USER MOD reduce.3.24.130724 H: found=0, std=0, add=426, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 427 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 Single : A 416 SER OG : rot 180:sc= 0.0361 USER MOD Single : A 417 SER OG : rot 95:sc= 1.29 USER MOD Single : A 418 THR OG1 : rot 180:sc= 0 USER MOD Single : A 425 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 426 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 432 ASN : amide:sc= -0.0439 X(o=-0.044,f=-0.41) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 438 SER OG : rot 180:sc= 0 USER MOD Single : A 440 SER OG : rot 180:sc= 0 USER MOD Single : A 441 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0966) USER MOD Single : A 443 THR OG1 : rot -36:sc= 1.14 USER MOD Single : A 444 SER OG : rot 180:sc= 0 USER MOD Single : A 447 SER OG : rot 73:sc= 0.479 USER MOD Single : A 449 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 452 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 457 THR OG1 : rot 85:sc= 0.25 USER MOD Single : A 460 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 461 TYR OH : rot 180:sc= 0 USER MOD Single : A 464 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 414 -16.667 -0.990 -7.541 1.00 21.21 N ATOM 2 CA GLU A 414 -17.478 -0.189 -6.632 1.00 52.32 C ATOM 3 C GLU A 414 -16.853 1.187 -6.413 1.00 73.41 C ATOM 4 O GLU A 414 -15.836 1.521 -7.020 1.00 74.15 O ATOM 5 CB GLU A 414 -17.639 -0.907 -5.290 1.00 40.20 C ATOM 6 CG GLU A 414 -19.085 -1.201 -4.927 1.00 43.41 C ATOM 7 CD GLU A 414 -19.324 -2.667 -4.622 1.00 24.32 C ATOM 8 OE1 GLU A 414 -18.624 -3.212 -3.743 1.00 15.33 O ATOM 9 OE2 GLU A 414 -20.209 -3.268 -5.264 1.00 74.31 O ATOM 0 HA GLU A 414 -18.460 -0.055 -7.085 1.00 52.32 H new ATOM 0 HB2 GLU A 414 -17.083 -1.844 -5.320 1.00 40.20 H new ATOM 0 HB3 GLU A 414 -17.193 -0.296 -4.505 1.00 40.20 H new ATOM 0 HG2 GLU A 414 -19.367 -0.603 -4.060 1.00 43.41 H new ATOM 0 HG3 GLU A 414 -19.732 -0.895 -5.749 1.00 43.41 H new ATOM 16 N ALA A 415 -17.470 1.978 -5.543 1.00 52.02 N ATOM 17 CA ALA A 415 -16.976 3.316 -5.242 1.00 63.43 C ATOM 18 C ALA A 415 -15.786 3.261 -4.291 1.00 10.32 C ATOM 19 O ALA A 415 -15.167 4.282 -3.996 1.00 44.35 O ATOM 20 CB ALA A 415 -18.088 4.171 -4.652 1.00 32.15 C ATOM 0 H ALA A 415 -18.314 1.716 -5.033 1.00 52.02 H new ATOM 0 HA ALA A 415 -16.641 3.770 -6.175 1.00 63.43 H new ATOM 0 HB1 ALA A 415 -17.704 5.167 -4.433 1.00 32.15 H new ATOM 0 HB2 ALA A 415 -18.907 4.248 -5.368 1.00 32.15 H new ATOM 0 HB3 ALA A 415 -18.451 3.712 -3.733 1.00 32.15 H new ATOM 26 N SER A 416 -15.472 2.061 -3.812 1.00 54.25 N ATOM 27 CA SER A 416 -14.359 1.874 -2.890 1.00 14.23 C ATOM 28 C SER A 416 -13.043 1.733 -3.648 1.00 3.14 C ATOM 29 O SER A 416 -11.967 1.968 -3.096 1.00 53.13 O ATOM 30 CB SER A 416 -14.593 0.638 -2.018 1.00 34.13 C ATOM 31 OG SER A 416 -15.919 0.159 -2.159 1.00 71.34 O ATOM 0 H SER A 416 -15.973 1.204 -4.048 1.00 54.25 H new ATOM 0 HA SER A 416 -14.298 2.755 -2.251 1.00 14.23 H new ATOM 0 HB2 SER A 416 -13.888 -0.146 -2.296 1.00 34.13 H new ATOM 0 HB3 SER A 416 -14.401 0.884 -0.974 1.00 34.13 H new ATOM 0 HG SER A 416 -16.043 -0.632 -1.594 1.00 71.34 H new ATOM 37 N SER A 417 -13.136 1.347 -4.916 1.00 62.03 N ATOM 38 CA SER A 417 -11.953 1.171 -5.750 1.00 33.11 C ATOM 39 C SER A 417 -11.191 2.484 -5.897 1.00 42.54 C ATOM 40 O SER A 417 -9.960 2.500 -5.943 1.00 43.14 O ATOM 41 CB SER A 417 -12.350 0.642 -7.130 1.00 33.23 C ATOM 42 OG SER A 417 -13.613 0.000 -7.086 1.00 42.21 O ATOM 0 H SER A 417 -14.018 1.150 -5.388 1.00 62.03 H new ATOM 0 HA SER A 417 -11.301 0.445 -5.264 1.00 33.11 H new ATOM 0 HB2 SER A 417 -12.382 1.466 -7.843 1.00 33.23 H new ATOM 0 HB3 SER A 417 -11.595 -0.059 -7.486 1.00 33.23 H new ATOM 0 HG SER A 417 -14.313 0.639 -7.334 1.00 42.21 H new ATOM 48 N THR A 418 -11.931 3.586 -5.968 1.00 62.44 N ATOM 49 CA THR A 418 -11.327 4.905 -6.111 1.00 55.14 C ATOM 50 C THR A 418 -10.695 5.364 -4.803 1.00 52.41 C ATOM 51 O THR A 418 -9.760 6.164 -4.800 1.00 25.51 O ATOM 52 CB THR A 418 -12.363 5.951 -6.563 1.00 42.23 C ATOM 53 OG1 THR A 418 -13.209 5.398 -7.577 1.00 31.54 O ATOM 54 CG2 THR A 418 -11.675 7.199 -7.096 1.00 20.22 C ATOM 0 H THR A 418 -12.950 3.591 -5.929 1.00 62.44 H new ATOM 0 HA THR A 418 -10.554 4.818 -6.874 1.00 55.14 H new ATOM 0 HB THR A 418 -12.966 6.228 -5.699 1.00 42.23 H new ATOM 0 HG1 THR A 418 -13.866 6.069 -7.857 1.00 31.54 H new ATOM 0 HG21 THR A 418 -12.427 7.923 -7.409 1.00 20.22 H new ATOM 0 HG22 THR A 418 -11.055 7.635 -6.313 1.00 20.22 H new ATOM 0 HG23 THR A 418 -11.050 6.934 -7.948 1.00 20.22 H new ATOM 62 N ALA A 419 -11.213 4.854 -3.690 1.00 44.34 N ATOM 63 CA ALA A 419 -10.697 5.210 -2.373 1.00 63.24 C ATOM 64 C ALA A 419 -9.320 4.600 -2.140 1.00 11.12 C ATOM 65 O ALA A 419 -8.535 5.104 -1.335 1.00 31.52 O ATOM 66 CB ALA A 419 -11.666 4.765 -1.288 1.00 61.32 C ATOM 0 H ALA A 419 -11.990 4.193 -3.674 1.00 44.34 H new ATOM 0 HA ALA A 419 -10.596 6.294 -2.330 1.00 63.24 H new ATOM 0 HB1 ALA A 419 -11.268 5.037 -0.311 1.00 61.32 H new ATOM 0 HB2 ALA A 419 -12.629 5.254 -1.437 1.00 61.32 H new ATOM 0 HB3 ALA A 419 -11.797 3.684 -1.338 1.00 61.32 H new ATOM 72 N ILE A 420 -9.033 3.512 -2.847 1.00 12.34 N ATOM 73 CA ILE A 420 -7.750 2.833 -2.716 1.00 13.55 C ATOM 74 C ILE A 420 -6.604 3.729 -3.174 1.00 35.43 C ATOM 75 O ILE A 420 -5.447 3.504 -2.818 1.00 50.24 O ATOM 76 CB ILE A 420 -7.720 1.524 -3.528 1.00 51.22 C ATOM 77 CG1 ILE A 420 -8.957 0.678 -3.218 1.00 23.03 C ATOM 78 CG2 ILE A 420 -6.449 0.743 -3.228 1.00 40.23 C ATOM 79 CD1 ILE A 420 -9.107 0.342 -1.751 1.00 72.32 C ATOM 0 H ILE A 420 -9.672 3.082 -3.516 1.00 12.34 H new ATOM 0 HA ILE A 420 -7.624 2.598 -1.659 1.00 13.55 H new ATOM 0 HB ILE A 420 -7.729 1.772 -4.589 1.00 51.22 H new ATOM 0 HG12 ILE A 420 -9.846 1.213 -3.553 1.00 23.03 H new ATOM 0 HG13 ILE A 420 -8.907 -0.248 -3.791 1.00 23.03 H new ATOM 0 HG21 ILE A 420 -6.443 -0.179 -3.809 1.00 40.23 H new ATOM 0 HG22 ILE A 420 -5.580 1.345 -3.494 1.00 40.23 H new ATOM 0 HG23 ILE A 420 -6.412 0.502 -2.166 1.00 40.23 H new ATOM 0 HD11 ILE A 420 -10.005 -0.259 -1.605 1.00 72.32 H new ATOM 0 HD12 ILE A 420 -8.236 -0.220 -1.416 1.00 72.32 H new ATOM 0 HD13 ILE A 420 -9.189 1.263 -1.173 1.00 72.32 H new ATOM 91 N ARG A 421 -6.935 4.744 -3.965 1.00 33.04 N ATOM 92 CA ARG A 421 -5.933 5.674 -4.471 1.00 62.53 C ATOM 93 C ARG A 421 -5.118 6.272 -3.329 1.00 32.14 C ATOM 94 O ARG A 421 -3.964 6.657 -3.511 1.00 31.53 O ATOM 95 CB ARG A 421 -6.605 6.793 -5.272 1.00 22.23 C ATOM 96 CG ARG A 421 -7.015 6.376 -6.675 1.00 35.11 C ATOM 97 CD ARG A 421 -6.353 7.247 -7.732 1.00 14.42 C ATOM 98 NE ARG A 421 -7.207 8.361 -8.135 1.00 11.12 N ATOM 99 CZ ARG A 421 -6.962 9.130 -9.190 1.00 71.00 C ATOM 100 NH1 ARG A 421 -5.894 8.906 -9.943 1.00 20.30 N ATOM 101 NH2 ARG A 421 -7.786 10.124 -9.493 1.00 61.14 N ATOM 0 H ARG A 421 -7.888 4.943 -4.269 1.00 33.04 H new ATOM 0 HA ARG A 421 -5.258 5.121 -5.124 1.00 62.53 H new ATOM 0 HB2 ARG A 421 -7.487 7.136 -4.732 1.00 22.23 H new ATOM 0 HB3 ARG A 421 -5.923 7.641 -5.339 1.00 22.23 H new ATOM 0 HG2 ARG A 421 -6.744 5.333 -6.839 1.00 35.11 H new ATOM 0 HG3 ARG A 421 -8.098 6.443 -6.773 1.00 35.11 H new ATOM 0 HD2 ARG A 421 -5.411 7.634 -7.345 1.00 14.42 H new ATOM 0 HD3 ARG A 421 -6.113 6.639 -8.605 1.00 14.42 H new ATOM 0 HE ARG A 421 -8.037 8.559 -7.576 1.00 11.12 H new ATOM 0 HH11 ARG A 421 -5.259 8.142 -9.713 1.00 20.30 H new ATOM 0 HH12 ARG A 421 -5.708 9.498 -10.753 1.00 20.30 H new ATOM 0 HH21 ARG A 421 -8.609 10.298 -8.916 1.00 61.14 H new ATOM 0 HH22 ARG A 421 -7.597 10.714 -10.303 1.00 61.14 H new ATOM 115 N ALA A 422 -5.727 6.346 -2.150 1.00 11.51 N ATOM 116 CA ALA A 422 -5.058 6.894 -0.977 1.00 23.43 C ATOM 117 C ALA A 422 -4.306 5.807 -0.215 1.00 74.22 C ATOM 118 O ALA A 422 -3.345 6.089 0.502 1.00 32.44 O ATOM 119 CB ALA A 422 -6.065 7.579 -0.067 1.00 53.43 C ATOM 0 H ALA A 422 -6.683 6.033 -1.982 1.00 11.51 H new ATOM 0 HA ALA A 422 -4.331 7.632 -1.316 1.00 23.43 H new ATOM 0 HB1 ALA A 422 -5.551 7.984 0.805 1.00 53.43 H new ATOM 0 HB2 ALA A 422 -6.553 8.389 -0.609 1.00 53.43 H new ATOM 0 HB3 ALA A 422 -6.814 6.856 0.256 1.00 53.43 H new ATOM 125 N LEU A 423 -4.751 4.566 -0.373 1.00 64.40 N ATOM 126 CA LEU A 423 -4.121 3.435 0.300 1.00 65.03 C ATOM 127 C LEU A 423 -2.657 3.306 -0.108 1.00 33.40 C ATOM 128 O LEU A 423 -1.767 3.251 0.741 1.00 54.03 O ATOM 129 CB LEU A 423 -4.870 2.142 -0.024 1.00 25.54 C ATOM 130 CG LEU A 423 -5.674 1.526 1.122 1.00 61.45 C ATOM 131 CD1 LEU A 423 -4.748 0.849 2.120 1.00 72.02 C ATOM 132 CD2 LEU A 423 -6.519 2.588 1.809 1.00 53.32 C ATOM 0 H LEU A 423 -5.546 4.317 -0.961 1.00 64.40 H new ATOM 0 HA LEU A 423 -4.165 3.612 1.375 1.00 65.03 H new ATOM 0 HB2 LEU A 423 -5.549 2.338 -0.854 1.00 25.54 H new ATOM 0 HB3 LEU A 423 -4.147 1.404 -0.371 1.00 25.54 H new ATOM 0 HG LEU A 423 -6.342 0.770 0.708 1.00 61.45 H new ATOM 0 HD11 LEU A 423 -5.338 0.417 2.928 1.00 72.02 H new ATOM 0 HD12 LEU A 423 -4.187 0.061 1.619 1.00 72.02 H new ATOM 0 HD13 LEU A 423 -4.055 1.584 2.530 1.00 72.02 H new ATOM 0 HD21 LEU A 423 -7.085 2.133 2.622 1.00 53.32 H new ATOM 0 HD22 LEU A 423 -5.870 3.366 2.210 1.00 53.32 H new ATOM 0 HD23 LEU A 423 -7.209 3.027 1.088 1.00 53.32 H new ATOM 144 N VAL A 424 -2.414 3.259 -1.414 1.00 24.32 N ATOM 145 CA VAL A 424 -1.058 3.139 -1.936 1.00 40.21 C ATOM 146 C VAL A 424 -0.199 4.326 -1.513 1.00 51.13 C ATOM 147 O VAL A 424 1.030 4.265 -1.557 1.00 51.04 O ATOM 148 CB VAL A 424 -1.054 3.039 -3.473 1.00 13.51 C ATOM 149 CG1 VAL A 424 0.361 2.840 -3.992 1.00 4.53 C ATOM 150 CG2 VAL A 424 -1.964 1.910 -3.935 1.00 45.23 C ATOM 0 H VAL A 424 -3.139 3.302 -2.130 1.00 24.32 H new ATOM 0 HA VAL A 424 -0.639 2.223 -1.519 1.00 40.21 H new ATOM 0 HB VAL A 424 -1.436 3.974 -3.882 1.00 13.51 H new ATOM 0 HG11 VAL A 424 0.343 2.772 -5.080 1.00 4.53 H new ATOM 0 HG12 VAL A 424 0.981 3.685 -3.692 1.00 4.53 H new ATOM 0 HG13 VAL A 424 0.775 1.921 -3.577 1.00 4.53 H new ATOM 0 HG21 VAL A 424 -1.950 1.853 -5.023 1.00 45.23 H new ATOM 0 HG22 VAL A 424 -1.613 0.966 -3.518 1.00 45.23 H new ATOM 0 HG23 VAL A 424 -2.982 2.101 -3.595 1.00 45.23 H new ATOM 160 N LYS A 425 -0.855 5.406 -1.102 1.00 0.41 N ATOM 161 CA LYS A 425 -0.153 6.609 -0.668 1.00 33.02 C ATOM 162 C LYS A 425 0.337 6.465 0.770 1.00 35.33 C ATOM 163 O LYS A 425 1.413 6.946 1.121 1.00 4.21 O ATOM 164 CB LYS A 425 -1.070 7.829 -0.786 1.00 11.31 C ATOM 165 CG LYS A 425 -0.338 9.104 -1.170 1.00 34.11 C ATOM 166 CD LYS A 425 -0.782 9.612 -2.531 1.00 21.20 C ATOM 167 CE LYS A 425 -0.620 11.121 -2.643 1.00 0.23 C ATOM 168 NZ LYS A 425 -1.118 11.637 -3.947 1.00 31.21 N ATOM 0 H LYS A 425 -1.872 5.473 -1.060 1.00 0.41 H new ATOM 0 HA LYS A 425 0.713 6.748 -1.315 1.00 33.02 H new ATOM 0 HB2 LYS A 425 -1.840 7.624 -1.530 1.00 11.31 H new ATOM 0 HB3 LYS A 425 -1.579 7.984 0.165 1.00 11.31 H new ATOM 0 HG2 LYS A 425 -0.521 9.871 -0.417 1.00 34.11 H new ATOM 0 HG3 LYS A 425 0.736 8.919 -1.182 1.00 34.11 H new ATOM 0 HD2 LYS A 425 -0.198 9.123 -3.311 1.00 21.20 H new ATOM 0 HD3 LYS A 425 -1.825 9.344 -2.698 1.00 21.20 H new ATOM 0 HE2 LYS A 425 -1.161 11.606 -1.830 1.00 0.23 H new ATOM 0 HE3 LYS A 425 0.432 11.383 -2.527 1.00 0.23 H new ATOM 0 HZ1 LYS A 425 -0.990 12.668 -3.984 1.00 31.21 H new ATOM 0 HZ2 LYS A 425 -0.585 11.194 -4.722 1.00 31.21 H new ATOM 0 HZ3 LYS A 425 -2.128 11.410 -4.047 1.00 31.21 H new ATOM 182 N LYS A 426 -0.461 5.797 1.597 1.00 21.21 N ATOM 183 CA LYS A 426 -0.108 5.587 2.996 1.00 14.34 C ATOM 184 C LYS A 426 1.252 4.907 3.118 1.00 63.30 C ATOM 185 O LYS A 426 2.023 5.196 4.034 1.00 43.32 O ATOM 186 CB LYS A 426 -1.176 4.740 3.691 1.00 34.41 C ATOM 187 CG LYS A 426 -1.813 5.425 4.888 1.00 65.22 C ATOM 188 CD LYS A 426 -1.411 4.758 6.192 1.00 72.02 C ATOM 189 CE LYS A 426 -2.398 5.073 7.305 1.00 11.53 C ATOM 190 NZ LYS A 426 -3.306 3.925 7.584 1.00 21.20 N ATOM 0 H LYS A 426 -1.356 5.392 1.322 1.00 21.21 H new ATOM 0 HA LYS A 426 -0.053 6.562 3.481 1.00 14.34 H new ATOM 0 HB2 LYS A 426 -1.954 4.489 2.970 1.00 34.41 H new ATOM 0 HB3 LYS A 426 -0.728 3.801 4.016 1.00 34.41 H new ATOM 0 HG2 LYS A 426 -1.517 6.474 4.908 1.00 65.22 H new ATOM 0 HG3 LYS A 426 -2.898 5.402 4.786 1.00 65.22 H new ATOM 0 HD2 LYS A 426 -1.355 3.679 6.048 1.00 72.02 H new ATOM 0 HD3 LYS A 426 -0.415 5.093 6.482 1.00 72.02 H new ATOM 0 HE2 LYS A 426 -1.852 5.333 8.212 1.00 11.53 H new ATOM 0 HE3 LYS A 426 -2.990 5.945 7.029 1.00 11.53 H new ATOM 0 HZ1 LYS A 426 -3.963 4.180 8.349 1.00 21.20 H new ATOM 0 HZ2 LYS A 426 -3.846 3.693 6.726 1.00 21.20 H new ATOM 0 HZ3 LYS A 426 -2.743 3.099 7.872 1.00 21.20 H new ATOM 204 N LEU A 427 1.542 4.003 2.188 1.00 44.22 N ATOM 205 CA LEU A 427 2.812 3.284 2.190 1.00 74.24 C ATOM 206 C LEU A 427 3.972 4.224 1.878 1.00 72.34 C ATOM 207 O LEU A 427 5.127 3.918 2.172 1.00 41.25 O ATOM 208 CB LEU A 427 2.775 2.144 1.171 1.00 23.21 C ATOM 209 CG LEU A 427 1.821 0.992 1.486 1.00 62.53 C ATOM 210 CD1 LEU A 427 1.945 0.578 2.945 1.00 63.54 C ATOM 211 CD2 LEU A 427 0.386 1.383 1.161 1.00 43.24 C ATOM 0 H LEU A 427 0.916 3.751 1.424 1.00 44.22 H new ATOM 0 HA LEU A 427 2.965 2.869 3.186 1.00 74.24 H new ATOM 0 HB2 LEU A 427 2.503 2.560 0.201 1.00 23.21 H new ATOM 0 HB3 LEU A 427 3.782 1.739 1.073 1.00 23.21 H new ATOM 0 HG LEU A 427 2.094 0.140 0.864 1.00 62.53 H new ATOM 0 HD11 LEU A 427 1.258 -0.243 3.150 1.00 63.54 H new ATOM 0 HD12 LEU A 427 2.967 0.255 3.146 1.00 63.54 H new ATOM 0 HD13 LEU A 427 1.699 1.425 3.586 1.00 63.54 H new ATOM 0 HD21 LEU A 427 -0.279 0.551 1.392 1.00 43.24 H new ATOM 0 HD22 LEU A 427 0.102 2.251 1.756 1.00 43.24 H new ATOM 0 HD23 LEU A 427 0.307 1.628 0.102 1.00 43.24 H new ATOM 223 N ILE A 428 3.654 5.369 1.282 1.00 31.33 N ATOM 224 CA ILE A 428 4.670 6.354 0.934 1.00 60.04 C ATOM 225 C ILE A 428 4.690 7.501 1.939 1.00 23.40 C ATOM 226 O ILE A 428 5.693 8.202 2.076 1.00 73.53 O ATOM 227 CB ILE A 428 4.438 6.927 -0.478 1.00 14.51 C ATOM 228 CG1 ILE A 428 4.484 5.807 -1.520 1.00 5.33 C ATOM 229 CG2 ILE A 428 5.474 7.995 -0.793 1.00 44.10 C ATOM 230 CD1 ILE A 428 3.397 5.911 -2.567 1.00 64.02 C ATOM 0 H ILE A 428 2.702 5.637 1.031 1.00 31.33 H new ATOM 0 HA ILE A 428 5.630 5.839 0.955 1.00 60.04 H new ATOM 0 HB ILE A 428 3.450 7.387 -0.510 1.00 14.51 H new ATOM 0 HG12 ILE A 428 5.456 5.821 -2.014 1.00 5.33 H new ATOM 0 HG13 ILE A 428 4.398 4.846 -1.013 1.00 5.33 H new ATOM 0 HG21 ILE A 428 5.297 8.390 -1.793 1.00 44.10 H new ATOM 0 HG22 ILE A 428 5.397 8.803 -0.065 1.00 44.10 H new ATOM 0 HG23 ILE A 428 6.472 7.559 -0.747 1.00 44.10 H new ATOM 0 HD11 ILE A 428 3.491 5.085 -3.272 1.00 64.02 H new ATOM 0 HD12 ILE A 428 2.421 5.867 -2.084 1.00 64.02 H new ATOM 0 HD13 ILE A 428 3.495 6.856 -3.101 1.00 64.02 H new ATOM 242 N ALA A 429 3.577 7.687 2.639 1.00 54.21 N ATOM 243 CA ALA A 429 3.468 8.745 3.634 1.00 45.33 C ATOM 244 C ALA A 429 4.644 8.711 4.604 1.00 15.43 C ATOM 245 O ALA A 429 5.294 9.728 4.843 1.00 41.43 O ATOM 246 CB ALA A 429 2.154 8.626 4.392 1.00 32.31 C ATOM 0 H ALA A 429 2.737 7.118 2.535 1.00 54.21 H new ATOM 0 HA ALA A 429 3.488 9.702 3.112 1.00 45.33 H new ATOM 0 HB1 ALA A 429 2.087 9.424 5.132 1.00 32.31 H new ATOM 0 HB2 ALA A 429 1.322 8.709 3.693 1.00 32.31 H new ATOM 0 HB3 ALA A 429 2.110 7.660 4.895 1.00 32.31 H new ATOM 252 N ALA A 430 4.912 7.534 5.161 1.00 62.51 N ATOM 253 CA ALA A 430 6.011 7.367 6.103 1.00 62.11 C ATOM 254 C ALA A 430 7.145 6.556 5.486 1.00 0.22 C ATOM 255 O ALA A 430 7.641 5.605 6.090 1.00 43.15 O ATOM 256 CB ALA A 430 5.517 6.701 7.378 1.00 35.43 C ATOM 0 H ALA A 430 4.382 6.682 4.976 1.00 62.51 H new ATOM 0 HA ALA A 430 6.399 8.356 6.349 1.00 62.11 H new ATOM 0 HB1 ALA A 430 6.349 6.583 8.072 1.00 35.43 H new ATOM 0 HB2 ALA A 430 4.746 7.320 7.837 1.00 35.43 H new ATOM 0 HB3 ALA A 430 5.101 5.722 7.140 1.00 35.43 H new ATOM 262 N GLU A 431 7.551 6.938 4.278 1.00 51.32 N ATOM 263 CA GLU A 431 8.626 6.244 3.580 1.00 23.21 C ATOM 264 C GLU A 431 9.341 7.182 2.612 1.00 11.21 C ATOM 265 O GLU A 431 8.760 8.155 2.132 1.00 62.22 O ATOM 266 CB GLU A 431 8.075 5.034 2.821 1.00 53.14 C ATOM 267 CG GLU A 431 7.557 3.931 3.729 1.00 52.14 C ATOM 268 CD GLU A 431 8.645 3.328 4.595 1.00 64.21 C ATOM 269 OE1 GLU A 431 9.822 3.363 4.176 1.00 3.42 O ATOM 270 OE2 GLU A 431 8.322 2.822 5.689 1.00 32.11 O ATOM 0 H GLU A 431 7.152 7.723 3.764 1.00 51.32 H new ATOM 0 HA GLU A 431 9.345 5.901 4.324 1.00 23.21 H new ATOM 0 HB2 GLU A 431 7.268 5.363 2.166 1.00 53.14 H new ATOM 0 HB3 GLU A 431 8.859 4.629 2.182 1.00 53.14 H new ATOM 0 HG2 GLU A 431 6.770 4.331 4.368 1.00 52.14 H new ATOM 0 HG3 GLU A 431 7.106 3.147 3.121 1.00 52.14 H new ATOM 277 N ASN A 432 10.605 6.883 2.332 1.00 63.21 N ATOM 278 CA ASN A 432 11.400 7.700 1.422 1.00 4.12 C ATOM 279 C ASN A 432 11.672 6.956 0.118 1.00 73.35 C ATOM 280 O ASN A 432 12.731 6.359 -0.077 1.00 11.11 O ATOM 281 CB ASN A 432 12.724 8.094 2.082 1.00 74.21 C ATOM 282 CG ASN A 432 12.933 7.402 3.415 1.00 63.13 C ATOM 283 OD1 ASN A 432 13.255 6.216 3.467 1.00 33.21 O ATOM 284 ND2 ASN A 432 12.751 8.144 4.501 1.00 5.30 N ATOM 0 H ASN A 432 11.101 6.081 2.722 1.00 63.21 H new ATOM 0 HA ASN A 432 10.832 8.602 1.193 1.00 4.12 H new ATOM 0 HB2 ASN A 432 13.548 7.846 1.413 1.00 74.21 H new ATOM 0 HB3 ASN A 432 12.747 9.174 2.229 1.00 74.21 H new ATOM 0 HD21 ASN A 432 12.878 7.734 5.426 1.00 5.30 H new ATOM 0 HD22 ASN A 432 12.484 9.124 4.410 1.00 5.30 H new ATOM 291 N PRO A 433 10.692 6.992 -0.798 1.00 31.12 N ATOM 292 CA PRO A 433 10.802 6.327 -2.100 1.00 72.40 C ATOM 293 C PRO A 433 11.815 7.006 -3.015 1.00 11.23 C ATOM 294 O PRO A 433 12.038 6.569 -4.144 1.00 53.42 O ATOM 295 CB PRO A 433 9.391 6.450 -2.681 1.00 30.11 C ATOM 296 CG PRO A 433 8.810 7.650 -2.016 1.00 5.24 C ATOM 297 CD PRO A 433 9.403 7.684 -0.634 1.00 50.50 C ATOM 0 HA PRO A 433 11.151 5.299 -2.004 1.00 72.40 H new ATOM 0 HB2 PRO A 433 9.418 6.572 -3.764 1.00 30.11 H new ATOM 0 HB3 PRO A 433 8.799 5.558 -2.475 1.00 30.11 H new ATOM 0 HG2 PRO A 433 9.053 8.558 -2.568 1.00 5.24 H new ATOM 0 HG3 PRO A 433 7.723 7.585 -1.973 1.00 5.24 H new ATOM 0 HD2 PRO A 433 9.538 8.706 -0.280 1.00 50.50 H new ATOM 0 HD3 PRO A 433 8.764 7.178 0.090 1.00 50.50 H new ATOM 305 N ALA A 434 12.428 8.077 -2.519 1.00 34.32 N ATOM 306 CA ALA A 434 13.420 8.815 -3.291 1.00 31.51 C ATOM 307 C ALA A 434 14.462 7.874 -3.889 1.00 53.44 C ATOM 308 O ALA A 434 14.522 7.689 -5.104 1.00 72.44 O ATOM 309 CB ALA A 434 14.092 9.865 -2.419 1.00 24.10 C ATOM 0 H ALA A 434 12.255 8.452 -1.586 1.00 34.32 H new ATOM 0 HA ALA A 434 12.907 9.315 -4.113 1.00 31.51 H new ATOM 0 HB1 ALA A 434 14.831 10.409 -3.008 1.00 24.10 H new ATOM 0 HB2 ALA A 434 13.342 10.562 -2.045 1.00 24.10 H new ATOM 0 HB3 ALA A 434 14.586 9.378 -1.578 1.00 24.10 H new ATOM 315 N LYS A 435 15.281 7.282 -3.027 1.00 54.52 N ATOM 316 CA LYS A 435 16.320 6.359 -3.467 1.00 61.13 C ATOM 317 C LYS A 435 15.725 5.003 -3.830 1.00 5.24 C ATOM 318 O LYS A 435 15.815 4.543 -4.969 1.00 13.21 O ATOM 319 CB LYS A 435 17.378 6.189 -2.374 1.00 60.13 C ATOM 320 CG LYS A 435 18.669 6.938 -2.655 1.00 62.42 C ATOM 321 CD LYS A 435 19.793 6.471 -1.745 1.00 64.25 C ATOM 322 CE LYS A 435 19.859 7.300 -0.471 1.00 24.32 C ATOM 323 NZ LYS A 435 20.610 6.600 0.607 1.00 51.41 N ATOM 0 H LYS A 435 15.245 7.425 -2.018 1.00 54.52 H new ATOM 0 HA LYS A 435 16.791 6.779 -4.356 1.00 61.13 H new ATOM 0 HB2 LYS A 435 16.967 6.534 -1.425 1.00 60.13 H new ATOM 0 HB3 LYS A 435 17.601 5.128 -2.258 1.00 60.13 H new ATOM 0 HG2 LYS A 435 18.957 6.791 -3.696 1.00 62.42 H new ATOM 0 HG3 LYS A 435 18.508 8.007 -2.517 1.00 62.42 H new ATOM 0 HD2 LYS A 435 19.644 5.422 -1.490 1.00 64.25 H new ATOM 0 HD3 LYS A 435 20.743 6.539 -2.274 1.00 64.25 H new ATOM 0 HE2 LYS A 435 20.336 8.256 -0.684 1.00 24.32 H new ATOM 0 HE3 LYS A 435 18.848 7.518 -0.127 1.00 24.32 H new ATOM 0 HZ1 LYS A 435 20.633 7.197 1.458 1.00 51.41 H new ATOM 0 HZ2 LYS A 435 20.140 5.699 0.828 1.00 51.41 H new ATOM 0 HZ3 LYS A 435 21.582 6.414 0.288 1.00 51.41 H new ATOM 337 N PRO A 436 15.102 4.346 -2.840 1.00 34.31 N ATOM 338 CA PRO A 436 14.479 3.033 -3.032 1.00 35.53 C ATOM 339 C PRO A 436 13.229 3.106 -3.903 1.00 73.10 C ATOM 340 O PRO A 436 12.815 4.188 -4.322 1.00 61.41 O ATOM 341 CB PRO A 436 14.115 2.602 -1.609 1.00 74.55 C ATOM 342 CG PRO A 436 13.968 3.877 -0.853 1.00 71.24 C ATOM 343 CD PRO A 436 14.958 4.834 -1.459 1.00 55.12 C ATOM 0 HA PRO A 436 15.143 2.338 -3.546 1.00 35.53 H new ATOM 0 HB2 PRO A 436 13.191 2.024 -1.595 1.00 74.55 H new ATOM 0 HB3 PRO A 436 14.892 1.972 -1.175 1.00 74.55 H new ATOM 0 HG2 PRO A 436 12.952 4.264 -0.933 1.00 71.24 H new ATOM 0 HG3 PRO A 436 14.169 3.727 0.208 1.00 71.24 H new ATOM 0 HD2 PRO A 436 14.593 5.861 -1.432 1.00 55.12 H new ATOM 0 HD3 PRO A 436 15.909 4.819 -0.926 1.00 55.12 H new ATOM 351 N LEU A 437 12.632 1.950 -4.171 1.00 61.52 N ATOM 352 CA LEU A 437 11.429 1.883 -4.993 1.00 55.12 C ATOM 353 C LEU A 437 10.833 0.479 -4.972 1.00 64.34 C ATOM 354 O LEU A 437 10.200 0.048 -5.937 1.00 42.21 O ATOM 355 CB LEU A 437 11.745 2.295 -6.432 1.00 22.01 C ATOM 356 CG LEU A 437 12.942 1.599 -7.081 1.00 12.03 C ATOM 357 CD1 LEU A 437 12.532 0.247 -7.645 1.00 12.30 C ATOM 358 CD2 LEU A 437 13.540 2.473 -8.173 1.00 42.45 C ATOM 0 H LEU A 437 12.961 1.046 -3.831 1.00 61.52 H new ATOM 0 HA LEU A 437 10.696 2.575 -4.578 1.00 55.12 H new ATOM 0 HB2 LEU A 437 10.864 2.106 -7.045 1.00 22.01 H new ATOM 0 HB3 LEU A 437 11.921 3.370 -6.451 1.00 22.01 H new ATOM 0 HG LEU A 437 13.701 1.437 -6.316 1.00 12.03 H new ATOM 0 HD11 LEU A 437 13.397 -0.234 -8.103 1.00 12.30 H new ATOM 0 HD12 LEU A 437 12.151 -0.382 -6.841 1.00 12.30 H new ATOM 0 HD13 LEU A 437 11.755 0.387 -8.396 1.00 12.30 H new ATOM 0 HD21 LEU A 437 14.391 1.961 -8.623 1.00 42.45 H new ATOM 0 HD22 LEU A 437 12.787 2.667 -8.937 1.00 42.45 H new ATOM 0 HD23 LEU A 437 13.871 3.418 -7.742 1.00 42.45 H new ATOM 370 N SER A 438 11.038 -0.230 -3.867 1.00 4.22 N ATOM 371 CA SER A 438 10.523 -1.586 -3.722 1.00 52.05 C ATOM 372 C SER A 438 9.596 -1.689 -2.514 1.00 23.01 C ATOM 373 O SER A 438 9.549 -0.789 -1.675 1.00 62.51 O ATOM 374 CB SER A 438 11.677 -2.580 -3.579 1.00 60.54 C ATOM 375 OG SER A 438 12.886 -1.914 -3.259 1.00 32.23 O ATOM 0 H SER A 438 11.557 0.112 -3.059 1.00 4.22 H new ATOM 0 HA SER A 438 9.952 -1.829 -4.618 1.00 52.05 H new ATOM 0 HB2 SER A 438 11.441 -3.306 -2.801 1.00 60.54 H new ATOM 0 HB3 SER A 438 11.799 -3.136 -4.508 1.00 60.54 H new ATOM 0 HG SER A 438 13.608 -2.571 -3.171 1.00 32.23 H new ATOM 381 N ASP A 439 8.861 -2.793 -2.433 1.00 42.24 N ATOM 382 CA ASP A 439 7.936 -3.015 -1.328 1.00 63.30 C ATOM 383 C ASP A 439 8.679 -3.490 -0.083 1.00 65.31 C ATOM 384 O ASP A 439 9.884 -3.274 0.051 1.00 14.32 O ATOM 385 CB ASP A 439 6.873 -4.040 -1.724 1.00 15.11 C ATOM 386 CG ASP A 439 6.555 -4.003 -3.206 1.00 65.13 C ATOM 387 OD1 ASP A 439 6.435 -2.889 -3.759 1.00 12.40 O ATOM 388 OD2 ASP A 439 6.427 -5.086 -3.814 1.00 53.20 O ATOM 0 H ASP A 439 8.888 -3.547 -3.119 1.00 42.24 H new ATOM 0 HA ASP A 439 7.449 -2.067 -1.099 1.00 63.30 H new ATOM 0 HB2 ASP A 439 7.217 -5.038 -1.454 1.00 15.11 H new ATOM 0 HB3 ASP A 439 5.962 -3.852 -1.155 1.00 15.11 H new ATOM 393 N SER A 440 7.954 -4.136 0.823 1.00 73.40 N ATOM 394 CA SER A 440 8.544 -4.637 2.059 1.00 74.51 C ATOM 395 C SER A 440 8.774 -3.501 3.051 1.00 22.42 C ATOM 396 O SER A 440 8.243 -3.513 4.162 1.00 21.41 O ATOM 397 CB SER A 440 9.866 -5.349 1.765 1.00 54.41 C ATOM 398 OG SER A 440 10.119 -6.368 2.718 1.00 32.40 O ATOM 0 H SER A 440 6.957 -4.325 0.725 1.00 73.40 H new ATOM 0 HA SER A 440 7.847 -5.348 2.504 1.00 74.51 H new ATOM 0 HB2 SER A 440 9.835 -5.781 0.765 1.00 54.41 H new ATOM 0 HB3 SER A 440 10.682 -4.626 1.775 1.00 54.41 H new ATOM 0 HG SER A 440 10.968 -6.809 2.507 1.00 32.40 H new ATOM 404 N LYS A 441 9.570 -2.519 2.641 1.00 30.31 N ATOM 405 CA LYS A 441 9.872 -1.374 3.490 1.00 41.52 C ATOM 406 C LYS A 441 8.590 -0.699 3.970 1.00 61.01 C ATOM 407 O LYS A 441 8.547 -0.128 5.060 1.00 14.44 O ATOM 408 CB LYS A 441 10.738 -0.365 2.733 1.00 44.32 C ATOM 409 CG LYS A 441 12.115 -0.168 3.344 1.00 45.02 C ATOM 410 CD LYS A 441 13.078 0.469 2.355 1.00 32.24 C ATOM 411 CE LYS A 441 14.520 0.100 2.666 1.00 45.14 C ATOM 412 NZ LYS A 441 14.884 0.423 4.073 1.00 44.22 N ATOM 0 H LYS A 441 10.018 -2.494 1.725 1.00 30.31 H new ATOM 0 HA LYS A 441 10.421 -1.734 4.360 1.00 41.52 H new ATOM 0 HB2 LYS A 441 10.851 -0.698 1.701 1.00 44.32 H new ATOM 0 HB3 LYS A 441 10.222 0.595 2.703 1.00 44.32 H new ATOM 0 HG2 LYS A 441 12.034 0.461 4.231 1.00 45.02 H new ATOM 0 HG3 LYS A 441 12.510 -1.130 3.670 1.00 45.02 H new ATOM 0 HD2 LYS A 441 12.829 0.147 1.344 1.00 32.24 H new ATOM 0 HD3 LYS A 441 12.965 1.553 2.382 1.00 32.24 H new ATOM 0 HE2 LYS A 441 14.669 -0.965 2.488 1.00 45.14 H new ATOM 0 HE3 LYS A 441 15.186 0.633 1.987 1.00 45.14 H new ATOM 0 HZ1 LYS A 441 15.915 0.350 4.190 1.00 44.22 H new ATOM 0 HZ2 LYS A 441 14.578 1.391 4.297 1.00 44.22 H new ATOM 0 HZ3 LYS A 441 14.414 -0.246 4.716 1.00 44.22 H new ATOM 426 N LEU A 442 7.547 -0.770 3.150 1.00 43.30 N ATOM 427 CA LEU A 442 6.263 -0.167 3.490 1.00 14.45 C ATOM 428 C LEU A 442 5.458 -1.084 4.405 1.00 31.13 C ATOM 429 O LEU A 442 4.569 -0.634 5.129 1.00 42.03 O ATOM 430 CB LEU A 442 5.466 0.135 2.221 1.00 14.14 C ATOM 431 CG LEU A 442 5.796 -0.726 1.001 1.00 61.22 C ATOM 432 CD1 LEU A 442 5.530 -2.194 1.295 1.00 12.25 C ATOM 433 CD2 LEU A 442 4.993 -0.269 -0.208 1.00 42.52 C ATOM 0 H LEU A 442 7.565 -1.239 2.245 1.00 43.30 H new ATOM 0 HA LEU A 442 6.456 0.766 4.019 1.00 14.45 H new ATOM 0 HB2 LEU A 442 4.406 0.020 2.446 1.00 14.14 H new ATOM 0 HB3 LEU A 442 5.624 1.181 1.957 1.00 14.14 H new ATOM 0 HG LEU A 442 6.856 -0.608 0.774 1.00 61.22 H new ATOM 0 HD11 LEU A 442 5.771 -2.791 0.415 1.00 12.25 H new ATOM 0 HD12 LEU A 442 6.150 -2.516 2.132 1.00 12.25 H new ATOM 0 HD13 LEU A 442 4.479 -2.330 1.549 1.00 12.25 H new ATOM 0 HD21 LEU A 442 5.241 -0.893 -1.067 1.00 42.52 H new ATOM 0 HD22 LEU A 442 3.928 -0.356 0.008 1.00 42.52 H new ATOM 0 HD23 LEU A 442 5.234 0.770 -0.433 1.00 42.52 H new ATOM 445 N THR A 443 5.775 -2.375 4.370 1.00 11.55 N ATOM 446 CA THR A 443 5.082 -3.355 5.196 1.00 21.10 C ATOM 447 C THR A 443 5.703 -3.441 6.586 1.00 23.12 C ATOM 448 O THR A 443 5.048 -3.850 7.545 1.00 23.10 O ATOM 449 CB THR A 443 5.106 -4.752 4.548 1.00 14.14 C ATOM 450 OG1 THR A 443 6.413 -5.324 4.663 1.00 22.31 O ATOM 451 CG2 THR A 443 4.707 -4.676 3.081 1.00 13.54 C ATOM 0 H THR A 443 6.508 -2.766 3.778 1.00 11.55 H new ATOM 0 HA THR A 443 4.048 -3.020 5.284 1.00 21.10 H new ATOM 0 HB THR A 443 4.387 -5.382 5.071 1.00 14.14 H new ATOM 0 HG1 THR A 443 7.088 -4.620 4.567 1.00 22.31 H new ATOM 0 HG21 THR A 443 4.731 -5.675 2.645 1.00 13.54 H new ATOM 0 HG22 THR A 443 3.699 -4.269 2.999 1.00 13.54 H new ATOM 0 HG23 THR A 443 5.404 -4.030 2.547 1.00 13.54 H new ATOM 459 N SER A 444 6.971 -3.055 6.687 1.00 40.42 N ATOM 460 CA SER A 444 7.682 -3.091 7.959 1.00 2.12 C ATOM 461 C SER A 444 6.939 -2.285 9.021 1.00 71.33 C ATOM 462 O SER A 444 6.626 -2.793 10.098 1.00 32.14 O ATOM 463 CB SER A 444 9.102 -2.546 7.791 1.00 35.14 C ATOM 464 OG SER A 444 9.917 -2.896 8.896 1.00 41.20 O ATOM 0 H SER A 444 7.527 -2.714 5.903 1.00 40.42 H new ATOM 0 HA SER A 444 7.735 -4.129 8.286 1.00 2.12 H new ATOM 0 HB2 SER A 444 9.540 -2.939 6.873 1.00 35.14 H new ATOM 0 HB3 SER A 444 9.069 -1.461 7.689 1.00 35.14 H new ATOM 0 HG SER A 444 10.819 -2.538 8.763 1.00 41.20 H new ATOM 470 N LEU A 445 6.658 -1.025 8.707 1.00 3.43 N ATOM 471 CA LEU A 445 5.951 -0.146 9.634 1.00 72.42 C ATOM 472 C LEU A 445 4.568 -0.700 9.962 1.00 24.13 C ATOM 473 O LEU A 445 4.051 -0.496 11.061 1.00 21.51 O ATOM 474 CB LEU A 445 5.823 1.257 9.038 1.00 72.31 C ATOM 475 CG LEU A 445 6.764 2.319 9.609 1.00 35.54 C ATOM 476 CD1 LEU A 445 7.039 3.400 8.576 1.00 11.01 C ATOM 477 CD2 LEU A 445 6.179 2.924 10.876 1.00 50.04 C ATOM 0 H LEU A 445 6.908 -0.589 7.819 1.00 3.43 H new ATOM 0 HA LEU A 445 6.528 -0.091 10.557 1.00 72.42 H new ATOM 0 HB2 LEU A 445 5.993 1.190 7.963 1.00 72.31 H new ATOM 0 HB3 LEU A 445 4.797 1.597 9.178 1.00 72.31 H new ATOM 0 HG LEU A 445 7.710 1.840 9.863 1.00 35.54 H new ATOM 0 HD11 LEU A 445 7.710 4.147 9.000 1.00 11.01 H new ATOM 0 HD12 LEU A 445 7.503 2.953 7.697 1.00 11.01 H new ATOM 0 HD13 LEU A 445 6.101 3.876 8.289 1.00 11.01 H new ATOM 0 HD21 LEU A 445 6.862 3.677 11.268 1.00 50.04 H new ATOM 0 HD22 LEU A 445 5.219 3.388 10.648 1.00 50.04 H new ATOM 0 HD23 LEU A 445 6.036 2.141 11.621 1.00 50.04 H new ATOM 489 N LEU A 446 3.976 -1.404 9.003 1.00 54.14 N ATOM 490 CA LEU A 446 2.653 -1.990 9.190 1.00 12.23 C ATOM 491 C LEU A 446 2.728 -3.227 10.081 1.00 73.54 C ATOM 492 O LEU A 446 1.805 -3.509 10.846 1.00 4.14 O ATOM 493 CB LEU A 446 2.040 -2.357 7.838 1.00 53.35 C ATOM 494 CG LEU A 446 0.999 -1.381 7.287 1.00 30.15 C ATOM 495 CD1 LEU A 446 0.468 -1.869 5.948 1.00 75.33 C ATOM 496 CD2 LEU A 446 -0.138 -1.197 8.280 1.00 34.43 C ATOM 0 H LEU A 446 4.391 -1.583 8.089 1.00 54.14 H new ATOM 0 HA LEU A 446 2.020 -1.250 9.679 1.00 12.23 H new ATOM 0 HB2 LEU A 446 2.845 -2.448 7.109 1.00 53.35 H new ATOM 0 HB3 LEU A 446 1.577 -3.340 7.926 1.00 53.35 H new ATOM 0 HG LEU A 446 1.479 -0.414 7.134 1.00 30.15 H new ATOM 0 HD11 LEU A 446 -0.271 -1.163 5.571 1.00 75.33 H new ATOM 0 HD12 LEU A 446 1.291 -1.948 5.237 1.00 75.33 H new ATOM 0 HD13 LEU A 446 0.004 -2.847 6.075 1.00 75.33 H new ATOM 0 HD21 LEU A 446 -0.869 -0.499 7.871 1.00 34.43 H new ATOM 0 HD22 LEU A 446 -0.618 -2.158 8.466 1.00 34.43 H new ATOM 0 HD23 LEU A 446 0.257 -0.802 9.216 1.00 34.43 H new ATOM 508 N SER A 447 3.832 -3.959 9.976 1.00 35.40 N ATOM 509 CA SER A 447 4.026 -5.167 10.769 1.00 55.23 C ATOM 510 C SER A 447 4.381 -4.818 12.212 1.00 41.31 C ATOM 511 O SER A 447 4.327 -5.669 13.098 1.00 51.42 O ATOM 512 CB SER A 447 5.127 -6.034 10.157 1.00 32.44 C ATOM 513 OG SER A 447 4.763 -6.482 8.862 1.00 0.43 O ATOM 0 H SER A 447 4.606 -3.737 9.350 1.00 35.40 H new ATOM 0 HA SER A 447 3.091 -5.727 10.768 1.00 55.23 H new ATOM 0 HB2 SER A 447 6.054 -5.464 10.101 1.00 32.44 H new ATOM 0 HB3 SER A 447 5.319 -6.892 10.801 1.00 32.44 H new ATOM 0 HG SER A 447 4.807 -5.732 8.232 1.00 0.43 H new ATOM 519 N GLU A 448 4.744 -3.559 12.437 1.00 61.53 N ATOM 520 CA GLU A 448 5.110 -3.097 13.771 1.00 62.44 C ATOM 521 C GLU A 448 3.986 -3.367 14.767 1.00 52.12 C ATOM 522 O GLU A 448 4.223 -3.489 15.968 1.00 23.40 O ATOM 523 CB GLU A 448 5.435 -1.602 13.746 1.00 63.30 C ATOM 524 CG GLU A 448 6.776 -1.281 13.107 1.00 21.43 C ATOM 525 CD GLU A 448 7.949 -1.742 13.951 1.00 64.43 C ATOM 526 OE1 GLU A 448 7.733 -2.083 15.132 1.00 14.00 O ATOM 527 OE2 GLU A 448 9.083 -1.761 13.428 1.00 10.01 O ATOM 0 H GLU A 448 4.792 -2.842 11.714 1.00 61.53 H new ATOM 0 HA GLU A 448 5.995 -3.649 14.089 1.00 62.44 H new ATOM 0 HB2 GLU A 448 4.649 -1.077 13.204 1.00 63.30 H new ATOM 0 HB3 GLU A 448 5.428 -1.220 14.767 1.00 63.30 H new ATOM 0 HG2 GLU A 448 6.830 -1.755 12.127 1.00 21.43 H new ATOM 0 HG3 GLU A 448 6.849 -0.205 12.946 1.00 21.43 H new ATOM 534 N GLN A 449 2.761 -3.460 14.257 1.00 51.54 N ATOM 535 CA GLN A 449 1.600 -3.714 15.102 1.00 70.20 C ATOM 536 C GLN A 449 1.035 -5.107 14.847 1.00 24.31 C ATOM 537 O GLN A 449 0.569 -5.777 15.766 1.00 33.04 O ATOM 538 CB GLN A 449 0.521 -2.660 14.852 1.00 54.13 C ATOM 539 CG GLN A 449 0.966 -1.540 13.926 1.00 4.01 C ATOM 540 CD GLN A 449 -0.022 -0.392 13.880 1.00 54.44 C ATOM 541 OE1 GLN A 449 -1.136 -0.495 14.397 1.00 24.01 O ATOM 542 NE2 GLN A 449 0.379 0.712 13.261 1.00 4.42 N ATOM 0 H GLN A 449 2.548 -3.363 13.264 1.00 51.54 H new ATOM 0 HA GLN A 449 1.920 -3.657 16.142 1.00 70.20 H new ATOM 0 HB2 GLN A 449 -0.357 -3.145 14.426 1.00 54.13 H new ATOM 0 HB3 GLN A 449 0.216 -2.231 15.807 1.00 54.13 H new ATOM 0 HG2 GLN A 449 1.936 -1.166 14.254 1.00 4.01 H new ATOM 0 HG3 GLN A 449 1.102 -1.938 12.920 1.00 4.01 H new ATOM 0 HE21 GLN A 449 1.310 0.755 12.847 1.00 4.42 H new ATOM 0 HE22 GLN A 449 -0.244 1.517 13.200 1.00 4.42 H new ATOM 551 N GLY A 450 1.082 -5.537 13.589 1.00 31.31 N ATOM 552 CA GLY A 450 0.571 -6.850 13.235 1.00 43.33 C ATOM 553 C GLY A 450 0.026 -6.896 11.822 1.00 35.30 C ATOM 554 O GLY A 450 -0.214 -7.974 11.278 1.00 21.33 O ATOM 0 H GLY A 450 1.464 -5.001 12.810 1.00 31.31 H new ATOM 0 HA2 GLY A 450 1.368 -7.587 13.338 1.00 43.33 H new ATOM 0 HA3 GLY A 450 -0.216 -7.131 13.934 1.00 43.33 H new ATOM 558 N ILE A 451 -0.173 -5.725 11.226 1.00 42.21 N ATOM 559 CA ILE A 451 -0.694 -5.638 9.868 1.00 72.41 C ATOM 560 C ILE A 451 0.191 -6.403 8.889 1.00 74.33 C ATOM 561 O ILE A 451 1.393 -6.548 9.107 1.00 12.14 O ATOM 562 CB ILE A 451 -0.810 -4.174 9.402 1.00 31.05 C ATOM 563 CG1 ILE A 451 -1.529 -3.336 10.460 1.00 65.13 C ATOM 564 CG2 ILE A 451 -1.542 -4.098 8.070 1.00 11.12 C ATOM 565 CD1 ILE A 451 -2.884 -3.884 10.849 1.00 3.15 C ATOM 0 H ILE A 451 0.019 -4.823 11.663 1.00 42.21 H new ATOM 0 HA ILE A 451 -1.688 -6.086 9.882 1.00 72.41 H new ATOM 0 HB ILE A 451 0.193 -3.770 9.266 1.00 31.05 H new ATOM 0 HG12 ILE A 451 -0.902 -3.274 11.350 1.00 65.13 H new ATOM 0 HG13 ILE A 451 -1.651 -2.320 10.085 1.00 65.13 H new ATOM 0 HG21 ILE A 451 -1.616 -3.057 7.754 1.00 11.12 H new ATOM 0 HG22 ILE A 451 -0.992 -4.667 7.320 1.00 11.12 H new ATOM 0 HG23 ILE A 451 -2.543 -4.516 8.180 1.00 11.12 H new ATOM 0 HD11 ILE A 451 -3.335 -3.239 11.603 1.00 3.15 H new ATOM 0 HD12 ILE A 451 -3.528 -3.920 9.970 1.00 3.15 H new ATOM 0 HD13 ILE A 451 -2.767 -4.889 11.255 1.00 3.15 H new ATOM 577 N MET A 452 -0.414 -6.888 7.809 1.00 25.02 N ATOM 578 CA MET A 452 0.321 -7.635 6.794 1.00 14.40 C ATOM 579 C MET A 452 -0.503 -7.772 5.518 1.00 21.10 C ATOM 580 O MET A 452 -1.025 -8.845 5.216 1.00 32.33 O ATOM 581 CB MET A 452 0.697 -9.021 7.324 1.00 32.11 C ATOM 582 CG MET A 452 -0.481 -9.792 7.897 1.00 13.44 C ATOM 583 SD MET A 452 -0.566 -11.487 7.286 1.00 43.24 S ATOM 584 CE MET A 452 -2.049 -12.068 8.105 1.00 22.41 C ATOM 0 H MET A 452 -1.409 -6.777 7.614 1.00 25.02 H new ATOM 0 HA MET A 452 1.232 -7.084 6.560 1.00 14.40 H new ATOM 0 HB2 MET A 452 1.142 -9.602 6.516 1.00 32.11 H new ATOM 0 HB3 MET A 452 1.459 -8.912 8.096 1.00 32.11 H new ATOM 0 HG2 MET A 452 -0.407 -9.805 8.984 1.00 13.44 H new ATOM 0 HG3 MET A 452 -1.406 -9.273 7.647 1.00 13.44 H new ATOM 0 HE1 MET A 452 -2.236 -13.105 7.827 1.00 22.41 H new ATOM 0 HE2 MET A 452 -1.919 -12.000 9.185 1.00 22.41 H new ATOM 0 HE3 MET A 452 -2.896 -11.453 7.803 1.00 22.41 H new ATOM 594 N VAL A 453 -0.615 -6.678 4.772 1.00 41.02 N ATOM 595 CA VAL A 453 -1.375 -6.676 3.527 1.00 44.21 C ATOM 596 C VAL A 453 -0.596 -5.993 2.409 1.00 62.32 C ATOM 597 O VAL A 453 -0.570 -6.469 1.275 1.00 71.20 O ATOM 598 CB VAL A 453 -2.732 -5.969 3.699 1.00 65.11 C ATOM 599 CG1 VAL A 453 -3.767 -6.930 4.266 1.00 43.25 C ATOM 600 CG2 VAL A 453 -2.585 -4.744 4.588 1.00 54.14 C ATOM 0 H VAL A 453 -0.189 -5.782 5.008 1.00 41.02 H new ATOM 0 HA VAL A 453 -1.549 -7.719 3.260 1.00 44.21 H new ATOM 0 HB VAL A 453 -3.077 -5.639 2.719 1.00 65.11 H new ATOM 0 HG11 VAL A 453 -4.720 -6.413 4.381 1.00 43.25 H new ATOM 0 HG12 VAL A 453 -3.891 -7.773 3.586 1.00 43.25 H new ATOM 0 HG13 VAL A 453 -3.432 -7.293 5.238 1.00 43.25 H new ATOM 0 HG21 VAL A 453 -3.554 -4.256 4.699 1.00 54.14 H new ATOM 0 HG22 VAL A 453 -2.217 -5.048 5.568 1.00 54.14 H new ATOM 0 HG23 VAL A 453 -1.878 -4.048 4.135 1.00 54.14 H new ATOM 610 N ALA A 454 0.040 -4.872 2.737 1.00 73.31 N ATOM 611 CA ALA A 454 0.822 -4.124 1.761 1.00 72.14 C ATOM 612 C ALA A 454 1.764 -5.043 0.992 1.00 63.22 C ATOM 613 O ALA A 454 2.116 -4.768 -0.156 1.00 44.51 O ATOM 614 CB ALA A 454 1.608 -3.018 2.451 1.00 73.44 C ATOM 0 H ALA A 454 0.028 -4.463 3.671 1.00 73.31 H new ATOM 0 HA ALA A 454 0.132 -3.674 1.047 1.00 72.14 H new ATOM 0 HB1 ALA A 454 2.188 -2.467 1.710 1.00 73.44 H new ATOM 0 HB2 ALA A 454 0.918 -2.338 2.950 1.00 73.44 H new ATOM 0 HB3 ALA A 454 2.282 -3.456 3.187 1.00 73.44 H new ATOM 620 N ARG A 455 2.170 -6.136 1.630 1.00 53.10 N ATOM 621 CA ARG A 455 3.074 -7.095 1.005 1.00 54.44 C ATOM 622 C ARG A 455 2.570 -7.493 -0.379 1.00 61.40 C ATOM 623 O ARG A 455 3.203 -7.191 -1.391 1.00 42.32 O ATOM 624 CB ARG A 455 3.218 -8.339 1.884 1.00 42.44 C ATOM 625 CG ARG A 455 4.495 -9.121 1.625 1.00 33.24 C ATOM 626 CD ARG A 455 4.197 -10.492 1.036 1.00 14.41 C ATOM 627 NE ARG A 455 4.039 -10.442 -0.415 1.00 12.11 N ATOM 628 CZ ARG A 455 4.002 -11.522 -1.187 1.00 3.30 C ATOM 629 NH1 ARG A 455 4.110 -12.730 -0.650 1.00 72.03 N ATOM 630 NH2 ARG A 455 3.856 -11.395 -2.499 1.00 60.51 N ATOM 0 H ARG A 455 1.887 -6.380 2.579 1.00 53.10 H new ATOM 0 HA ARG A 455 4.049 -6.621 0.896 1.00 54.44 H new ATOM 0 HB2 ARG A 455 3.192 -8.039 2.932 1.00 42.44 H new ATOM 0 HB3 ARG A 455 2.361 -8.992 1.718 1.00 42.44 H new ATOM 0 HG2 ARG A 455 5.134 -8.561 0.942 1.00 33.24 H new ATOM 0 HG3 ARG A 455 5.048 -9.236 2.557 1.00 33.24 H new ATOM 0 HD2 ARG A 455 5.005 -11.179 1.289 1.00 14.41 H new ATOM 0 HD3 ARG A 455 3.288 -10.890 1.486 1.00 14.41 H new ATOM 0 HE ARG A 455 3.952 -9.528 -0.860 1.00 12.11 H new ATOM 0 HH11 ARG A 455 4.222 -12.832 0.359 1.00 72.03 H new ATOM 0 HH12 ARG A 455 4.081 -13.557 -1.246 1.00 72.03 H new ATOM 0 HH21 ARG A 455 3.772 -10.468 -2.915 1.00 60.51 H new ATOM 0 HH22 ARG A 455 3.828 -12.225 -3.092 1.00 60.51 H new ATOM 644 N ARG A 456 1.429 -8.173 -0.415 1.00 24.53 N ATOM 645 CA ARG A 456 0.843 -8.615 -1.675 1.00 63.32 C ATOM 646 C ARG A 456 -0.041 -7.525 -2.275 1.00 25.11 C ATOM 647 O ARG A 456 -0.244 -7.472 -3.489 1.00 42.11 O ATOM 648 CB ARG A 456 0.024 -9.889 -1.463 1.00 31.01 C ATOM 649 CG ARG A 456 -1.396 -9.629 -0.989 1.00 52.23 C ATOM 650 CD ARG A 456 -2.359 -9.501 -2.159 1.00 23.11 C ATOM 651 NE ARG A 456 -3.143 -10.716 -2.359 1.00 12.02 N ATOM 652 CZ ARG A 456 -4.229 -10.773 -3.121 1.00 34.33 C ATOM 653 NH1 ARG A 456 -4.658 -9.689 -3.752 1.00 61.45 N ATOM 654 NH2 ARG A 456 -4.889 -11.917 -3.253 1.00 54.01 N ATOM 0 H ARG A 456 0.892 -8.430 0.413 1.00 24.53 H new ATOM 0 HA ARG A 456 1.656 -8.825 -2.370 1.00 63.32 H new ATOM 0 HB2 ARG A 456 -0.011 -10.448 -2.398 1.00 31.01 H new ATOM 0 HB3 ARG A 456 0.532 -10.520 -0.733 1.00 31.01 H new ATOM 0 HG2 ARG A 456 -1.718 -10.442 -0.338 1.00 52.23 H new ATOM 0 HG3 ARG A 456 -1.421 -8.716 -0.394 1.00 52.23 H new ATOM 0 HD2 ARG A 456 -3.031 -8.661 -1.985 1.00 23.11 H new ATOM 0 HD3 ARG A 456 -1.799 -9.278 -3.067 1.00 23.11 H new ATOM 0 HE ARG A 456 -2.840 -11.568 -1.887 1.00 12.02 H new ATOM 0 HH11 ARG A 456 -4.154 -8.808 -3.653 1.00 61.45 H new ATOM 0 HH12 ARG A 456 -5.493 -9.736 -4.337 1.00 61.45 H new ATOM 0 HH21 ARG A 456 -4.562 -12.753 -2.769 1.00 54.01 H new ATOM 0 HH22 ARG A 456 -5.723 -11.960 -3.838 1.00 54.01 H new ATOM 668 N THR A 457 -0.564 -6.654 -1.417 1.00 13.42 N ATOM 669 CA THR A 457 -1.426 -5.567 -1.861 1.00 0.24 C ATOM 670 C THR A 457 -0.658 -4.576 -2.728 1.00 51.04 C ATOM 671 O THR A 457 -1.014 -4.341 -3.883 1.00 71.40 O ATOM 672 CB THR A 457 -2.042 -4.815 -0.666 1.00 54.50 C ATOM 673 OG1 THR A 457 -3.023 -5.637 -0.023 1.00 32.42 O ATOM 674 CG2 THR A 457 -2.684 -3.512 -1.119 1.00 73.21 C ATOM 0 H THR A 457 -0.405 -6.681 -0.410 1.00 13.42 H new ATOM 0 HA THR A 457 -2.226 -6.018 -2.449 1.00 0.24 H new ATOM 0 HB THR A 457 -1.244 -4.583 0.039 1.00 54.50 H new ATOM 0 HG1 THR A 457 -2.583 -6.225 0.626 1.00 32.42 H new ATOM 0 HG21 THR A 457 -3.112 -2.999 -0.258 1.00 73.21 H new ATOM 0 HG22 THR A 457 -1.929 -2.876 -1.582 1.00 73.21 H new ATOM 0 HG23 THR A 457 -3.471 -3.726 -1.842 1.00 73.21 H new ATOM 682 N VAL A 458 0.397 -3.997 -2.165 1.00 64.42 N ATOM 683 CA VAL A 458 1.216 -3.032 -2.889 1.00 24.23 C ATOM 684 C VAL A 458 1.647 -3.584 -4.243 1.00 41.10 C ATOM 685 O VAL A 458 1.491 -2.926 -5.271 1.00 41.11 O ATOM 686 CB VAL A 458 2.470 -2.643 -2.082 1.00 31.41 C ATOM 687 CG1 VAL A 458 3.372 -1.734 -2.902 1.00 22.41 C ATOM 688 CG2 VAL A 458 2.074 -1.976 -0.774 1.00 3.23 C ATOM 0 H VAL A 458 0.705 -4.179 -1.210 1.00 64.42 H new ATOM 0 HA VAL A 458 0.601 -2.145 -3.041 1.00 24.23 H new ATOM 0 HB VAL A 458 3.027 -3.550 -1.847 1.00 31.41 H new ATOM 0 HG11 VAL A 458 4.252 -1.470 -2.316 1.00 22.41 H new ATOM 0 HG12 VAL A 458 3.682 -2.252 -3.809 1.00 22.41 H new ATOM 0 HG13 VAL A 458 2.829 -0.828 -3.169 1.00 22.41 H new ATOM 0 HG21 VAL A 458 2.971 -1.708 -0.216 1.00 3.23 H new ATOM 0 HG22 VAL A 458 1.495 -1.077 -0.985 1.00 3.23 H new ATOM 0 HG23 VAL A 458 1.471 -2.665 -0.182 1.00 3.23 H new ATOM 698 N ALA A 459 2.191 -4.796 -4.236 1.00 5.20 N ATOM 699 CA ALA A 459 2.643 -5.438 -5.465 1.00 42.23 C ATOM 700 C ALA A 459 1.476 -5.691 -6.413 1.00 21.21 C ATOM 701 O ALA A 459 1.664 -5.837 -7.621 1.00 32.13 O ATOM 702 CB ALA A 459 3.360 -6.742 -5.146 1.00 51.42 C ATOM 0 H ALA A 459 2.330 -5.354 -3.393 1.00 5.20 H new ATOM 0 HA ALA A 459 3.341 -4.765 -5.962 1.00 42.23 H new ATOM 0 HB1 ALA A 459 3.692 -7.211 -6.072 1.00 51.42 H new ATOM 0 HB2 ALA A 459 4.224 -6.537 -4.513 1.00 51.42 H new ATOM 0 HB3 ALA A 459 2.679 -7.414 -4.624 1.00 51.42 H new ATOM 708 N LYS A 460 0.269 -5.743 -5.859 1.00 2.32 N ATOM 709 CA LYS A 460 -0.929 -5.978 -6.654 1.00 1.11 C ATOM 710 C LYS A 460 -1.365 -4.705 -7.372 1.00 42.43 C ATOM 711 O LYS A 460 -1.754 -4.741 -8.540 1.00 14.21 O ATOM 712 CB LYS A 460 -2.065 -6.488 -5.764 1.00 74.20 C ATOM 713 CG LYS A 460 -2.369 -7.965 -5.953 1.00 42.31 C ATOM 714 CD LYS A 460 -2.993 -8.237 -7.311 1.00 61.33 C ATOM 715 CE LYS A 460 -3.980 -9.391 -7.249 1.00 33.40 C ATOM 716 NZ LYS A 460 -3.353 -10.680 -7.654 1.00 34.13 N ATOM 0 H LYS A 460 0.095 -5.625 -4.861 1.00 2.32 H new ATOM 0 HA LYS A 460 -0.694 -6.734 -7.403 1.00 1.11 H new ATOM 0 HB2 LYS A 460 -1.806 -6.309 -4.720 1.00 74.20 H new ATOM 0 HB3 LYS A 460 -2.966 -5.911 -5.972 1.00 74.20 H new ATOM 0 HG2 LYS A 460 -1.450 -8.542 -5.852 1.00 42.31 H new ATOM 0 HG3 LYS A 460 -3.045 -8.302 -5.167 1.00 42.31 H new ATOM 0 HD2 LYS A 460 -3.502 -7.340 -7.665 1.00 61.33 H new ATOM 0 HD3 LYS A 460 -2.209 -8.465 -8.034 1.00 61.33 H new ATOM 0 HE2 LYS A 460 -4.371 -9.480 -6.236 1.00 33.40 H new ATOM 0 HE3 LYS A 460 -4.828 -9.179 -7.900 1.00 33.40 H new ATOM 0 HZ1 LYS A 460 -4.059 -11.442 -7.598 1.00 34.13 H new ATOM 0 HZ2 LYS A 460 -3.002 -10.604 -8.630 1.00 34.13 H new ATOM 0 HZ3 LYS A 460 -2.560 -10.896 -7.017 1.00 34.13 H new ATOM 730 N TYR A 461 -1.294 -3.580 -6.667 1.00 34.33 N ATOM 731 CA TYR A 461 -1.682 -2.296 -7.237 1.00 70.43 C ATOM 732 C TYR A 461 -0.546 -1.703 -8.066 1.00 51.35 C ATOM 733 O TYR A 461 -0.775 -0.882 -8.954 1.00 41.31 O ATOM 734 CB TYR A 461 -2.081 -1.321 -6.128 1.00 34.31 C ATOM 735 CG TYR A 461 -3.428 -1.626 -5.511 1.00 4.44 C ATOM 736 CD1 TYR A 461 -4.604 -1.413 -6.220 1.00 4.54 C ATOM 737 CD2 TYR A 461 -3.524 -2.128 -4.218 1.00 45.50 C ATOM 738 CE1 TYR A 461 -5.836 -1.689 -5.659 1.00 65.42 C ATOM 739 CE2 TYR A 461 -4.752 -2.407 -3.650 1.00 62.31 C ATOM 740 CZ TYR A 461 -5.904 -2.186 -4.374 1.00 72.03 C ATOM 741 OH TYR A 461 -7.130 -2.463 -3.813 1.00 12.30 O ATOM 0 H TYR A 461 -0.971 -3.532 -5.701 1.00 34.33 H new ATOM 0 HA TYR A 461 -2.538 -2.462 -7.891 1.00 70.43 H new ATOM 0 HB2 TYR A 461 -1.320 -1.340 -5.348 1.00 34.31 H new ATOM 0 HB3 TYR A 461 -2.097 -0.309 -6.533 1.00 34.31 H new ATOM 0 HD1 TYR A 461 -4.554 -1.025 -7.227 1.00 4.54 H new ATOM 0 HD2 TYR A 461 -2.623 -2.303 -3.648 1.00 45.50 H new ATOM 0 HE1 TYR A 461 -6.741 -1.517 -6.223 1.00 65.42 H new ATOM 0 HE2 TYR A 461 -4.809 -2.796 -2.644 1.00 62.31 H new ATOM 0 HH TYR A 461 -7.004 -2.807 -2.904 1.00 12.30 H new ATOM 751 N ARG A 462 0.677 -2.126 -7.769 1.00 3.24 N ATOM 752 CA ARG A 462 1.850 -1.637 -8.485 1.00 32.50 C ATOM 753 C ARG A 462 1.701 -1.862 -9.987 1.00 24.42 C ATOM 754 O ARG A 462 2.318 -1.164 -10.793 1.00 13.30 O ATOM 755 CB ARG A 462 3.112 -2.336 -7.976 1.00 61.34 C ATOM 756 CG ARG A 462 3.343 -3.705 -8.595 1.00 72.31 C ATOM 757 CD ARG A 462 4.296 -3.629 -9.777 1.00 71.52 C ATOM 758 NE ARG A 462 4.173 -4.791 -10.654 1.00 4.43 N ATOM 759 CZ ARG A 462 4.879 -4.948 -11.769 1.00 40.54 C ATOM 760 NH1 ARG A 462 5.752 -4.022 -12.140 1.00 5.21 N ATOM 761 NH2 ARG A 462 4.713 -6.033 -12.514 1.00 15.12 N ATOM 0 H ARG A 462 0.883 -2.806 -7.037 1.00 3.24 H new ATOM 0 HA ARG A 462 1.938 -0.566 -8.302 1.00 32.50 H new ATOM 0 HB2 ARG A 462 3.975 -1.703 -8.182 1.00 61.34 H new ATOM 0 HB3 ARG A 462 3.046 -2.443 -6.893 1.00 61.34 H new ATOM 0 HG2 ARG A 462 3.748 -4.382 -7.843 1.00 72.31 H new ATOM 0 HG3 ARG A 462 2.391 -4.124 -8.921 1.00 72.31 H new ATOM 0 HD2 ARG A 462 4.095 -2.722 -10.347 1.00 71.52 H new ATOM 0 HD3 ARG A 462 5.321 -3.557 -9.413 1.00 71.52 H new ATOM 0 HE ARG A 462 3.509 -5.521 -10.397 1.00 4.43 H new ATOM 0 HH11 ARG A 462 5.883 -3.187 -11.569 1.00 5.21 H new ATOM 0 HH12 ARG A 462 6.293 -4.145 -12.996 1.00 5.21 H new ATOM 0 HH21 ARG A 462 4.043 -6.748 -12.231 1.00 15.12 H new ATOM 0 HH22 ARG A 462 5.256 -6.152 -13.369 1.00 15.12 H new ATOM 775 N GLU A 463 0.881 -2.841 -10.356 1.00 43.11 N ATOM 776 CA GLU A 463 0.654 -3.157 -11.761 1.00 64.11 C ATOM 777 C GLU A 463 -0.105 -2.031 -12.458 1.00 53.42 C ATOM 778 O GLU A 463 0.354 -1.485 -13.460 1.00 52.30 O ATOM 779 CB GLU A 463 -0.123 -4.468 -11.893 1.00 13.31 C ATOM 780 CG GLU A 463 0.452 -5.603 -11.062 1.00 51.32 C ATOM 781 CD GLU A 463 -0.311 -6.902 -11.239 1.00 63.31 C ATOM 782 OE1 GLU A 463 -0.514 -7.314 -12.401 1.00 14.11 O ATOM 783 OE2 GLU A 463 -0.705 -7.504 -10.219 1.00 24.13 O ATOM 0 H GLU A 463 0.363 -3.428 -9.702 1.00 43.11 H new ATOM 0 HA GLU A 463 1.626 -3.268 -12.242 1.00 64.11 H new ATOM 0 HB2 GLU A 463 -1.158 -4.299 -11.595 1.00 13.31 H new ATOM 0 HB3 GLU A 463 -0.138 -4.768 -12.941 1.00 13.31 H new ATOM 0 HG2 GLU A 463 1.495 -5.758 -11.338 1.00 51.32 H new ATOM 0 HG3 GLU A 463 0.440 -5.320 -10.010 1.00 51.32 H new ATOM 790 N SER A 464 -1.271 -1.690 -11.917 1.00 40.13 N ATOM 791 CA SER A 464 -2.097 -0.632 -12.487 1.00 63.54 C ATOM 792 C SER A 464 -2.243 0.530 -11.510 1.00 52.40 C ATOM 793 O SER A 464 -3.351 0.875 -11.098 1.00 75.31 O ATOM 794 CB SER A 464 -3.477 -1.177 -12.859 1.00 14.43 C ATOM 795 OG SER A 464 -4.169 -0.280 -13.709 1.00 13.03 O ATOM 0 H SER A 464 -1.664 -2.131 -11.086 1.00 40.13 H new ATOM 0 HA SER A 464 -1.604 -0.266 -13.388 1.00 63.54 H new ATOM 0 HB2 SER A 464 -3.369 -2.142 -13.355 1.00 14.43 H new ATOM 0 HB3 SER A 464 -4.060 -1.348 -11.954 1.00 14.43 H new ATOM 0 HG SER A 464 -5.047 -0.653 -13.933 1.00 13.03 H new ATOM 801 N LEU A 465 -1.117 1.131 -11.142 1.00 22.21 N ATOM 802 CA LEU A 465 -1.117 2.255 -10.213 1.00 71.14 C ATOM 803 C LEU A 465 -2.144 3.304 -10.627 1.00 44.12 C ATOM 804 O LEU A 465 -3.000 3.696 -9.835 1.00 71.12 O ATOM 805 CB LEU A 465 0.274 2.886 -10.145 1.00 44.42 C ATOM 806 CG LEU A 465 1.093 2.848 -11.436 1.00 31.11 C ATOM 807 CD1 LEU A 465 1.780 4.184 -11.673 1.00 2.51 C ATOM 808 CD2 LEU A 465 2.116 1.722 -11.385 1.00 71.00 C ATOM 0 H LEU A 465 -0.192 0.858 -11.473 1.00 22.21 H new ATOM 0 HA LEU A 465 -1.387 1.879 -9.226 1.00 71.14 H new ATOM 0 HB2 LEU A 465 0.164 3.926 -9.839 1.00 44.42 H new ATOM 0 HB3 LEU A 465 0.842 2.382 -9.363 1.00 44.42 H new ATOM 0 HG LEU A 465 0.415 2.659 -12.268 1.00 31.11 H new ATOM 0 HD11 LEU A 465 2.358 4.137 -12.596 1.00 2.51 H new ATOM 0 HD12 LEU A 465 1.029 4.970 -11.754 1.00 2.51 H new ATOM 0 HD13 LEU A 465 2.446 4.404 -10.839 1.00 2.51 H new ATOM 0 HD21 LEU A 465 2.690 1.710 -12.312 1.00 71.00 H new ATOM 0 HD22 LEU A 465 2.790 1.880 -10.543 1.00 71.00 H new ATOM 0 HD23 LEU A 465 1.602 0.769 -11.264 1.00 71.00 H new