USER MOD reduce.3.24.130724 H: found=0, std=0, add=990, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 987 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 41 SER OG : rot -156:sc= -0.888! USER MOD Set 1.2: A 112 SER OG : rot -149:sc= 0.328 USER MOD Set 2.1: A 6 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.0951 (180deg=0) USER MOD Single : A 2 SER OG : rot 21:sc= 0.676 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot -38:sc= 1.24 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -1.63 K(o=-1.6,f=-2.2!) USER MOD Single : A 35 CYS SG : rot -170:sc= -0.12 USER MOD Single : A 37 LYS NZ :NH3+ -155:sc= -0.0593 (180deg=-0.481) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -106:sc= -0.43 (180deg=-1.24) USER MOD Single : A 50 LYS NZ :NH3+ -171:sc=-0.00552 (180deg=-0.171) USER MOD Single : A 51 TYR OH : rot -56:sc= 0.494 USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.525 USER MOD Single : A 61 GLN : amide:sc= -2.27! C(o=-2.3!,f=-4.6!) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 85 THR OG1 : rot 65:sc= 0.0774 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 MET CE :methyl 148:sc= 0 (180deg=-0.00538) USER MOD Single : A 94 SER OG : rot -170:sc= 0 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.966 K(o=-0.97,f=-1.9) USER MOD Single : A 100 HIS : no HD1:sc= -1.81 K(o=-1.8,f=-4.9!) USER MOD Single : A 101 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.16) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= -0.798 USER MOD Single : A 111 TYR OH : rot 18:sc= 0.4 USER MOD Single : A 115 ASN : amide:sc= -3.94! C(o=-3.9!,f=-7.8!) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.117 16.627 -23.374 1.00 43.15 N ATOM 2 CA GLY A 1 11.050 15.582 -22.371 1.00 30.25 C ATOM 3 C GLY A 1 9.971 14.560 -22.668 1.00 63.32 C ATOM 4 O GLY A 1 9.220 14.702 -23.633 1.00 3.15 O ATOM 0 H1 GLY A 1 12.042 16.595 -23.848 1.00 43.15 H new ATOM 0 H2 GLY A 1 10.363 16.483 -24.076 1.00 43.15 H new ATOM 0 H3 GLY A 1 10.994 17.554 -22.919 1.00 43.15 H new ATOM 0 HA2 GLY A 1 12.015 15.079 -22.310 1.00 30.25 H new ATOM 0 HA3 GLY A 1 10.862 16.031 -21.396 1.00 30.25 H new ATOM 8 N SER A 2 9.893 13.524 -21.837 1.00 44.30 N ATOM 9 CA SER A 2 8.901 12.471 -22.020 1.00 5.42 C ATOM 10 C SER A 2 7.636 12.773 -21.222 1.00 52.15 C ATOM 11 O SER A 2 7.674 12.892 -19.999 1.00 10.04 O ATOM 12 CB SER A 2 9.477 11.120 -21.592 1.00 52.32 C ATOM 13 OG SER A 2 9.726 11.090 -20.197 1.00 50.11 O ATOM 0 H SER A 2 10.505 13.392 -21.031 1.00 44.30 H new ATOM 0 HA SER A 2 8.641 12.429 -23.078 1.00 5.42 H new ATOM 0 HB2 SER A 2 8.781 10.324 -21.857 1.00 52.32 H new ATOM 0 HB3 SER A 2 10.403 10.928 -22.134 1.00 52.32 H new ATOM 0 HG SER A 2 9.193 11.783 -19.755 1.00 50.11 H new ATOM 19 N MET A 3 6.516 12.896 -21.927 1.00 52.30 N ATOM 20 CA MET A 3 5.237 13.183 -21.285 1.00 3.04 C ATOM 21 C MET A 3 4.865 12.080 -20.299 1.00 15.33 C ATOM 22 O MET A 3 5.478 11.013 -20.284 1.00 14.12 O ATOM 23 CB MET A 3 4.137 13.334 -22.337 1.00 11.41 C ATOM 24 CG MET A 3 4.005 12.132 -23.257 1.00 24.33 C ATOM 25 SD MET A 3 2.448 12.119 -24.166 1.00 3.52 S ATOM 26 CE MET A 3 2.173 10.358 -24.342 1.00 14.23 C ATOM 0 H MET A 3 6.467 12.802 -22.941 1.00 52.30 H new ATOM 0 HA MET A 3 5.336 14.119 -20.736 1.00 3.04 H new ATOM 0 HB2 MET A 3 3.185 13.502 -21.833 1.00 11.41 H new ATOM 0 HB3 MET A 3 4.340 14.220 -22.938 1.00 11.41 H new ATOM 0 HG2 MET A 3 4.834 12.128 -23.965 1.00 24.33 H new ATOM 0 HG3 MET A 3 4.085 11.218 -22.668 1.00 24.33 H new ATOM 0 HE1 MET A 3 1.244 10.187 -24.886 1.00 14.23 H new ATOM 0 HE2 MET A 3 3.002 9.913 -24.892 1.00 14.23 H new ATOM 0 HE3 MET A 3 2.105 9.900 -23.355 1.00 14.23 H new ATOM 36 N LYS A 4 3.857 12.346 -19.474 1.00 51.51 N ATOM 37 CA LYS A 4 3.401 11.377 -18.485 1.00 4.45 C ATOM 38 C LYS A 4 2.665 10.221 -19.154 1.00 62.21 C ATOM 39 O LYS A 4 2.106 10.374 -20.240 1.00 1.45 O ATOM 40 CB LYS A 4 2.487 12.054 -17.461 1.00 53.30 C ATOM 41 CG LYS A 4 3.058 13.341 -16.892 1.00 43.45 C ATOM 42 CD LYS A 4 2.127 13.957 -15.862 1.00 24.03 C ATOM 43 CE LYS A 4 0.909 14.590 -16.517 1.00 23.11 C ATOM 44 NZ LYS A 4 1.230 15.913 -17.123 1.00 32.22 N ATOM 0 H LYS A 4 3.340 13.226 -19.471 1.00 51.51 H new ATOM 0 HA LYS A 4 4.277 10.978 -17.973 1.00 4.45 H new ATOM 0 HB2 LYS A 4 1.527 12.269 -17.930 1.00 53.30 H new ATOM 0 HB3 LYS A 4 2.294 11.359 -16.643 1.00 53.30 H new ATOM 0 HG2 LYS A 4 4.026 13.139 -16.434 1.00 43.45 H new ATOM 0 HG3 LYS A 4 3.230 14.052 -17.700 1.00 43.45 H new ATOM 0 HD2 LYS A 4 1.805 13.190 -15.157 1.00 24.03 H new ATOM 0 HD3 LYS A 4 2.666 14.711 -15.288 1.00 24.03 H new ATOM 0 HE2 LYS A 4 0.522 13.922 -17.287 1.00 23.11 H new ATOM 0 HE3 LYS A 4 0.120 14.712 -15.775 1.00 23.11 H new ATOM 0 HZ1 LYS A 4 0.374 16.312 -17.559 1.00 32.22 H new ATOM 0 HZ2 LYS A 4 1.575 16.559 -16.384 1.00 32.22 H new ATOM 0 HZ3 LYS A 4 1.965 15.793 -17.849 1.00 32.22 H new ATOM 58 N SER A 5 2.669 9.065 -18.498 1.00 75.22 N ATOM 59 CA SER A 5 2.002 7.882 -19.031 1.00 25.34 C ATOM 60 C SER A 5 0.787 7.516 -18.185 1.00 64.43 C ATOM 61 O SER A 5 0.921 7.048 -17.054 1.00 54.22 O ATOM 62 CB SER A 5 2.976 6.703 -19.083 1.00 61.11 C ATOM 63 OG SER A 5 4.006 6.933 -20.029 1.00 24.02 O ATOM 0 H SER A 5 3.126 8.922 -17.597 1.00 75.22 H new ATOM 0 HA SER A 5 1.663 8.110 -20.042 1.00 25.34 H new ATOM 0 HB2 SER A 5 3.413 6.544 -18.097 1.00 61.11 H new ATOM 0 HB3 SER A 5 2.436 5.792 -19.343 1.00 61.11 H new ATOM 0 HG SER A 5 4.616 6.166 -20.042 1.00 24.02 H new ATOM 69 N THR A 6 -0.401 7.731 -18.742 1.00 42.31 N ATOM 70 CA THR A 6 -1.641 7.425 -18.041 1.00 40.40 C ATOM 71 C THR A 6 -2.418 6.325 -18.753 1.00 75.23 C ATOM 72 O THR A 6 -2.824 6.482 -19.905 1.00 41.31 O ATOM 73 CB THR A 6 -2.537 8.672 -17.915 1.00 42.05 C ATOM 74 OG1 THR A 6 -3.833 8.298 -17.435 1.00 61.11 O ATOM 75 CG2 THR A 6 -2.672 9.378 -19.256 1.00 41.43 C ATOM 0 H THR A 6 -0.530 8.116 -19.678 1.00 42.31 H new ATOM 0 HA THR A 6 -1.364 7.083 -17.044 1.00 40.40 H new ATOM 0 HB THR A 6 -2.071 9.357 -17.206 1.00 42.05 H new ATOM 0 HG1 THR A 6 -4.396 9.096 -17.356 1.00 61.11 H new ATOM 0 HG21 THR A 6 -3.309 10.255 -19.143 1.00 41.43 H new ATOM 0 HG22 THR A 6 -1.687 9.687 -19.605 1.00 41.43 H new ATOM 0 HG23 THR A 6 -3.117 8.698 -19.982 1.00 41.43 H new ATOM 83 N PHE A 7 -2.623 5.208 -18.060 1.00 43.35 N ATOM 84 CA PHE A 7 -3.352 4.080 -18.628 1.00 35.12 C ATOM 85 C PHE A 7 -4.786 4.043 -18.108 1.00 54.11 C ATOM 86 O PHE A 7 -5.704 3.623 -18.813 1.00 62.35 O ATOM 87 CB PHE A 7 -2.643 2.767 -18.292 1.00 61.44 C ATOM 88 CG PHE A 7 -1.430 2.508 -19.139 1.00 51.02 C ATOM 89 CD1 PHE A 7 -0.204 3.057 -18.803 1.00 23.13 C ATOM 90 CD2 PHE A 7 -1.516 1.715 -20.273 1.00 11.20 C ATOM 91 CE1 PHE A 7 0.915 2.820 -19.581 1.00 30.15 C ATOM 92 CE2 PHE A 7 -0.402 1.475 -21.053 1.00 62.34 C ATOM 93 CZ PHE A 7 0.815 2.029 -20.708 1.00 23.04 C ATOM 0 H PHE A 7 -2.295 5.061 -17.106 1.00 43.35 H new ATOM 0 HA PHE A 7 -3.379 4.204 -19.711 1.00 35.12 H new ATOM 0 HB2 PHE A 7 -2.348 2.781 -17.243 1.00 61.44 H new ATOM 0 HB3 PHE A 7 -3.345 1.942 -18.415 1.00 61.44 H new ATOM 0 HD1 PHE A 7 -0.120 3.678 -17.923 1.00 23.13 H new ATOM 0 HD2 PHE A 7 -2.465 1.280 -20.549 1.00 11.20 H new ATOM 0 HE1 PHE A 7 1.866 3.253 -19.307 1.00 30.15 H new ATOM 0 HE2 PHE A 7 -0.483 0.854 -21.933 1.00 62.34 H new ATOM 0 HZ PHE A 7 1.686 1.844 -21.318 1.00 23.04 H new ATOM 103 N LYS A 8 -4.972 4.487 -16.869 1.00 51.23 N ATOM 104 CA LYS A 8 -6.294 4.507 -16.254 1.00 74.21 C ATOM 105 C LYS A 8 -7.271 5.332 -17.086 1.00 25.23 C ATOM 106 O LYS A 8 -8.480 5.107 -17.044 1.00 4.24 O ATOM 107 CB LYS A 8 -6.209 5.075 -14.836 1.00 12.03 C ATOM 108 CG LYS A 8 -5.810 6.540 -14.790 1.00 31.23 C ATOM 109 CD LYS A 8 -5.279 6.931 -13.421 1.00 11.12 C ATOM 110 CE LYS A 8 -3.790 6.646 -13.298 1.00 52.31 C ATOM 111 NZ LYS A 8 -2.966 7.738 -13.887 1.00 55.14 N ATOM 0 H LYS A 8 -4.224 4.838 -16.271 1.00 51.23 H new ATOM 0 HA LYS A 8 -6.661 3.482 -16.208 1.00 74.21 H new ATOM 0 HB2 LYS A 8 -7.176 4.955 -14.347 1.00 12.03 H new ATOM 0 HB3 LYS A 8 -5.488 4.493 -14.263 1.00 12.03 H new ATOM 0 HG2 LYS A 8 -5.049 6.735 -15.546 1.00 31.23 H new ATOM 0 HG3 LYS A 8 -6.671 7.160 -15.038 1.00 31.23 H new ATOM 0 HD2 LYS A 8 -5.463 7.991 -13.248 1.00 11.12 H new ATOM 0 HD3 LYS A 8 -5.820 6.383 -12.650 1.00 11.12 H new ATOM 0 HE2 LYS A 8 -3.530 6.521 -12.247 1.00 52.31 H new ATOM 0 HE3 LYS A 8 -3.558 5.706 -13.798 1.00 52.31 H new ATOM 0 HZ1 LYS A 8 -1.957 7.506 -13.783 1.00 55.14 H new ATOM 0 HZ2 LYS A 8 -3.196 7.841 -14.896 1.00 55.14 H new ATOM 0 HZ3 LYS A 8 -3.169 8.631 -13.393 1.00 55.14 H new ATOM 125 N SER A 9 -6.737 6.285 -17.843 1.00 2.00 N ATOM 126 CA SER A 9 -7.561 7.145 -18.684 1.00 52.31 C ATOM 127 C SER A 9 -8.494 6.314 -19.560 1.00 43.14 C ATOM 128 O SER A 9 -9.696 6.569 -19.620 1.00 74.30 O ATOM 129 CB SER A 9 -6.679 8.036 -19.559 1.00 54.32 C ATOM 130 OG SER A 9 -7.464 8.902 -20.361 1.00 14.43 O ATOM 0 H SER A 9 -5.737 6.481 -17.891 1.00 2.00 H new ATOM 0 HA SER A 9 -8.167 7.775 -18.033 1.00 52.31 H new ATOM 0 HB2 SER A 9 -6.012 8.624 -18.929 1.00 54.32 H new ATOM 0 HB3 SER A 9 -6.050 7.416 -20.197 1.00 54.32 H new ATOM 0 HG SER A 9 -6.876 9.462 -20.910 1.00 14.43 H new ATOM 136 N GLU A 10 -7.928 5.321 -20.240 1.00 54.42 N ATOM 137 CA GLU A 10 -8.708 4.453 -21.114 1.00 55.34 C ATOM 138 C GLU A 10 -9.178 3.208 -20.368 1.00 24.12 C ATOM 139 O GLU A 10 -10.205 2.619 -20.705 1.00 1.42 O ATOM 140 CB GLU A 10 -7.882 4.048 -22.336 1.00 64.22 C ATOM 141 CG GLU A 10 -6.670 3.196 -21.995 1.00 74.23 C ATOM 142 CD GLU A 10 -5.715 3.047 -23.163 1.00 43.44 C ATOM 143 OE1 GLU A 10 -5.149 4.072 -23.601 1.00 35.33 O ATOM 144 OE2 GLU A 10 -5.531 1.907 -23.640 1.00 13.51 O ATOM 0 H GLU A 10 -6.933 5.098 -20.202 1.00 54.42 H new ATOM 0 HA GLU A 10 -9.585 5.008 -21.445 1.00 55.34 H new ATOM 0 HB2 GLU A 10 -8.519 3.498 -23.029 1.00 64.22 H new ATOM 0 HB3 GLU A 10 -7.549 4.948 -22.854 1.00 64.22 H new ATOM 0 HG2 GLU A 10 -6.141 3.643 -21.153 1.00 74.23 H new ATOM 0 HG3 GLU A 10 -7.003 2.209 -21.674 1.00 74.23 H new ATOM 151 N TYR A 11 -8.418 2.813 -19.352 1.00 45.30 N ATOM 152 CA TYR A 11 -8.754 1.637 -18.559 1.00 25.11 C ATOM 153 C TYR A 11 -9.016 2.017 -17.105 1.00 75.13 C ATOM 154 O TYR A 11 -8.215 1.744 -16.210 1.00 72.23 O ATOM 155 CB TYR A 11 -7.625 0.607 -18.633 1.00 40.51 C ATOM 156 CG TYR A 11 -7.679 -0.263 -19.868 1.00 30.51 C ATOM 157 CD1 TYR A 11 -8.752 -1.118 -20.092 1.00 21.21 C ATOM 158 CD2 TYR A 11 -6.659 -0.233 -20.809 1.00 64.52 C ATOM 159 CE1 TYR A 11 -8.806 -1.916 -21.219 1.00 21.14 C ATOM 160 CE2 TYR A 11 -6.705 -1.027 -21.939 1.00 43.12 C ATOM 161 CZ TYR A 11 -7.780 -1.866 -22.139 1.00 63.45 C ATOM 162 OH TYR A 11 -7.830 -2.660 -23.263 1.00 3.23 O ATOM 0 H TYR A 11 -7.566 3.290 -19.059 1.00 45.30 H new ATOM 0 HA TYR A 11 -9.664 1.200 -18.971 1.00 25.11 H new ATOM 0 HB2 TYR A 11 -6.668 1.127 -18.607 1.00 40.51 H new ATOM 0 HB3 TYR A 11 -7.666 -0.029 -17.749 1.00 40.51 H new ATOM 0 HD1 TYR A 11 -9.557 -1.159 -19.373 1.00 21.21 H new ATOM 0 HD2 TYR A 11 -5.815 0.422 -20.655 1.00 64.52 H new ATOM 0 HE1 TYR A 11 -9.647 -2.575 -21.378 1.00 21.14 H new ATOM 0 HE2 TYR A 11 -5.903 -0.990 -22.661 1.00 43.12 H new ATOM 0 HH TYR A 11 -7.031 -2.504 -23.809 1.00 3.23 H new ATOM 172 N PRO A 12 -10.166 2.662 -16.862 1.00 41.34 N ATOM 173 CA PRO A 12 -10.563 3.093 -15.518 1.00 55.23 C ATOM 174 C PRO A 12 -10.918 1.918 -14.614 1.00 42.40 C ATOM 175 O PRO A 12 -11.127 0.800 -15.085 1.00 32.02 O ATOM 176 CB PRO A 12 -11.797 3.962 -15.774 1.00 55.34 C ATOM 177 CG PRO A 12 -12.352 3.462 -17.064 1.00 2.00 C ATOM 178 CD PRO A 12 -11.168 3.020 -17.880 1.00 11.22 C ATOM 0 HA PRO A 12 -9.757 3.615 -15.003 1.00 55.23 H new ATOM 0 HB2 PRO A 12 -12.523 3.866 -14.967 1.00 55.34 H new ATOM 0 HB3 PRO A 12 -11.531 5.017 -15.840 1.00 55.34 H new ATOM 0 HG2 PRO A 12 -13.042 2.635 -16.898 1.00 2.00 H new ATOM 0 HG3 PRO A 12 -12.910 4.244 -17.578 1.00 2.00 H new ATOM 0 HD2 PRO A 12 -11.414 2.171 -18.518 1.00 11.22 H new ATOM 0 HD3 PRO A 12 -10.810 3.816 -18.533 1.00 11.22 H new ATOM 186 N PHE A 13 -10.985 2.178 -13.312 1.00 13.12 N ATOM 187 CA PHE A 13 -11.315 1.141 -12.341 1.00 45.45 C ATOM 188 C PHE A 13 -12.767 0.699 -12.488 1.00 54.55 C ATOM 189 O PHE A 13 -13.115 -0.439 -12.175 1.00 50.55 O ATOM 190 CB PHE A 13 -11.065 1.647 -10.919 1.00 14.13 C ATOM 191 CG PHE A 13 -12.008 2.738 -10.497 1.00 22.42 C ATOM 192 CD1 PHE A 13 -11.758 4.058 -10.836 1.00 61.22 C ATOM 193 CD2 PHE A 13 -13.143 2.442 -9.760 1.00 12.44 C ATOM 194 CE1 PHE A 13 -12.623 5.063 -10.450 1.00 11.40 C ATOM 195 CE2 PHE A 13 -14.012 3.444 -9.370 1.00 52.24 C ATOM 196 CZ PHE A 13 -13.752 4.756 -9.715 1.00 12.10 C ATOM 0 H PHE A 13 -10.815 3.098 -12.905 1.00 13.12 H new ATOM 0 HA PHE A 13 -10.672 0.282 -12.532 1.00 45.45 H new ATOM 0 HB2 PHE A 13 -11.153 0.812 -10.224 1.00 14.13 H new ATOM 0 HB3 PHE A 13 -10.041 2.014 -10.847 1.00 14.13 H new ATOM 0 HD1 PHE A 13 -10.876 4.304 -11.409 1.00 61.22 H new ATOM 0 HD2 PHE A 13 -13.351 1.418 -9.487 1.00 12.44 H new ATOM 0 HE1 PHE A 13 -12.417 6.088 -10.722 1.00 11.40 H new ATOM 0 HE2 PHE A 13 -14.894 3.201 -8.796 1.00 52.24 H new ATOM 0 HZ PHE A 13 -14.430 5.540 -9.411 1.00 12.10 H new ATOM 206 N GLU A 14 -13.611 1.609 -12.967 1.00 64.02 N ATOM 207 CA GLU A 14 -15.026 1.313 -13.155 1.00 12.51 C ATOM 208 C GLU A 14 -15.222 0.247 -14.228 1.00 40.40 C ATOM 209 O GLU A 14 -16.111 -0.598 -14.125 1.00 61.55 O ATOM 210 CB GLU A 14 -15.789 2.584 -13.537 1.00 34.40 C ATOM 211 CG GLU A 14 -15.896 3.592 -12.405 1.00 55.22 C ATOM 212 CD GLU A 14 -16.840 4.735 -12.729 1.00 63.04 C ATOM 213 OE1 GLU A 14 -18.068 4.512 -12.721 1.00 71.30 O ATOM 214 OE2 GLU A 14 -16.348 5.852 -12.992 1.00 12.41 O ATOM 0 H GLU A 14 -13.339 2.556 -13.231 1.00 64.02 H new ATOM 0 HA GLU A 14 -15.419 0.931 -12.213 1.00 12.51 H new ATOM 0 HB2 GLU A 14 -15.293 3.055 -14.386 1.00 34.40 H new ATOM 0 HB3 GLU A 14 -16.792 2.311 -13.865 1.00 34.40 H new ATOM 0 HG2 GLU A 14 -16.241 3.085 -11.504 1.00 55.22 H new ATOM 0 HG3 GLU A 14 -14.907 3.994 -12.186 1.00 55.22 H new ATOM 221 N LYS A 15 -14.386 0.295 -15.260 1.00 63.12 N ATOM 222 CA LYS A 15 -14.464 -0.666 -16.353 1.00 43.24 C ATOM 223 C LYS A 15 -15.852 -0.657 -16.987 1.00 22.21 C ATOM 224 O LYS A 15 -16.431 -1.712 -17.249 1.00 1.13 O ATOM 225 CB LYS A 15 -14.130 -2.072 -15.850 1.00 34.01 C ATOM 226 CG LYS A 15 -12.830 -2.146 -15.069 1.00 24.04 C ATOM 227 CD LYS A 15 -12.281 -3.561 -15.032 1.00 22.54 C ATOM 228 CE LYS A 15 -13.026 -4.422 -14.023 1.00 51.01 C ATOM 229 NZ LYS A 15 -12.581 -4.154 -12.628 1.00 3.32 N ATOM 0 H LYS A 15 -13.646 0.990 -15.362 1.00 63.12 H new ATOM 0 HA LYS A 15 -13.736 -0.376 -17.110 1.00 43.24 H new ATOM 0 HB2 LYS A 15 -14.944 -2.425 -15.218 1.00 34.01 H new ATOM 0 HB3 LYS A 15 -14.071 -2.749 -16.702 1.00 34.01 H new ATOM 0 HG2 LYS A 15 -12.094 -1.481 -15.522 1.00 24.04 H new ATOM 0 HG3 LYS A 15 -12.995 -1.792 -14.051 1.00 24.04 H new ATOM 0 HD2 LYS A 15 -12.360 -4.009 -16.023 1.00 22.54 H new ATOM 0 HD3 LYS A 15 -11.221 -3.535 -14.777 1.00 22.54 H new ATOM 0 HE2 LYS A 15 -14.096 -4.233 -14.105 1.00 51.01 H new ATOM 0 HE3 LYS A 15 -12.869 -5.475 -14.258 1.00 51.01 H new ATOM 0 HZ1 LYS A 15 -13.113 -4.761 -11.971 1.00 3.32 H new ATOM 0 HZ2 LYS A 15 -11.565 -4.358 -12.542 1.00 3.32 H new ATOM 0 HZ3 LYS A 15 -12.754 -3.156 -12.394 1.00 3.32 H new ATOM 243 N ARG A 16 -16.378 0.538 -17.232 1.00 44.01 N ATOM 244 CA ARG A 16 -17.697 0.683 -17.836 1.00 15.12 C ATOM 245 C ARG A 16 -17.588 0.857 -19.347 1.00 4.20 C ATOM 246 O ARG A 16 -18.506 0.513 -20.091 1.00 74.51 O ATOM 247 CB ARG A 16 -18.432 1.878 -17.225 1.00 33.31 C ATOM 248 CG ARG A 16 -19.945 1.736 -17.243 1.00 40.43 C ATOM 249 CD ARG A 16 -20.590 2.495 -16.094 1.00 32.45 C ATOM 250 NE ARG A 16 -20.295 1.882 -14.801 1.00 23.04 N ATOM 251 CZ ARG A 16 -20.635 2.424 -13.637 1.00 45.42 C ATOM 252 NH1 ARG A 16 -21.278 3.583 -13.604 1.00 14.34 N ATOM 253 NH2 ARG A 16 -20.330 1.807 -12.502 1.00 74.34 N ATOM 0 H ARG A 16 -15.911 1.420 -17.022 1.00 44.01 H new ATOM 0 HA ARG A 16 -18.263 -0.226 -17.633 1.00 15.12 H new ATOM 0 HB2 ARG A 16 -18.100 2.010 -16.195 1.00 33.31 H new ATOM 0 HB3 ARG A 16 -18.154 2.781 -17.768 1.00 33.31 H new ATOM 0 HG2 ARG A 16 -20.335 2.108 -18.190 1.00 40.43 H new ATOM 0 HG3 ARG A 16 -20.213 0.681 -17.180 1.00 40.43 H new ATOM 0 HD2 ARG A 16 -20.236 3.526 -16.096 1.00 32.45 H new ATOM 0 HD3 ARG A 16 -21.669 2.528 -16.242 1.00 32.45 H new ATOM 0 HE ARG A 16 -19.801 0.990 -14.792 1.00 23.04 H new ATOM 0 HH11 ARG A 16 -21.513 4.061 -14.474 1.00 14.34 H new ATOM 0 HH12 ARG A 16 -21.538 3.997 -12.709 1.00 14.34 H new ATOM 0 HH21 ARG A 16 -19.834 0.916 -12.523 1.00 74.34 H new ATOM 0 HH22 ARG A 16 -20.591 2.224 -11.609 1.00 74.34 H new ATOM 267 N LYS A 17 -16.458 1.396 -19.795 1.00 54.25 N ATOM 268 CA LYS A 17 -16.228 1.617 -21.218 1.00 24.24 C ATOM 269 C LYS A 17 -15.141 0.685 -21.743 1.00 23.30 C ATOM 270 O LYS A 17 -15.114 0.353 -22.928 1.00 70.14 O ATOM 271 CB LYS A 17 -15.831 3.073 -21.470 1.00 51.23 C ATOM 272 CG LYS A 17 -17.017 4.016 -21.582 1.00 12.43 C ATOM 273 CD LYS A 17 -16.570 5.448 -21.820 1.00 13.31 C ATOM 274 CE LYS A 17 -16.064 5.647 -23.240 1.00 60.12 C ATOM 275 NZ LYS A 17 -15.162 6.827 -23.349 1.00 11.00 N ATOM 0 H LYS A 17 -15.688 1.688 -19.193 1.00 54.25 H new ATOM 0 HA LYS A 17 -17.155 1.402 -21.749 1.00 24.24 H new ATOM 0 HB2 LYS A 17 -15.185 3.410 -20.660 1.00 51.23 H new ATOM 0 HB3 LYS A 17 -15.246 3.128 -22.388 1.00 51.23 H new ATOM 0 HG2 LYS A 17 -17.662 3.695 -22.399 1.00 12.43 H new ATOM 0 HG3 LYS A 17 -17.610 3.966 -20.669 1.00 12.43 H new ATOM 0 HD2 LYS A 17 -17.402 6.126 -21.631 1.00 13.31 H new ATOM 0 HD3 LYS A 17 -15.782 5.706 -21.113 1.00 13.31 H new ATOM 0 HE2 LYS A 17 -15.532 4.753 -23.564 1.00 60.12 H new ATOM 0 HE3 LYS A 17 -16.912 5.775 -23.913 1.00 60.12 H new ATOM 0 HZ1 LYS A 17 -14.839 6.928 -24.333 1.00 11.00 H new ATOM 0 HZ2 LYS A 17 -15.676 7.685 -23.064 1.00 11.00 H new ATOM 0 HZ3 LYS A 17 -14.340 6.694 -22.727 1.00 11.00 H new ATOM 289 N ALA A 18 -14.247 0.264 -20.854 1.00 13.35 N ATOM 290 CA ALA A 18 -13.162 -0.633 -21.228 1.00 4.23 C ATOM 291 C ALA A 18 -13.696 -1.893 -21.899 1.00 72.35 C ATOM 292 O ALA A 18 -13.021 -2.498 -22.732 1.00 75.11 O ATOM 293 CB ALA A 18 -12.332 -0.996 -20.005 1.00 62.04 C ATOM 0 H ALA A 18 -14.253 0.530 -19.869 1.00 13.35 H new ATOM 0 HA ALA A 18 -12.526 -0.113 -21.945 1.00 4.23 H new ATOM 0 HB1 ALA A 18 -11.525 -1.667 -20.299 1.00 62.04 H new ATOM 0 HB2 ALA A 18 -11.910 -0.090 -19.569 1.00 62.04 H new ATOM 0 HB3 ALA A 18 -12.966 -1.491 -19.269 1.00 62.04 H new ATOM 299 N GLU A 19 -14.913 -2.283 -21.532 1.00 32.35 N ATOM 300 CA GLU A 19 -15.537 -3.473 -22.098 1.00 64.01 C ATOM 301 C GLU A 19 -16.001 -3.215 -23.529 1.00 24.25 C ATOM 302 O GLU A 19 -15.742 -4.012 -24.431 1.00 30.04 O ATOM 303 CB GLU A 19 -16.723 -3.913 -21.237 1.00 70.11 C ATOM 304 CG GLU A 19 -16.918 -5.419 -21.194 1.00 65.44 C ATOM 305 CD GLU A 19 -18.303 -5.816 -20.724 1.00 14.51 C ATOM 306 OE1 GLU A 19 -19.290 -5.389 -21.359 1.00 51.14 O ATOM 307 OE2 GLU A 19 -18.401 -6.553 -19.720 1.00 13.51 O ATOM 0 H GLU A 19 -15.486 -1.792 -20.846 1.00 32.35 H new ATOM 0 HA GLU A 19 -14.793 -4.270 -22.113 1.00 64.01 H new ATOM 0 HB2 GLU A 19 -16.580 -3.544 -20.221 1.00 70.11 H new ATOM 0 HB3 GLU A 19 -17.631 -3.448 -21.620 1.00 70.11 H new ATOM 0 HG2 GLU A 19 -16.743 -5.832 -22.187 1.00 65.44 H new ATOM 0 HG3 GLU A 19 -16.174 -5.859 -20.530 1.00 65.44 H new ATOM 314 N SER A 20 -16.689 -2.095 -23.728 1.00 72.22 N ATOM 315 CA SER A 20 -17.194 -1.734 -25.048 1.00 62.11 C ATOM 316 C SER A 20 -16.069 -1.733 -26.078 1.00 43.34 C ATOM 317 O SER A 20 -16.292 -2.011 -27.256 1.00 45.32 O ATOM 318 CB SER A 20 -17.860 -0.357 -25.003 1.00 30.53 C ATOM 319 OG SER A 20 -16.894 0.673 -24.891 1.00 11.21 O ATOM 0 H SER A 20 -16.909 -1.423 -22.993 1.00 72.22 H new ATOM 0 HA SER A 20 -17.933 -2.478 -25.343 1.00 62.11 H new ATOM 0 HB2 SER A 20 -18.453 -0.207 -25.905 1.00 30.53 H new ATOM 0 HB3 SER A 20 -18.547 -0.309 -24.158 1.00 30.53 H new ATOM 0 HG SER A 20 -16.172 0.381 -24.296 1.00 11.21 H new ATOM 325 N GLU A 21 -14.859 -1.418 -25.625 1.00 12.34 N ATOM 326 CA GLU A 21 -13.699 -1.379 -26.507 1.00 72.50 C ATOM 327 C GLU A 21 -13.350 -2.778 -27.008 1.00 74.40 C ATOM 328 O GLU A 21 -13.376 -3.043 -28.210 1.00 71.21 O ATOM 329 CB GLU A 21 -12.498 -0.772 -25.781 1.00 0.21 C ATOM 330 CG GLU A 21 -11.227 -0.756 -26.614 1.00 12.13 C ATOM 331 CD GLU A 21 -11.451 -0.206 -28.009 1.00 61.14 C ATOM 332 OE1 GLU A 21 -11.824 -0.993 -28.904 1.00 42.21 O ATOM 333 OE2 GLU A 21 -11.254 1.012 -28.205 1.00 73.13 O ATOM 0 H GLU A 21 -14.657 -1.186 -24.652 1.00 12.34 H new ATOM 0 HA GLU A 21 -13.948 -0.755 -27.365 1.00 72.50 H new ATOM 0 HB2 GLU A 21 -12.741 0.248 -25.485 1.00 0.21 H new ATOM 0 HB3 GLU A 21 -12.315 -1.335 -24.866 1.00 0.21 H new ATOM 0 HG2 GLU A 21 -10.472 -0.155 -26.107 1.00 12.13 H new ATOM 0 HG3 GLU A 21 -10.831 -1.769 -26.686 1.00 12.13 H new ATOM 340 N ARG A 22 -13.023 -3.669 -26.078 1.00 15.35 N ATOM 341 CA ARG A 22 -12.668 -5.040 -26.423 1.00 44.14 C ATOM 342 C ARG A 22 -13.781 -5.703 -27.229 1.00 32.33 C ATOM 343 O ARG A 22 -13.521 -6.540 -28.095 1.00 24.24 O ATOM 344 CB ARG A 22 -12.385 -5.851 -25.158 1.00 61.11 C ATOM 345 CG ARG A 22 -13.562 -5.910 -24.197 1.00 60.25 C ATOM 346 CD ARG A 22 -13.299 -6.876 -23.054 1.00 33.34 C ATOM 347 NE ARG A 22 -14.538 -7.397 -22.479 1.00 44.43 N ATOM 348 CZ ARG A 22 -14.574 -8.287 -21.495 1.00 40.22 C ATOM 349 NH1 ARG A 22 -13.447 -8.755 -20.977 1.00 71.22 N ATOM 350 NH2 ARG A 22 -15.741 -8.711 -21.027 1.00 30.54 N ATOM 0 H ARG A 22 -12.997 -3.466 -25.079 1.00 15.35 H new ATOM 0 HA ARG A 22 -11.767 -5.012 -27.036 1.00 44.14 H new ATOM 0 HB2 ARG A 22 -12.107 -6.866 -25.442 1.00 61.11 H new ATOM 0 HB3 ARG A 22 -11.527 -5.418 -24.643 1.00 61.11 H new ATOM 0 HG2 ARG A 22 -13.756 -4.915 -23.797 1.00 60.25 H new ATOM 0 HG3 ARG A 22 -14.458 -6.217 -24.736 1.00 60.25 H new ATOM 0 HD2 ARG A 22 -12.690 -7.705 -23.414 1.00 33.34 H new ATOM 0 HD3 ARG A 22 -12.724 -6.371 -22.278 1.00 33.34 H new ATOM 0 HE ARG A 22 -15.424 -7.058 -22.855 1.00 44.43 H new ATOM 0 HH11 ARG A 22 -12.548 -8.431 -21.335 1.00 71.22 H new ATOM 0 HH12 ARG A 22 -13.479 -9.439 -20.221 1.00 71.22 H new ATOM 0 HH21 ARG A 22 -16.610 -8.353 -21.423 1.00 30.54 H new ATOM 0 HH22 ARG A 22 -15.769 -9.395 -20.271 1.00 30.54 H new ATOM 364 N ILE A 23 -15.021 -5.326 -26.937 1.00 64.21 N ATOM 365 CA ILE A 23 -16.173 -5.884 -27.634 1.00 71.43 C ATOM 366 C ILE A 23 -16.247 -5.375 -29.070 1.00 35.12 C ATOM 367 O ILE A 23 -16.574 -6.125 -29.989 1.00 4.42 O ATOM 368 CB ILE A 23 -17.489 -5.541 -26.911 1.00 45.02 C ATOM 369 CG1 ILE A 23 -17.475 -6.102 -25.488 1.00 33.14 C ATOM 370 CG2 ILE A 23 -18.678 -6.085 -27.689 1.00 0.33 C ATOM 371 CD1 ILE A 23 -18.342 -5.324 -24.523 1.00 55.32 C ATOM 0 H ILE A 23 -15.254 -4.636 -26.222 1.00 64.21 H new ATOM 0 HA ILE A 23 -16.043 -6.966 -27.641 1.00 71.43 H new ATOM 0 HB ILE A 23 -17.583 -4.457 -26.853 1.00 45.02 H new ATOM 0 HG12 ILE A 23 -17.811 -7.138 -25.511 1.00 33.14 H new ATOM 0 HG13 ILE A 23 -16.450 -6.108 -25.119 1.00 33.14 H new ATOM 0 HG21 ILE A 23 -19.601 -5.835 -27.165 1.00 0.33 H new ATOM 0 HG22 ILE A 23 -18.694 -5.642 -28.685 1.00 0.33 H new ATOM 0 HG23 ILE A 23 -18.592 -7.168 -27.775 1.00 0.33 H new ATOM 0 HD11 ILE A 23 -18.284 -5.778 -23.534 1.00 55.32 H new ATOM 0 HD12 ILE A 23 -17.993 -4.293 -24.470 1.00 55.32 H new ATOM 0 HD13 ILE A 23 -19.376 -5.339 -24.869 1.00 55.32 H new ATOM 383 N ALA A 24 -15.940 -4.096 -29.254 1.00 51.51 N ATOM 384 CA ALA A 24 -15.968 -3.486 -30.578 1.00 72.01 C ATOM 385 C ALA A 24 -14.971 -4.162 -31.514 1.00 71.03 C ATOM 386 O ALA A 24 -15.164 -4.184 -32.730 1.00 1.55 O ATOM 387 CB ALA A 24 -15.675 -1.996 -30.479 1.00 41.34 C ATOM 0 H ALA A 24 -15.669 -3.461 -28.503 1.00 51.51 H new ATOM 0 HA ALA A 24 -16.967 -3.622 -30.993 1.00 72.01 H new ATOM 0 HB1 ALA A 24 -15.699 -1.553 -31.475 1.00 41.34 H new ATOM 0 HB2 ALA A 24 -16.427 -1.518 -29.851 1.00 41.34 H new ATOM 0 HB3 ALA A 24 -14.688 -1.848 -30.040 1.00 41.34 H new ATOM 393 N ASP A 25 -13.908 -4.712 -30.940 1.00 63.04 N ATOM 394 CA ASP A 25 -12.881 -5.389 -31.724 1.00 23.22 C ATOM 395 C ASP A 25 -13.469 -6.576 -32.480 1.00 64.34 C ATOM 396 O ASP A 25 -13.129 -6.818 -33.639 1.00 4.04 O ATOM 397 CB ASP A 25 -11.743 -5.859 -30.816 1.00 60.34 C ATOM 398 CG ASP A 25 -10.594 -6.467 -31.596 1.00 21.20 C ATOM 399 OD1 ASP A 25 -10.780 -7.557 -32.177 1.00 54.43 O ATOM 400 OD2 ASP A 25 -9.507 -5.853 -31.625 1.00 32.00 O ATOM 0 H ASP A 25 -13.734 -4.703 -29.935 1.00 63.04 H new ATOM 0 HA ASP A 25 -12.486 -4.679 -32.450 1.00 23.22 H new ATOM 0 HB2 ASP A 25 -11.376 -5.015 -30.232 1.00 60.34 H new ATOM 0 HB3 ASP A 25 -12.127 -6.594 -30.108 1.00 60.34 H new ATOM 405 N ARG A 26 -14.353 -7.315 -31.816 1.00 63.22 N ATOM 406 CA ARG A 26 -14.986 -8.479 -32.425 1.00 54.41 C ATOM 407 C ARG A 26 -16.271 -8.082 -33.147 1.00 34.01 C ATOM 408 O ARG A 26 -16.698 -8.750 -34.089 1.00 63.50 O ATOM 409 CB ARG A 26 -15.291 -9.534 -31.361 1.00 13.21 C ATOM 410 CG ARG A 26 -14.105 -10.424 -31.029 1.00 71.52 C ATOM 411 CD ARG A 26 -13.172 -9.760 -30.029 1.00 20.03 C ATOM 412 NE ARG A 26 -12.087 -10.647 -29.619 1.00 12.43 N ATOM 413 CZ ARG A 26 -11.076 -10.987 -30.411 1.00 44.43 C ATOM 414 NH1 ARG A 26 -11.012 -10.516 -31.649 1.00 0.44 N ATOM 415 NH2 ARG A 26 -10.126 -11.799 -29.965 1.00 40.42 N ATOM 0 H ARG A 26 -14.647 -7.128 -30.857 1.00 63.22 H new ATOM 0 HA ARG A 26 -14.294 -8.899 -33.155 1.00 54.41 H new ATOM 0 HB2 ARG A 26 -15.626 -9.035 -30.452 1.00 13.21 H new ATOM 0 HB3 ARG A 26 -16.117 -10.157 -31.705 1.00 13.21 H new ATOM 0 HG2 ARG A 26 -14.462 -11.370 -30.622 1.00 71.52 H new ATOM 0 HG3 ARG A 26 -13.556 -10.656 -31.942 1.00 71.52 H new ATOM 0 HD2 ARG A 26 -12.753 -8.855 -30.470 1.00 20.03 H new ATOM 0 HD3 ARG A 26 -13.741 -9.453 -29.151 1.00 20.03 H new ATOM 0 HE ARG A 26 -12.106 -11.026 -28.672 1.00 12.43 H new ATOM 0 HH11 ARG A 26 -11.740 -9.891 -31.995 1.00 0.44 H new ATOM 0 HH12 ARG A 26 -10.235 -10.779 -32.255 1.00 0.44 H new ATOM 0 HH21 ARG A 26 -10.171 -12.163 -29.013 1.00 40.42 H new ATOM 0 HH22 ARG A 26 -9.350 -12.059 -30.574 1.00 40.42 H new ATOM 429 N PHE A 27 -16.883 -6.992 -32.698 1.00 41.11 N ATOM 430 CA PHE A 27 -18.120 -6.508 -33.300 1.00 3.43 C ATOM 431 C PHE A 27 -17.837 -5.391 -34.300 1.00 42.12 C ATOM 432 O PHE A 27 -17.480 -4.276 -33.920 1.00 0.32 O ATOM 433 CB PHE A 27 -19.078 -6.007 -32.217 1.00 42.41 C ATOM 434 CG PHE A 27 -19.870 -7.102 -31.564 1.00 30.21 C ATOM 435 CD1 PHE A 27 -19.341 -7.821 -30.504 1.00 23.21 C ATOM 436 CD2 PHE A 27 -21.144 -7.415 -32.010 1.00 11.34 C ATOM 437 CE1 PHE A 27 -20.067 -8.830 -29.900 1.00 72.34 C ATOM 438 CE2 PHE A 27 -21.875 -8.422 -31.409 1.00 51.33 C ATOM 439 CZ PHE A 27 -21.337 -9.131 -30.354 1.00 64.54 C ATOM 0 H PHE A 27 -16.543 -6.427 -31.920 1.00 41.11 H new ATOM 0 HA PHE A 27 -18.585 -7.339 -33.831 1.00 3.43 H new ATOM 0 HB2 PHE A 27 -18.507 -5.478 -31.454 1.00 42.41 H new ATOM 0 HB3 PHE A 27 -19.766 -5.285 -32.657 1.00 42.41 H new ATOM 0 HD1 PHE A 27 -18.349 -7.590 -30.145 1.00 23.21 H new ATOM 0 HD2 PHE A 27 -21.570 -6.866 -32.836 1.00 11.34 H new ATOM 0 HE1 PHE A 27 -19.643 -9.382 -29.075 1.00 72.34 H new ATOM 0 HE2 PHE A 27 -22.868 -8.654 -31.765 1.00 51.33 H new ATOM 0 HZ PHE A 27 -21.907 -9.919 -29.885 1.00 64.54 H new ATOM 449 N LYS A 28 -17.999 -5.699 -35.583 1.00 1.45 N ATOM 450 CA LYS A 28 -17.763 -4.723 -36.640 1.00 4.22 C ATOM 451 C LYS A 28 -18.978 -3.821 -36.831 1.00 72.22 C ATOM 452 O LYS A 28 -18.842 -2.616 -37.039 1.00 62.15 O ATOM 453 CB LYS A 28 -17.430 -5.433 -37.954 1.00 70.55 C ATOM 454 CG LYS A 28 -18.530 -6.365 -38.436 1.00 64.40 C ATOM 455 CD LYS A 28 -18.118 -7.108 -39.696 1.00 24.44 C ATOM 456 CE LYS A 28 -17.128 -8.222 -39.388 1.00 13.44 C ATOM 457 NZ LYS A 28 -16.496 -8.760 -40.624 1.00 31.44 N ATOM 0 H LYS A 28 -18.293 -6.617 -35.915 1.00 1.45 H new ATOM 0 HA LYS A 28 -16.916 -4.104 -36.344 1.00 4.22 H new ATOM 0 HB2 LYS A 28 -17.236 -4.685 -38.723 1.00 70.55 H new ATOM 0 HB3 LYS A 28 -16.511 -6.005 -37.826 1.00 70.55 H new ATOM 0 HG2 LYS A 28 -18.770 -7.082 -37.651 1.00 64.40 H new ATOM 0 HG3 LYS A 28 -19.436 -5.791 -38.631 1.00 64.40 H new ATOM 0 HD2 LYS A 28 -19.001 -7.528 -40.177 1.00 24.44 H new ATOM 0 HD3 LYS A 28 -17.672 -6.408 -40.403 1.00 24.44 H new ATOM 0 HE2 LYS A 28 -16.354 -7.845 -38.719 1.00 13.44 H new ATOM 0 HE3 LYS A 28 -17.640 -9.028 -38.862 1.00 13.44 H new ATOM 0 HZ1 LYS A 28 -15.829 -9.517 -40.372 1.00 31.44 H new ATOM 0 HZ2 LYS A 28 -17.232 -9.143 -41.252 1.00 31.44 H new ATOM 0 HZ3 LYS A 28 -15.986 -7.997 -41.113 1.00 31.44 H new ATOM 471 N ASN A 29 -20.165 -4.413 -36.756 1.00 72.22 N ATOM 472 CA ASN A 29 -21.405 -3.663 -36.920 1.00 54.51 C ATOM 473 C ASN A 29 -22.161 -3.567 -35.598 1.00 52.15 C ATOM 474 O ASN A 29 -22.759 -4.540 -35.142 1.00 34.44 O ATOM 475 CB ASN A 29 -22.289 -4.324 -37.979 1.00 53.54 C ATOM 476 CG ASN A 29 -21.537 -4.612 -39.263 1.00 42.21 C ATOM 477 OD1 ASN A 29 -21.466 -5.756 -39.711 1.00 72.41 O ATOM 478 ND2 ASN A 29 -20.969 -3.571 -39.862 1.00 41.11 N ATOM 0 H ASN A 29 -20.295 -5.410 -36.583 1.00 72.22 H new ATOM 0 HA ASN A 29 -21.150 -2.655 -37.247 1.00 54.51 H new ATOM 0 HB2 ASN A 29 -22.693 -5.255 -37.581 1.00 53.54 H new ATOM 0 HB3 ASN A 29 -23.138 -3.675 -38.196 1.00 53.54 H new ATOM 0 HD21 ASN A 29 -20.448 -3.703 -40.729 1.00 41.11 H new ATOM 0 HD22 ASN A 29 -21.054 -2.640 -39.455 1.00 41.11 H new ATOM 485 N ARG A 30 -22.130 -2.386 -34.990 1.00 11.11 N ATOM 486 CA ARG A 30 -22.812 -2.162 -33.720 1.00 61.01 C ATOM 487 C ARG A 30 -23.524 -0.813 -33.716 1.00 22.01 C ATOM 488 O ARG A 30 -23.213 0.066 -34.520 1.00 2.33 O ATOM 489 CB ARG A 30 -21.814 -2.228 -32.562 1.00 40.23 C ATOM 490 CG ARG A 30 -20.558 -1.403 -32.793 1.00 31.13 C ATOM 491 CD ARG A 30 -19.474 -2.217 -33.482 1.00 33.54 C ATOM 492 NE ARG A 30 -18.156 -1.606 -33.338 1.00 10.32 N ATOM 493 CZ ARG A 30 -17.779 -0.511 -33.988 1.00 62.01 C ATOM 494 NH1 ARG A 30 -18.617 0.090 -34.823 1.00 4.53 N ATOM 495 NH2 ARG A 30 -16.562 -0.014 -33.805 1.00 20.12 N ATOM 0 H ARG A 30 -21.640 -1.569 -35.356 1.00 11.11 H new ATOM 0 HA ARG A 30 -23.557 -2.947 -33.593 1.00 61.01 H new ATOM 0 HB2 ARG A 30 -22.303 -1.882 -31.651 1.00 40.23 H new ATOM 0 HB3 ARG A 30 -21.531 -3.267 -32.396 1.00 40.23 H new ATOM 0 HG2 ARG A 30 -20.801 -0.531 -33.400 1.00 31.13 H new ATOM 0 HG3 ARG A 30 -20.184 -1.032 -31.838 1.00 31.13 H new ATOM 0 HD2 ARG A 30 -19.455 -3.223 -33.063 1.00 33.54 H new ATOM 0 HD3 ARG A 30 -19.713 -2.317 -34.541 1.00 33.54 H new ATOM 0 HE ARG A 30 -17.488 -2.044 -32.704 1.00 10.32 H new ATOM 0 HH11 ARG A 30 -19.553 -0.289 -34.967 1.00 4.53 H new ATOM 0 HH12 ARG A 30 -18.325 0.931 -35.321 1.00 4.53 H new ATOM 0 HH21 ARG A 30 -15.915 -0.473 -33.164 1.00 20.12 H new ATOM 0 HH22 ARG A 30 -16.274 0.827 -34.305 1.00 20.12 H new ATOM 509 N ILE A 31 -24.479 -0.656 -32.806 1.00 52.11 N ATOM 510 CA ILE A 31 -25.234 0.585 -32.697 1.00 5.33 C ATOM 511 C ILE A 31 -25.089 1.197 -31.307 1.00 12.44 C ATOM 512 O ILE A 31 -25.461 0.600 -30.297 1.00 30.35 O ATOM 513 CB ILE A 31 -26.729 0.364 -32.994 1.00 24.11 C ATOM 514 CG1 ILE A 31 -27.152 -1.044 -32.567 1.00 51.51 C ATOM 515 CG2 ILE A 31 -27.013 0.584 -34.473 1.00 22.45 C ATOM 516 CD1 ILE A 31 -28.644 -1.279 -32.659 1.00 12.23 C ATOM 0 H ILE A 31 -24.748 -1.374 -32.133 1.00 52.11 H new ATOM 0 HA ILE A 31 -24.822 1.270 -33.438 1.00 5.33 H new ATOM 0 HB ILE A 31 -27.310 1.087 -32.422 1.00 24.11 H new ATOM 0 HG12 ILE A 31 -26.638 -1.775 -33.192 1.00 51.51 H new ATOM 0 HG13 ILE A 31 -26.827 -1.217 -31.541 1.00 51.51 H new ATOM 0 HG21 ILE A 31 -28.074 0.424 -34.668 1.00 22.45 H new ATOM 0 HG22 ILE A 31 -26.743 1.604 -34.748 1.00 22.45 H new ATOM 0 HG23 ILE A 31 -26.426 -0.118 -35.065 1.00 22.45 H new ATOM 0 HD11 ILE A 31 -28.872 -2.296 -32.342 1.00 12.23 H new ATOM 0 HD12 ILE A 31 -29.164 -0.572 -32.013 1.00 12.23 H new ATOM 0 HD13 ILE A 31 -28.972 -1.138 -33.689 1.00 12.23 H new ATOM 528 N PRO A 32 -24.536 2.418 -31.253 1.00 14.53 N ATOM 529 CA PRO A 32 -24.331 3.139 -29.993 1.00 13.21 C ATOM 530 C PRO A 32 -25.644 3.598 -29.367 1.00 45.03 C ATOM 531 O PRO A 32 -26.156 4.670 -29.690 1.00 71.33 O ATOM 532 CB PRO A 32 -23.486 4.345 -30.408 1.00 2.50 C ATOM 533 CG PRO A 32 -23.807 4.556 -31.848 1.00 11.44 C ATOM 534 CD PRO A 32 -24.070 3.189 -32.418 1.00 2.42 C ATOM 0 HA PRO A 32 -23.860 2.511 -29.236 1.00 13.21 H new ATOM 0 HB2 PRO A 32 -23.734 5.225 -29.814 1.00 2.50 H new ATOM 0 HB3 PRO A 32 -22.423 4.152 -30.264 1.00 2.50 H new ATOM 0 HG2 PRO A 32 -24.678 5.201 -31.963 1.00 11.44 H new ATOM 0 HG3 PRO A 32 -22.980 5.042 -32.365 1.00 11.44 H new ATOM 0 HD2 PRO A 32 -24.822 3.220 -33.206 1.00 2.42 H new ATOM 0 HD3 PRO A 32 -23.170 2.755 -32.853 1.00 2.42 H new ATOM 542 N VAL A 33 -26.185 2.780 -28.470 1.00 21.41 N ATOM 543 CA VAL A 33 -27.438 3.103 -27.798 1.00 21.20 C ATOM 544 C VAL A 33 -27.183 3.678 -26.409 1.00 33.34 C ATOM 545 O VAL A 33 -26.289 3.225 -25.693 1.00 15.00 O ATOM 546 CB VAL A 33 -28.342 1.862 -27.670 1.00 44.34 C ATOM 547 CG1 VAL A 33 -28.876 1.449 -29.034 1.00 20.23 C ATOM 548 CG2 VAL A 33 -27.586 0.718 -27.014 1.00 71.35 C ATOM 0 H VAL A 33 -25.775 1.888 -28.192 1.00 21.41 H new ATOM 0 HA VAL A 33 -27.943 3.850 -28.411 1.00 21.20 H new ATOM 0 HB VAL A 33 -29.191 2.115 -27.035 1.00 44.34 H new ATOM 0 HG11 VAL A 33 -29.513 0.571 -28.925 1.00 20.23 H new ATOM 0 HG12 VAL A 33 -29.456 2.267 -29.460 1.00 20.23 H new ATOM 0 HG13 VAL A 33 -28.042 1.213 -29.695 1.00 20.23 H new ATOM 0 HG21 VAL A 33 -28.240 -0.150 -26.932 1.00 71.35 H new ATOM 0 HG22 VAL A 33 -26.717 0.462 -27.620 1.00 71.35 H new ATOM 0 HG23 VAL A 33 -27.259 1.021 -26.020 1.00 71.35 H new ATOM 558 N ILE A 34 -27.976 4.676 -26.033 1.00 51.45 N ATOM 559 CA ILE A 34 -27.838 5.311 -24.729 1.00 5.23 C ATOM 560 C ILE A 34 -29.135 5.221 -23.934 1.00 32.24 C ATOM 561 O ILE A 34 -29.974 6.121 -23.989 1.00 74.24 O ATOM 562 CB ILE A 34 -27.434 6.791 -24.864 1.00 10.40 C ATOM 563 CG1 ILE A 34 -26.110 6.914 -25.621 1.00 23.14 C ATOM 564 CG2 ILE A 34 -27.328 7.439 -23.491 1.00 71.33 C ATOM 565 CD1 ILE A 34 -26.281 7.122 -27.109 1.00 71.33 C ATOM 0 H ILE A 34 -28.721 5.062 -26.613 1.00 51.45 H new ATOM 0 HA ILE A 34 -27.051 4.775 -24.198 1.00 5.23 H new ATOM 0 HB ILE A 34 -28.205 7.312 -25.431 1.00 10.40 H new ATOM 0 HG12 ILE A 34 -25.542 7.748 -25.209 1.00 23.14 H new ATOM 0 HG13 ILE A 34 -25.520 6.013 -25.454 1.00 23.14 H new ATOM 0 HG21 ILE A 34 -27.042 8.485 -23.603 1.00 71.33 H new ATOM 0 HG22 ILE A 34 -28.292 7.379 -22.985 1.00 71.33 H new ATOM 0 HG23 ILE A 34 -26.575 6.918 -22.900 1.00 71.33 H new ATOM 0 HD11 ILE A 34 -25.301 7.201 -27.580 1.00 71.33 H new ATOM 0 HD12 ILE A 34 -26.822 6.277 -27.535 1.00 71.33 H new ATOM 0 HD13 ILE A 34 -26.843 8.039 -27.286 1.00 71.33 H new ATOM 577 N CYS A 35 -29.293 4.129 -23.192 1.00 53.53 N ATOM 578 CA CYS A 35 -30.488 3.921 -22.383 1.00 54.11 C ATOM 579 C CYS A 35 -30.382 4.662 -21.054 1.00 62.51 C ATOM 580 O CYS A 35 -29.451 4.437 -20.282 1.00 33.52 O ATOM 581 CB CYS A 35 -30.707 2.428 -22.133 1.00 42.40 C ATOM 582 SG CYS A 35 -32.335 1.825 -22.638 1.00 30.13 S ATOM 0 H CYS A 35 -28.608 3.375 -23.135 1.00 53.53 H new ATOM 0 HA CYS A 35 -31.341 4.319 -22.932 1.00 54.11 H new ATOM 0 HB2 CYS A 35 -29.941 1.865 -22.667 1.00 42.40 H new ATOM 0 HB3 CYS A 35 -30.570 2.225 -21.071 1.00 42.40 H new ATOM 0 HG CYS A 35 -32.504 0.613 -22.200 1.00 30.13 H new ATOM 588 N GLU A 36 -31.340 5.546 -20.797 1.00 23.03 N ATOM 589 CA GLU A 36 -31.351 6.321 -19.562 1.00 31.15 C ATOM 590 C GLU A 36 -32.453 5.836 -18.624 1.00 62.42 C ATOM 591 O GLU A 36 -33.272 4.992 -18.993 1.00 3.43 O ATOM 592 CB GLU A 36 -31.546 7.807 -19.867 1.00 52.34 C ATOM 593 CG GLU A 36 -30.273 8.509 -20.313 1.00 34.54 C ATOM 594 CD GLU A 36 -30.542 9.866 -20.934 1.00 32.02 C ATOM 595 OE1 GLU A 36 -31.528 9.988 -21.691 1.00 31.30 O ATOM 596 OE2 GLU A 36 -29.766 10.806 -20.663 1.00 41.12 O ATOM 0 H GLU A 36 -32.118 5.743 -21.427 1.00 23.03 H new ATOM 0 HA GLU A 36 -30.389 6.181 -19.069 1.00 31.15 H new ATOM 0 HB2 GLU A 36 -32.301 7.913 -20.645 1.00 52.34 H new ATOM 0 HB3 GLU A 36 -31.933 8.304 -18.977 1.00 52.34 H new ATOM 0 HG2 GLU A 36 -29.610 8.631 -19.456 1.00 34.54 H new ATOM 0 HG3 GLU A 36 -29.750 7.881 -21.034 1.00 34.54 H new ATOM 603 N LYS A 37 -32.467 6.373 -17.409 1.00 23.20 N ATOM 604 CA LYS A 37 -33.468 5.997 -16.417 1.00 22.55 C ATOM 605 C LYS A 37 -34.593 7.024 -16.363 1.00 34.10 C ATOM 606 O LYS A 37 -34.355 8.209 -16.139 1.00 5.54 O ATOM 607 CB LYS A 37 -32.821 5.860 -15.037 1.00 20.03 C ATOM 608 CG LYS A 37 -31.980 7.061 -14.638 1.00 14.23 C ATOM 609 CD LYS A 37 -31.447 6.922 -13.222 1.00 4.41 C ATOM 610 CE LYS A 37 -30.135 7.671 -13.045 1.00 3.33 C ATOM 611 NZ LYS A 37 -29.038 7.066 -13.848 1.00 43.55 N ATOM 0 H LYS A 37 -31.796 7.071 -17.087 1.00 23.20 H new ATOM 0 HA LYS A 37 -33.891 5.036 -16.710 1.00 22.55 H new ATOM 0 HB2 LYS A 37 -33.602 5.710 -14.292 1.00 20.03 H new ATOM 0 HB3 LYS A 37 -32.194 4.968 -15.026 1.00 20.03 H new ATOM 0 HG2 LYS A 37 -31.147 7.170 -15.332 1.00 14.23 H new ATOM 0 HG3 LYS A 37 -32.580 7.968 -14.715 1.00 14.23 H new ATOM 0 HD2 LYS A 37 -32.184 7.304 -12.515 1.00 4.41 H new ATOM 0 HD3 LYS A 37 -31.300 5.867 -12.989 1.00 4.41 H new ATOM 0 HE2 LYS A 37 -30.269 8.712 -13.339 1.00 3.33 H new ATOM 0 HE3 LYS A 37 -29.856 7.671 -11.991 1.00 3.33 H new ATOM 0 HZ1 LYS A 37 -28.122 7.295 -13.412 1.00 43.55 H new ATOM 0 HZ2 LYS A 37 -29.158 6.033 -13.878 1.00 43.55 H new ATOM 0 HZ3 LYS A 37 -29.066 7.446 -14.816 1.00 43.55 H new ATOM 625 N ALA A 38 -35.822 6.560 -16.569 1.00 30.40 N ATOM 626 CA ALA A 38 -36.985 7.437 -16.540 1.00 63.22 C ATOM 627 C ALA A 38 -37.319 7.860 -15.113 1.00 71.04 C ATOM 628 O ALA A 38 -37.270 7.049 -14.189 1.00 3.10 O ATOM 629 CB ALA A 38 -38.181 6.750 -17.183 1.00 14.34 C ATOM 0 H ALA A 38 -36.037 5.581 -16.758 1.00 30.40 H new ATOM 0 HA ALA A 38 -36.746 8.335 -17.110 1.00 63.22 H new ATOM 0 HB1 ALA A 38 -39.043 7.417 -17.154 1.00 14.34 H new ATOM 0 HB2 ALA A 38 -37.946 6.505 -18.219 1.00 14.34 H new ATOM 0 HB3 ALA A 38 -38.412 5.835 -16.637 1.00 14.34 H new ATOM 635 N GLU A 39 -37.658 9.134 -14.943 1.00 30.31 N ATOM 636 CA GLU A 39 -37.998 9.664 -13.627 1.00 54.12 C ATOM 637 C GLU A 39 -39.469 9.418 -13.306 1.00 31.54 C ATOM 638 O GLU A 39 -39.880 9.462 -12.146 1.00 5.51 O ATOM 639 CB GLU A 39 -37.694 11.161 -13.562 1.00 4.42 C ATOM 640 CG GLU A 39 -36.263 11.509 -13.936 1.00 31.24 C ATOM 641 CD GLU A 39 -35.991 13.000 -13.883 1.00 63.15 C ATOM 642 OE1 GLU A 39 -36.332 13.700 -14.859 1.00 13.20 O ATOM 643 OE2 GLU A 39 -35.438 13.467 -12.865 1.00 75.40 O ATOM 0 H GLU A 39 -37.705 9.818 -15.699 1.00 30.31 H new ATOM 0 HA GLU A 39 -37.390 9.145 -12.886 1.00 54.12 H new ATOM 0 HB2 GLU A 39 -38.374 11.690 -14.229 1.00 4.42 H new ATOM 0 HB3 GLU A 39 -37.894 11.520 -12.553 1.00 4.42 H new ATOM 0 HG2 GLU A 39 -35.580 10.995 -13.260 1.00 31.24 H new ATOM 0 HG3 GLU A 39 -36.055 11.141 -14.941 1.00 31.24 H new ATOM 650 N LYS A 40 -40.260 9.158 -14.341 1.00 65.44 N ATOM 651 CA LYS A 40 -41.686 8.904 -14.172 1.00 5.10 C ATOM 652 C LYS A 40 -41.967 7.407 -14.096 1.00 64.41 C ATOM 653 O LYS A 40 -43.064 6.954 -14.424 1.00 24.13 O ATOM 654 CB LYS A 40 -42.476 9.524 -15.327 1.00 51.12 C ATOM 655 CG LYS A 40 -43.960 9.667 -15.039 1.00 51.24 C ATOM 656 CD LYS A 40 -44.618 10.659 -15.984 1.00 43.13 C ATOM 657 CE LYS A 40 -46.043 10.976 -15.557 1.00 53.22 C ATOM 658 NZ LYS A 40 -46.091 12.081 -14.561 1.00 31.22 N ATOM 0 H LYS A 40 -39.937 9.118 -15.308 1.00 65.44 H new ATOM 0 HA LYS A 40 -42.003 9.363 -13.235 1.00 5.10 H new ATOM 0 HB2 LYS A 40 -42.062 10.506 -15.554 1.00 51.12 H new ATOM 0 HB3 LYS A 40 -42.345 8.909 -16.218 1.00 51.12 H new ATOM 0 HG2 LYS A 40 -44.445 8.696 -15.134 1.00 51.24 H new ATOM 0 HG3 LYS A 40 -44.102 9.995 -14.009 1.00 51.24 H new ATOM 0 HD2 LYS A 40 -44.033 11.578 -16.013 1.00 43.13 H new ATOM 0 HD3 LYS A 40 -44.622 10.252 -16.995 1.00 43.13 H new ATOM 0 HE2 LYS A 40 -46.632 11.250 -16.432 1.00 53.22 H new ATOM 0 HE3 LYS A 40 -46.502 10.083 -15.131 1.00 53.22 H new ATOM 0 HZ1 LYS A 40 -47.079 12.267 -14.296 1.00 31.22 H new ATOM 0 HZ2 LYS A 40 -45.550 11.810 -13.715 1.00 31.22 H new ATOM 0 HZ3 LYS A 40 -45.677 12.940 -14.975 1.00 31.22 H new ATOM 672 N SER A 41 -40.969 6.644 -13.662 1.00 21.23 N ATOM 673 CA SER A 41 -41.108 5.196 -13.545 1.00 2.12 C ATOM 674 C SER A 41 -40.711 4.723 -12.150 1.00 41.20 C ATOM 675 O SER A 41 -40.173 5.491 -11.351 1.00 15.10 O ATOM 676 CB SER A 41 -40.249 4.494 -14.598 1.00 24.21 C ATOM 677 OG SER A 41 -40.230 5.225 -15.812 1.00 3.34 O ATOM 0 H SER A 41 -40.055 7.004 -13.386 1.00 21.23 H new ATOM 0 HA SER A 41 -42.155 4.941 -13.711 1.00 2.12 H new ATOM 0 HB2 SER A 41 -39.232 4.378 -14.224 1.00 24.21 H new ATOM 0 HB3 SER A 41 -40.638 3.492 -14.779 1.00 24.21 H new ATOM 0 HG SER A 41 -40.030 4.619 -16.556 1.00 3.34 H new ATOM 683 N ASP A 42 -40.979 3.455 -11.864 1.00 73.41 N ATOM 684 CA ASP A 42 -40.650 2.876 -10.565 1.00 42.35 C ATOM 685 C ASP A 42 -39.545 1.835 -10.700 1.00 5.00 C ATOM 686 O ASP A 42 -39.125 1.230 -9.712 1.00 64.42 O ATOM 687 CB ASP A 42 -41.891 2.243 -9.936 1.00 13.00 C ATOM 688 CG ASP A 42 -41.671 1.855 -8.487 1.00 54.42 C ATOM 689 OD1 ASP A 42 -41.822 2.731 -7.610 1.00 24.15 O ATOM 690 OD2 ASP A 42 -41.349 0.677 -8.230 1.00 21.13 O ATOM 0 H ASP A 42 -41.424 2.807 -12.514 1.00 73.41 H new ATOM 0 HA ASP A 42 -40.293 3.677 -9.917 1.00 42.35 H new ATOM 0 HB2 ASP A 42 -42.724 2.943 -9.999 1.00 13.00 H new ATOM 0 HB3 ASP A 42 -42.174 1.359 -10.507 1.00 13.00 H new ATOM 695 N ILE A 43 -39.078 1.630 -11.926 1.00 64.43 N ATOM 696 CA ILE A 43 -38.020 0.660 -12.189 1.00 10.53 C ATOM 697 C ILE A 43 -36.669 1.178 -11.708 1.00 23.30 C ATOM 698 O ILE A 43 -36.273 2.308 -11.991 1.00 3.41 O ATOM 699 CB ILE A 43 -37.924 0.324 -13.689 1.00 30.00 C ATOM 700 CG1 ILE A 43 -37.153 -0.982 -13.893 1.00 13.31 C ATOM 701 CG2 ILE A 43 -37.258 1.463 -14.446 1.00 40.11 C ATOM 702 CD1 ILE A 43 -37.294 -1.555 -15.286 1.00 15.04 C ATOM 0 H ILE A 43 -39.415 2.122 -12.754 1.00 64.43 H new ATOM 0 HA ILE A 43 -38.277 -0.245 -11.639 1.00 10.53 H new ATOM 0 HB ILE A 43 -38.932 0.194 -14.082 1.00 30.00 H new ATOM 0 HG12 ILE A 43 -36.097 -0.807 -13.686 1.00 13.31 H new ATOM 0 HG13 ILE A 43 -37.503 -1.718 -13.169 1.00 13.31 H new ATOM 0 HG21 ILE A 43 -37.198 1.210 -15.505 1.00 40.11 H new ATOM 0 HG22 ILE A 43 -37.845 2.373 -14.323 1.00 40.11 H new ATOM 0 HG23 ILE A 43 -36.254 1.623 -14.053 1.00 40.11 H new ATOM 0 HD11 ILE A 43 -36.722 -2.480 -15.359 1.00 15.04 H new ATOM 0 HD12 ILE A 43 -38.345 -1.762 -15.490 1.00 15.04 H new ATOM 0 HD13 ILE A 43 -36.917 -0.837 -16.015 1.00 15.04 H new ATOM 714 N PRO A 44 -35.942 0.331 -10.965 1.00 61.43 N ATOM 715 CA PRO A 44 -34.622 0.679 -10.431 1.00 63.41 C ATOM 716 C PRO A 44 -33.563 0.784 -11.524 1.00 31.43 C ATOM 717 O PRO A 44 -33.766 0.316 -12.644 1.00 15.04 O ATOM 718 CB PRO A 44 -34.303 -0.483 -9.487 1.00 23.31 C ATOM 719 CG PRO A 44 -35.096 -1.628 -10.015 1.00 63.30 C ATOM 720 CD PRO A 44 -36.351 -1.032 -10.589 1.00 73.45 C ATOM 0 HA PRO A 44 -34.624 1.654 -9.943 1.00 63.41 H new ATOM 0 HB2 PRO A 44 -33.237 -0.708 -9.483 1.00 23.31 H new ATOM 0 HB3 PRO A 44 -34.583 -0.247 -8.460 1.00 23.31 H new ATOM 0 HG2 PRO A 44 -34.538 -2.171 -10.778 1.00 63.30 H new ATOM 0 HG3 PRO A 44 -35.329 -2.340 -9.223 1.00 63.30 H new ATOM 0 HD2 PRO A 44 -36.706 -1.597 -11.451 1.00 73.45 H new ATOM 0 HD3 PRO A 44 -37.161 -1.021 -9.859 1.00 73.45 H new ATOM 728 N GLU A 45 -32.433 1.399 -11.190 1.00 74.13 N ATOM 729 CA GLU A 45 -31.343 1.564 -12.145 1.00 31.21 C ATOM 730 C GLU A 45 -30.717 0.217 -12.493 1.00 61.41 C ATOM 731 O GLU A 45 -30.631 -0.676 -11.650 1.00 25.44 O ATOM 732 CB GLU A 45 -30.276 2.503 -11.577 1.00 72.34 C ATOM 733 CG GLU A 45 -29.581 3.344 -12.634 1.00 65.33 C ATOM 734 CD GLU A 45 -28.168 3.726 -12.239 1.00 61.52 C ATOM 735 OE1 GLU A 45 -27.850 3.658 -11.034 1.00 5.23 O ATOM 736 OE2 GLU A 45 -27.380 4.092 -13.137 1.00 52.40 O ATOM 0 H GLU A 45 -32.248 1.791 -10.267 1.00 74.13 H new ATOM 0 HA GLU A 45 -31.754 2.001 -13.055 1.00 31.21 H new ATOM 0 HB2 GLU A 45 -30.739 3.165 -10.845 1.00 72.34 H new ATOM 0 HB3 GLU A 45 -29.530 1.912 -11.046 1.00 72.34 H new ATOM 0 HG2 GLU A 45 -29.555 2.792 -13.573 1.00 65.33 H new ATOM 0 HG3 GLU A 45 -30.162 4.249 -12.813 1.00 65.33 H new ATOM 743 N ILE A 46 -30.282 0.079 -13.742 1.00 32.25 N ATOM 744 CA ILE A 46 -29.664 -1.159 -14.202 1.00 2.53 C ATOM 745 C ILE A 46 -28.147 -1.102 -14.055 1.00 34.44 C ATOM 746 O ILE A 46 -27.424 -1.876 -14.682 1.00 22.24 O ATOM 747 CB ILE A 46 -30.015 -1.449 -15.673 1.00 33.53 C ATOM 748 CG1 ILE A 46 -31.481 -1.106 -15.947 1.00 62.43 C ATOM 749 CG2 ILE A 46 -29.735 -2.907 -16.005 1.00 72.24 C ATOM 750 CD1 ILE A 46 -31.930 -1.455 -17.349 1.00 74.44 C ATOM 0 H ILE A 46 -30.346 0.808 -14.452 1.00 32.25 H new ATOM 0 HA ILE A 46 -30.058 -1.961 -13.578 1.00 2.53 H new ATOM 0 HB ILE A 46 -29.390 -0.824 -16.311 1.00 33.53 H new ATOM 0 HG12 ILE A 46 -32.110 -1.635 -15.230 1.00 62.43 H new ATOM 0 HG13 ILE A 46 -31.634 -0.040 -15.780 1.00 62.43 H new ATOM 0 HG21 ILE A 46 -29.988 -3.098 -17.048 1.00 72.24 H new ATOM 0 HG22 ILE A 46 -28.679 -3.121 -15.843 1.00 72.24 H new ATOM 0 HG23 ILE A 46 -30.338 -3.549 -15.362 1.00 72.24 H new ATOM 0 HD11 ILE A 46 -32.979 -1.185 -17.473 1.00 74.44 H new ATOM 0 HD12 ILE A 46 -31.326 -0.906 -18.072 1.00 74.44 H new ATOM 0 HD13 ILE A 46 -31.809 -2.526 -17.514 1.00 74.44 H new ATOM 762 N ASP A 47 -27.673 -0.183 -13.221 1.00 45.13 N ATOM 763 CA ASP A 47 -26.242 -0.028 -12.988 1.00 42.50 C ATOM 764 C ASP A 47 -25.477 0.003 -14.308 1.00 31.34 C ATOM 765 O ASP A 47 -24.382 -0.551 -14.417 1.00 44.45 O ATOM 766 CB ASP A 47 -25.720 -1.165 -12.109 1.00 2.20 C ATOM 767 CG ASP A 47 -26.290 -1.119 -10.705 1.00 60.24 C ATOM 768 OD1 ASP A 47 -27.117 -0.225 -10.429 1.00 31.15 O ATOM 769 OD2 ASP A 47 -25.909 -1.979 -9.882 1.00 54.41 O ATOM 0 H ASP A 47 -28.259 0.466 -12.695 1.00 45.13 H new ATOM 0 HA ASP A 47 -26.084 0.920 -12.474 1.00 42.50 H new ATOM 0 HB2 ASP A 47 -25.971 -2.121 -12.569 1.00 2.20 H new ATOM 0 HB3 ASP A 47 -24.632 -1.112 -12.059 1.00 2.20 H new ATOM 774 N LYS A 48 -26.061 0.653 -15.309 1.00 42.13 N ATOM 775 CA LYS A 48 -25.435 0.757 -16.622 1.00 1.40 C ATOM 776 C LYS A 48 -25.889 2.024 -17.342 1.00 20.51 C ATOM 777 O LYS A 48 -27.038 2.445 -17.211 1.00 20.04 O ATOM 778 CB LYS A 48 -25.772 -0.472 -17.469 1.00 62.22 C ATOM 779 CG LYS A 48 -25.153 -1.758 -16.948 1.00 13.23 C ATOM 780 CD LYS A 48 -23.636 -1.709 -17.004 1.00 30.43 C ATOM 781 CE LYS A 48 -23.135 -1.547 -18.431 1.00 14.44 C ATOM 782 NZ LYS A 48 -22.912 -0.117 -18.780 1.00 42.14 N ATOM 0 H LYS A 48 -26.967 1.116 -15.236 1.00 42.13 H new ATOM 0 HA LYS A 48 -24.356 0.808 -16.480 1.00 1.40 H new ATOM 0 HB2 LYS A 48 -26.855 -0.590 -17.509 1.00 62.22 H new ATOM 0 HB3 LYS A 48 -25.432 -0.303 -18.491 1.00 62.22 H new ATOM 0 HG2 LYS A 48 -25.475 -1.927 -15.920 1.00 13.23 H new ATOM 0 HG3 LYS A 48 -25.513 -2.601 -17.538 1.00 13.23 H new ATOM 0 HD2 LYS A 48 -23.275 -0.881 -16.394 1.00 30.43 H new ATOM 0 HD3 LYS A 48 -23.225 -2.623 -16.575 1.00 30.43 H new ATOM 0 HE2 LYS A 48 -22.204 -2.101 -18.554 1.00 14.44 H new ATOM 0 HE3 LYS A 48 -23.858 -1.981 -19.122 1.00 14.44 H new ATOM 0 HZ1 LYS A 48 -23.670 0.208 -19.414 1.00 42.14 H new ATOM 0 HZ2 LYS A 48 -22.916 0.457 -17.913 1.00 42.14 H new ATOM 0 HZ3 LYS A 48 -21.994 -0.015 -19.258 1.00 42.14 H new ATOM 796 N ARG A 49 -24.980 2.623 -18.103 1.00 43.24 N ATOM 797 CA ARG A 49 -25.287 3.841 -18.845 1.00 34.22 C ATOM 798 C ARG A 49 -25.228 3.592 -20.349 1.00 31.10 C ATOM 799 O ARG A 49 -26.202 3.824 -21.067 1.00 24.43 O ATOM 800 CB ARG A 49 -24.312 4.956 -18.462 1.00 71.21 C ATOM 801 CG ARG A 49 -24.486 5.456 -17.038 1.00 35.32 C ATOM 802 CD ARG A 49 -24.113 6.925 -16.913 1.00 25.23 C ATOM 803 NE ARG A 49 -22.746 7.181 -17.358 1.00 21.33 N ATOM 804 CZ ARG A 49 -22.286 8.390 -17.663 1.00 30.33 C ATOM 805 NH1 ARG A 49 -23.081 9.447 -17.571 1.00 32.33 N ATOM 806 NH2 ARG A 49 -21.030 8.543 -18.061 1.00 22.35 N ATOM 0 H ARG A 49 -24.025 2.286 -18.223 1.00 43.24 H new ATOM 0 HA ARG A 49 -26.300 4.149 -18.586 1.00 34.22 H new ATOM 0 HB2 ARG A 49 -23.292 4.594 -18.589 1.00 71.21 H new ATOM 0 HB3 ARG A 49 -24.441 5.792 -19.150 1.00 71.21 H new ATOM 0 HG2 ARG A 49 -25.521 5.315 -16.726 1.00 35.32 H new ATOM 0 HG3 ARG A 49 -23.866 4.864 -16.365 1.00 35.32 H new ATOM 0 HD2 ARG A 49 -24.805 7.526 -17.503 1.00 25.23 H new ATOM 0 HD3 ARG A 49 -24.222 7.240 -15.875 1.00 25.23 H new ATOM 0 HE ARG A 49 -22.109 6.388 -17.439 1.00 21.33 H new ATOM 0 HH11 ARG A 49 -24.048 9.333 -17.266 1.00 32.33 H new ATOM 0 HH12 ARG A 49 -22.726 10.374 -17.806 1.00 32.33 H new ATOM 0 HH21 ARG A 49 -20.416 7.732 -18.133 1.00 22.35 H new ATOM 0 HH22 ARG A 49 -20.679 9.472 -18.295 1.00 22.35 H new ATOM 820 N LYS A 50 -24.079 3.118 -20.820 1.00 15.21 N ATOM 821 CA LYS A 50 -23.892 2.836 -22.238 1.00 74.20 C ATOM 822 C LYS A 50 -24.083 1.350 -22.527 1.00 45.32 C ATOM 823 O LYS A 50 -23.604 0.497 -21.780 1.00 71.00 O ATOM 824 CB LYS A 50 -22.498 3.280 -22.687 1.00 75.32 C ATOM 825 CG LYS A 50 -22.439 4.726 -23.147 1.00 24.14 C ATOM 826 CD LYS A 50 -22.187 5.672 -21.984 1.00 72.34 C ATOM 827 CE LYS A 50 -22.349 7.125 -22.402 1.00 24.12 C ATOM 828 NZ LYS A 50 -21.501 7.460 -23.580 1.00 54.55 N ATOM 0 H LYS A 50 -23.263 2.921 -20.240 1.00 15.21 H new ATOM 0 HA LYS A 50 -24.642 3.395 -22.797 1.00 74.20 H new ATOM 0 HB2 LYS A 50 -21.799 3.141 -21.863 1.00 75.32 H new ATOM 0 HB3 LYS A 50 -22.165 2.635 -23.500 1.00 75.32 H new ATOM 0 HG2 LYS A 50 -21.648 4.841 -23.888 1.00 24.14 H new ATOM 0 HG3 LYS A 50 -23.376 4.991 -23.637 1.00 24.14 H new ATOM 0 HD2 LYS A 50 -22.880 5.446 -21.173 1.00 72.34 H new ATOM 0 HD3 LYS A 50 -21.181 5.514 -21.597 1.00 72.34 H new ATOM 0 HE2 LYS A 50 -23.395 7.320 -22.640 1.00 24.12 H new ATOM 0 HE3 LYS A 50 -22.085 7.775 -21.568 1.00 24.12 H new ATOM 0 HZ1 LYS A 50 -21.520 8.487 -23.741 1.00 54.55 H new ATOM 0 HZ2 LYS A 50 -20.523 7.156 -23.401 1.00 54.55 H new ATOM 0 HZ3 LYS A 50 -21.867 6.971 -24.422 1.00 54.55 H new ATOM 842 N TYR A 51 -24.783 1.050 -23.615 1.00 24.42 N ATOM 843 CA TYR A 51 -25.036 -0.333 -24.002 1.00 72.33 C ATOM 844 C TYR A 51 -24.564 -0.595 -25.429 1.00 50.10 C ATOM 845 O TYR A 51 -24.828 0.195 -26.337 1.00 63.44 O ATOM 846 CB TYR A 51 -26.526 -0.654 -23.880 1.00 34.54 C ATOM 847 CG TYR A 51 -27.104 -0.333 -22.520 1.00 11.04 C ATOM 848 CD1 TYR A 51 -27.462 0.968 -22.184 1.00 64.41 C ATOM 849 CD2 TYR A 51 -27.295 -1.330 -21.570 1.00 42.22 C ATOM 850 CE1 TYR A 51 -27.990 1.266 -20.943 1.00 25.35 C ATOM 851 CE2 TYR A 51 -27.824 -1.041 -20.327 1.00 65.05 C ATOM 852 CZ TYR A 51 -28.169 0.258 -20.018 1.00 23.25 C ATOM 853 OH TYR A 51 -28.696 0.551 -18.781 1.00 23.01 O ATOM 0 H TYR A 51 -25.185 1.745 -24.244 1.00 24.42 H new ATOM 0 HA TYR A 51 -24.475 -0.980 -23.328 1.00 72.33 H new ATOM 0 HB2 TYR A 51 -27.073 -0.095 -24.639 1.00 34.54 H new ATOM 0 HB3 TYR A 51 -26.680 -1.712 -24.091 1.00 34.54 H new ATOM 0 HD1 TYR A 51 -27.325 1.759 -22.906 1.00 64.41 H new ATOM 0 HD2 TYR A 51 -27.025 -2.348 -21.808 1.00 42.22 H new ATOM 0 HE1 TYR A 51 -28.261 2.282 -20.698 1.00 25.35 H new ATOM 0 HE2 TYR A 51 -27.967 -1.828 -19.601 1.00 65.05 H new ATOM 0 HH TYR A 51 -28.148 1.237 -18.346 1.00 23.01 H new ATOM 863 N LEU A 52 -23.865 -1.709 -25.620 1.00 1.31 N ATOM 864 CA LEU A 52 -23.357 -2.077 -26.936 1.00 23.10 C ATOM 865 C LEU A 52 -24.195 -3.192 -27.552 1.00 11.03 C ATOM 866 O LEU A 52 -24.162 -4.334 -27.093 1.00 41.24 O ATOM 867 CB LEU A 52 -21.895 -2.519 -26.834 1.00 51.25 C ATOM 868 CG LEU A 52 -21.027 -2.256 -28.066 1.00 73.52 C ATOM 869 CD1 LEU A 52 -21.653 -2.881 -29.303 1.00 71.13 C ATOM 870 CD2 LEU A 52 -20.824 -0.762 -28.266 1.00 34.00 C ATOM 0 H LEU A 52 -23.637 -2.373 -24.880 1.00 1.31 H new ATOM 0 HA LEU A 52 -23.422 -1.201 -27.581 1.00 23.10 H new ATOM 0 HB2 LEU A 52 -21.442 -2.014 -25.981 1.00 51.25 H new ATOM 0 HB3 LEU A 52 -21.873 -3.588 -26.620 1.00 51.25 H new ATOM 0 HG LEU A 52 -20.052 -2.716 -27.905 1.00 73.52 H new ATOM 0 HD11 LEU A 52 -21.022 -2.684 -30.169 1.00 71.13 H new ATOM 0 HD12 LEU A 52 -21.746 -3.957 -29.159 1.00 71.13 H new ATOM 0 HD13 LEU A 52 -22.641 -2.450 -29.468 1.00 71.13 H new ATOM 0 HD21 LEU A 52 -20.204 -0.594 -29.147 1.00 34.00 H new ATOM 0 HD22 LEU A 52 -21.791 -0.279 -28.405 1.00 34.00 H new ATOM 0 HD23 LEU A 52 -20.331 -0.341 -27.390 1.00 34.00 H new ATOM 882 N VAL A 53 -24.946 -2.853 -28.595 1.00 70.13 N ATOM 883 CA VAL A 53 -25.791 -3.827 -29.277 1.00 12.14 C ATOM 884 C VAL A 53 -25.434 -3.925 -30.756 1.00 4.34 C ATOM 885 O VAL A 53 -25.153 -2.927 -31.419 1.00 64.01 O ATOM 886 CB VAL A 53 -27.283 -3.465 -29.143 1.00 73.35 C ATOM 887 CG1 VAL A 53 -27.899 -4.173 -27.946 1.00 60.12 C ATOM 888 CG2 VAL A 53 -27.458 -1.958 -29.031 1.00 21.24 C ATOM 0 H VAL A 53 -24.987 -1.912 -28.986 1.00 70.13 H new ATOM 0 HA VAL A 53 -25.613 -4.791 -28.799 1.00 12.14 H new ATOM 0 HB VAL A 53 -27.803 -3.802 -30.040 1.00 73.35 H new ATOM 0 HG11 VAL A 53 -28.953 -3.905 -27.868 1.00 60.12 H new ATOM 0 HG12 VAL A 53 -27.807 -5.252 -28.074 1.00 60.12 H new ATOM 0 HG13 VAL A 53 -27.379 -3.870 -27.037 1.00 60.12 H new ATOM 0 HG21 VAL A 53 -28.518 -1.721 -28.937 1.00 21.24 H new ATOM 0 HG22 VAL A 53 -26.925 -1.594 -28.152 1.00 21.24 H new ATOM 0 HG23 VAL A 53 -27.056 -1.478 -29.923 1.00 21.24 H new ATOM 898 N PRO A 54 -25.445 -5.157 -31.286 1.00 24.21 N ATOM 899 CA PRO A 54 -25.125 -5.415 -32.693 1.00 32.41 C ATOM 900 C PRO A 54 -26.202 -4.893 -33.638 1.00 21.42 C ATOM 901 O PRO A 54 -27.363 -4.753 -33.254 1.00 4.53 O ATOM 902 CB PRO A 54 -25.046 -6.943 -32.764 1.00 13.23 C ATOM 903 CG PRO A 54 -25.906 -7.419 -31.644 1.00 3.21 C ATOM 904 CD PRO A 54 -25.771 -6.392 -30.553 1.00 44.21 C ATOM 0 HA PRO A 54 -24.209 -4.912 -33.001 1.00 32.41 H new ATOM 0 HB2 PRO A 54 -25.405 -7.314 -33.724 1.00 13.23 H new ATOM 0 HB3 PRO A 54 -24.020 -7.292 -32.651 1.00 13.23 H new ATOM 0 HG2 PRO A 54 -26.944 -7.516 -31.963 1.00 3.21 H new ATOM 0 HG3 PRO A 54 -25.586 -8.402 -31.297 1.00 3.21 H new ATOM 0 HD2 PRO A 54 -26.694 -6.289 -29.982 1.00 44.21 H new ATOM 0 HD3 PRO A 54 -24.986 -6.658 -29.845 1.00 44.21 H new ATOM 912 N ALA A 55 -25.809 -4.608 -34.874 1.00 43.55 N ATOM 913 CA ALA A 55 -26.742 -4.103 -35.875 1.00 64.11 C ATOM 914 C ALA A 55 -27.840 -5.120 -36.164 1.00 24.21 C ATOM 915 O ALA A 55 -28.870 -4.786 -36.751 1.00 65.12 O ATOM 916 CB ALA A 55 -26.001 -3.746 -37.154 1.00 45.35 C ATOM 0 H ALA A 55 -24.851 -4.718 -35.207 1.00 43.55 H new ATOM 0 HA ALA A 55 -27.212 -3.203 -35.477 1.00 64.11 H new ATOM 0 HB1 ALA A 55 -26.710 -3.371 -37.892 1.00 45.35 H new ATOM 0 HB2 ALA A 55 -25.257 -2.978 -36.941 1.00 45.35 H new ATOM 0 HB3 ALA A 55 -25.504 -4.633 -37.546 1.00 45.35 H new ATOM 922 N ASP A 56 -27.614 -6.361 -35.749 1.00 71.33 N ATOM 923 CA ASP A 56 -28.585 -7.428 -35.963 1.00 30.00 C ATOM 924 C ASP A 56 -29.367 -7.716 -34.685 1.00 41.31 C ATOM 925 O ASP A 56 -29.956 -8.787 -34.533 1.00 4.44 O ATOM 926 CB ASP A 56 -27.882 -8.699 -36.442 1.00 31.43 C ATOM 927 CG ASP A 56 -26.691 -8.401 -37.332 1.00 63.50 C ATOM 928 OD1 ASP A 56 -25.612 -8.081 -36.791 1.00 5.43 O ATOM 929 OD2 ASP A 56 -26.838 -8.491 -38.568 1.00 24.11 O ATOM 0 H ASP A 56 -26.767 -6.653 -35.262 1.00 71.33 H new ATOM 0 HA ASP A 56 -29.286 -7.099 -36.730 1.00 30.00 H new ATOM 0 HB2 ASP A 56 -27.551 -9.275 -35.578 1.00 31.43 H new ATOM 0 HB3 ASP A 56 -28.593 -9.321 -36.987 1.00 31.43 H new ATOM 934 N LEU A 57 -29.369 -6.752 -33.770 1.00 74.42 N ATOM 935 CA LEU A 57 -30.078 -6.902 -32.504 1.00 61.31 C ATOM 936 C LEU A 57 -31.517 -6.409 -32.624 1.00 30.14 C ATOM 937 O LEU A 57 -31.771 -5.319 -33.137 1.00 2.32 O ATOM 938 CB LEU A 57 -29.354 -6.134 -31.398 1.00 15.12 C ATOM 939 CG LEU A 57 -29.461 -6.723 -29.990 1.00 64.23 C ATOM 940 CD1 LEU A 57 -30.902 -6.691 -29.506 1.00 42.21 C ATOM 941 CD2 LEU A 57 -28.919 -8.145 -29.966 1.00 0.25 C ATOM 0 H LEU A 57 -28.888 -5.859 -33.881 1.00 74.42 H new ATOM 0 HA LEU A 57 -30.097 -7.962 -32.249 1.00 61.31 H new ATOM 0 HB2 LEU A 57 -28.299 -6.065 -31.662 1.00 15.12 H new ATOM 0 HB3 LEU A 57 -29.744 -5.116 -31.375 1.00 15.12 H new ATOM 0 HG LEU A 57 -28.860 -6.114 -29.315 1.00 64.23 H new ATOM 0 HD11 LEU A 57 -30.958 -7.114 -28.503 1.00 42.21 H new ATOM 0 HD12 LEU A 57 -31.256 -5.660 -29.486 1.00 42.21 H new ATOM 0 HD13 LEU A 57 -31.526 -7.276 -30.182 1.00 42.21 H new ATOM 0 HD21 LEU A 57 -29.002 -8.549 -28.957 1.00 0.25 H new ATOM 0 HD22 LEU A 57 -29.494 -8.765 -30.654 1.00 0.25 H new ATOM 0 HD23 LEU A 57 -27.872 -8.141 -30.270 1.00 0.25 H new ATOM 953 N THR A 58 -32.456 -7.218 -32.145 1.00 54.12 N ATOM 954 CA THR A 58 -33.869 -6.864 -32.197 1.00 72.45 C ATOM 955 C THR A 58 -34.388 -6.467 -30.820 1.00 4.30 C ATOM 956 O THR A 58 -33.789 -6.806 -29.799 1.00 53.34 O ATOM 957 CB THR A 58 -34.720 -8.029 -32.738 1.00 52.00 C ATOM 958 OG1 THR A 58 -34.794 -9.076 -31.764 1.00 24.42 O ATOM 959 CG2 THR A 58 -34.134 -8.573 -34.032 1.00 52.54 C ATOM 0 H THR A 58 -32.264 -8.123 -31.716 1.00 54.12 H new ATOM 0 HA THR A 58 -33.957 -6.014 -32.874 1.00 72.45 H new ATOM 0 HB THR A 58 -35.722 -7.653 -32.942 1.00 52.00 H new ATOM 0 HG1 THR A 58 -35.338 -9.812 -32.115 1.00 24.42 H new ATOM 0 HG21 THR A 58 -34.752 -9.394 -34.394 1.00 52.54 H new ATOM 0 HG22 THR A 58 -34.108 -7.781 -34.781 1.00 52.54 H new ATOM 0 HG23 THR A 58 -33.122 -8.934 -33.850 1.00 52.54 H new ATOM 967 N VAL A 59 -35.505 -5.747 -30.798 1.00 72.34 N ATOM 968 CA VAL A 59 -36.106 -5.306 -29.545 1.00 41.34 C ATOM 969 C VAL A 59 -36.276 -6.470 -28.577 1.00 55.14 C ATOM 970 O VAL A 59 -35.890 -6.385 -27.412 1.00 14.02 O ATOM 971 CB VAL A 59 -37.477 -4.645 -29.783 1.00 21.15 C ATOM 972 CG1 VAL A 59 -38.145 -4.309 -28.458 1.00 33.54 C ATOM 973 CG2 VAL A 59 -37.326 -3.399 -30.644 1.00 70.40 C ATOM 0 H VAL A 59 -36.012 -5.457 -31.634 1.00 72.34 H new ATOM 0 HA VAL A 59 -35.428 -4.572 -29.109 1.00 41.34 H new ATOM 0 HB VAL A 59 -38.114 -5.352 -30.315 1.00 21.15 H new ATOM 0 HG11 VAL A 59 -39.112 -3.843 -28.646 1.00 33.54 H new ATOM 0 HG12 VAL A 59 -38.289 -5.222 -27.881 1.00 33.54 H new ATOM 0 HG13 VAL A 59 -37.514 -3.621 -27.896 1.00 33.54 H new ATOM 0 HG21 VAL A 59 -38.304 -2.945 -30.802 1.00 70.40 H new ATOM 0 HG22 VAL A 59 -36.672 -2.686 -30.141 1.00 70.40 H new ATOM 0 HG23 VAL A 59 -36.893 -3.672 -31.606 1.00 70.40 H new ATOM 983 N GLY A 60 -36.858 -7.561 -29.067 1.00 61.44 N ATOM 984 CA GLY A 60 -37.069 -8.729 -28.232 1.00 21.10 C ATOM 985 C GLY A 60 -35.769 -9.319 -27.721 1.00 44.35 C ATOM 986 O GLY A 60 -35.656 -9.659 -26.544 1.00 2.55 O ATOM 0 H GLY A 60 -37.187 -7.656 -30.028 1.00 61.44 H new ATOM 0 HA2 GLY A 60 -37.699 -8.457 -27.385 1.00 21.10 H new ATOM 0 HA3 GLY A 60 -37.609 -9.486 -28.801 1.00 21.10 H new ATOM 990 N GLN A 61 -34.788 -9.442 -28.608 1.00 65.02 N ATOM 991 CA GLN A 61 -33.491 -9.998 -28.241 1.00 12.24 C ATOM 992 C GLN A 61 -32.858 -9.197 -27.107 1.00 32.41 C ATOM 993 O GLN A 61 -32.207 -9.758 -26.225 1.00 64.03 O ATOM 994 CB GLN A 61 -32.557 -10.015 -29.452 1.00 1.23 C ATOM 995 CG GLN A 61 -31.936 -11.376 -29.722 1.00 74.52 C ATOM 996 CD GLN A 61 -30.936 -11.345 -30.861 1.00 71.24 C ATOM 997 OE1 GLN A 61 -29.847 -10.786 -30.732 1.00 32.35 O ATOM 998 NE2 GLN A 61 -31.302 -11.948 -31.987 1.00 34.44 N ATOM 0 H GLN A 61 -34.866 -9.164 -29.586 1.00 65.02 H new ATOM 0 HA GLN A 61 -33.646 -11.021 -27.898 1.00 12.24 H new ATOM 0 HB2 GLN A 61 -33.113 -9.697 -30.334 1.00 1.23 H new ATOM 0 HB3 GLN A 61 -31.761 -9.286 -29.297 1.00 1.23 H new ATOM 0 HG2 GLN A 61 -31.441 -11.731 -28.818 1.00 74.52 H new ATOM 0 HG3 GLN A 61 -32.725 -12.091 -29.955 1.00 74.52 H new ATOM 0 HE21 GLN A 61 -32.215 -12.399 -32.050 1.00 34.44 H new ATOM 0 HE22 GLN A 61 -30.670 -11.960 -32.788 1.00 34.44 H new ATOM 1007 N PHE A 62 -33.053 -7.883 -27.136 1.00 40.35 N ATOM 1008 CA PHE A 62 -32.501 -7.005 -26.112 1.00 45.01 C ATOM 1009 C PHE A 62 -33.297 -7.114 -24.815 1.00 25.10 C ATOM 1010 O PHE A 62 -32.735 -7.048 -23.721 1.00 23.41 O ATOM 1011 CB PHE A 62 -32.497 -5.555 -26.601 1.00 41.32 C ATOM 1012 CG PHE A 62 -31.570 -4.664 -25.825 1.00 44.32 C ATOM 1013 CD1 PHE A 62 -30.263 -5.051 -25.573 1.00 14.43 C ATOM 1014 CD2 PHE A 62 -32.005 -3.438 -25.348 1.00 42.30 C ATOM 1015 CE1 PHE A 62 -29.408 -4.232 -24.859 1.00 54.01 C ATOM 1016 CE2 PHE A 62 -31.154 -2.614 -24.634 1.00 74.03 C ATOM 1017 CZ PHE A 62 -29.855 -3.013 -24.389 1.00 30.05 C ATOM 0 H PHE A 62 -33.590 -7.403 -27.858 1.00 40.35 H new ATOM 0 HA PHE A 62 -31.475 -7.318 -25.915 1.00 45.01 H new ATOM 0 HB2 PHE A 62 -32.211 -5.535 -27.653 1.00 41.32 H new ATOM 0 HB3 PHE A 62 -33.509 -5.156 -26.538 1.00 41.32 H new ATOM 0 HD1 PHE A 62 -29.908 -6.003 -25.939 1.00 14.43 H new ATOM 0 HD2 PHE A 62 -33.021 -3.122 -25.536 1.00 42.30 H new ATOM 0 HE1 PHE A 62 -28.392 -4.545 -24.669 1.00 54.01 H new ATOM 0 HE2 PHE A 62 -31.505 -1.660 -24.269 1.00 74.03 H new ATOM 0 HZ PHE A 62 -29.189 -2.372 -23.830 1.00 30.05 H new ATOM 1027 N VAL A 63 -34.608 -7.280 -24.945 1.00 32.52 N ATOM 1028 CA VAL A 63 -35.482 -7.399 -23.784 1.00 34.40 C ATOM 1029 C VAL A 63 -35.184 -8.672 -22.999 1.00 50.41 C ATOM 1030 O VAL A 63 -35.262 -8.688 -21.770 1.00 71.43 O ATOM 1031 CB VAL A 63 -36.967 -7.400 -24.196 1.00 45.43 C ATOM 1032 CG1 VAL A 63 -37.859 -7.604 -22.982 1.00 71.41 C ATOM 1033 CG2 VAL A 63 -37.320 -6.106 -24.916 1.00 63.43 C ATOM 0 H VAL A 63 -35.089 -7.335 -25.843 1.00 32.52 H new ATOM 0 HA VAL A 63 -35.288 -6.532 -23.153 1.00 34.40 H new ATOM 0 HB VAL A 63 -37.135 -8.230 -24.883 1.00 45.43 H new ATOM 0 HG11 VAL A 63 -38.904 -7.602 -23.293 1.00 71.41 H new ATOM 0 HG12 VAL A 63 -37.622 -8.559 -22.513 1.00 71.41 H new ATOM 0 HG13 VAL A 63 -37.692 -6.798 -22.268 1.00 71.41 H new ATOM 0 HG21 VAL A 63 -38.372 -6.123 -25.200 1.00 63.43 H new ATOM 0 HG22 VAL A 63 -37.137 -5.260 -24.254 1.00 63.43 H new ATOM 0 HG23 VAL A 63 -36.704 -6.007 -25.810 1.00 63.43 H new ATOM 1043 N TYR A 64 -34.842 -9.736 -23.716 1.00 62.10 N ATOM 1044 CA TYR A 64 -34.534 -11.014 -23.088 1.00 23.53 C ATOM 1045 C TYR A 64 -33.416 -10.861 -22.061 1.00 23.30 C ATOM 1046 O TYR A 64 -33.523 -11.341 -20.932 1.00 0.11 O ATOM 1047 CB TYR A 64 -34.131 -12.043 -24.146 1.00 31.21 C ATOM 1048 CG TYR A 64 -35.303 -12.794 -24.737 1.00 34.24 C ATOM 1049 CD1 TYR A 64 -36.169 -13.520 -23.927 1.00 4.34 C ATOM 1050 CD2 TYR A 64 -35.545 -12.779 -26.104 1.00 51.32 C ATOM 1051 CE1 TYR A 64 -37.240 -14.207 -24.462 1.00 11.24 C ATOM 1052 CE2 TYR A 64 -36.616 -13.463 -26.648 1.00 45.24 C ATOM 1053 CZ TYR A 64 -37.460 -14.176 -25.823 1.00 44.30 C ATOM 1054 OH TYR A 64 -38.526 -14.858 -26.361 1.00 34.41 O ATOM 0 H TYR A 64 -34.771 -9.738 -24.734 1.00 62.10 H new ATOM 0 HA TYR A 64 -35.430 -11.362 -22.575 1.00 23.53 H new ATOM 0 HB2 TYR A 64 -33.593 -11.536 -24.947 1.00 31.21 H new ATOM 0 HB3 TYR A 64 -33.439 -12.758 -23.701 1.00 31.21 H new ATOM 0 HD1 TYR A 64 -36.001 -13.547 -22.861 1.00 4.34 H new ATOM 0 HD2 TYR A 64 -34.885 -12.223 -26.754 1.00 51.32 H new ATOM 0 HE1 TYR A 64 -37.902 -14.766 -23.818 1.00 11.24 H new ATOM 0 HE2 TYR A 64 -36.791 -13.439 -27.713 1.00 45.24 H new ATOM 0 HH TYR A 64 -38.538 -14.732 -27.333 1.00 34.41 H new ATOM 1064 N VAL A 65 -32.341 -10.188 -22.462 1.00 11.01 N ATOM 1065 CA VAL A 65 -31.203 -9.968 -21.577 1.00 74.03 C ATOM 1066 C VAL A 65 -31.505 -8.880 -20.553 1.00 3.31 C ATOM 1067 O VAL A 65 -31.033 -8.935 -19.417 1.00 35.33 O ATOM 1068 CB VAL A 65 -29.943 -9.575 -22.372 1.00 34.23 C ATOM 1069 CG1 VAL A 65 -29.488 -10.728 -23.255 1.00 54.41 C ATOM 1070 CG2 VAL A 65 -30.204 -8.327 -23.201 1.00 70.23 C ATOM 0 H VAL A 65 -32.235 -9.786 -23.393 1.00 11.01 H new ATOM 0 HA VAL A 65 -31.018 -10.909 -21.058 1.00 74.03 H new ATOM 0 HB VAL A 65 -29.143 -9.352 -21.666 1.00 34.23 H new ATOM 0 HG11 VAL A 65 -28.597 -10.432 -23.809 1.00 54.41 H new ATOM 0 HG12 VAL A 65 -29.258 -11.594 -22.634 1.00 54.41 H new ATOM 0 HG13 VAL A 65 -30.282 -10.985 -23.956 1.00 54.41 H new ATOM 0 HG21 VAL A 65 -29.303 -8.064 -23.756 1.00 70.23 H new ATOM 0 HG22 VAL A 65 -31.018 -8.518 -23.900 1.00 70.23 H new ATOM 0 HG23 VAL A 65 -30.478 -7.503 -22.542 1.00 70.23 H new ATOM 1080 N ILE A 66 -32.292 -7.891 -20.963 1.00 60.32 N ATOM 1081 CA ILE A 66 -32.658 -6.791 -20.080 1.00 40.35 C ATOM 1082 C ILE A 66 -33.205 -7.308 -18.754 1.00 3.30 C ATOM 1083 O ILE A 66 -32.799 -6.853 -17.684 1.00 64.41 O ATOM 1084 CB ILE A 66 -33.708 -5.872 -20.732 1.00 41.55 C ATOM 1085 CG1 ILE A 66 -33.022 -4.717 -21.466 1.00 62.22 C ATOM 1086 CG2 ILE A 66 -34.672 -5.340 -19.682 1.00 25.12 C ATOM 1087 CD1 ILE A 66 -32.449 -3.667 -20.540 1.00 71.41 C ATOM 0 H ILE A 66 -32.688 -7.829 -21.901 1.00 60.32 H new ATOM 0 HA ILE A 66 -31.749 -6.218 -19.896 1.00 40.35 H new ATOM 0 HB ILE A 66 -34.276 -6.453 -21.458 1.00 41.55 H new ATOM 0 HG12 ILE A 66 -32.221 -5.117 -22.088 1.00 62.22 H new ATOM 0 HG13 ILE A 66 -33.741 -4.245 -22.136 1.00 62.22 H new ATOM 0 HG21 ILE A 66 -35.408 -4.692 -20.159 1.00 25.12 H new ATOM 0 HG22 ILE A 66 -35.181 -6.174 -19.200 1.00 25.12 H new ATOM 0 HG23 ILE A 66 -34.118 -4.772 -18.934 1.00 25.12 H new ATOM 0 HD11 ILE A 66 -31.979 -2.880 -21.129 1.00 71.41 H new ATOM 0 HD12 ILE A 66 -33.249 -3.239 -19.936 1.00 71.41 H new ATOM 0 HD13 ILE A 66 -31.706 -4.124 -19.887 1.00 71.41 H new ATOM 1099 N ARG A 67 -34.127 -8.260 -18.832 1.00 75.45 N ATOM 1100 CA ARG A 67 -34.730 -8.841 -17.638 1.00 63.13 C ATOM 1101 C ARG A 67 -33.657 -9.370 -16.691 1.00 21.14 C ATOM 1102 O ARG A 67 -33.798 -9.292 -15.470 1.00 50.34 O ATOM 1103 CB ARG A 67 -35.688 -9.970 -18.021 1.00 15.41 C ATOM 1104 CG ARG A 67 -36.207 -10.759 -16.830 1.00 73.41 C ATOM 1105 CD ARG A 67 -37.328 -11.703 -17.234 1.00 35.53 C ATOM 1106 NE ARG A 67 -36.866 -12.742 -18.151 1.00 71.03 N ATOM 1107 CZ ARG A 67 -37.675 -13.612 -18.745 1.00 42.44 C ATOM 1108 NH1 ARG A 67 -38.981 -13.568 -18.519 1.00 72.53 N ATOM 1109 NH2 ARG A 67 -37.179 -14.526 -19.568 1.00 62.24 N ATOM 0 H ARG A 67 -34.474 -8.646 -19.710 1.00 75.45 H new ATOM 0 HA ARG A 67 -35.289 -8.058 -17.126 1.00 63.13 H new ATOM 0 HB2 ARG A 67 -36.534 -9.549 -18.563 1.00 15.41 H new ATOM 0 HB3 ARG A 67 -35.179 -10.651 -18.703 1.00 15.41 H new ATOM 0 HG2 ARG A 67 -35.391 -11.330 -16.387 1.00 73.41 H new ATOM 0 HG3 ARG A 67 -36.567 -10.071 -16.065 1.00 73.41 H new ATOM 0 HD2 ARG A 67 -37.749 -12.168 -16.343 1.00 35.53 H new ATOM 0 HD3 ARG A 67 -38.129 -11.134 -17.705 1.00 35.53 H new ATOM 0 HE ARG A 67 -35.867 -12.803 -18.346 1.00 71.03 H new ATOM 0 HH11 ARG A 67 -39.366 -12.865 -17.888 1.00 72.53 H new ATOM 0 HH12 ARG A 67 -39.601 -14.237 -18.976 1.00 72.53 H new ATOM 0 HH21 ARG A 67 -36.175 -14.561 -19.745 1.00 62.24 H new ATOM 0 HH22 ARG A 67 -37.801 -15.194 -20.024 1.00 62.24 H new ATOM 1123 N LYS A 68 -32.585 -9.910 -17.261 1.00 51.42 N ATOM 1124 CA LYS A 68 -31.488 -10.451 -16.468 1.00 64.43 C ATOM 1125 C LYS A 68 -30.668 -9.332 -15.836 1.00 42.11 C ATOM 1126 O LYS A 68 -30.236 -9.436 -14.688 1.00 72.50 O ATOM 1127 CB LYS A 68 -30.586 -11.328 -17.341 1.00 11.11 C ATOM 1128 CG LYS A 68 -29.582 -12.147 -16.548 1.00 1.32 C ATOM 1129 CD LYS A 68 -30.273 -13.152 -15.643 1.00 33.51 C ATOM 1130 CE LYS A 68 -29.296 -14.194 -15.119 1.00 51.10 C ATOM 1131 NZ LYS A 68 -29.017 -15.251 -16.130 1.00 52.44 N ATOM 0 H LYS A 68 -32.453 -9.985 -18.270 1.00 51.42 H new ATOM 0 HA LYS A 68 -31.915 -11.058 -15.670 1.00 64.43 H new ATOM 0 HB2 LYS A 68 -31.208 -12.002 -17.929 1.00 11.11 H new ATOM 0 HB3 LYS A 68 -30.049 -10.694 -18.046 1.00 11.11 H new ATOM 0 HG2 LYS A 68 -28.916 -12.671 -17.234 1.00 1.32 H new ATOM 0 HG3 LYS A 68 -28.962 -11.482 -15.948 1.00 1.32 H new ATOM 0 HD2 LYS A 68 -30.735 -12.631 -14.805 1.00 33.51 H new ATOM 0 HD3 LYS A 68 -31.075 -13.647 -16.192 1.00 33.51 H new ATOM 0 HE2 LYS A 68 -28.363 -13.707 -14.836 1.00 51.10 H new ATOM 0 HE3 LYS A 68 -29.703 -14.652 -14.217 1.00 51.10 H new ATOM 0 HZ1 LYS A 68 -28.347 -15.941 -15.735 1.00 52.44 H new ATOM 0 HZ2 LYS A 68 -29.903 -15.733 -16.382 1.00 52.44 H new ATOM 0 HZ3 LYS A 68 -28.605 -14.817 -16.981 1.00 52.44 H new ATOM 1145 N ARG A 69 -30.458 -8.259 -16.593 1.00 25.42 N ATOM 1146 CA ARG A 69 -29.690 -7.120 -16.106 1.00 3.23 C ATOM 1147 C ARG A 69 -30.298 -6.563 -14.822 1.00 70.31 C ATOM 1148 O ARG A 69 -29.580 -6.210 -13.886 1.00 3.11 O ATOM 1149 CB ARG A 69 -29.632 -6.023 -17.172 1.00 34.31 C ATOM 1150 CG ARG A 69 -29.139 -6.514 -18.524 1.00 11.45 C ATOM 1151 CD ARG A 69 -28.282 -5.467 -19.218 1.00 74.24 C ATOM 1152 NE ARG A 69 -26.941 -5.392 -18.648 1.00 23.23 N ATOM 1153 CZ ARG A 69 -25.917 -4.797 -19.250 1.00 61.25 C ATOM 1154 NH1 ARG A 69 -26.083 -4.227 -20.436 1.00 74.01 N ATOM 1155 NH2 ARG A 69 -24.726 -4.771 -18.667 1.00 64.12 N ATOM 0 H ARG A 69 -30.809 -8.155 -17.545 1.00 25.42 H new ATOM 0 HA ARG A 69 -28.678 -7.462 -15.890 1.00 3.23 H new ATOM 0 HB2 ARG A 69 -30.626 -5.591 -17.292 1.00 34.31 H new ATOM 0 HB3 ARG A 69 -28.977 -5.224 -16.824 1.00 34.31 H new ATOM 0 HG2 ARG A 69 -28.562 -7.429 -18.392 1.00 11.45 H new ATOM 0 HG3 ARG A 69 -29.992 -6.764 -19.155 1.00 11.45 H new ATOM 0 HD2 ARG A 69 -28.212 -5.702 -20.280 1.00 74.24 H new ATOM 0 HD3 ARG A 69 -28.765 -4.493 -19.138 1.00 74.24 H new ATOM 0 HE ARG A 69 -26.781 -5.820 -17.736 1.00 23.23 H new ATOM 0 HH11 ARG A 69 -26.998 -4.245 -20.887 1.00 74.01 H new ATOM 0 HH12 ARG A 69 -25.296 -3.771 -20.897 1.00 74.01 H new ATOM 0 HH21 ARG A 69 -24.595 -5.208 -17.755 1.00 64.12 H new ATOM 0 HH22 ARG A 69 -23.941 -4.314 -19.131 1.00 64.12 H new ATOM 1169 N ILE A 70 -31.624 -6.488 -14.785 1.00 23.11 N ATOM 1170 CA ILE A 70 -32.327 -5.975 -13.616 1.00 13.32 C ATOM 1171 C ILE A 70 -32.819 -7.112 -12.727 1.00 65.44 C ATOM 1172 O ILE A 70 -33.420 -6.880 -11.680 1.00 13.02 O ATOM 1173 CB ILE A 70 -33.527 -5.099 -14.021 1.00 35.01 C ATOM 1174 CG1 ILE A 70 -33.140 -4.163 -15.167 1.00 53.02 C ATOM 1175 CG2 ILE A 70 -34.030 -4.303 -12.825 1.00 61.03 C ATOM 1176 CD1 ILE A 70 -34.237 -3.194 -15.552 1.00 43.43 C ATOM 0 H ILE A 70 -32.233 -6.776 -15.551 1.00 23.11 H new ATOM 0 HA ILE A 70 -31.614 -5.366 -13.061 1.00 13.32 H new ATOM 0 HB ILE A 70 -34.332 -5.748 -14.365 1.00 35.01 H new ATOM 0 HG12 ILE A 70 -32.252 -3.599 -14.881 1.00 53.02 H new ATOM 0 HG13 ILE A 70 -32.871 -4.760 -16.038 1.00 53.02 H new ATOM 0 HG21 ILE A 70 -34.878 -3.689 -13.127 1.00 61.03 H new ATOM 0 HG22 ILE A 70 -34.341 -4.988 -12.037 1.00 61.03 H new ATOM 0 HG23 ILE A 70 -33.231 -3.661 -12.453 1.00 61.03 H new ATOM 0 HD11 ILE A 70 -33.893 -2.562 -16.370 1.00 43.43 H new ATOM 0 HD12 ILE A 70 -35.119 -3.750 -15.869 1.00 43.43 H new ATOM 0 HD13 ILE A 70 -34.490 -2.571 -14.694 1.00 43.43 H new ATOM 1188 N MET A 71 -32.557 -8.344 -13.154 1.00 2.14 N ATOM 1189 CA MET A 71 -32.971 -9.518 -12.394 1.00 64.42 C ATOM 1190 C MET A 71 -34.462 -9.467 -12.083 1.00 33.43 C ATOM 1191 O MET A 71 -34.922 -10.050 -11.099 1.00 65.23 O ATOM 1192 CB MET A 71 -32.168 -9.621 -11.095 1.00 55.12 C ATOM 1193 CG MET A 71 -30.709 -9.226 -11.249 1.00 3.25 C ATOM 1194 SD MET A 71 -29.658 -9.938 -9.970 1.00 12.24 S ATOM 1195 CE MET A 71 -29.288 -11.537 -10.687 1.00 1.45 C ATOM 0 H MET A 71 -32.061 -8.554 -14.020 1.00 2.14 H new ATOM 0 HA MET A 71 -32.776 -10.401 -13.003 1.00 64.42 H new ATOM 0 HB2 MET A 71 -32.630 -8.985 -10.340 1.00 55.12 H new ATOM 0 HB3 MET A 71 -32.221 -10.645 -10.725 1.00 55.12 H new ATOM 0 HG2 MET A 71 -30.351 -9.546 -12.228 1.00 3.25 H new ATOM 0 HG3 MET A 71 -30.626 -8.140 -11.219 1.00 3.25 H new ATOM 0 HE1 MET A 71 -28.643 -12.099 -10.011 1.00 1.45 H new ATOM 0 HE2 MET A 71 -30.215 -12.088 -10.846 1.00 1.45 H new ATOM 0 HE3 MET A 71 -28.780 -11.399 -11.641 1.00 1.45 H new ATOM 1205 N LEU A 72 -35.214 -8.766 -12.923 1.00 55.15 N ATOM 1206 CA LEU A 72 -36.655 -8.638 -12.738 1.00 15.12 C ATOM 1207 C LEU A 72 -37.334 -10.004 -12.786 1.00 43.10 C ATOM 1208 O LEU A 72 -37.019 -10.851 -13.622 1.00 21.30 O ATOM 1209 CB LEU A 72 -37.249 -7.723 -13.810 1.00 21.13 C ATOM 1210 CG LEU A 72 -38.400 -6.821 -13.360 1.00 33.40 C ATOM 1211 CD1 LEU A 72 -37.969 -5.948 -12.193 1.00 14.15 C ATOM 1212 CD2 LEU A 72 -38.889 -5.963 -14.518 1.00 73.41 C ATOM 0 H LEU A 72 -34.849 -8.277 -13.740 1.00 55.15 H new ATOM 0 HA LEU A 72 -36.832 -8.199 -11.756 1.00 15.12 H new ATOM 0 HB2 LEU A 72 -36.452 -7.092 -14.203 1.00 21.13 H new ATOM 0 HB3 LEU A 72 -37.601 -8.343 -14.634 1.00 21.13 H new ATOM 0 HG LEU A 72 -39.224 -7.453 -13.029 1.00 33.40 H new ATOM 0 HD11 LEU A 72 -38.801 -5.313 -11.887 1.00 14.15 H new ATOM 0 HD12 LEU A 72 -37.668 -6.580 -11.358 1.00 14.15 H new ATOM 0 HD13 LEU A 72 -37.129 -5.324 -12.497 1.00 14.15 H new ATOM 0 HD21 LEU A 72 -39.708 -5.328 -14.180 1.00 73.41 H new ATOM 0 HD22 LEU A 72 -38.071 -5.339 -14.879 1.00 73.41 H new ATOM 0 HD23 LEU A 72 -39.239 -6.606 -15.325 1.00 73.41 H new ATOM 1224 N PRO A 73 -38.290 -10.223 -11.871 1.00 5.54 N ATOM 1225 CA PRO A 73 -39.035 -11.483 -11.790 1.00 43.21 C ATOM 1226 C PRO A 73 -39.984 -11.671 -12.969 1.00 43.43 C ATOM 1227 O PRO A 73 -40.268 -10.740 -13.723 1.00 74.10 O ATOM 1228 CB PRO A 73 -39.823 -11.345 -10.486 1.00 74.21 C ATOM 1229 CG PRO A 73 -39.966 -9.877 -10.282 1.00 42.52 C ATOM 1230 CD PRO A 73 -38.716 -9.257 -10.844 1.00 73.54 C ATOM 0 HA PRO A 73 -38.375 -12.350 -11.815 1.00 43.21 H new ATOM 0 HB2 PRO A 73 -40.796 -11.831 -10.558 1.00 74.21 H new ATOM 0 HB3 PRO A 73 -39.295 -11.811 -9.654 1.00 74.21 H new ATOM 0 HG2 PRO A 73 -40.852 -9.497 -10.790 1.00 42.52 H new ATOM 0 HG3 PRO A 73 -40.078 -9.639 -9.224 1.00 42.52 H new ATOM 0 HD2 PRO A 73 -38.912 -8.274 -11.273 1.00 73.54 H new ATOM 0 HD3 PRO A 73 -37.953 -9.123 -10.077 1.00 73.54 H new ATOM 1238 N PRO A 74 -40.486 -12.904 -13.134 1.00 52.35 N ATOM 1239 CA PRO A 74 -41.412 -13.242 -14.220 1.00 31.14 C ATOM 1240 C PRO A 74 -42.783 -12.602 -14.033 1.00 73.04 C ATOM 1241 O PRO A 74 -43.483 -12.321 -15.004 1.00 50.11 O ATOM 1242 CB PRO A 74 -41.517 -14.767 -14.133 1.00 31.01 C ATOM 1243 CG PRO A 74 -41.196 -15.089 -12.714 1.00 63.12 C ATOM 1244 CD PRO A 74 -40.189 -14.061 -12.274 1.00 73.14 C ATOM 0 HA PRO A 74 -41.059 -12.879 -15.185 1.00 31.14 H new ATOM 0 HB2 PRO A 74 -42.516 -15.111 -14.401 1.00 31.01 H new ATOM 0 HB3 PRO A 74 -40.820 -15.251 -14.816 1.00 31.01 H new ATOM 0 HG2 PRO A 74 -42.091 -15.050 -12.093 1.00 63.12 H new ATOM 0 HG3 PRO A 74 -40.790 -16.097 -12.625 1.00 63.12 H new ATOM 0 HD2 PRO A 74 -40.300 -13.816 -11.218 1.00 73.14 H new ATOM 0 HD3 PRO A 74 -39.167 -14.414 -12.414 1.00 73.14 H new ATOM 1252 N GLU A 75 -43.159 -12.375 -12.778 1.00 75.22 N ATOM 1253 CA GLU A 75 -44.448 -11.768 -12.466 1.00 62.11 C ATOM 1254 C GLU A 75 -44.647 -10.478 -13.255 1.00 44.44 C ATOM 1255 O GLU A 75 -45.773 -10.109 -13.592 1.00 20.02 O ATOM 1256 CB GLU A 75 -44.552 -11.483 -10.966 1.00 43.44 C ATOM 1257 CG GLU A 75 -44.459 -12.728 -10.101 1.00 63.33 C ATOM 1258 CD GLU A 75 -43.051 -12.986 -9.599 1.00 72.44 C ATOM 1259 OE1 GLU A 75 -42.576 -12.212 -8.742 1.00 53.25 O ATOM 1260 OE2 GLU A 75 -42.426 -13.962 -10.064 1.00 2.43 O ATOM 0 H GLU A 75 -42.590 -12.602 -11.962 1.00 75.22 H new ATOM 0 HA GLU A 75 -45.231 -12.471 -12.750 1.00 62.11 H new ATOM 0 HB2 GLU A 75 -43.758 -10.793 -10.680 1.00 43.44 H new ATOM 0 HB3 GLU A 75 -45.499 -10.981 -10.765 1.00 43.44 H new ATOM 0 HG2 GLU A 75 -45.131 -12.625 -9.249 1.00 63.33 H new ATOM 0 HG3 GLU A 75 -44.800 -13.590 -10.674 1.00 63.33 H new ATOM 1267 N LYS A 76 -43.546 -9.795 -13.549 1.00 52.41 N ATOM 1268 CA LYS A 76 -43.597 -8.546 -14.300 1.00 13.51 C ATOM 1269 C LYS A 76 -42.619 -8.574 -15.470 1.00 40.00 C ATOM 1270 O LYS A 76 -41.902 -9.554 -15.668 1.00 72.44 O ATOM 1271 CB LYS A 76 -43.279 -7.362 -13.383 1.00 73.33 C ATOM 1272 CG LYS A 76 -44.209 -7.252 -12.187 1.00 72.22 C ATOM 1273 CD LYS A 76 -45.255 -6.169 -12.392 1.00 30.21 C ATOM 1274 CE LYS A 76 -46.441 -6.357 -11.459 1.00 52.33 C ATOM 1275 NZ LYS A 76 -47.469 -5.294 -11.647 1.00 65.22 N ATOM 0 H LYS A 76 -42.606 -10.086 -13.278 1.00 52.41 H new ATOM 0 HA LYS A 76 -44.606 -8.430 -14.696 1.00 13.51 H new ATOM 0 HB2 LYS A 76 -42.253 -7.454 -13.027 1.00 73.33 H new ATOM 0 HB3 LYS A 76 -43.334 -6.440 -13.962 1.00 73.33 H new ATOM 0 HG2 LYS A 76 -44.703 -8.209 -12.020 1.00 72.22 H new ATOM 0 HG3 LYS A 76 -43.627 -7.033 -11.292 1.00 72.22 H new ATOM 0 HD2 LYS A 76 -44.806 -5.191 -12.219 1.00 30.21 H new ATOM 0 HD3 LYS A 76 -45.598 -6.184 -13.426 1.00 30.21 H new ATOM 0 HE2 LYS A 76 -46.892 -7.333 -11.637 1.00 52.33 H new ATOM 0 HE3 LYS A 76 -46.095 -6.349 -10.425 1.00 52.33 H new ATOM 0 HZ1 LYS A 76 -48.261 -5.457 -10.993 1.00 65.22 H new ATOM 0 HZ2 LYS A 76 -47.046 -4.364 -11.453 1.00 65.22 H new ATOM 0 HZ3 LYS A 76 -47.818 -5.318 -12.626 1.00 65.22 H new ATOM 1289 N ALA A 77 -42.593 -7.491 -16.240 1.00 72.04 N ATOM 1290 CA ALA A 77 -41.701 -7.391 -17.387 1.00 43.35 C ATOM 1291 C ALA A 77 -41.458 -5.934 -17.769 1.00 51.12 C ATOM 1292 O ALA A 77 -42.162 -5.036 -17.306 1.00 74.23 O ATOM 1293 CB ALA A 77 -42.272 -8.160 -18.570 1.00 4.25 C ATOM 0 H ALA A 77 -43.180 -6.671 -16.089 1.00 72.04 H new ATOM 0 HA ALA A 77 -40.743 -7.832 -17.109 1.00 43.35 H new ATOM 0 HB1 ALA A 77 -41.594 -8.076 -19.420 1.00 4.25 H new ATOM 0 HB2 ALA A 77 -42.387 -9.210 -18.300 1.00 4.25 H new ATOM 0 HB3 ALA A 77 -43.244 -7.746 -18.839 1.00 4.25 H new ATOM 1299 N ILE A 78 -40.458 -5.707 -18.614 1.00 51.14 N ATOM 1300 CA ILE A 78 -40.123 -4.360 -19.057 1.00 13.32 C ATOM 1301 C ILE A 78 -39.767 -4.340 -20.540 1.00 32.21 C ATOM 1302 O ILE A 78 -39.536 -5.386 -21.147 1.00 23.20 O ATOM 1303 CB ILE A 78 -38.948 -3.777 -18.250 1.00 53.51 C ATOM 1304 CG1 ILE A 78 -37.824 -4.808 -18.128 1.00 75.30 C ATOM 1305 CG2 ILE A 78 -39.419 -3.333 -16.874 1.00 1.42 C ATOM 1306 CD1 ILE A 78 -36.616 -4.299 -17.374 1.00 73.12 C ATOM 0 H ILE A 78 -39.866 -6.439 -19.006 1.00 51.14 H new ATOM 0 HA ILE A 78 -41.007 -3.745 -18.891 1.00 13.32 H new ATOM 0 HB ILE A 78 -38.561 -2.906 -18.778 1.00 53.51 H new ATOM 0 HG12 ILE A 78 -38.209 -5.695 -17.625 1.00 75.30 H new ATOM 0 HG13 ILE A 78 -37.515 -5.117 -19.127 1.00 75.30 H new ATOM 0 HG21 ILE A 78 -38.577 -2.923 -16.316 1.00 1.42 H new ATOM 0 HG22 ILE A 78 -40.189 -2.569 -16.982 1.00 1.42 H new ATOM 0 HG23 ILE A 78 -39.829 -4.188 -16.336 1.00 1.42 H new ATOM 0 HD11 ILE A 78 -35.860 -5.083 -17.327 1.00 73.12 H new ATOM 0 HD12 ILE A 78 -36.206 -3.430 -17.888 1.00 73.12 H new ATOM 0 HD13 ILE A 78 -36.910 -4.017 -16.363 1.00 73.12 H new ATOM 1318 N PHE A 79 -39.724 -3.144 -21.117 1.00 74.21 N ATOM 1319 CA PHE A 79 -39.395 -2.988 -22.529 1.00 61.32 C ATOM 1320 C PHE A 79 -38.651 -1.679 -22.772 1.00 63.32 C ATOM 1321 O PHE A 79 -38.478 -0.872 -21.858 1.00 60.05 O ATOM 1322 CB PHE A 79 -40.667 -3.030 -23.379 1.00 73.01 C ATOM 1323 CG PHE A 79 -41.918 -2.740 -22.599 1.00 44.31 C ATOM 1324 CD1 PHE A 79 -42.074 -1.531 -21.940 1.00 55.24 C ATOM 1325 CD2 PHE A 79 -42.937 -3.676 -22.526 1.00 54.45 C ATOM 1326 CE1 PHE A 79 -43.225 -1.260 -21.224 1.00 1.02 C ATOM 1327 CE2 PHE A 79 -44.090 -3.410 -21.810 1.00 64.32 C ATOM 1328 CZ PHE A 79 -44.234 -2.201 -21.158 1.00 23.51 C ATOM 0 H PHE A 79 -39.913 -2.269 -20.629 1.00 74.21 H new ATOM 0 HA PHE A 79 -38.746 -3.814 -22.818 1.00 61.32 H new ATOM 0 HB2 PHE A 79 -40.577 -2.306 -24.189 1.00 73.01 H new ATOM 0 HB3 PHE A 79 -40.755 -4.014 -23.839 1.00 73.01 H new ATOM 0 HD1 PHE A 79 -41.288 -0.792 -21.986 1.00 55.24 H new ATOM 0 HD2 PHE A 79 -42.830 -4.623 -23.034 1.00 54.45 H new ATOM 0 HE1 PHE A 79 -43.335 -0.313 -20.717 1.00 1.02 H new ATOM 0 HE2 PHE A 79 -44.877 -4.147 -21.761 1.00 64.32 H new ATOM 0 HZ PHE A 79 -45.133 -1.992 -20.598 1.00 23.51 H new ATOM 1338 N ILE A 80 -38.210 -1.477 -24.010 1.00 61.41 N ATOM 1339 CA ILE A 80 -37.485 -0.267 -24.374 1.00 2.03 C ATOM 1340 C ILE A 80 -38.367 0.684 -25.174 1.00 52.22 C ATOM 1341 O ILE A 80 -39.179 0.254 -25.994 1.00 62.34 O ATOM 1342 CB ILE A 80 -36.223 -0.592 -25.196 1.00 35.31 C ATOM 1343 CG1 ILE A 80 -35.370 -1.633 -24.470 1.00 24.11 C ATOM 1344 CG2 ILE A 80 -35.419 0.673 -25.456 1.00 1.04 C ATOM 1345 CD1 ILE A 80 -34.776 -1.130 -23.172 1.00 42.24 C ATOM 0 H ILE A 80 -38.343 -2.136 -24.777 1.00 61.41 H new ATOM 0 HA ILE A 80 -37.188 0.214 -23.442 1.00 2.03 H new ATOM 0 HB ILE A 80 -36.529 -1.007 -26.156 1.00 35.31 H new ATOM 0 HG12 ILE A 80 -35.981 -2.512 -24.264 1.00 24.11 H new ATOM 0 HG13 ILE A 80 -34.563 -1.953 -25.129 1.00 24.11 H new ATOM 0 HG21 ILE A 80 -34.531 0.426 -26.038 1.00 1.04 H new ATOM 0 HG22 ILE A 80 -36.030 1.385 -26.011 1.00 1.04 H new ATOM 0 HG23 ILE A 80 -35.119 1.115 -24.506 1.00 1.04 H new ATOM 0 HD11 ILE A 80 -34.184 -1.921 -22.712 1.00 42.24 H new ATOM 0 HD12 ILE A 80 -34.138 -0.269 -23.373 1.00 42.24 H new ATOM 0 HD13 ILE A 80 -35.578 -0.837 -22.495 1.00 42.24 H new ATOM 1357 N PHE A 81 -38.204 1.981 -24.931 1.00 63.52 N ATOM 1358 CA PHE A 81 -38.985 2.994 -25.630 1.00 74.42 C ATOM 1359 C PHE A 81 -38.077 3.947 -26.401 1.00 0.04 C ATOM 1360 O PHE A 81 -37.147 4.526 -25.838 1.00 43.54 O ATOM 1361 CB PHE A 81 -39.844 3.780 -24.637 1.00 53.15 C ATOM 1362 CG PHE A 81 -41.038 3.017 -24.140 1.00 61.42 C ATOM 1363 CD1 PHE A 81 -42.215 2.992 -24.872 1.00 20.45 C ATOM 1364 CD2 PHE A 81 -40.984 2.323 -22.942 1.00 44.11 C ATOM 1365 CE1 PHE A 81 -43.315 2.289 -24.418 1.00 51.22 C ATOM 1366 CE2 PHE A 81 -42.081 1.619 -22.483 1.00 4.41 C ATOM 1367 CZ PHE A 81 -43.248 1.603 -23.221 1.00 21.23 C ATOM 0 H PHE A 81 -37.538 2.355 -24.255 1.00 63.52 H new ATOM 0 HA PHE A 81 -39.636 2.487 -26.342 1.00 74.42 H new ATOM 0 HB2 PHE A 81 -39.228 4.069 -23.786 1.00 53.15 H new ATOM 0 HB3 PHE A 81 -40.183 4.700 -25.112 1.00 53.15 H new ATOM 0 HD1 PHE A 81 -42.273 3.528 -25.808 1.00 20.45 H new ATOM 0 HD2 PHE A 81 -40.074 2.332 -22.360 1.00 44.11 H new ATOM 0 HE1 PHE A 81 -44.226 2.276 -24.998 1.00 51.22 H new ATOM 0 HE2 PHE A 81 -42.026 1.082 -21.548 1.00 4.41 H new ATOM 0 HZ PHE A 81 -44.107 1.055 -22.863 1.00 21.23 H new ATOM 1377 N VAL A 82 -38.351 4.103 -27.691 1.00 52.41 N ATOM 1378 CA VAL A 82 -37.559 4.986 -28.540 1.00 20.04 C ATOM 1379 C VAL A 82 -38.447 5.988 -29.271 1.00 31.23 C ATOM 1380 O VAL A 82 -39.440 5.613 -29.893 1.00 3.21 O ATOM 1381 CB VAL A 82 -36.744 4.188 -29.574 1.00 60.15 C ATOM 1382 CG1 VAL A 82 -37.670 3.419 -30.506 1.00 14.01 C ATOM 1383 CG2 VAL A 82 -35.831 5.114 -30.363 1.00 2.34 C ATOM 0 H VAL A 82 -39.116 3.630 -28.172 1.00 52.41 H new ATOM 0 HA VAL A 82 -36.873 5.523 -27.885 1.00 20.04 H new ATOM 0 HB VAL A 82 -36.122 3.468 -29.042 1.00 60.15 H new ATOM 0 HG11 VAL A 82 -37.076 2.861 -31.230 1.00 14.01 H new ATOM 0 HG12 VAL A 82 -38.278 2.726 -29.924 1.00 14.01 H new ATOM 0 HG13 VAL A 82 -38.320 4.119 -31.032 1.00 14.01 H new ATOM 0 HG21 VAL A 82 -35.263 4.533 -31.089 1.00 2.34 H new ATOM 0 HG22 VAL A 82 -36.432 5.859 -30.885 1.00 2.34 H new ATOM 0 HG23 VAL A 82 -35.144 5.615 -29.681 1.00 2.34 H new ATOM 1393 N ASN A 83 -38.080 7.262 -29.192 1.00 41.52 N ATOM 1394 CA ASN A 83 -38.844 8.319 -29.847 1.00 3.25 C ATOM 1395 C ASN A 83 -40.312 8.264 -29.435 1.00 0.13 C ATOM 1396 O ASN A 83 -41.204 8.503 -30.249 1.00 22.22 O ATOM 1397 CB ASN A 83 -38.724 8.197 -31.367 1.00 24.43 C ATOM 1398 CG ASN A 83 -37.437 8.803 -31.896 1.00 34.44 C ATOM 1399 OD1 ASN A 83 -36.413 8.804 -31.214 1.00 63.00 O ATOM 1400 ND2 ASN A 83 -37.487 9.323 -33.116 1.00 62.43 N ATOM 0 H ASN A 83 -37.259 7.588 -28.682 1.00 41.52 H new ATOM 0 HA ASN A 83 -38.433 9.278 -29.533 1.00 3.25 H new ATOM 0 HB2 ASN A 83 -38.770 7.145 -31.649 1.00 24.43 H new ATOM 0 HB3 ASN A 83 -39.575 8.691 -31.837 1.00 24.43 H new ATOM 0 HD21 ASN A 83 -36.654 9.746 -33.525 1.00 62.43 H new ATOM 0 HD22 ASN A 83 -38.359 9.300 -33.645 1.00 62.43 H new ATOM 1407 N ASP A 84 -40.553 7.949 -28.168 1.00 34.13 N ATOM 1408 CA ASP A 84 -41.913 7.864 -27.647 1.00 11.00 C ATOM 1409 C ASP A 84 -42.716 6.803 -28.394 1.00 42.15 C ATOM 1410 O ASP A 84 -43.928 6.936 -28.571 1.00 65.31 O ATOM 1411 CB ASP A 84 -42.610 9.221 -27.758 1.00 12.24 C ATOM 1412 CG ASP A 84 -41.638 10.381 -27.664 1.00 64.44 C ATOM 1413 OD1 ASP A 84 -41.250 10.738 -26.533 1.00 24.11 O ATOM 1414 OD2 ASP A 84 -41.266 10.930 -28.722 1.00 52.43 O ATOM 0 H ASP A 84 -39.825 7.748 -27.482 1.00 34.13 H new ATOM 0 HA ASP A 84 -41.856 7.578 -26.597 1.00 11.00 H new ATOM 0 HB2 ASP A 84 -43.145 9.275 -28.706 1.00 12.24 H new ATOM 0 HB3 ASP A 84 -43.354 9.310 -26.967 1.00 12.24 H new ATOM 1419 N THR A 85 -42.032 5.750 -28.833 1.00 14.34 N ATOM 1420 CA THR A 85 -42.681 4.669 -29.562 1.00 74.25 C ATOM 1421 C THR A 85 -42.138 3.311 -29.130 1.00 52.24 C ATOM 1422 O THR A 85 -40.969 3.186 -28.764 1.00 13.12 O ATOM 1423 CB THR A 85 -42.490 4.824 -31.083 1.00 52.31 C ATOM 1424 OG1 THR A 85 -42.961 6.108 -31.508 1.00 31.02 O ATOM 1425 CG2 THR A 85 -43.235 3.731 -31.836 1.00 20.10 C ATOM 0 H THR A 85 -41.029 5.624 -28.696 1.00 14.34 H new ATOM 0 HA THR A 85 -43.744 4.724 -29.328 1.00 74.25 H new ATOM 0 HB THR A 85 -41.426 4.736 -31.304 1.00 52.31 H new ATOM 0 HG1 THR A 85 -42.407 6.809 -31.106 1.00 31.02 H new ATOM 0 HG21 THR A 85 -43.086 3.861 -32.908 1.00 20.10 H new ATOM 0 HG22 THR A 85 -42.855 2.756 -31.532 1.00 20.10 H new ATOM 0 HG23 THR A 85 -44.299 3.793 -31.608 1.00 20.10 H new ATOM 1433 N LEU A 86 -42.994 2.296 -29.175 1.00 11.22 N ATOM 1434 CA LEU A 86 -42.600 0.946 -28.789 1.00 35.24 C ATOM 1435 C LEU A 86 -42.831 -0.038 -29.931 1.00 15.12 C ATOM 1436 O LEU A 86 -43.928 -0.569 -30.114 1.00 11.43 O ATOM 1437 CB LEU A 86 -43.381 0.500 -27.551 1.00 14.34 C ATOM 1438 CG LEU A 86 -42.848 -0.739 -26.830 1.00 71.44 C ATOM 1439 CD1 LEU A 86 -41.977 -0.337 -25.651 1.00 74.11 C ATOM 1440 CD2 LEU A 86 -43.997 -1.624 -26.371 1.00 61.51 C ATOM 0 H LEU A 86 -43.965 2.382 -29.475 1.00 11.22 H new ATOM 0 HA LEU A 86 -41.535 0.959 -28.555 1.00 35.24 H new ATOM 0 HB2 LEU A 86 -43.402 1.327 -26.842 1.00 14.34 H new ATOM 0 HB3 LEU A 86 -44.412 0.308 -27.847 1.00 14.34 H new ATOM 0 HG LEU A 86 -42.235 -1.308 -27.529 1.00 71.44 H new ATOM 0 HD11 LEU A 86 -41.607 -1.232 -25.150 1.00 74.11 H new ATOM 0 HD12 LEU A 86 -41.134 0.255 -26.007 1.00 74.11 H new ATOM 0 HD13 LEU A 86 -42.565 0.254 -24.949 1.00 74.11 H new ATOM 0 HD21 LEU A 86 -43.599 -2.501 -25.860 1.00 61.51 H new ATOM 0 HD22 LEU A 86 -44.636 -1.065 -25.688 1.00 61.51 H new ATOM 0 HD23 LEU A 86 -44.580 -1.941 -27.236 1.00 61.51 H new ATOM 1452 N PRO A 87 -41.776 -0.290 -30.719 1.00 53.40 N ATOM 1453 CA PRO A 87 -41.839 -1.212 -31.856 1.00 22.14 C ATOM 1454 C PRO A 87 -41.980 -2.665 -31.415 1.00 53.14 C ATOM 1455 O PRO A 87 -41.802 -3.005 -30.246 1.00 24.20 O ATOM 1456 CB PRO A 87 -40.498 -0.996 -32.563 1.00 51.40 C ATOM 1457 CG PRO A 87 -39.584 -0.499 -31.496 1.00 63.44 C ATOM 1458 CD PRO A 87 -40.439 0.308 -30.560 1.00 11.40 C ATOM 0 HA PRO A 87 -42.706 -1.021 -32.489 1.00 22.14 H new ATOM 0 HB2 PRO A 87 -40.128 -1.923 -33.002 1.00 51.40 H new ATOM 0 HB3 PRO A 87 -40.590 -0.274 -33.374 1.00 51.40 H new ATOM 0 HG2 PRO A 87 -39.108 -1.328 -30.973 1.00 63.44 H new ATOM 0 HG3 PRO A 87 -38.786 0.111 -31.919 1.00 63.44 H new ATOM 0 HD2 PRO A 87 -40.086 0.237 -29.531 1.00 11.40 H new ATOM 0 HD3 PRO A 87 -40.437 1.365 -30.825 1.00 11.40 H new ATOM 1466 N PRO A 88 -42.308 -3.546 -32.374 1.00 11.42 N ATOM 1467 CA PRO A 88 -42.479 -4.977 -32.108 1.00 41.43 C ATOM 1468 C PRO A 88 -41.159 -5.669 -31.787 1.00 33.13 C ATOM 1469 O PRO A 88 -40.089 -5.200 -32.176 1.00 21.44 O ATOM 1470 CB PRO A 88 -43.060 -5.514 -33.419 1.00 4.23 C ATOM 1471 CG PRO A 88 -42.593 -4.555 -34.460 1.00 71.30 C ATOM 1472 CD PRO A 88 -42.535 -3.211 -33.790 1.00 35.30 C ATOM 0 HA PRO A 88 -43.112 -5.157 -31.239 1.00 41.43 H new ATOM 0 HB2 PRO A 88 -42.707 -6.524 -33.624 1.00 4.23 H new ATOM 0 HB3 PRO A 88 -44.148 -5.558 -33.381 1.00 4.23 H new ATOM 0 HG2 PRO A 88 -41.614 -4.842 -34.844 1.00 71.30 H new ATOM 0 HG3 PRO A 88 -43.276 -4.538 -35.309 1.00 71.30 H new ATOM 0 HD2 PRO A 88 -41.730 -2.596 -34.192 1.00 35.30 H new ATOM 0 HD3 PRO A 88 -43.461 -2.653 -33.928 1.00 35.30 H new ATOM 1480 N THR A 89 -41.241 -6.789 -31.075 1.00 61.01 N ATOM 1481 CA THR A 89 -40.053 -7.546 -30.701 1.00 15.32 C ATOM 1482 C THR A 89 -39.405 -8.189 -31.921 1.00 2.13 C ATOM 1483 O THR A 89 -38.279 -8.683 -31.850 1.00 31.32 O ATOM 1484 CB THR A 89 -40.387 -8.643 -29.672 1.00 51.22 C ATOM 1485 OG1 THR A 89 -41.068 -9.726 -30.315 1.00 64.43 O ATOM 1486 CG2 THR A 89 -41.252 -8.089 -28.551 1.00 3.52 C ATOM 0 H THR A 89 -42.118 -7.192 -30.746 1.00 61.01 H new ATOM 0 HA THR A 89 -39.355 -6.839 -30.253 1.00 15.32 H new ATOM 0 HB THR A 89 -39.452 -9.004 -29.243 1.00 51.22 H new ATOM 0 HG1 THR A 89 -41.275 -10.420 -29.655 1.00 64.43 H new ATOM 0 HG21 THR A 89 -41.474 -8.882 -27.837 1.00 3.52 H new ATOM 0 HG22 THR A 89 -40.720 -7.284 -28.045 1.00 3.52 H new ATOM 0 HG23 THR A 89 -42.183 -7.703 -28.966 1.00 3.52 H new ATOM 1494 N ALA A 90 -40.121 -8.180 -33.040 1.00 41.34 N ATOM 1495 CA ALA A 90 -39.613 -8.760 -34.278 1.00 24.30 C ATOM 1496 C ALA A 90 -38.895 -7.712 -35.121 1.00 21.20 C ATOM 1497 O ALA A 90 -38.324 -8.027 -36.165 1.00 3.04 O ATOM 1498 CB ALA A 90 -40.748 -9.391 -35.070 1.00 12.33 C ATOM 0 H ALA A 90 -41.055 -7.777 -33.115 1.00 41.34 H new ATOM 0 HA ALA A 90 -38.892 -9.535 -34.018 1.00 24.30 H new ATOM 0 HB1 ALA A 90 -40.354 -9.820 -35.991 1.00 12.33 H new ATOM 0 HB2 ALA A 90 -41.215 -10.176 -34.475 1.00 12.33 H new ATOM 0 HB3 ALA A 90 -41.490 -8.630 -35.312 1.00 12.33 H new ATOM 1504 N ALA A 91 -38.928 -6.465 -34.663 1.00 15.11 N ATOM 1505 CA ALA A 91 -38.279 -5.371 -35.375 1.00 34.42 C ATOM 1506 C ALA A 91 -36.761 -5.492 -35.300 1.00 65.03 C ATOM 1507 O ALA A 91 -36.230 -6.510 -34.856 1.00 61.31 O ATOM 1508 CB ALA A 91 -38.733 -4.032 -34.812 1.00 22.24 C ATOM 0 H ALA A 91 -39.398 -6.187 -33.801 1.00 15.11 H new ATOM 0 HA ALA A 91 -38.570 -5.429 -36.424 1.00 34.42 H new ATOM 0 HB1 ALA A 91 -38.240 -3.224 -35.353 1.00 22.24 H new ATOM 0 HB2 ALA A 91 -39.813 -3.938 -34.924 1.00 22.24 H new ATOM 0 HB3 ALA A 91 -38.471 -3.974 -33.756 1.00 22.24 H new ATOM 1514 N LEU A 92 -36.067 -4.447 -35.738 1.00 13.20 N ATOM 1515 CA LEU A 92 -34.608 -4.436 -35.721 1.00 40.44 C ATOM 1516 C LEU A 92 -34.080 -3.118 -35.165 1.00 63.11 C ATOM 1517 O LEU A 92 -34.464 -2.042 -35.622 1.00 20.21 O ATOM 1518 CB LEU A 92 -34.061 -4.663 -37.132 1.00 71.30 C ATOM 1519 CG LEU A 92 -32.867 -5.612 -37.244 1.00 11.11 C ATOM 1520 CD1 LEU A 92 -31.703 -5.107 -36.405 1.00 73.13 C ATOM 1521 CD2 LEU A 92 -33.263 -7.019 -36.817 1.00 43.34 C ATOM 0 H LEU A 92 -36.491 -3.597 -36.109 1.00 13.20 H new ATOM 0 HA LEU A 92 -34.270 -5.244 -35.072 1.00 40.44 H new ATOM 0 HB2 LEU A 92 -34.867 -5.051 -37.755 1.00 71.30 H new ATOM 0 HB3 LEU A 92 -33.773 -3.698 -37.548 1.00 71.30 H new ATOM 0 HG LEU A 92 -32.550 -5.645 -38.286 1.00 11.11 H new ATOM 0 HD11 LEU A 92 -30.863 -5.795 -36.497 1.00 73.13 H new ATOM 0 HD12 LEU A 92 -31.403 -4.119 -36.755 1.00 73.13 H new ATOM 0 HD13 LEU A 92 -32.008 -5.044 -35.360 1.00 73.13 H new ATOM 0 HD21 LEU A 92 -32.402 -7.681 -36.903 1.00 43.34 H new ATOM 0 HD22 LEU A 92 -33.606 -7.002 -35.783 1.00 43.34 H new ATOM 0 HD23 LEU A 92 -34.065 -7.382 -37.460 1.00 43.34 H new ATOM 1533 N MET A 93 -33.196 -3.210 -34.178 1.00 21.10 N ATOM 1534 CA MET A 93 -32.612 -2.025 -33.561 1.00 3.21 C ATOM 1535 C MET A 93 -31.904 -1.163 -34.602 1.00 73.13 C ATOM 1536 O MET A 93 -32.080 0.054 -34.637 1.00 52.21 O ATOM 1537 CB MET A 93 -31.627 -2.428 -32.462 1.00 55.51 C ATOM 1538 CG MET A 93 -32.281 -3.153 -31.297 1.00 34.32 C ATOM 1539 SD MET A 93 -33.084 -2.027 -30.140 1.00 11.12 S ATOM 1540 CE MET A 93 -31.681 -1.478 -29.173 1.00 3.25 C ATOM 0 H MET A 93 -32.868 -4.093 -33.788 1.00 21.10 H new ATOM 0 HA MET A 93 -33.420 -1.441 -33.119 1.00 3.21 H new ATOM 0 HB2 MET A 93 -30.857 -3.069 -32.892 1.00 55.51 H new ATOM 0 HB3 MET A 93 -31.126 -1.535 -32.089 1.00 55.51 H new ATOM 0 HG2 MET A 93 -33.017 -3.859 -31.681 1.00 34.32 H new ATOM 0 HG3 MET A 93 -31.527 -3.735 -30.767 1.00 34.32 H new ATOM 0 HE1 MET A 93 -31.845 -0.452 -28.845 1.00 3.25 H new ATOM 0 HE2 MET A 93 -31.564 -2.123 -28.302 1.00 3.25 H new ATOM 0 HE3 MET A 93 -30.778 -1.525 -29.782 1.00 3.25 H new ATOM 1550 N SER A 94 -31.103 -1.804 -35.449 1.00 13.43 N ATOM 1551 CA SER A 94 -30.367 -1.095 -36.488 1.00 61.04 C ATOM 1552 C SER A 94 -31.322 -0.434 -37.477 1.00 71.13 C ATOM 1553 O SER A 94 -30.985 0.567 -38.108 1.00 1.41 O ATOM 1554 CB SER A 94 -29.434 -2.056 -37.228 1.00 33.01 C ATOM 1555 OG SER A 94 -28.744 -1.394 -38.273 1.00 24.21 O ATOM 0 H SER A 94 -30.948 -2.812 -35.435 1.00 13.43 H new ATOM 0 HA SER A 94 -29.772 -0.317 -36.010 1.00 61.04 H new ATOM 0 HB2 SER A 94 -28.716 -2.483 -36.527 1.00 33.01 H new ATOM 0 HB3 SER A 94 -30.011 -2.885 -37.637 1.00 33.01 H new ATOM 0 HG SER A 94 -28.278 -2.055 -38.827 1.00 24.21 H new ATOM 1561 N ALA A 95 -32.516 -1.002 -37.607 1.00 20.04 N ATOM 1562 CA ALA A 95 -33.522 -0.469 -38.517 1.00 12.44 C ATOM 1563 C ALA A 95 -34.284 0.687 -37.875 1.00 43.51 C ATOM 1564 O ALA A 95 -34.691 1.628 -38.557 1.00 71.24 O ATOM 1565 CB ALA A 95 -34.485 -1.566 -38.941 1.00 53.12 C ATOM 0 H ALA A 95 -32.811 -1.832 -37.093 1.00 20.04 H new ATOM 0 HA ALA A 95 -33.011 -0.088 -39.401 1.00 12.44 H new ATOM 0 HB1 ALA A 95 -35.231 -1.153 -39.620 1.00 53.12 H new ATOM 0 HB2 ALA A 95 -33.934 -2.359 -39.446 1.00 53.12 H new ATOM 0 HB3 ALA A 95 -34.982 -1.974 -38.061 1.00 53.12 H new ATOM 1571 N ILE A 96 -34.472 0.610 -36.563 1.00 12.11 N ATOM 1572 CA ILE A 96 -35.185 1.650 -35.831 1.00 51.43 C ATOM 1573 C ILE A 96 -34.278 2.843 -35.550 1.00 31.35 C ATOM 1574 O ILE A 96 -34.618 3.984 -35.867 1.00 73.44 O ATOM 1575 CB ILE A 96 -35.744 1.118 -34.498 1.00 25.02 C ATOM 1576 CG1 ILE A 96 -36.739 -0.015 -34.753 1.00 74.22 C ATOM 1577 CG2 ILE A 96 -36.404 2.243 -33.715 1.00 30.11 C ATOM 1578 CD1 ILE A 96 -38.060 0.456 -35.319 1.00 12.11 C ATOM 0 H ILE A 96 -34.141 -0.162 -35.984 1.00 12.11 H new ATOM 0 HA ILE A 96 -36.015 1.968 -36.462 1.00 51.43 H new ATOM 0 HB ILE A 96 -34.918 0.724 -33.906 1.00 25.02 H new ATOM 0 HG12 ILE A 96 -36.292 -0.731 -35.443 1.00 74.22 H new ATOM 0 HG13 ILE A 96 -36.922 -0.544 -33.818 1.00 74.22 H new ATOM 0 HG21 ILE A 96 -36.794 1.852 -32.775 1.00 30.11 H new ATOM 0 HG22 ILE A 96 -35.670 3.021 -33.507 1.00 30.11 H new ATOM 0 HG23 ILE A 96 -37.222 2.663 -34.301 1.00 30.11 H new ATOM 0 HD11 ILE A 96 -38.716 -0.401 -35.474 1.00 12.11 H new ATOM 0 HD12 ILE A 96 -38.529 1.149 -34.621 1.00 12.11 H new ATOM 0 HD13 ILE A 96 -37.889 0.959 -36.271 1.00 12.11 H new ATOM 1590 N TYR A 97 -33.122 2.573 -34.953 1.00 43.53 N ATOM 1591 CA TYR A 97 -32.166 3.624 -34.628 1.00 43.02 C ATOM 1592 C TYR A 97 -31.805 4.436 -35.870 1.00 33.12 C ATOM 1593 O TYR A 97 -31.535 5.634 -35.783 1.00 71.44 O ATOM 1594 CB TYR A 97 -30.901 3.021 -34.015 1.00 64.11 C ATOM 1595 CG TYR A 97 -29.621 3.613 -34.562 1.00 12.21 C ATOM 1596 CD1 TYR A 97 -29.158 4.845 -34.116 1.00 40.34 C ATOM 1597 CD2 TYR A 97 -28.876 2.941 -35.523 1.00 13.42 C ATOM 1598 CE1 TYR A 97 -27.990 5.391 -34.612 1.00 32.30 C ATOM 1599 CE2 TYR A 97 -27.706 3.479 -36.024 1.00 34.11 C ATOM 1600 CZ TYR A 97 -27.267 4.703 -35.565 1.00 55.24 C ATOM 1601 OH TYR A 97 -26.103 5.242 -36.063 1.00 14.42 O ATOM 0 H TYR A 97 -32.825 1.635 -34.685 1.00 43.53 H new ATOM 0 HA TYR A 97 -32.631 4.291 -33.902 1.00 43.02 H new ATOM 0 HB2 TYR A 97 -30.926 3.166 -32.935 1.00 64.11 H new ATOM 0 HB3 TYR A 97 -30.899 1.945 -34.192 1.00 64.11 H new ATOM 0 HD1 TYR A 97 -29.721 5.385 -33.369 1.00 40.34 H new ATOM 0 HD2 TYR A 97 -29.217 1.982 -35.885 1.00 13.42 H new ATOM 0 HE1 TYR A 97 -27.645 6.350 -34.256 1.00 32.30 H new ATOM 0 HE2 TYR A 97 -27.138 2.944 -36.771 1.00 34.11 H new ATOM 0 HH TYR A 97 -25.716 4.631 -36.724 1.00 14.42 H new ATOM 1611 N GLN A 98 -31.805 3.774 -37.022 1.00 11.14 N ATOM 1612 CA GLN A 98 -31.479 4.433 -38.281 1.00 25.05 C ATOM 1613 C GLN A 98 -32.217 5.761 -38.408 1.00 2.42 C ATOM 1614 O GLN A 98 -31.611 6.793 -38.691 1.00 40.45 O ATOM 1615 CB GLN A 98 -31.829 3.526 -39.462 1.00 11.51 C ATOM 1616 CG GLN A 98 -30.806 3.568 -40.586 1.00 0.01 C ATOM 1617 CD GLN A 98 -31.436 3.400 -41.954 1.00 52.44 C ATOM 1618 OE1 GLN A 98 -32.486 2.772 -42.095 1.00 32.21 O ATOM 1619 NE2 GLN A 98 -30.798 3.963 -42.974 1.00 3.25 N ATOM 0 H GLN A 98 -32.027 2.782 -37.110 1.00 11.14 H new ATOM 0 HA GLN A 98 -30.407 4.632 -38.290 1.00 25.05 H new ATOM 0 HB2 GLN A 98 -31.923 2.500 -39.106 1.00 11.51 H new ATOM 0 HB3 GLN A 98 -32.802 3.817 -39.857 1.00 11.51 H new ATOM 0 HG2 GLN A 98 -30.271 4.517 -40.550 1.00 0.01 H new ATOM 0 HG3 GLN A 98 -30.068 2.781 -40.431 1.00 0.01 H new ATOM 0 HE21 GLN A 98 -29.930 4.475 -42.813 1.00 3.25 H new ATOM 0 HE22 GLN A 98 -31.176 3.884 -43.918 1.00 3.25 H new ATOM 1628 N GLU A 99 -33.528 5.726 -38.195 1.00 75.23 N ATOM 1629 CA GLU A 99 -34.349 6.928 -38.287 1.00 52.00 C ATOM 1630 C GLU A 99 -34.657 7.485 -36.900 1.00 63.54 C ATOM 1631 O GLU A 99 -35.145 8.606 -36.763 1.00 11.14 O ATOM 1632 CB GLU A 99 -35.654 6.626 -39.028 1.00 42.11 C ATOM 1633 CG GLU A 99 -35.473 5.718 -40.233 1.00 43.23 C ATOM 1634 CD GLU A 99 -34.254 6.081 -41.059 1.00 71.34 C ATOM 1635 OE1 GLU A 99 -33.955 7.287 -41.179 1.00 23.11 O ATOM 1636 OE2 GLU A 99 -33.598 5.157 -41.584 1.00 72.52 O ATOM 0 H GLU A 99 -34.045 4.879 -37.958 1.00 75.23 H new ATOM 0 HA GLU A 99 -33.788 7.678 -38.844 1.00 52.00 H new ATOM 0 HB2 GLU A 99 -36.356 6.161 -38.336 1.00 42.11 H new ATOM 0 HB3 GLU A 99 -36.102 7.564 -39.355 1.00 42.11 H new ATOM 0 HG2 GLU A 99 -35.384 4.686 -39.895 1.00 43.23 H new ATOM 0 HG3 GLU A 99 -36.362 5.772 -40.861 1.00 43.23 H new ATOM 1643 N HIS A 100 -34.368 6.691 -35.874 1.00 2.14 N ATOM 1644 CA HIS A 100 -34.613 7.104 -34.496 1.00 31.44 C ATOM 1645 C HIS A 100 -33.334 7.626 -33.849 1.00 73.21 C ATOM 1646 O HIS A 100 -33.226 7.691 -32.625 1.00 33.03 O ATOM 1647 CB HIS A 100 -35.169 5.934 -33.682 1.00 40.23 C ATOM 1648 CG HIS A 100 -36.575 5.567 -34.045 1.00 25.12 C ATOM 1649 ND1 HIS A 100 -37.600 5.512 -33.123 1.00 42.14 N ATOM 1650 CD2 HIS A 100 -37.124 5.236 -35.237 1.00 53.23 C ATOM 1651 CE1 HIS A 100 -38.718 5.162 -33.733 1.00 51.34 C ATOM 1652 NE2 HIS A 100 -38.457 4.989 -35.017 1.00 35.11 N ATOM 0 H HIS A 100 -33.964 5.759 -35.970 1.00 2.14 H new ATOM 0 HA HIS A 100 -35.347 7.910 -34.510 1.00 31.44 H new ATOM 0 HB2 HIS A 100 -34.527 5.065 -33.825 1.00 40.23 H new ATOM 0 HB3 HIS A 100 -35.130 6.188 -32.623 1.00 40.23 H new ATOM 0 HD2 HIS A 100 -36.610 5.177 -36.185 1.00 53.23 H new ATOM 0 HE1 HIS A 100 -39.682 5.038 -33.262 1.00 51.34 H new ATOM 0 HE2 HIS A 100 -39.135 4.716 -35.729 1.00 35.11 H new ATOM 1660 N LYS A 101 -32.366 7.997 -34.680 1.00 20.24 N ATOM 1661 CA LYS A 101 -31.094 8.515 -34.191 1.00 23.43 C ATOM 1662 C LYS A 101 -31.141 10.032 -34.050 1.00 15.12 C ATOM 1663 O LYS A 101 -31.721 10.725 -34.887 1.00 33.32 O ATOM 1664 CB LYS A 101 -29.959 8.114 -35.137 1.00 1.43 C ATOM 1665 CG LYS A 101 -30.096 8.698 -36.532 1.00 12.42 C ATOM 1666 CD LYS A 101 -28.803 8.572 -37.320 1.00 11.10 C ATOM 1667 CE LYS A 101 -29.053 8.651 -38.818 1.00 2.32 C ATOM 1668 NZ LYS A 101 -29.872 9.842 -39.181 1.00 61.53 N ATOM 0 H LYS A 101 -32.438 7.948 -35.696 1.00 20.24 H new ATOM 0 HA LYS A 101 -30.909 8.083 -33.207 1.00 23.43 H new ATOM 0 HB2 LYS A 101 -29.010 8.436 -34.709 1.00 1.43 H new ATOM 0 HB3 LYS A 101 -29.924 7.027 -35.209 1.00 1.43 H new ATOM 0 HG2 LYS A 101 -30.898 8.187 -37.064 1.00 12.42 H new ATOM 0 HG3 LYS A 101 -30.379 9.748 -36.461 1.00 12.42 H new ATOM 0 HD2 LYS A 101 -28.116 9.364 -37.023 1.00 11.10 H new ATOM 0 HD3 LYS A 101 -28.320 7.625 -37.080 1.00 11.10 H new ATOM 0 HE2 LYS A 101 -28.099 8.692 -39.344 1.00 2.32 H new ATOM 0 HE3 LYS A 101 -29.561 7.746 -39.150 1.00 2.32 H new ATOM 0 HZ1 LYS A 101 -29.824 9.996 -40.208 1.00 61.53 H new ATOM 0 HZ2 LYS A 101 -30.861 9.682 -38.901 1.00 61.53 H new ATOM 0 HZ3 LYS A 101 -29.504 10.680 -38.688 1.00 61.53 H new ATOM 1682 N ASP A 102 -30.528 10.543 -32.988 1.00 44.32 N ATOM 1683 CA ASP A 102 -30.498 11.980 -32.740 1.00 62.31 C ATOM 1684 C ASP A 102 -30.008 12.734 -33.972 1.00 13.23 C ATOM 1685 O ASP A 102 -29.338 12.167 -34.835 1.00 1.10 O ATOM 1686 CB ASP A 102 -29.599 12.294 -31.544 1.00 22.24 C ATOM 1687 CG ASP A 102 -29.523 13.779 -31.249 1.00 54.52 C ATOM 1688 OD1 ASP A 102 -30.589 14.399 -31.044 1.00 71.22 O ATOM 1689 OD2 ASP A 102 -28.399 14.322 -31.224 1.00 13.53 O ATOM 0 H ASP A 102 -30.045 9.984 -32.285 1.00 44.32 H new ATOM 0 HA ASP A 102 -31.514 12.306 -32.517 1.00 62.31 H new ATOM 0 HB2 ASP A 102 -29.974 11.771 -30.664 1.00 22.24 H new ATOM 0 HB3 ASP A 102 -28.596 11.914 -31.738 1.00 22.24 H new ATOM 1694 N LYS A 103 -30.349 14.017 -34.048 1.00 30.22 N ATOM 1695 CA LYS A 103 -29.944 14.850 -35.174 1.00 23.25 C ATOM 1696 C LYS A 103 -28.427 14.849 -35.334 1.00 74.24 C ATOM 1697 O LYS A 103 -27.907 15.148 -36.409 1.00 53.52 O ATOM 1698 CB LYS A 103 -30.445 16.283 -34.980 1.00 35.23 C ATOM 1699 CG LYS A 103 -30.237 16.815 -33.573 1.00 13.42 C ATOM 1700 CD LYS A 103 -30.548 18.300 -33.486 1.00 54.21 C ATOM 1701 CE LYS A 103 -30.616 18.772 -32.042 1.00 24.11 C ATOM 1702 NZ LYS A 103 -31.285 20.097 -31.922 1.00 32.11 N ATOM 0 H LYS A 103 -30.905 14.502 -33.343 1.00 30.22 H new ATOM 0 HA LYS A 103 -30.388 14.435 -36.079 1.00 23.25 H new ATOM 0 HB2 LYS A 103 -29.933 16.937 -35.686 1.00 35.23 H new ATOM 0 HB3 LYS A 103 -31.507 16.323 -35.221 1.00 35.23 H new ATOM 0 HG2 LYS A 103 -30.874 16.268 -32.878 1.00 13.42 H new ATOM 0 HG3 LYS A 103 -29.206 16.640 -33.266 1.00 13.42 H new ATOM 0 HD2 LYS A 103 -29.783 18.865 -34.019 1.00 54.21 H new ATOM 0 HD3 LYS A 103 -31.497 18.504 -33.981 1.00 54.21 H new ATOM 0 HE2 LYS A 103 -31.156 18.037 -31.445 1.00 24.11 H new ATOM 0 HE3 LYS A 103 -29.608 18.836 -31.633 1.00 24.11 H new ATOM 0 HZ1 LYS A 103 -31.311 20.383 -30.923 1.00 32.11 H new ATOM 0 HZ2 LYS A 103 -30.756 20.804 -32.471 1.00 32.11 H new ATOM 0 HZ3 LYS A 103 -32.256 20.030 -32.289 1.00 32.11 H new ATOM 1716 N ASP A 104 -27.723 14.509 -34.260 1.00 72.22 N ATOM 1717 CA ASP A 104 -26.266 14.466 -34.284 1.00 22.53 C ATOM 1718 C ASP A 104 -25.770 13.115 -34.792 1.00 52.24 C ATOM 1719 O ASP A 104 -24.650 13.000 -35.288 1.00 41.44 O ATOM 1720 CB ASP A 104 -25.704 14.735 -32.887 1.00 42.23 C ATOM 1721 CG ASP A 104 -26.159 16.069 -32.328 1.00 2.30 C ATOM 1722 OD1 ASP A 104 -26.372 17.006 -33.126 1.00 24.31 O ATOM 1723 OD2 ASP A 104 -26.303 16.176 -31.092 1.00 32.13 O ATOM 0 H ASP A 104 -28.138 14.259 -33.362 1.00 72.22 H new ATOM 0 HA ASP A 104 -25.916 15.242 -34.965 1.00 22.53 H new ATOM 0 HB2 ASP A 104 -26.015 13.937 -32.213 1.00 42.23 H new ATOM 0 HB3 ASP A 104 -24.615 14.713 -32.926 1.00 42.23 H new ATOM 1728 N GLY A 105 -26.613 12.095 -34.665 1.00 61.02 N ATOM 1729 CA GLY A 105 -26.241 10.766 -35.116 1.00 74.11 C ATOM 1730 C GLY A 105 -26.285 9.742 -33.998 1.00 61.12 C ATOM 1731 O GLY A 105 -26.198 8.539 -34.246 1.00 51.22 O ATOM 0 H GLY A 105 -27.546 12.165 -34.258 1.00 61.02 H new ATOM 0 HA2 GLY A 105 -26.913 10.455 -35.916 1.00 74.11 H new ATOM 0 HA3 GLY A 105 -25.236 10.796 -35.538 1.00 74.11 H new ATOM 1735 N PHE A 106 -26.419 10.219 -32.766 1.00 1.00 N ATOM 1736 CA PHE A 106 -26.471 9.337 -31.606 1.00 21.41 C ATOM 1737 C PHE A 106 -27.805 8.599 -31.543 1.00 61.25 C ATOM 1738 O PHE A 106 -28.604 8.657 -32.478 1.00 50.20 O ATOM 1739 CB PHE A 106 -26.256 10.137 -30.320 1.00 30.42 C ATOM 1740 CG PHE A 106 -25.035 11.010 -30.353 1.00 12.12 C ATOM 1741 CD1 PHE A 106 -23.768 10.451 -30.399 1.00 33.12 C ATOM 1742 CD2 PHE A 106 -25.153 12.391 -30.339 1.00 74.10 C ATOM 1743 CE1 PHE A 106 -22.642 11.252 -30.429 1.00 54.32 C ATOM 1744 CE2 PHE A 106 -24.031 13.198 -30.369 1.00 60.04 C ATOM 1745 CZ PHE A 106 -22.774 12.628 -30.416 1.00 74.40 C ATOM 0 H PHE A 106 -26.494 11.212 -32.544 1.00 1.00 H new ATOM 0 HA PHE A 106 -25.673 8.601 -31.705 1.00 21.41 H new ATOM 0 HB2 PHE A 106 -27.132 10.759 -30.138 1.00 30.42 H new ATOM 0 HB3 PHE A 106 -26.176 9.446 -29.481 1.00 30.42 H new ATOM 0 HD1 PHE A 106 -23.659 9.377 -30.412 1.00 33.12 H new ATOM 0 HD2 PHE A 106 -26.134 12.842 -30.304 1.00 74.10 H new ATOM 0 HE1 PHE A 106 -21.660 10.803 -30.463 1.00 54.32 H new ATOM 0 HE2 PHE A 106 -24.137 14.273 -30.356 1.00 60.04 H new ATOM 0 HZ PHE A 106 -21.896 13.256 -30.443 1.00 74.40 H new ATOM 1755 N LEU A 107 -28.038 7.905 -30.434 1.00 71.13 N ATOM 1756 CA LEU A 107 -29.275 7.154 -30.248 1.00 53.11 C ATOM 1757 C LEU A 107 -29.858 7.401 -28.861 1.00 33.34 C ATOM 1758 O LEU A 107 -29.142 7.363 -27.860 1.00 23.30 O ATOM 1759 CB LEU A 107 -29.023 5.660 -30.450 1.00 73.22 C ATOM 1760 CG LEU A 107 -30.260 4.761 -30.427 1.00 24.43 C ATOM 1761 CD1 LEU A 107 -30.695 4.490 -28.995 1.00 22.53 C ATOM 1762 CD2 LEU A 107 -31.394 5.393 -31.220 1.00 21.32 C ATOM 0 H LEU A 107 -27.387 7.847 -29.651 1.00 71.13 H new ATOM 0 HA LEU A 107 -29.995 7.498 -30.991 1.00 53.11 H new ATOM 0 HB2 LEU A 107 -28.517 5.523 -31.406 1.00 73.22 H new ATOM 0 HB3 LEU A 107 -28.337 5.320 -29.675 1.00 73.22 H new ATOM 0 HG LEU A 107 -30.003 3.810 -30.894 1.00 24.43 H new ATOM 0 HD11 LEU A 107 -31.576 3.849 -28.998 1.00 22.53 H new ATOM 0 HD12 LEU A 107 -29.887 3.994 -28.457 1.00 22.53 H new ATOM 0 HD13 LEU A 107 -30.934 5.433 -28.503 1.00 22.53 H new ATOM 0 HD21 LEU A 107 -32.266 4.739 -31.192 1.00 21.32 H new ATOM 0 HD22 LEU A 107 -31.650 6.358 -30.783 1.00 21.32 H new ATOM 0 HD23 LEU A 107 -31.080 5.535 -32.254 1.00 21.32 H new ATOM 1774 N TYR A 108 -31.161 7.651 -28.808 1.00 11.42 N ATOM 1775 CA TYR A 108 -31.840 7.903 -27.542 1.00 43.54 C ATOM 1776 C TYR A 108 -32.893 6.834 -27.267 1.00 11.43 C ATOM 1777 O TYR A 108 -33.865 6.697 -28.009 1.00 43.22 O ATOM 1778 CB TYR A 108 -32.493 9.287 -27.557 1.00 51.33 C ATOM 1779 CG TYR A 108 -31.512 10.422 -27.369 1.00 34.14 C ATOM 1780 CD1 TYR A 108 -30.770 10.537 -26.200 1.00 31.14 C ATOM 1781 CD2 TYR A 108 -31.329 11.380 -28.358 1.00 70.23 C ATOM 1782 CE1 TYR A 108 -29.873 11.572 -26.023 1.00 2.44 C ATOM 1783 CE2 TYR A 108 -30.434 12.418 -28.190 1.00 43.21 C ATOM 1784 CZ TYR A 108 -29.708 12.510 -27.021 1.00 71.23 C ATOM 1785 OH TYR A 108 -28.816 13.544 -26.849 1.00 23.12 O ATOM 0 H TYR A 108 -31.769 7.685 -29.627 1.00 11.42 H new ATOM 0 HA TYR A 108 -31.096 7.868 -26.746 1.00 43.54 H new ATOM 0 HB2 TYR A 108 -33.015 9.423 -28.504 1.00 51.33 H new ATOM 0 HB3 TYR A 108 -33.245 9.333 -26.769 1.00 51.33 H new ATOM 0 HD1 TYR A 108 -30.897 9.805 -25.416 1.00 31.14 H new ATOM 0 HD2 TYR A 108 -31.897 11.312 -29.274 1.00 70.23 H new ATOM 0 HE1 TYR A 108 -29.304 11.647 -25.108 1.00 2.44 H new ATOM 0 HE2 TYR A 108 -30.303 13.154 -28.970 1.00 43.21 H new ATOM 0 HH TYR A 108 -28.820 14.115 -27.645 1.00 23.12 H new ATOM 1795 N VAL A 109 -32.692 6.079 -26.191 1.00 12.43 N ATOM 1796 CA VAL A 109 -33.624 5.023 -25.813 1.00 44.33 C ATOM 1797 C VAL A 109 -33.904 5.047 -24.316 1.00 20.14 C ATOM 1798 O VAL A 109 -33.123 5.592 -23.534 1.00 61.32 O ATOM 1799 CB VAL A 109 -33.085 3.634 -26.202 1.00 21.33 C ATOM 1800 CG1 VAL A 109 -33.341 3.354 -27.675 1.00 13.52 C ATOM 1801 CG2 VAL A 109 -31.602 3.530 -25.881 1.00 44.02 C ATOM 0 H VAL A 109 -31.892 6.179 -25.566 1.00 12.43 H new ATOM 0 HA VAL A 109 -34.551 5.210 -26.355 1.00 44.33 H new ATOM 0 HB VAL A 109 -33.614 2.881 -25.617 1.00 21.33 H new ATOM 0 HG11 VAL A 109 -32.953 2.368 -27.931 1.00 13.52 H new ATOM 0 HG12 VAL A 109 -34.413 3.384 -27.870 1.00 13.52 H new ATOM 0 HG13 VAL A 109 -32.841 4.109 -28.281 1.00 13.52 H new ATOM 0 HG21 VAL A 109 -31.237 2.542 -26.162 1.00 44.02 H new ATOM 0 HG22 VAL A 109 -31.055 4.291 -26.438 1.00 44.02 H new ATOM 0 HG23 VAL A 109 -31.449 3.683 -24.813 1.00 44.02 H new ATOM 1811 N THR A 110 -35.025 4.452 -23.919 1.00 13.34 N ATOM 1812 CA THR A 110 -35.410 4.405 -22.514 1.00 53.35 C ATOM 1813 C THR A 110 -35.925 3.023 -22.131 1.00 20.33 C ATOM 1814 O THR A 110 -36.298 2.228 -22.994 1.00 11.23 O ATOM 1815 CB THR A 110 -36.494 5.452 -22.193 1.00 25.11 C ATOM 1816 OG1 THR A 110 -37.788 4.839 -22.212 1.00 32.32 O ATOM 1817 CG2 THR A 110 -36.455 6.596 -23.194 1.00 44.24 C ATOM 0 H THR A 110 -35.682 3.996 -24.552 1.00 13.34 H new ATOM 0 HA THR A 110 -34.515 4.630 -21.934 1.00 53.35 H new ATOM 0 HB THR A 110 -36.297 5.853 -21.199 1.00 25.11 H new ATOM 0 HG1 THR A 110 -38.471 5.511 -22.006 1.00 32.32 H new ATOM 0 HG21 THR A 110 -37.229 7.322 -22.947 1.00 44.24 H new ATOM 0 HG22 THR A 110 -35.479 7.079 -23.156 1.00 44.24 H new ATOM 0 HG23 THR A 110 -36.629 6.208 -24.197 1.00 44.24 H new ATOM 1825 N TYR A 111 -35.944 2.743 -20.833 1.00 70.32 N ATOM 1826 CA TYR A 111 -36.412 1.455 -20.335 1.00 73.43 C ATOM 1827 C TYR A 111 -37.355 1.638 -19.150 1.00 72.04 C ATOM 1828 O TYR A 111 -37.068 2.400 -18.227 1.00 71.12 O ATOM 1829 CB TYR A 111 -35.226 0.579 -19.928 1.00 53.21 C ATOM 1830 CG TYR A 111 -34.693 0.888 -18.547 1.00 34.11 C ATOM 1831 CD1 TYR A 111 -35.198 0.240 -17.425 1.00 61.04 C ATOM 1832 CD2 TYR A 111 -33.684 1.825 -18.362 1.00 51.43 C ATOM 1833 CE1 TYR A 111 -34.715 0.519 -16.162 1.00 14.54 C ATOM 1834 CE2 TYR A 111 -33.194 2.109 -17.103 1.00 50.01 C ATOM 1835 CZ TYR A 111 -33.713 1.455 -16.005 1.00 62.43 C ATOM 1836 OH TYR A 111 -33.228 1.733 -14.749 1.00 11.34 O ATOM 0 H TYR A 111 -35.641 3.391 -20.106 1.00 70.32 H new ATOM 0 HA TYR A 111 -36.960 0.962 -21.138 1.00 73.43 H new ATOM 0 HB2 TYR A 111 -35.528 -0.468 -19.966 1.00 53.21 H new ATOM 0 HB3 TYR A 111 -34.424 0.706 -20.655 1.00 53.21 H new ATOM 0 HD1 TYR A 111 -35.981 -0.494 -17.544 1.00 61.04 H new ATOM 0 HD2 TYR A 111 -33.276 2.341 -19.219 1.00 51.43 H new ATOM 0 HE1 TYR A 111 -35.119 0.007 -15.301 1.00 14.54 H new ATOM 0 HE2 TYR A 111 -32.408 2.839 -16.978 1.00 50.01 H new ATOM 0 HH TYR A 111 -33.475 1.010 -14.136 1.00 11.34 H new ATOM 1846 N SER A 112 -38.481 0.933 -19.183 1.00 60.15 N ATOM 1847 CA SER A 112 -39.469 1.019 -18.114 1.00 64.10 C ATOM 1848 C SER A 112 -40.349 -0.226 -18.087 1.00 15.24 C ATOM 1849 O SER A 112 -40.317 -1.044 -19.005 1.00 0.40 O ATOM 1850 CB SER A 112 -40.336 2.267 -18.291 1.00 50.40 C ATOM 1851 OG SER A 112 -40.496 2.955 -17.063 1.00 2.53 O ATOM 0 H SER A 112 -38.732 0.296 -19.939 1.00 60.15 H new ATOM 0 HA SER A 112 -38.937 1.087 -17.165 1.00 64.10 H new ATOM 0 HB2 SER A 112 -39.879 2.930 -19.026 1.00 50.40 H new ATOM 0 HB3 SER A 112 -41.313 1.983 -18.682 1.00 50.40 H new ATOM 0 HG SER A 112 -41.368 3.402 -17.050 1.00 2.53 H new ATOM 1857 N GLY A 113 -41.137 -0.364 -17.024 1.00 3.24 N ATOM 1858 CA GLY A 113 -42.016 -1.510 -16.894 1.00 73.52 C ATOM 1859 C GLY A 113 -43.468 -1.161 -17.154 1.00 74.10 C ATOM 1860 O GLY A 113 -44.372 -1.795 -16.611 1.00 24.41 O ATOM 0 H GLY A 113 -41.181 0.299 -16.250 1.00 3.24 H new ATOM 0 HA2 GLY A 113 -41.702 -2.286 -17.592 1.00 73.52 H new ATOM 0 HA3 GLY A 113 -41.920 -1.926 -15.891 1.00 73.52 H new ATOM 1864 N GLU A 114 -43.692 -0.149 -17.986 1.00 42.44 N ATOM 1865 CA GLU A 114 -45.045 0.284 -18.314 1.00 11.21 C ATOM 1866 C GLU A 114 -45.058 1.095 -19.608 1.00 74.44 C ATOM 1867 O GLU A 114 -44.066 1.725 -19.968 1.00 5.24 O ATOM 1868 CB GLU A 114 -45.628 1.118 -17.172 1.00 11.25 C ATOM 1869 CG GLU A 114 -44.644 2.115 -16.582 1.00 32.12 C ATOM 1870 CD GLU A 114 -45.232 2.901 -15.425 1.00 70.34 C ATOM 1871 OE1 GLU A 114 -45.768 2.269 -14.491 1.00 52.42 O ATOM 1872 OE2 GLU A 114 -45.155 4.146 -15.455 1.00 52.12 O ATOM 0 H GLU A 114 -42.955 0.386 -18.445 1.00 42.44 H new ATOM 0 HA GLU A 114 -45.659 -0.605 -18.456 1.00 11.21 H new ATOM 0 HB2 GLU A 114 -46.503 1.656 -17.536 1.00 11.25 H new ATOM 0 HB3 GLU A 114 -45.971 0.449 -16.383 1.00 11.25 H new ATOM 0 HG2 GLU A 114 -43.755 1.584 -16.241 1.00 32.12 H new ATOM 0 HG3 GLU A 114 -44.323 2.807 -17.361 1.00 32.12 H new ATOM 1879 N ASN A 115 -46.190 1.070 -20.303 1.00 33.30 N ATOM 1880 CA ASN A 115 -46.334 1.800 -21.557 1.00 63.11 C ATOM 1881 C ASN A 115 -47.296 2.973 -21.397 1.00 14.23 C ATOM 1882 O ASN A 115 -47.371 3.851 -22.256 1.00 13.22 O ATOM 1883 CB ASN A 115 -46.830 0.865 -22.662 1.00 54.41 C ATOM 1884 CG ASN A 115 -46.288 1.243 -24.026 1.00 41.12 C ATOM 1885 OD1 ASN A 115 -45.583 0.462 -24.664 1.00 44.41 O ATOM 1886 ND2 ASN A 115 -46.617 2.448 -24.481 1.00 21.44 N ATOM 0 H ASN A 115 -47.021 0.552 -20.019 1.00 33.30 H new ATOM 0 HA ASN A 115 -45.355 2.192 -21.834 1.00 63.11 H new ATOM 0 HB2 ASN A 115 -46.535 -0.158 -22.428 1.00 54.41 H new ATOM 0 HB3 ASN A 115 -47.919 0.885 -22.689 1.00 54.41 H new ATOM 0 HD21 ASN A 115 -46.282 2.758 -25.393 1.00 21.44 H new ATOM 0 HD22 ASN A 115 -47.204 3.063 -23.918 1.00 21.44 H new ATOM 1893 N THR A 116 -48.031 2.982 -20.288 1.00 71.45 N ATOM 1894 CA THR A 116 -48.988 4.045 -20.015 1.00 14.33 C ATOM 1895 C THR A 116 -48.740 4.671 -18.647 1.00 64.00 C ATOM 1896 O THR A 116 -47.794 4.305 -17.948 1.00 45.25 O ATOM 1897 CB THR A 116 -50.438 3.525 -20.072 1.00 71.12 C ATOM 1898 OG1 THR A 116 -50.599 2.423 -19.172 1.00 65.03 O ATOM 1899 CG2 THR A 116 -50.801 3.091 -21.483 1.00 41.22 C ATOM 0 H THR A 116 -47.981 2.264 -19.565 1.00 71.45 H new ATOM 0 HA THR A 116 -48.849 4.800 -20.789 1.00 14.33 H new ATOM 0 HB THR A 116 -51.104 4.336 -19.775 1.00 71.12 H new ATOM 0 HG1 THR A 116 -51.523 2.100 -19.213 1.00 65.03 H new ATOM 0 HG21 THR A 116 -51.829 2.728 -21.499 1.00 41.22 H new ATOM 0 HG22 THR A 116 -50.705 3.939 -22.161 1.00 41.22 H new ATOM 0 HG23 THR A 116 -50.130 2.294 -21.803 1.00 41.22 H new ATOM 1907 N PHE A 117 -49.594 5.617 -18.270 1.00 44.14 N ATOM 1908 CA PHE A 117 -49.465 6.294 -16.985 1.00 1.42 C ATOM 1909 C PHE A 117 -49.371 5.284 -15.845 1.00 2.23 C ATOM 1910 O PHE A 117 -48.744 5.547 -14.818 1.00 55.55 O ATOM 1911 CB PHE A 117 -50.655 7.229 -16.756 1.00 64.02 C ATOM 1912 CG PHE A 117 -51.903 6.516 -16.324 1.00 34.34 C ATOM 1913 CD1 PHE A 117 -52.476 5.543 -17.128 1.00 64.33 C ATOM 1914 CD2 PHE A 117 -52.505 6.817 -15.114 1.00 13.45 C ATOM 1915 CE1 PHE A 117 -53.624 4.884 -16.733 1.00 30.14 C ATOM 1916 CE2 PHE A 117 -53.654 6.162 -14.713 1.00 30.41 C ATOM 1917 CZ PHE A 117 -54.215 5.195 -15.524 1.00 20.33 C ATOM 0 H PHE A 117 -50.382 5.932 -18.836 1.00 44.14 H new ATOM 0 HA PHE A 117 -48.547 6.882 -17.003 1.00 1.42 H new ATOM 0 HB2 PHE A 117 -50.387 7.966 -15.999 1.00 64.02 H new ATOM 0 HB3 PHE A 117 -50.859 7.776 -17.676 1.00 64.02 H new ATOM 0 HD1 PHE A 117 -52.019 5.297 -18.075 1.00 64.33 H new ATOM 0 HD2 PHE A 117 -52.071 7.573 -14.476 1.00 13.45 H new ATOM 0 HE1 PHE A 117 -54.059 4.127 -17.369 1.00 30.14 H new ATOM 0 HE2 PHE A 117 -54.113 6.406 -13.766 1.00 30.41 H new ATOM 0 HZ PHE A 117 -55.114 4.683 -15.213 1.00 20.33 H new ATOM 1927 N GLY A 118 -49.998 4.128 -16.033 1.00 31.31 N ATOM 1928 CA GLY A 118 -49.975 3.096 -15.013 1.00 23.43 C ATOM 1929 C GLY A 118 -50.818 3.455 -13.805 1.00 64.45 C ATOM 1930 O GLY A 118 -52.044 3.355 -13.846 1.00 32.11 O ATOM 0 H GLY A 118 -50.522 3.887 -16.874 1.00 31.31 H new ATOM 0 HA2 GLY A 118 -50.337 2.160 -15.439 1.00 23.43 H new ATOM 0 HA3 GLY A 118 -48.946 2.925 -14.696 1.00 23.43 H new ATOM 1934 N ARG A 119 -50.160 3.871 -12.728 1.00 74.11 N ATOM 1935 CA ARG A 119 -50.859 4.243 -11.504 1.00 23.52 C ATOM 1936 C ARG A 119 -51.640 5.538 -11.695 1.00 20.11 C ATOM 1937 O ARG A 119 -51.057 6.600 -11.913 1.00 21.13 O ATOM 1938 CB ARG A 119 -49.863 4.400 -10.352 1.00 72.10 C ATOM 1939 CG ARG A 119 -48.913 3.223 -10.203 1.00 34.23 C ATOM 1940 CD ARG A 119 -48.672 2.883 -8.740 1.00 70.01 C ATOM 1941 NE ARG A 119 -47.265 2.606 -8.467 1.00 13.23 N ATOM 1942 CZ ARG A 119 -46.313 3.534 -8.500 1.00 74.44 C ATOM 1943 NH1 ARG A 119 -46.618 4.790 -8.794 1.00 62.45 N ATOM 1944 NH2 ARG A 119 -45.055 3.204 -8.240 1.00 32.54 N ATOM 0 H ARG A 119 -49.145 3.959 -12.678 1.00 74.11 H new ATOM 0 HA ARG A 119 -51.564 3.448 -11.262 1.00 23.52 H new ATOM 0 HB2 ARG A 119 -49.281 5.308 -10.508 1.00 72.10 H new ATOM 0 HB3 ARG A 119 -50.415 4.531 -9.421 1.00 72.10 H new ATOM 0 HG2 ARG A 119 -49.325 2.354 -10.716 1.00 34.23 H new ATOM 0 HG3 ARG A 119 -47.964 3.457 -10.684 1.00 34.23 H new ATOM 0 HD2 ARG A 119 -49.006 3.712 -8.116 1.00 70.01 H new ATOM 0 HD3 ARG A 119 -49.272 2.015 -8.466 1.00 70.01 H new ATOM 0 HE ARG A 119 -46.997 1.649 -8.239 1.00 13.23 H new ATOM 0 HH11 ARG A 119 -47.584 5.046 -8.995 1.00 62.45 H new ATOM 0 HH12 ARG A 119 -45.886 5.500 -8.819 1.00 62.45 H new ATOM 0 HH21 ARG A 119 -44.817 2.238 -8.015 1.00 32.54 H new ATOM 0 HH22 ARG A 119 -44.325 3.916 -8.265 1.00 32.54 H new TER 1958 ARG A 119