 -3.616 14.486 -14.435 1.00 53.01 H new ATOM 1386 N GLY A 538 -1.013 14.381 -10.837 1.00 3.44 N ATOM 1387 CA GLY A 538 -1.222 14.439 -9.414 1.00 13.51 C ATOM 1388 C GLY A 538 -2.152 13.380 -8.871 1.00 12.23 C ATOM 1389 O GLY A 538 -2.109 13.092 -7.678 1.00 25.42 O ATOM 0 H GLY A 538 -1.101 13.458 -11.262 1.00 3.44 H new ATOM 0 HA2 GLY A 538 -0.258 14.348 -8.914 1.00 13.51 H new ATOM 0 HA3 GLY A 538 -1.622 15.420 -9.158 1.00 13.51 H new ATOM 1393 N THR A 539 -3.004 12.803 -9.703 1.00 74.14 N ATOM 1394 CA THR A 539 -3.897 11.779 -9.196 1.00 51.01 C ATOM 1395 C THR A 539 -3.297 10.394 -9.425 1.00 15.24 C ATOM 1396 O THR A 539 -2.950 10.015 -10.549 1.00 63.10 O ATOM 1397 CB THR A 539 -5.271 11.835 -9.835 1.00 22.12 C ATOM 1398 OG1 THR A 539 -5.672 13.204 -9.989 1.00 10.34 O ATOM 1399 CG2 THR A 539 -6.270 11.171 -8.915 1.00 25.15 C ATOM 0 H THR A 539 -3.095 13.017 -10.696 1.00 74.14 H new ATOM 0 HA THR A 539 -4.016 11.969 -8.129 1.00 51.01 H new ATOM 0 HB THR A 539 -5.235 11.334 -10.802 1.00 22.12 H new ATOM 0 HG1 THR A 539 -5.163 13.614 -10.719 1.00 10.34 H new ATOM 0 HG21 THR A 539 -7.261 11.207 -9.367 1.00 25.15 H new ATOM 0 HG22 THR A 539 -5.982 10.132 -8.754 1.00 25.15 H new ATOM 0 HG23 THR A 539 -6.288 11.694 -7.959 1.00 25.15 H new ATOM 1407 N VAL A 540 -3.193 9.666 -8.372 1.00 72.42 N ATOM 1408 CA VAL A 540 -2.575 8.377 -8.359 1.00 32.20 C ATOM 1409 C VAL A 540 -3.628 7.294 -8.233 1.00 61.52 C ATOM 1410 O VAL A 540 -4.597 7.451 -7.496 1.00 22.11 O ATOM 1411 CB VAL A 540 -1.623 8.285 -7.154 1.00 60.13 C ATOM 1412 CG1 VAL A 540 -0.890 6.987 -7.130 1.00 65.43 C ATOM 1413 CG2 VAL A 540 -0.658 9.435 -7.145 1.00 50.12 C ATOM 0 H VAL A 540 -3.546 9.956 -7.460 1.00 72.42 H new ATOM 0 HA VAL A 540 -2.024 8.239 -9.289 1.00 32.20 H new ATOM 0 HB VAL A 540 -2.234 8.338 -6.253 1.00 60.13 H new ATOM 0 HG11 VAL A 540 -0.228 6.959 -6.265 1.00 65.43 H new ATOM 0 HG12 VAL A 540 -1.605 6.167 -7.066 1.00 65.43 H new ATOM 0 HG13 VAL A 540 -0.301 6.885 -8.041 1.00 65.43 H new ATOM 0 HG21 VAL A 540 0.004 9.347 -6.284 1.00 50.12 H new ATOM 0 HG22 VAL A 540 -0.067 9.421 -8.060 1.00 50.12 H new ATOM 0 HG23 VAL A 540 -1.210 10.373 -7.084 1.00 50.12 H new ATOM 1423 N SER A 541 -3.435 6.209 -8.948 1.00 3.52 N ATOM 1424 CA SER A 541 -4.337 5.094 -8.886 1.00 74.22 C ATOM 1425 C SER A 541 -3.766 4.013 -7.954 1.00 11.40 C ATOM 1426 O SER A 541 -2.726 3.433 -8.222 1.00 64.12 O ATOM 1427 CB SER A 541 -4.587 4.545 -10.298 1.00 54.13 C ATOM 1428 OG SER A 541 -5.529 3.481 -10.309 1.00 14.43 O ATOM 0 H SER A 541 -2.649 6.080 -9.585 1.00 3.52 H new ATOM 0 HA SER A 541 -5.294 5.419 -8.478 1.00 74.22 H new ATOM 0 HB2 SER A 541 -4.946 5.350 -10.939 1.00 54.13 H new ATOM 0 HB3 SER A 541 -3.645 4.196 -10.721 1.00 54.13 H new ATOM 0 HG SER A 541 -5.656 3.166 -11.228 1.00 14.43 H new ATOM 1434 N LEU A 542 -4.445 3.787 -6.875 1.00 21.15 N ATOM 1435 CA LEU A 542 -4.083 2.820 -5.869 1.00 24.42 C ATOM 1436 C LEU A 542 -4.932 1.592 -6.040 1.00 65.35 C ATOM 1437 O LEU A 542 -6.146 1.684 -6.018 1.00 21.00 O ATOM 1438 CB LEU A 542 -4.356 3.386 -4.449 1.00 24.42 C ATOM 1439 CG LEU A 542 -3.444 4.510 -3.930 1.00 23.01 C ATOM 1440 CD1 LEU A 542 -2.022 4.034 -3.890 1.00 54.45 C ATOM 1441 CD2 LEU A 542 -3.559 5.787 -4.749 1.00 3.45 C ATOM 0 H LEU A 542 -5.305 4.289 -6.654 1.00 21.15 H new ATOM 0 HA LEU A 542 -3.024 2.587 -5.979 1.00 24.42 H new ATOM 0 HB2 LEU A 542 -5.382 3.753 -4.428 1.00 24.42 H new ATOM 0 HB3 LEU A 542 -4.299 2.557 -3.743 1.00 24.42 H new ATOM 0 HG LEU A 542 -3.776 4.758 -2.922 1.00 23.01 H new ATOM 0 HD11 LEU A 542 -1.381 4.835 -3.522 1.00 54.45 H new ATOM 0 HD12 LEU A 542 -1.945 3.173 -3.226 1.00 54.45 H new ATOM 0 HD13 LEU A 542 -1.706 3.748 -4.893 1.00 54.45 H new ATOM 0 HD21 LEU A 542 -2.893 6.545 -4.337 1.00 3.45 H new ATOM 0 HD22 LEU A 542 -3.280 5.583 -5.783 1.00 3.45 H new ATOM 0 HD23 LEU A 542 -4.586 6.150 -4.715 1.00 3.45 H new ATOM 1453 N LEU A 543 -4.327 0.473 -6.229 1.00 15.00 N ATOM 1454 CA LEU A 543 -5.074 -0.751 -6.280 1.00 55.15 C ATOM 1455 C LEU A 543 -4.830 -1.444 -4.991 1.00 72.54 C ATOM 1456 O LEU A 543 -3.678 -1.770 -4.662 1.00 64.34 O ATOM 1457 CB LEU A 543 -4.612 -1.638 -7.412 1.00 44.13 C ATOM 1458 CG LEU A 543 -5.413 -2.916 -7.681 1.00 4.25 C ATOM 1459 CD1 LEU A 543 -6.797 -2.589 -8.199 1.00 54.15 C ATOM 1460 CD2 LEU A 543 -4.671 -3.808 -8.654 1.00 30.50 C ATOM 0 H LEU A 543 -3.320 0.371 -6.352 1.00 15.00 H new ATOM 0 HA LEU A 543 -6.130 -0.537 -6.445 1.00 55.15 H new ATOM 0 HB2 LEU A 543 -4.610 -1.044 -8.326 1.00 44.13 H new ATOM 0 HB3 LEU A 543 -3.579 -1.924 -7.215 1.00 44.13 H new ATOM 0 HG LEU A 543 -5.528 -3.453 -6.739 1.00 4.25 H new ATOM 0 HD11 LEU A 543 -7.345 -3.513 -8.382 1.00 54.15 H new ATOM 0 HD12 LEU A 543 -7.330 -1.991 -7.460 1.00 54.15 H new ATOM 0 HD13 LEU A 543 -6.714 -2.026 -9.129 1.00 54.15 H new ATOM 0 HD21 LEU A 543 -5.253 -4.712 -8.835 1.00 30.50 H new ATOM 0 HD22 LEU A 543 -4.523 -3.277 -9.594 1.00 30.50 H new ATOM 0 HD23 LEU A 543 -3.702 -4.078 -8.234 1.00 30.50 H new ATOM 1472 N VAL A 544 -5.854 -1.662 -4.256 1.00 33.00 N ATOM 1473 CA VAL A 544 -5.707 -2.264 -2.978 1.00 51.20 C ATOM 1474 C VAL A 544 -6.369 -3.606 -2.939 1.00 11.01 C ATOM 1475 O VAL A 544 -7.376 -3.839 -3.606 1.00 72.35 O ATOM 1476 CB VAL A 544 -6.233 -1.368 -1.829 1.00 63.11 C ATOM 1477 CG1 VAL A 544 -5.438 -0.072 -1.754 1.00 33.13 C ATOM 1478 CG2 VAL A 544 -7.722 -1.075 -1.981 1.00 14.23 C ATOM 0 H VAL A 544 -6.813 -1.432 -4.516 1.00 33.00 H new ATOM 0 HA VAL A 544 -4.636 -2.392 -2.818 1.00 51.20 H new ATOM 0 HB VAL A 544 -6.098 -1.916 -0.896 1.00 63.11 H new ATOM 0 HG11 VAL A 544 -5.822 0.544 -0.941 1.00 33.13 H new ATOM 0 HG12 VAL A 544 -4.388 -0.299 -1.572 1.00 33.13 H new ATOM 0 HG13 VAL A 544 -5.534 0.469 -2.696 1.00 33.13 H new ATOM 0 HG21 VAL A 544 -8.055 -0.444 -1.157 1.00 14.23 H new ATOM 0 HG22 VAL A 544 -7.897 -0.560 -2.926 1.00 14.23 H new ATOM 0 HG23 VAL A 544 -8.280 -2.011 -1.969 1.00 14.23 H new ATOM 1488 N PHE A 545 -5.779 -4.492 -2.203 1.00 63.24 N ATOM 1489 CA PHE A 545 -6.273 -5.819 -2.071 1.00 4.23 C ATOM 1490 C PHE A 545 -6.767 -6.047 -0.673 1.00 73.43 C ATOM 1491 O PHE A 545 -5.994 -5.989 0.302 1.00 1.21 O ATOM 1492 CB PHE A 545 -5.173 -6.829 -2.437 1.00 43.22 C ATOM 1493 CG PHE A 545 -5.543 -8.289 -2.326 1.00 74.22 C ATOM 1494 CD1 PHE A 545 -6.251 -8.915 -3.334 1.00 12.50 C ATOM 1495 CD2 PHE A 545 -5.162 -9.034 -1.220 1.00 3.43 C ATOM 1496 CE1 PHE A 545 -6.579 -10.254 -3.246 1.00 62.41 C ATOM 1497 CE2 PHE A 545 -5.482 -10.372 -1.126 1.00 43.01 C ATOM 1498 CZ PHE A 545 -6.193 -10.984 -2.138 1.00 33.44 C ATOM 0 H PHE A 545 -4.929 -4.309 -1.670 1.00 63.24 H new ATOM 0 HA PHE A 545 -7.109 -5.961 -2.756 1.00 4.23 H new ATOM 0 HB2 PHE A 545 -4.855 -6.633 -3.461 1.00 43.22 H new ATOM 0 HB3 PHE A 545 -4.311 -6.644 -1.795 1.00 43.22 H new ATOM 0 HD1 PHE A 545 -6.552 -8.349 -4.203 1.00 12.50 H new ATOM 0 HD2 PHE A 545 -4.608 -8.561 -0.423 1.00 3.43 H new ATOM 0 HE1 PHE A 545 -7.135 -10.729 -4.041 1.00 62.41 H new ATOM 0 HE2 PHE A 545 -5.176 -10.941 -0.260 1.00 43.01 H new ATOM 0 HZ PHE A 545 -6.447 -12.031 -2.064 1.00 33.44 H new ATOM 1508 N ARG A 546 -8.031 -6.284 -0.571 1.00 24.52 N ATOM 1509 CA ARG A 546 -8.638 -6.622 0.685 1.00 20.35 C ATOM 1510 C ARG A 546 -8.851 -8.116 0.698 1.00 54.55 C ATOM 1511 O ARG A 546 -9.530 -8.657 -0.166 1.00 4.23 O ATOM 1512 CB ARG A 546 -9.923 -5.758 0.947 1.00 33.21 C ATOM 1513 CG ARG A 546 -11.029 -5.799 -0.119 1.00 11.32 C ATOM 1514 CD ARG A 546 -11.979 -6.982 0.020 1.00 4.32 C ATOM 1515 NE ARG A 546 -12.842 -6.869 1.200 1.00 1.34 N ATOM 1516 CZ ARG A 546 -13.965 -7.581 1.386 1.00 40.10 C ATOM 1517 NH1 ARG A 546 -14.298 -8.537 0.525 1.00 33.32 N ATOM 1518 NH2 ARG A 546 -14.734 -7.360 2.444 1.00 55.45 N ATOM 0 H ARG A 546 -8.681 -6.250 -1.356 1.00 24.52 H new ATOM 0 HA ARG A 546 -7.992 -6.376 1.528 1.00 20.35 H new ATOM 0 HB2 ARG A 546 -10.356 -6.077 1.895 1.00 33.21 H new ATOM 0 HB3 ARG A 546 -9.612 -4.721 1.071 1.00 33.21 H new ATOM 0 HG2 ARG A 546 -11.605 -4.875 -0.066 1.00 11.32 H new ATOM 0 HG3 ARG A 546 -10.567 -5.831 -1.106 1.00 11.32 H new ATOM 0 HD2 ARG A 546 -12.598 -7.055 -0.874 1.00 4.32 H new ATOM 0 HD3 ARG A 546 -11.401 -7.904 0.083 1.00 4.32 H new ATOM 0 HE ARG A 546 -12.572 -6.206 1.927 1.00 1.34 H new ATOM 0 HH11 ARG A 546 -13.700 -8.731 -0.278 1.00 33.32 H new ATOM 0 HH12 ARG A 546 -15.151 -9.077 0.668 1.00 33.32 H new ATOM 0 HH21 ARG A 546 -14.474 -6.645 3.123 1.00 55.45 H new ATOM 0 HH22 ARG A 546 -15.586 -7.905 2.578 1.00 55.45 H new ATOM 1532 N GLN A 547 -8.218 -8.781 1.626 1.00 51.12 N ATOM 1533 CA GLN A 547 -8.218 -10.224 1.651 1.00 63.15 C ATOM 1534 C GLN A 547 -9.386 -10.760 2.448 1.00 4.22 C ATOM 1535 O GLN A 547 -9.523 -10.457 3.647 1.00 14.24 O ATOM 1536 CB GLN A 547 -6.885 -10.749 2.196 1.00 51.42 C ATOM 1537 CG GLN A 547 -6.760 -12.263 2.187 1.00 35.42 C ATOM 1538 CD GLN A 547 -5.408 -12.736 2.670 1.00 61.01 C ATOM 1539 OE1 GLN A 547 -4.478 -12.906 1.878 1.00 0.35 O ATOM 1540 NE2 GLN A 547 -5.285 -12.949 3.954 1.00 20.03 N ATOM 0 H GLN A 547 -7.690 -8.345 2.382 1.00 51.12 H new ATOM 0 HA GLN A 547 -8.333 -10.582 0.628 1.00 63.15 H new ATOM 0 HB2 GLN A 547 -6.072 -10.325 1.606 1.00 51.42 H new ATOM 0 HB3 GLN A 547 -6.757 -10.391 3.218 1.00 51.42 H new ATOM 0 HG2 GLN A 547 -7.538 -12.692 2.818 1.00 35.42 H new ATOM 0 HG3 GLN A 547 -6.930 -12.632 1.176 1.00 35.42 H new ATOM 0 HE21 GLN A 547 -6.080 -12.796 4.575 1.00 20.03 H new ATOM 0 HE22 GLN A 547 -4.394 -13.268 4.335 1.00 20.03 H new ATOM 1549 N GLU A 548 -10.218 -11.569 1.765 1.00 30.20 N ATOM 1550 CA GLU A 548 -11.436 -12.176 2.330 1.00 22.51 C ATOM 1551 C GLU A 548 -12.488 -11.118 2.573 1.00 14.14 C ATOM 1552 O GLU A 548 -12.280 -9.956 2.250 1.00 42.33 O ATOM 1553 CB GLU A 548 -11.144 -12.931 3.617 1.00 64.21 C ATOM 1554 CG GLU A 548 -10.197 -14.084 3.461 1.00 72.13 C ATOM 1555 CD GLU A 548 -9.897 -14.710 4.777 1.00 43.32 C ATOM 1556 OE1 GLU A 548 -10.692 -15.558 5.238 1.00 43.30 O ATOM 1557 OE2 GLU A 548 -8.876 -14.356 5.388 1.00 41.33 O ATOM 0 H GLU A 548 -10.059 -11.823 0.790 1.00 30.20 H new ATOM 0 HA GLU A 548 -11.813 -12.894 1.602 1.00 22.51 H new ATOM 0 HB2 GLU A 548 -10.731 -12.234 4.346 1.00 64.21 H new ATOM 0 HB3 GLU A 548 -12.083 -13.302 4.027 1.00 64.21 H new ATOM 0 HG2 GLU A 548 -10.630 -14.827 2.791 1.00 72.13 H new ATOM 0 HG3 GLU A 548 -9.272 -13.739 2.999 1.00 72.13 H new ATOM 1564 N ASP A 549 -13.605 -11.511 3.121 1.00 24.34 N ATOM 1565 CA ASP A 549 -14.657 -10.573 3.409 1.00 31.24 C ATOM 1566 C ASP A 549 -14.855 -10.472 4.892 1.00 65.44 C ATOM 1567 O ASP A 549 -14.407 -9.481 5.490 1.00 37.73 O ATOM 1568 CB ASP A 549 -15.958 -10.955 2.719 1.00 40.03 C ATOM 1569 CG ASP A 549 -17.033 -9.914 2.936 1.00 13.24 C ATOM 1570 OD1 ASP A 549 -16.979 -8.849 2.276 1.00 24.41 O ATOM 1571 OD2 ASP A 549 -17.951 -10.138 3.763 1.00 1.02 O ATOM 1572 OXT ASP A 549 -15.396 -11.422 5.490 1.00 37.73 O ATOM 0 H ASP A 549 -13.811 -12.476 3.378 1.00 24.34 H new ATOM 0 HA ASP A 549 -14.359 -9.600 3.019 1.00 31.24 H new ATOM 0 HB2 ASP A 549 -15.781 -11.078 1.651 1.00 40.03 H new ATOM 0 HB3 ASP A 549 -16.302 -11.918 3.098 1.00 40.03 H new TER 1577 ASP A 549