USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 910 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -119:sc= 0.124 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 MET CE :methyl -145:sc= -0.345 (180deg=-2.13!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.577) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 166:sc= -0.0477 (180deg=-0.402) USER MOD Single : A 16 CYS SG : rot 180:sc= -8.71! USER MOD Single : A 19 TYR OH : rot 180:sc= -0.621 USER MOD Single : A 21 SER OG : rot -14:sc= 1.5 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -134:sc= -0.312 (180deg=-2.85!) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 THR OG1 : rot -176:sc= -2.82! USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= -0.605 USER MOD Single : A 33 LYS NZ :NH3+ 169:sc= 1.16 (180deg=1.05) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 19:sc= 0.438! USER MOD Single : A 45 MET CE :methyl -178:sc= -4.38! (180deg=-4.5!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -0.234 X(o=-0.23,f=0) USER MOD Single : A 52 GLN : amide:sc= -3.69! K(o=-3.7!,f=-1.2) USER MOD Single : A 55 MET CE :methyl -120:sc= -1.67 (180deg=-7.28!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 GLN : amide:sc= -7.28! C(o=-7.3!,f=-3.9!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.823 K(o=-0.82,f=-0.086) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -7.24! C(o=-7.2!,f=-4.4!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc=-0.00195 X(o=-0.002,f=0) USER MOD Single : A 97 HIS : no HD1:sc= -0.215 X(o=-0.21,f=-0.55) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 101 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -0.32 X(o=-0.32,f=-0.066) USER MOD Single : A 104 LYS NZ :NH3+ 143:sc= -0.256 (180deg=-1.65!) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= -1.26 K(o=-1.3,f=-0.003) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.837 -7.424 -22.377 1.00 32.02 N ATOM 2 CA GLY A 1 10.864 -8.887 -22.664 1.00 10.42 C ATOM 3 C GLY A 1 9.567 -9.529 -22.172 1.00 41.40 C ATOM 4 O GLY A 1 8.739 -8.885 -21.558 1.00 22.22 O ATOM 0 H1 GLY A 1 10.901 -6.894 -23.269 1.00 32.02 H new ATOM 0 H2 GLY A 1 9.949 -7.182 -21.893 1.00 32.02 H new ATOM 0 H3 GLY A 1 11.642 -7.175 -21.768 1.00 32.02 H new ATOM 0 HA2 GLY A 1 10.982 -9.056 -23.734 1.00 10.42 H new ATOM 0 HA3 GLY A 1 11.720 -9.349 -22.172 1.00 10.42 H new ATOM 8 N SER A 2 9.381 -10.793 -22.436 1.00 1.51 N ATOM 9 CA SER A 2 8.133 -11.471 -21.983 1.00 63.01 C ATOM 10 C SER A 2 8.468 -12.792 -21.284 1.00 63.01 C ATOM 11 O SER A 2 8.171 -12.979 -20.121 1.00 62.43 O ATOM 12 CB SER A 2 7.336 -11.728 -23.261 1.00 61.43 C ATOM 13 OG SER A 2 6.122 -12.391 -22.931 1.00 75.43 O ATOM 0 H SER A 2 10.038 -11.385 -22.945 1.00 1.51 H new ATOM 0 HA SER A 2 7.574 -10.868 -21.267 1.00 63.01 H new ATOM 0 HB2 SER A 2 7.124 -10.786 -23.767 1.00 61.43 H new ATOM 0 HB3 SER A 2 7.920 -12.336 -23.952 1.00 61.43 H new ATOM 0 HG SER A 2 5.607 -12.556 -23.748 1.00 75.43 H new ATOM 19 N MET A 3 9.079 -13.707 -21.984 1.00 5.44 N ATOM 20 CA MET A 3 9.428 -15.019 -21.358 1.00 14.04 C ATOM 21 C MET A 3 10.210 -14.804 -20.058 1.00 64.42 C ATOM 22 O MET A 3 11.364 -14.426 -20.083 1.00 72.21 O ATOM 23 CB MET A 3 10.296 -15.734 -22.392 1.00 64.23 C ATOM 24 CG MET A 3 9.696 -17.107 -22.699 1.00 74.21 C ATOM 25 SD MET A 3 9.751 -18.134 -21.210 1.00 20.40 S ATOM 26 CE MET A 3 11.547 -18.121 -20.992 1.00 11.11 C ATOM 0 H MET A 3 9.353 -13.606 -22.961 1.00 5.44 H new ATOM 0 HA MET A 3 8.541 -15.596 -21.099 1.00 14.04 H new ATOM 0 HB2 MET A 3 10.358 -15.140 -23.304 1.00 64.23 H new ATOM 0 HB3 MET A 3 11.313 -15.846 -22.015 1.00 64.23 H new ATOM 0 HG2 MET A 3 8.667 -16.998 -23.041 1.00 74.21 H new ATOM 0 HG3 MET A 3 10.251 -17.586 -23.505 1.00 74.21 H new ATOM 0 HE1 MET A 3 11.873 -19.084 -20.598 1.00 11.11 H new ATOM 0 HE2 MET A 3 12.029 -17.941 -21.953 1.00 11.11 H new ATOM 0 HE3 MET A 3 11.823 -17.331 -20.294 1.00 11.11 H new ATOM 36 N PRO A 4 9.547 -15.057 -18.962 1.00 33.31 N ATOM 37 CA PRO A 4 10.185 -14.895 -17.633 1.00 4.02 C ATOM 38 C PRO A 4 11.102 -16.084 -17.332 1.00 22.32 C ATOM 39 O PRO A 4 10.821 -17.205 -17.709 1.00 0.42 O ATOM 40 CB PRO A 4 9.000 -14.868 -16.673 1.00 32.41 C ATOM 41 CG PRO A 4 7.904 -15.610 -17.373 1.00 32.35 C ATOM 42 CD PRO A 4 8.156 -15.509 -18.858 1.00 12.32 C ATOM 0 HA PRO A 4 10.809 -14.004 -17.561 1.00 4.02 H new ATOM 0 HB2 PRO A 4 9.252 -15.342 -15.724 1.00 32.41 H new ATOM 0 HB3 PRO A 4 8.700 -13.845 -16.448 1.00 32.41 H new ATOM 0 HG2 PRO A 4 7.887 -16.653 -17.058 1.00 32.35 H new ATOM 0 HG3 PRO A 4 6.933 -15.185 -17.120 1.00 32.35 H new ATOM 0 HD2 PRO A 4 8.013 -16.470 -19.352 1.00 12.32 H new ATOM 0 HD3 PRO A 4 7.472 -14.803 -19.330 1.00 12.32 H new ATOM 50 N LYS A 5 12.191 -15.850 -16.655 1.00 14.34 N ATOM 51 CA LYS A 5 13.121 -16.973 -16.333 1.00 4.22 C ATOM 52 C LYS A 5 12.823 -17.519 -14.932 1.00 60.20 C ATOM 53 O LYS A 5 12.855 -16.788 -13.964 1.00 63.53 O ATOM 54 CB LYS A 5 14.519 -16.358 -16.381 1.00 14.11 C ATOM 55 CG LYS A 5 15.566 -17.472 -16.329 1.00 24.15 C ATOM 56 CD LYS A 5 16.598 -17.256 -17.438 1.00 21.24 C ATOM 57 CE LYS A 5 16.217 -18.096 -18.660 1.00 55.13 C ATOM 58 NZ LYS A 5 17.242 -19.176 -18.717 1.00 42.41 N ATOM 0 H LYS A 5 12.479 -14.934 -16.311 1.00 14.34 H new ATOM 0 HA LYS A 5 13.019 -17.806 -17.029 1.00 4.22 H new ATOM 0 HB2 LYS A 5 14.640 -15.773 -17.293 1.00 14.11 H new ATOM 0 HB3 LYS A 5 14.657 -15.675 -15.543 1.00 14.11 H new ATOM 0 HG2 LYS A 5 16.058 -17.478 -15.356 1.00 24.15 H new ATOM 0 HG3 LYS A 5 15.085 -18.443 -16.449 1.00 24.15 H new ATOM 0 HD2 LYS A 5 16.642 -16.201 -17.708 1.00 21.24 H new ATOM 0 HD3 LYS A 5 17.591 -17.537 -17.086 1.00 21.24 H new ATOM 0 HE2 LYS A 5 15.213 -18.509 -18.558 1.00 55.13 H new ATOM 0 HE3 LYS A 5 16.224 -17.496 -19.570 1.00 55.13 H new ATOM 0 HZ1 LYS A 5 17.049 -19.795 -19.530 1.00 42.41 H new ATOM 0 HZ2 LYS A 5 18.186 -18.753 -18.820 1.00 42.41 H new ATOM 0 HZ3 LYS A 5 17.207 -19.735 -17.840 1.00 42.41 H new ATOM 72 N PRO A 6 12.541 -18.794 -14.875 1.00 60.33 N ATOM 73 CA PRO A 6 12.234 -19.445 -13.577 1.00 33.13 C ATOM 74 C PRO A 6 13.509 -19.599 -12.742 1.00 51.32 C ATOM 75 O PRO A 6 14.356 -20.420 -13.028 1.00 14.14 O ATOM 76 CB PRO A 6 11.683 -20.809 -13.985 1.00 65.03 C ATOM 77 CG PRO A 6 12.265 -21.075 -15.336 1.00 14.54 C ATOM 78 CD PRO A 6 12.481 -19.738 -15.995 1.00 31.33 C ATOM 0 HA PRO A 6 11.537 -18.874 -12.964 1.00 33.13 H new ATOM 0 HB2 PRO A 6 11.973 -21.581 -13.272 1.00 65.03 H new ATOM 0 HB3 PRO A 6 10.594 -20.800 -14.020 1.00 65.03 H new ATOM 0 HG2 PRO A 6 13.206 -21.619 -15.250 1.00 14.54 H new ATOM 0 HG3 PRO A 6 11.592 -21.693 -15.930 1.00 14.54 H new ATOM 0 HD2 PRO A 6 13.402 -19.725 -16.578 1.00 31.33 H new ATOM 0 HD3 PRO A 6 11.668 -19.494 -16.679 1.00 31.33 H new ATOM 86 N GLY A 7 13.650 -18.811 -11.711 1.00 30.20 N ATOM 87 CA GLY A 7 14.868 -18.910 -10.858 1.00 43.03 C ATOM 88 C GLY A 7 15.049 -20.344 -10.386 1.00 42.32 C ATOM 89 O GLY A 7 14.387 -21.255 -10.848 1.00 53.51 O ATOM 0 H GLY A 7 12.974 -18.103 -11.423 1.00 30.20 H new ATOM 0 HA2 GLY A 7 15.745 -18.589 -11.421 1.00 43.03 H new ATOM 0 HA3 GLY A 7 14.778 -18.243 -10.000 1.00 43.03 H new ATOM 93 N ILE A 8 15.941 -20.547 -9.460 1.00 23.40 N ATOM 94 CA ILE A 8 16.177 -21.917 -8.931 1.00 43.13 C ATOM 95 C ILE A 8 14.842 -22.651 -8.762 1.00 61.53 C ATOM 96 O ILE A 8 13.979 -22.233 -8.017 1.00 74.44 O ATOM 97 CB ILE A 8 16.862 -21.700 -7.574 1.00 73.14 C ATOM 98 CG1 ILE A 8 16.676 -22.941 -6.709 1.00 4.31 C ATOM 99 CG2 ILE A 8 16.244 -20.493 -6.858 1.00 32.02 C ATOM 100 CD1 ILE A 8 17.925 -23.166 -5.853 1.00 65.34 C ATOM 0 H ILE A 8 16.521 -19.818 -9.044 1.00 23.40 H new ATOM 0 HA ILE A 8 16.787 -22.527 -9.598 1.00 43.13 H new ATOM 0 HB ILE A 8 17.924 -21.516 -7.739 1.00 73.14 H new ATOM 0 HG12 ILE A 8 15.802 -22.822 -6.069 1.00 4.31 H new ATOM 0 HG13 ILE A 8 16.494 -23.811 -7.339 1.00 4.31 H new ATOM 0 HG21 ILE A 8 16.737 -20.348 -5.897 1.00 32.02 H new ATOM 0 HG22 ILE A 8 16.374 -19.601 -7.471 1.00 32.02 H new ATOM 0 HG23 ILE A 8 15.181 -20.671 -6.697 1.00 32.02 H new ATOM 0 HD11 ILE A 8 17.788 -24.054 -5.236 1.00 65.34 H new ATOM 0 HD12 ILE A 8 18.790 -23.304 -6.501 1.00 65.34 H new ATOM 0 HD13 ILE A 8 18.087 -22.300 -5.211 1.00 65.34 H new ATOM 112 N LEU A 9 14.666 -23.744 -9.457 1.00 22.51 N ATOM 113 CA LEU A 9 13.387 -24.502 -9.344 1.00 1.34 C ATOM 114 C LEU A 9 13.662 -25.958 -8.952 1.00 21.20 C ATOM 115 O LEU A 9 12.888 -26.846 -9.248 1.00 70.22 O ATOM 116 CB LEU A 9 12.763 -24.433 -10.738 1.00 72.11 C ATOM 117 CG LEU A 9 13.650 -25.185 -11.731 1.00 11.41 C ATOM 118 CD1 LEU A 9 12.804 -26.195 -12.509 1.00 62.30 C ATOM 119 CD2 LEU A 9 14.281 -24.189 -12.707 1.00 50.41 C ATOM 0 H LEU A 9 15.352 -24.144 -10.097 1.00 22.51 H new ATOM 0 HA LEU A 9 12.730 -24.088 -8.579 1.00 1.34 H new ATOM 0 HB2 LEU A 9 11.764 -24.869 -10.723 1.00 72.11 H new ATOM 0 HB3 LEU A 9 12.652 -23.394 -11.048 1.00 72.11 H new ATOM 0 HG LEU A 9 14.436 -25.711 -11.189 1.00 11.41 H new ATOM 0 HD11 LEU A 9 13.437 -26.731 -13.217 1.00 62.30 H new ATOM 0 HD12 LEU A 9 12.355 -26.905 -11.814 1.00 62.30 H new ATOM 0 HD13 LEU A 9 12.017 -25.670 -13.051 1.00 62.30 H new ATOM 0 HD21 LEU A 9 14.913 -24.724 -13.415 1.00 50.41 H new ATOM 0 HD22 LEU A 9 13.495 -23.663 -13.248 1.00 50.41 H new ATOM 0 HD23 LEU A 9 14.885 -23.470 -12.153 1.00 50.41 H new ATOM 131 N LYS A 10 14.758 -26.208 -8.291 1.00 52.14 N ATOM 132 CA LYS A 10 15.079 -27.607 -7.885 1.00 2.43 C ATOM 133 C LYS A 10 13.902 -28.215 -7.115 1.00 34.50 C ATOM 134 O LYS A 10 13.718 -27.955 -5.942 1.00 52.42 O ATOM 135 CB LYS A 10 16.308 -27.486 -6.986 1.00 42.13 C ATOM 136 CG LYS A 10 17.413 -26.737 -7.735 1.00 32.22 C ATOM 137 CD LYS A 10 18.780 -27.214 -7.237 1.00 13.12 C ATOM 138 CE LYS A 10 19.743 -27.325 -8.422 1.00 3.31 C ATOM 139 NZ LYS A 10 19.811 -25.949 -8.987 1.00 13.04 N ATOM 0 H LYS A 10 15.445 -25.506 -8.014 1.00 52.14 H new ATOM 0 HA LYS A 10 15.266 -28.255 -8.741 1.00 2.43 H new ATOM 0 HB2 LYS A 10 16.051 -26.956 -6.069 1.00 42.13 H new ATOM 0 HB3 LYS A 10 16.658 -28.476 -6.694 1.00 42.13 H new ATOM 0 HG2 LYS A 10 17.323 -26.912 -8.807 1.00 32.22 H new ATOM 0 HG3 LYS A 10 17.311 -25.663 -7.577 1.00 32.22 H new ATOM 0 HD2 LYS A 10 19.174 -26.516 -6.498 1.00 13.12 H new ATOM 0 HD3 LYS A 10 18.682 -28.180 -6.742 1.00 13.12 H new ATOM 0 HE2 LYS A 10 20.726 -27.670 -8.102 1.00 3.31 H new ATOM 0 HE3 LYS A 10 19.380 -28.039 -9.161 1.00 3.31 H new ATOM 0 HZ1 LYS A 10 20.697 -25.836 -9.519 1.00 13.04 H new ATOM 0 HZ2 LYS A 10 19.003 -25.795 -9.623 1.00 13.04 H new ATOM 0 HZ3 LYS A 10 19.780 -25.254 -8.214 1.00 13.04 H new ATOM 153 N SER A 11 13.105 -29.017 -7.766 1.00 62.04 N ATOM 154 CA SER A 11 11.942 -29.639 -7.073 1.00 3.15 C ATOM 155 C SER A 11 10.962 -28.557 -6.610 1.00 71.23 C ATOM 156 O SER A 11 10.950 -28.170 -5.458 1.00 23.25 O ATOM 157 CB SER A 11 12.536 -30.373 -5.874 1.00 50.23 C ATOM 158 OG SER A 11 11.577 -31.296 -5.367 1.00 21.42 O ATOM 0 H SER A 11 13.209 -29.269 -8.749 1.00 62.04 H new ATOM 0 HA SER A 11 11.387 -30.313 -7.726 1.00 3.15 H new ATOM 0 HB2 SER A 11 13.444 -30.899 -6.168 1.00 50.23 H new ATOM 0 HB3 SER A 11 12.817 -29.660 -5.099 1.00 50.23 H new ATOM 0 HG SER A 11 11.955 -31.771 -4.598 1.00 21.42 H new ATOM 164 N LYS A 12 10.143 -28.065 -7.496 1.00 24.04 N ATOM 165 CA LYS A 12 9.168 -27.007 -7.104 1.00 1.03 C ATOM 166 C LYS A 12 7.776 -27.338 -7.657 1.00 70.15 C ATOM 167 O LYS A 12 7.347 -26.790 -8.652 1.00 2.31 O ATOM 168 CB LYS A 12 9.704 -25.720 -7.734 1.00 12.32 C ATOM 169 CG LYS A 12 8.766 -24.560 -7.403 1.00 60.41 C ATOM 170 CD LYS A 12 9.126 -23.349 -8.268 1.00 15.23 C ATOM 171 CE LYS A 12 8.444 -23.475 -9.632 1.00 30.34 C ATOM 172 NZ LYS A 12 8.786 -22.215 -10.350 1.00 60.24 N ATOM 0 H LYS A 12 10.105 -28.349 -8.475 1.00 24.04 H new ATOM 0 HA LYS A 12 9.067 -26.919 -6.022 1.00 1.03 H new ATOM 0 HB2 LYS A 12 10.706 -25.509 -7.360 1.00 12.32 H new ATOM 0 HB3 LYS A 12 9.786 -25.838 -8.814 1.00 12.32 H new ATOM 0 HG2 LYS A 12 7.731 -24.853 -7.581 1.00 60.41 H new ATOM 0 HG3 LYS A 12 8.847 -24.303 -6.347 1.00 60.41 H new ATOM 0 HD2 LYS A 12 8.810 -22.430 -7.775 1.00 15.23 H new ATOM 0 HD3 LYS A 12 10.207 -23.287 -8.394 1.00 15.23 H new ATOM 0 HE2 LYS A 12 8.804 -24.349 -10.175 1.00 30.34 H new ATOM 0 HE3 LYS A 12 7.365 -23.588 -9.525 1.00 30.34 H new ATOM 0 HZ1 LYS A 12 8.353 -22.226 -11.296 1.00 60.24 H new ATOM 0 HZ2 LYS A 12 8.425 -21.401 -9.813 1.00 60.24 H new ATOM 0 HZ3 LYS A 12 9.819 -22.138 -10.443 1.00 60.24 H new ATOM 186 N SER A 13 7.070 -28.230 -7.015 1.00 62.42 N ATOM 187 CA SER A 13 5.707 -28.597 -7.497 1.00 42.42 C ATOM 188 C SER A 13 4.793 -28.893 -6.305 1.00 63.02 C ATOM 189 O SER A 13 4.681 -30.018 -5.861 1.00 4.14 O ATOM 190 CB SER A 13 5.912 -29.853 -8.343 1.00 10.25 C ATOM 191 OG SER A 13 4.659 -30.283 -8.855 1.00 20.12 O ATOM 0 H SER A 13 7.379 -28.721 -6.176 1.00 62.42 H new ATOM 0 HA SER A 13 5.237 -27.796 -8.068 1.00 42.42 H new ATOM 0 HB2 SER A 13 6.601 -29.645 -9.162 1.00 10.25 H new ATOM 0 HB3 SER A 13 6.362 -30.642 -7.740 1.00 10.25 H new ATOM 0 HG SER A 13 4.787 -31.088 -9.400 1.00 20.12 H new ATOM 197 N MET A 14 4.142 -27.891 -5.780 1.00 2.31 N ATOM 198 CA MET A 14 3.242 -28.120 -4.613 1.00 64.04 C ATOM 199 C MET A 14 1.792 -28.276 -5.077 1.00 62.52 C ATOM 200 O MET A 14 1.504 -28.313 -6.258 1.00 0.25 O ATOM 201 CB MET A 14 3.391 -26.867 -3.748 1.00 20.12 C ATOM 202 CG MET A 14 3.833 -27.269 -2.339 1.00 3.30 C ATOM 203 SD MET A 14 3.216 -26.057 -1.145 1.00 22.40 S ATOM 204 CE MET A 14 1.917 -27.088 -0.422 1.00 40.24 C ATOM 0 H MET A 14 4.194 -26.926 -6.107 1.00 2.31 H new ATOM 0 HA MET A 14 3.500 -29.029 -4.070 1.00 64.04 H new ATOM 0 HB2 MET A 14 4.122 -26.191 -4.191 1.00 20.12 H new ATOM 0 HB3 MET A 14 2.445 -26.328 -3.704 1.00 20.12 H new ATOM 0 HG2 MET A 14 3.452 -28.261 -2.096 1.00 3.30 H new ATOM 0 HG3 MET A 14 4.920 -27.324 -2.289 1.00 3.30 H new ATOM 0 HE1 MET A 14 1.566 -26.634 0.505 1.00 40.24 H new ATOM 0 HE2 MET A 14 1.086 -27.171 -1.123 1.00 40.24 H new ATOM 0 HE3 MET A 14 2.315 -28.081 -0.212 1.00 40.24 H new ATOM 214 N PHE A 15 0.876 -28.365 -4.152 1.00 11.12 N ATOM 215 CA PHE A 15 -0.558 -28.515 -4.527 1.00 52.31 C ATOM 216 C PHE A 15 -1.319 -27.231 -4.182 1.00 22.22 C ATOM 217 O PHE A 15 -1.075 -26.610 -3.166 1.00 30.02 O ATOM 218 CB PHE A 15 -1.057 -29.695 -3.680 1.00 14.53 C ATOM 219 CG PHE A 15 -2.550 -29.591 -3.472 1.00 65.01 C ATOM 220 CD1 PHE A 15 -3.060 -28.737 -2.486 1.00 4.24 C ATOM 221 CD2 PHE A 15 -3.423 -30.346 -4.263 1.00 53.12 C ATOM 222 CE1 PHE A 15 -4.442 -28.638 -2.293 1.00 61.22 C ATOM 223 CE2 PHE A 15 -4.805 -30.247 -4.069 1.00 4.21 C ATOM 224 CZ PHE A 15 -5.315 -29.394 -3.084 1.00 12.21 C ATOM 0 H PHE A 15 1.060 -28.340 -3.149 1.00 11.12 H new ATOM 0 HA PHE A 15 -0.704 -28.692 -5.593 1.00 52.31 H new ATOM 0 HB2 PHE A 15 -0.816 -30.636 -4.175 1.00 14.53 H new ATOM 0 HB3 PHE A 15 -0.547 -29.702 -2.716 1.00 14.53 H new ATOM 0 HD1 PHE A 15 -2.386 -28.155 -1.875 1.00 4.24 H new ATOM 0 HD2 PHE A 15 -3.030 -31.005 -5.023 1.00 53.12 H new ATOM 0 HE1 PHE A 15 -4.835 -27.978 -1.534 1.00 61.22 H new ATOM 0 HE2 PHE A 15 -5.479 -30.829 -4.680 1.00 4.21 H new ATOM 0 HZ PHE A 15 -6.382 -29.319 -2.934 1.00 12.21 H new ATOM 234 N CYS A 16 -2.239 -26.828 -5.014 1.00 50.04 N ATOM 235 CA CYS A 16 -3.006 -25.585 -4.715 1.00 44.12 C ATOM 236 C CYS A 16 -4.493 -25.790 -5.025 1.00 42.02 C ATOM 237 O CYS A 16 -4.859 -26.613 -5.840 1.00 24.00 O ATOM 238 CB CYS A 16 -2.378 -24.499 -5.605 1.00 24.11 C ATOM 239 SG CYS A 16 -3.125 -24.507 -7.259 1.00 50.43 S ATOM 0 H CYS A 16 -2.492 -27.301 -5.882 1.00 50.04 H new ATOM 0 HA CYS A 16 -2.955 -25.305 -3.663 1.00 44.12 H new ATOM 0 HB2 CYS A 16 -2.515 -23.521 -5.144 1.00 24.11 H new ATOM 0 HB3 CYS A 16 -1.304 -24.665 -5.686 1.00 24.11 H new ATOM 0 HG CYS A 16 -2.577 -23.579 -7.987 1.00 50.43 H new ATOM 245 N VAL A 17 -5.351 -25.056 -4.373 1.00 71.43 N ATOM 246 CA VAL A 17 -6.812 -25.217 -4.626 1.00 34.12 C ATOM 247 C VAL A 17 -7.374 -23.966 -5.304 1.00 31.21 C ATOM 248 O VAL A 17 -7.162 -22.855 -4.861 1.00 45.05 O ATOM 249 CB VAL A 17 -7.445 -25.401 -3.245 1.00 61.04 C ATOM 250 CG1 VAL A 17 -8.820 -26.051 -3.397 1.00 21.21 C ATOM 251 CG2 VAL A 17 -6.553 -26.297 -2.381 1.00 51.35 C ATOM 0 H VAL A 17 -5.105 -24.352 -3.677 1.00 71.43 H new ATOM 0 HA VAL A 17 -7.020 -26.060 -5.285 1.00 34.12 H new ATOM 0 HB VAL A 17 -7.551 -24.427 -2.766 1.00 61.04 H new ATOM 0 HG11 VAL A 17 -9.271 -26.182 -2.413 1.00 21.21 H new ATOM 0 HG12 VAL A 17 -9.459 -25.412 -4.007 1.00 21.21 H new ATOM 0 HG13 VAL A 17 -8.712 -27.023 -3.879 1.00 21.21 H new ATOM 0 HG21 VAL A 17 -7.008 -26.425 -1.399 1.00 51.35 H new ATOM 0 HG22 VAL A 17 -6.443 -27.270 -2.859 1.00 51.35 H new ATOM 0 HG23 VAL A 17 -5.572 -25.835 -2.269 1.00 51.35 H new ATOM 261 N ILE A 18 -8.093 -24.141 -6.378 1.00 70.41 N ATOM 262 CA ILE A 18 -8.674 -22.966 -7.091 1.00 73.11 C ATOM 263 C ILE A 18 -10.138 -22.758 -6.683 1.00 3.14 C ATOM 264 O ILE A 18 -10.998 -23.556 -6.994 1.00 3.11 O ATOM 265 CB ILE A 18 -8.570 -23.318 -8.575 1.00 43.32 C ATOM 266 CG1 ILE A 18 -7.141 -23.059 -9.059 1.00 74.22 C ATOM 267 CG2 ILE A 18 -9.541 -22.455 -9.386 1.00 50.14 C ATOM 268 CD1 ILE A 18 -6.402 -24.392 -9.209 1.00 63.52 C ATOM 0 H ILE A 18 -8.304 -25.048 -6.794 1.00 70.41 H new ATOM 0 HA ILE A 18 -8.152 -22.039 -6.853 1.00 73.11 H new ATOM 0 HB ILE A 18 -8.823 -24.369 -8.712 1.00 43.32 H new ATOM 0 HG12 ILE A 18 -7.159 -22.532 -10.013 1.00 74.22 H new ATOM 0 HG13 ILE A 18 -6.616 -22.418 -8.350 1.00 74.22 H new ATOM 0 HG21 ILE A 18 -9.461 -22.712 -10.442 1.00 50.14 H new ATOM 0 HG22 ILE A 18 -10.560 -22.636 -9.045 1.00 50.14 H new ATOM 0 HG23 ILE A 18 -9.294 -21.402 -9.249 1.00 50.14 H new ATOM 0 HD11 ILE A 18 -5.385 -24.207 -9.554 1.00 63.52 H new ATOM 0 HD12 ILE A 18 -6.372 -24.902 -8.246 1.00 63.52 H new ATOM 0 HD13 ILE A 18 -6.923 -25.017 -9.934 1.00 63.52 H new ATOM 280 N TYR A 19 -10.425 -21.684 -5.998 1.00 60.41 N ATOM 281 CA TYR A 19 -11.831 -21.415 -5.582 1.00 43.12 C ATOM 282 C TYR A 19 -12.529 -20.556 -6.639 1.00 60.33 C ATOM 283 O TYR A 19 -11.891 -19.857 -7.401 1.00 10.21 O ATOM 284 CB TYR A 19 -11.719 -20.646 -4.267 1.00 42.34 C ATOM 285 CG TYR A 19 -11.502 -21.616 -3.129 1.00 52.42 C ATOM 286 CD1 TYR A 19 -10.213 -22.078 -2.839 1.00 31.34 C ATOM 287 CD2 TYR A 19 -12.590 -22.052 -2.363 1.00 1.21 C ATOM 288 CE1 TYR A 19 -10.011 -22.977 -1.786 1.00 61.22 C ATOM 289 CE2 TYR A 19 -12.387 -22.950 -1.308 1.00 11.53 C ATOM 290 CZ TYR A 19 -11.098 -23.415 -1.019 1.00 14.02 C ATOM 291 OH TYR A 19 -10.900 -24.301 0.019 1.00 34.13 O ATOM 0 H TYR A 19 -9.745 -20.981 -5.708 1.00 60.41 H new ATOM 0 HA TYR A 19 -12.411 -22.331 -5.469 1.00 43.12 H new ATOM 0 HB2 TYR A 19 -10.892 -19.938 -4.317 1.00 42.34 H new ATOM 0 HB3 TYR A 19 -12.625 -20.065 -4.095 1.00 42.34 H new ATOM 0 HD1 TYR A 19 -9.374 -21.740 -3.429 1.00 31.34 H new ATOM 0 HD2 TYR A 19 -13.585 -21.696 -2.586 1.00 1.21 H new ATOM 0 HE1 TYR A 19 -9.016 -23.334 -1.564 1.00 61.22 H new ATOM 0 HE2 TYR A 19 -13.226 -23.285 -0.716 1.00 11.53 H new ATOM 0 HH TYR A 19 -11.759 -24.500 0.447 1.00 34.13 H new ATOM 301 N ARG A 20 -13.831 -20.594 -6.689 1.00 30.15 N ATOM 302 CA ARG A 20 -14.552 -19.770 -7.699 1.00 42.30 C ATOM 303 C ARG A 20 -15.581 -18.868 -7.012 1.00 62.01 C ATOM 304 O ARG A 20 -16.254 -19.266 -6.082 1.00 43.30 O ATOM 305 CB ARG A 20 -15.243 -20.777 -8.625 1.00 52.14 C ATOM 306 CG ARG A 20 -16.367 -21.494 -7.869 1.00 71.35 C ATOM 307 CD ARG A 20 -17.270 -22.216 -8.871 1.00 55.03 C ATOM 308 NE ARG A 20 -18.323 -22.862 -8.039 1.00 42.31 N ATOM 309 CZ ARG A 20 -19.240 -23.597 -8.605 1.00 40.14 C ATOM 310 NH1 ARG A 20 -18.895 -24.608 -9.355 1.00 41.40 N ATOM 311 NH2 ARG A 20 -20.503 -23.323 -8.419 1.00 65.12 N ATOM 0 H ARG A 20 -14.424 -21.156 -6.079 1.00 30.15 H new ATOM 0 HA ARG A 20 -13.878 -19.115 -8.250 1.00 42.30 H new ATOM 0 HB2 ARG A 20 -15.649 -20.264 -9.497 1.00 52.14 H new ATOM 0 HB3 ARG A 20 -14.518 -21.504 -8.992 1.00 52.14 H new ATOM 0 HG2 ARG A 20 -15.947 -22.208 -7.161 1.00 71.35 H new ATOM 0 HG3 ARG A 20 -16.948 -20.775 -7.291 1.00 71.35 H new ATOM 0 HD2 ARG A 20 -17.704 -21.518 -9.586 1.00 55.03 H new ATOM 0 HD3 ARG A 20 -16.711 -22.955 -9.446 1.00 55.03 H new ATOM 0 HE ARG A 20 -18.327 -22.730 -7.028 1.00 42.31 H new ATOM 0 HH11 ARG A 20 -17.908 -24.823 -9.498 1.00 41.40 H new ATOM 0 HH12 ARG A 20 -19.612 -25.183 -9.798 1.00 41.40 H new ATOM 0 HH21 ARG A 20 -20.773 -22.534 -7.831 1.00 65.12 H new ATOM 0 HH22 ARG A 20 -21.220 -23.898 -8.862 1.00 65.12 H new ATOM 325 N SER A 21 -15.701 -17.646 -7.460 1.00 55.03 N ATOM 326 CA SER A 21 -16.683 -16.715 -6.832 1.00 53.30 C ATOM 327 C SER A 21 -18.109 -17.109 -7.227 1.00 44.02 C ATOM 328 O SER A 21 -18.438 -17.200 -8.395 1.00 30.22 O ATOM 329 CB SER A 21 -16.333 -15.336 -7.391 1.00 12.42 C ATOM 330 OG SER A 21 -15.063 -14.935 -6.892 1.00 14.03 O ATOM 0 H SER A 21 -15.162 -17.253 -8.232 1.00 55.03 H new ATOM 0 HA SER A 21 -16.637 -16.737 -5.743 1.00 53.30 H new ATOM 0 HB2 SER A 21 -16.315 -15.366 -8.480 1.00 12.42 H new ATOM 0 HB3 SER A 21 -17.095 -14.611 -7.105 1.00 12.42 H new ATOM 0 HG SER A 21 -14.809 -15.513 -6.143 1.00 14.03 H new ATOM 336 N SER A 22 -18.960 -17.343 -6.265 1.00 30.00 N ATOM 337 CA SER A 22 -20.363 -17.733 -6.591 1.00 2.25 C ATOM 338 C SER A 22 -20.933 -16.816 -7.675 1.00 65.23 C ATOM 339 O SER A 22 -21.627 -17.258 -8.569 1.00 21.22 O ATOM 340 CB SER A 22 -21.136 -17.563 -5.282 1.00 40.33 C ATOM 341 OG SER A 22 -21.744 -18.798 -4.934 1.00 54.15 O ATOM 0 H SER A 22 -18.746 -17.281 -5.270 1.00 30.00 H new ATOM 0 HA SER A 22 -20.428 -18.751 -6.974 1.00 2.25 H new ATOM 0 HB2 SER A 22 -20.463 -17.239 -4.488 1.00 40.33 H new ATOM 0 HB3 SER A 22 -21.895 -16.789 -5.392 1.00 40.33 H new ATOM 0 HG SER A 22 -22.239 -18.694 -4.095 1.00 54.15 H new ATOM 347 N LYS A 23 -20.651 -15.545 -7.604 1.00 1.11 N ATOM 348 CA LYS A 23 -21.181 -14.608 -8.637 1.00 65.11 C ATOM 349 C LYS A 23 -20.221 -13.431 -8.832 1.00 23.03 C ATOM 350 O LYS A 23 -20.267 -12.452 -8.113 1.00 30.33 O ATOM 351 CB LYS A 23 -22.522 -14.122 -8.087 1.00 50.42 C ATOM 352 CG LYS A 23 -22.310 -13.481 -6.712 1.00 74.41 C ATOM 353 CD LYS A 23 -23.102 -14.256 -5.658 1.00 15.32 C ATOM 354 CE LYS A 23 -22.608 -13.874 -4.262 1.00 5.22 C ATOM 355 NZ LYS A 23 -21.172 -14.269 -4.242 1.00 50.04 N ATOM 0 H LYS A 23 -20.078 -15.114 -6.878 1.00 1.11 H new ATOM 0 HA LYS A 23 -21.291 -15.090 -9.609 1.00 65.11 H new ATOM 0 HB2 LYS A 23 -22.967 -13.400 -8.771 1.00 50.42 H new ATOM 0 HB3 LYS A 23 -23.218 -14.957 -8.007 1.00 50.42 H new ATOM 0 HG2 LYS A 23 -21.250 -13.482 -6.459 1.00 74.41 H new ATOM 0 HG3 LYS A 23 -22.632 -12.440 -6.731 1.00 74.41 H new ATOM 0 HD2 LYS A 23 -24.165 -14.035 -5.752 1.00 15.32 H new ATOM 0 HD3 LYS A 23 -22.985 -15.328 -5.816 1.00 15.32 H new ATOM 0 HE2 LYS A 23 -22.726 -12.806 -4.080 1.00 5.22 H new ATOM 0 HE3 LYS A 23 -23.172 -14.394 -3.487 1.00 5.22 H new ATOM 0 HZ1 LYS A 23 -20.964 -14.776 -3.358 1.00 50.04 H new ATOM 0 HZ2 LYS A 23 -20.971 -14.889 -5.052 1.00 50.04 H new ATOM 0 HZ3 LYS A 23 -20.577 -13.418 -4.301 1.00 50.04 H new ATOM 369 N ARG A 24 -19.356 -13.520 -9.802 1.00 41.42 N ATOM 370 CA ARG A 24 -18.394 -12.407 -10.054 1.00 73.14 C ATOM 371 C ARG A 24 -17.887 -12.471 -11.494 1.00 64.13 C ATOM 372 O ARG A 24 -18.390 -13.221 -12.306 1.00 24.13 O ATOM 373 CB ARG A 24 -17.250 -12.640 -9.065 1.00 70.31 C ATOM 374 CG ARG A 24 -17.449 -11.754 -7.833 1.00 33.22 C ATOM 375 CD ARG A 24 -17.551 -10.289 -8.266 1.00 51.03 C ATOM 376 NE ARG A 24 -19.004 -9.971 -8.209 1.00 13.14 N ATOM 377 CZ ARG A 24 -19.396 -8.749 -7.969 1.00 22.31 C ATOM 378 NH1 ARG A 24 -18.907 -8.097 -6.949 1.00 13.13 N ATOM 379 NH2 ARG A 24 -20.274 -8.182 -8.748 1.00 5.42 N ATOM 0 H ARG A 24 -19.272 -14.316 -10.434 1.00 41.42 H new ATOM 0 HA ARG A 24 -18.848 -11.425 -9.921 1.00 73.14 H new ATOM 0 HB2 ARG A 24 -17.219 -13.689 -8.770 1.00 70.31 H new ATOM 0 HB3 ARG A 24 -16.295 -12.413 -9.538 1.00 70.31 H new ATOM 0 HG2 ARG A 24 -18.353 -12.051 -7.301 1.00 33.22 H new ATOM 0 HG3 ARG A 24 -16.616 -11.882 -7.142 1.00 33.22 H new ATOM 0 HD2 ARG A 24 -16.979 -9.641 -7.603 1.00 51.03 H new ATOM 0 HD3 ARG A 24 -17.155 -10.146 -9.271 1.00 51.03 H new ATOM 0 HE ARG A 24 -19.693 -10.708 -8.357 1.00 13.14 H new ATOM 0 HH11 ARG A 24 -18.220 -8.542 -6.341 1.00 13.13 H new ATOM 0 HH12 ARG A 24 -19.212 -7.142 -6.760 1.00 13.13 H new ATOM 0 HH21 ARG A 24 -20.654 -8.693 -9.545 1.00 5.42 H new ATOM 0 HH22 ARG A 24 -20.581 -7.227 -8.561 1.00 5.42 H new ATOM 393 N ASP A 25 -16.890 -11.694 -11.819 1.00 63.13 N ATOM 394 CA ASP A 25 -16.355 -11.716 -13.210 1.00 65.11 C ATOM 395 C ASP A 25 -15.340 -12.853 -13.368 1.00 34.12 C ATOM 396 O ASP A 25 -14.195 -12.633 -13.707 1.00 61.05 O ATOM 397 CB ASP A 25 -15.675 -10.359 -13.397 1.00 63.23 C ATOM 398 CG ASP A 25 -15.975 -9.828 -14.799 1.00 12.52 C ATOM 399 OD1 ASP A 25 -16.370 -10.619 -15.639 1.00 61.23 O ATOM 400 OD2 ASP A 25 -15.806 -8.638 -15.008 1.00 21.34 O ATOM 0 H ASP A 25 -16.424 -11.047 -11.183 1.00 63.13 H new ATOM 0 HA ASP A 25 -17.137 -11.883 -13.950 1.00 65.11 H new ATOM 0 HB2 ASP A 25 -16.032 -9.655 -12.646 1.00 63.23 H new ATOM 0 HB3 ASP A 25 -14.599 -10.457 -13.256 1.00 63.23 H new ATOM 405 N GLN A 26 -15.757 -14.065 -13.128 1.00 2.13 N ATOM 406 CA GLN A 26 -14.821 -15.218 -13.266 1.00 62.04 C ATOM 407 C GLN A 26 -13.600 -15.023 -12.363 1.00 14.23 C ATOM 408 O GLN A 26 -12.469 -15.138 -12.795 1.00 52.14 O ATOM 409 CB GLN A 26 -14.412 -15.220 -14.740 1.00 51.12 C ATOM 410 CG GLN A 26 -15.663 -15.335 -15.614 1.00 22.22 C ATOM 411 CD GLN A 26 -15.268 -15.242 -17.089 1.00 32.23 C ATOM 412 OE1 GLN A 26 -14.540 -16.076 -17.589 1.00 34.04 O ATOM 413 NE2 GLN A 26 -15.722 -14.255 -17.813 1.00 62.04 N ATOM 0 H GLN A 26 -16.706 -14.308 -12.842 1.00 2.13 H new ATOM 0 HA GLN A 26 -15.280 -16.162 -12.971 1.00 62.04 H new ATOM 0 HB2 GLN A 26 -13.870 -14.305 -14.980 1.00 51.12 H new ATOM 0 HB3 GLN A 26 -13.737 -16.052 -14.940 1.00 51.12 H new ATOM 0 HG2 GLN A 26 -16.168 -16.282 -15.421 1.00 22.22 H new ATOM 0 HG3 GLN A 26 -16.367 -14.541 -15.365 1.00 22.22 H new ATOM 0 HE21 GLN A 26 -16.333 -13.554 -17.394 1.00 62.04 H new ATOM 0 HE22 GLN A 26 -15.465 -14.185 -18.798 1.00 62.04 H new ATOM 422 N THR A 27 -13.820 -14.738 -11.106 1.00 4.32 N ATOM 423 CA THR A 27 -12.675 -14.543 -10.169 1.00 35.00 C ATOM 424 C THR A 27 -12.353 -15.860 -9.458 1.00 52.40 C ATOM 425 O THR A 27 -13.240 -16.584 -9.049 1.00 44.14 O ATOM 426 CB THR A 27 -13.161 -13.495 -9.167 1.00 40.23 C ATOM 427 OG1 THR A 27 -13.318 -12.248 -9.828 1.00 1.23 O ATOM 428 CG2 THR A 27 -12.140 -13.350 -8.035 1.00 34.10 C ATOM 0 H THR A 27 -14.744 -14.632 -10.688 1.00 4.32 H new ATOM 0 HA THR A 27 -11.766 -14.225 -10.680 1.00 35.00 H new ATOM 0 HB THR A 27 -14.117 -13.810 -8.750 1.00 40.23 H new ATOM 0 HG1 THR A 27 -13.569 -11.561 -9.176 1.00 1.23 H new ATOM 0 HG21 THR A 27 -12.490 -12.602 -7.323 1.00 34.10 H new ATOM 0 HG22 THR A 27 -12.021 -14.307 -7.527 1.00 34.10 H new ATOM 0 HG23 THR A 27 -11.181 -13.037 -8.448 1.00 34.10 H new ATOM 436 N TYR A 28 -11.097 -16.187 -9.312 1.00 32.00 N ATOM 437 CA TYR A 28 -10.744 -17.470 -8.631 1.00 14.22 C ATOM 438 C TYR A 28 -9.638 -17.251 -7.594 1.00 63.01 C ATOM 439 O TYR A 28 -8.716 -16.489 -7.801 1.00 72.01 O ATOM 440 CB TYR A 28 -10.247 -18.386 -9.749 1.00 61.24 C ATOM 441 CG TYR A 28 -11.411 -18.813 -10.612 1.00 13.41 C ATOM 442 CD1 TYR A 28 -12.015 -17.896 -11.479 1.00 53.25 C ATOM 443 CD2 TYR A 28 -11.887 -20.128 -10.545 1.00 65.13 C ATOM 444 CE1 TYR A 28 -13.092 -18.294 -12.279 1.00 41.25 C ATOM 445 CE2 TYR A 28 -12.963 -20.527 -11.345 1.00 4.21 C ATOM 446 CZ TYR A 28 -13.566 -19.608 -12.213 1.00 10.34 C ATOM 447 OH TYR A 28 -14.627 -20.002 -13.001 1.00 41.22 O ATOM 0 H TYR A 28 -10.305 -15.628 -9.631 1.00 32.00 H new ATOM 0 HA TYR A 28 -11.595 -17.892 -8.096 1.00 14.22 H new ATOM 0 HB2 TYR A 28 -9.504 -17.867 -10.354 1.00 61.24 H new ATOM 0 HB3 TYR A 28 -9.756 -19.262 -9.324 1.00 61.24 H new ATOM 0 HD1 TYR A 28 -11.650 -16.881 -11.531 1.00 53.25 H new ATOM 0 HD2 TYR A 28 -11.423 -20.836 -9.874 1.00 65.13 H new ATOM 0 HE1 TYR A 28 -13.558 -17.586 -12.948 1.00 41.25 H new ATOM 0 HE2 TYR A 28 -13.328 -21.542 -11.293 1.00 4.21 H new ATOM 0 HH TYR A 28 -14.827 -20.946 -12.832 1.00 41.22 H new ATOM 457 N LEU A 29 -9.723 -17.929 -6.479 1.00 61.14 N ATOM 458 CA LEU A 29 -8.676 -17.775 -5.426 1.00 75.33 C ATOM 459 C LEU A 29 -7.751 -18.995 -5.426 1.00 12.14 C ATOM 460 O LEU A 29 -8.127 -20.069 -5.852 1.00 71.24 O ATOM 461 CB LEU A 29 -9.450 -17.690 -4.110 1.00 21.34 C ATOM 462 CG LEU A 29 -9.387 -16.261 -3.566 1.00 72.13 C ATOM 463 CD1 LEU A 29 -10.058 -16.208 -2.192 1.00 65.43 C ATOM 464 CD2 LEU A 29 -7.925 -15.830 -3.431 1.00 53.13 C ATOM 0 H LEU A 29 -10.472 -18.583 -6.252 1.00 61.14 H new ATOM 0 HA LEU A 29 -8.049 -16.898 -5.587 1.00 75.33 H new ATOM 0 HB2 LEU A 29 -10.488 -17.984 -4.268 1.00 21.34 H new ATOM 0 HB3 LEU A 29 -9.029 -18.385 -3.384 1.00 21.34 H new ATOM 0 HG LEU A 29 -9.904 -15.590 -4.252 1.00 72.13 H new ATOM 0 HD11 LEU A 29 -10.013 -15.190 -1.804 1.00 65.43 H new ATOM 0 HD12 LEU A 29 -11.100 -16.516 -2.284 1.00 65.43 H new ATOM 0 HD13 LEU A 29 -9.540 -16.880 -1.508 1.00 65.43 H new ATOM 0 HD21 LEU A 29 -7.880 -14.812 -3.044 1.00 53.13 H new ATOM 0 HD22 LEU A 29 -7.409 -16.502 -2.745 1.00 53.13 H new ATOM 0 HD23 LEU A 29 -7.443 -15.868 -4.408 1.00 53.13 H new ATOM 476 N TYR A 30 -6.547 -18.840 -4.950 1.00 24.13 N ATOM 477 CA TYR A 30 -5.603 -19.994 -4.922 1.00 4.32 C ATOM 478 C TYR A 30 -4.969 -20.126 -3.536 1.00 31.13 C ATOM 479 O TYR A 30 -4.676 -19.147 -2.879 1.00 41.12 O ATOM 480 CB TYR A 30 -4.536 -19.663 -5.966 1.00 52.40 C ATOM 481 CG TYR A 30 -5.153 -19.659 -7.343 1.00 51.25 C ATOM 482 CD1 TYR A 30 -6.079 -18.670 -7.688 1.00 21.41 C ATOM 483 CD2 TYR A 30 -4.799 -20.644 -8.273 1.00 10.41 C ATOM 484 CE1 TYR A 30 -6.651 -18.663 -8.966 1.00 15.54 C ATOM 485 CE2 TYR A 30 -5.372 -20.636 -9.551 1.00 74.12 C ATOM 486 CZ TYR A 30 -6.298 -19.645 -9.898 1.00 23.30 C ATOM 487 OH TYR A 30 -6.862 -19.637 -11.156 1.00 33.21 O ATOM 0 H TYR A 30 -6.175 -17.965 -4.579 1.00 24.13 H new ATOM 0 HA TYR A 30 -6.104 -20.938 -5.136 1.00 4.32 H new ATOM 0 HB2 TYR A 30 -4.095 -18.690 -5.752 1.00 52.40 H new ATOM 0 HB3 TYR A 30 -3.730 -20.395 -5.921 1.00 52.40 H new ATOM 0 HD1 TYR A 30 -6.353 -17.912 -6.969 1.00 21.41 H new ATOM 0 HD2 TYR A 30 -4.085 -21.409 -8.005 1.00 10.41 H new ATOM 0 HE1 TYR A 30 -7.366 -17.898 -9.233 1.00 15.54 H new ATOM 0 HE2 TYR A 30 -5.099 -21.395 -10.269 1.00 74.12 H new ATOM 0 HH TYR A 30 -6.507 -20.387 -11.678 1.00 33.21 H new ATOM 497 N VAL A 31 -4.753 -21.332 -3.089 1.00 52.24 N ATOM 498 CA VAL A 31 -4.134 -21.535 -1.744 1.00 2.12 C ATOM 499 C VAL A 31 -3.382 -22.864 -1.709 1.00 15.42 C ATOM 500 O VAL A 31 -3.720 -23.800 -2.406 1.00 52.13 O ATOM 501 CB VAL A 31 -5.292 -21.551 -0.730 1.00 70.25 C ATOM 502 CG1 VAL A 31 -5.492 -20.143 -0.175 1.00 74.21 C ATOM 503 CG2 VAL A 31 -6.591 -22.023 -1.398 1.00 15.23 C ATOM 0 H VAL A 31 -4.978 -22.188 -3.596 1.00 52.24 H new ATOM 0 HA VAL A 31 -3.419 -20.745 -1.512 1.00 2.12 H new ATOM 0 HB VAL A 31 -5.044 -22.241 0.076 1.00 70.25 H new ATOM 0 HG11 VAL A 31 -6.311 -20.148 0.544 1.00 74.21 H new ATOM 0 HG12 VAL A 31 -4.578 -19.813 0.319 1.00 74.21 H new ATOM 0 HG13 VAL A 31 -5.730 -19.461 -0.991 1.00 74.21 H new ATOM 0 HG21 VAL A 31 -7.397 -22.027 -0.664 1.00 15.23 H new ATOM 0 HG22 VAL A 31 -6.847 -21.347 -2.214 1.00 15.23 H new ATOM 0 HG23 VAL A 31 -6.453 -23.030 -1.791 1.00 15.23 H new ATOM 513 N GLU A 32 -2.364 -22.955 -0.900 1.00 44.02 N ATOM 514 CA GLU A 32 -1.593 -24.227 -0.817 1.00 61.43 C ATOM 515 C GLU A 32 -2.510 -25.362 -0.352 1.00 13.13 C ATOM 516 O GLU A 32 -2.220 -26.527 -0.539 1.00 0.15 O ATOM 517 CB GLU A 32 -0.494 -23.961 0.211 1.00 22.34 C ATOM 518 CG GLU A 32 -1.119 -23.446 1.508 1.00 4.41 C ATOM 519 CD GLU A 32 -0.182 -23.745 2.680 1.00 21.15 C ATOM 520 OE1 GLU A 32 0.954 -24.109 2.425 1.00 20.31 O ATOM 521 OE2 GLU A 32 -0.615 -23.603 3.812 1.00 20.30 O ATOM 0 H GLU A 32 -2.033 -22.205 -0.293 1.00 44.02 H new ATOM 0 HA GLU A 32 -1.178 -24.527 -1.779 1.00 61.43 H new ATOM 0 HB2 GLU A 32 0.067 -24.876 0.404 1.00 22.34 H new ATOM 0 HB3 GLU A 32 0.214 -23.229 -0.179 1.00 22.34 H new ATOM 0 HG2 GLU A 32 -1.299 -22.373 1.437 1.00 4.41 H new ATOM 0 HG3 GLU A 32 -2.086 -23.921 1.672 1.00 4.41 H new ATOM 528 N LYS A 33 -3.619 -25.023 0.243 1.00 2.21 N ATOM 529 CA LYS A 33 -4.567 -26.070 0.716 1.00 3.02 C ATOM 530 C LYS A 33 -5.959 -25.460 0.904 1.00 3.14 C ATOM 531 O LYS A 33 -6.112 -24.260 1.024 1.00 11.42 O ATOM 532 CB LYS A 33 -4.001 -26.551 2.053 1.00 34.02 C ATOM 533 CG LYS A 33 -4.216 -25.474 3.116 1.00 31.50 C ATOM 534 CD LYS A 33 -2.942 -25.315 3.949 1.00 62.14 C ATOM 535 CE LYS A 33 -3.171 -25.882 5.351 1.00 65.23 C ATOM 536 NZ LYS A 33 -2.936 -24.736 6.273 1.00 11.30 N ATOM 0 H LYS A 33 -3.911 -24.062 0.423 1.00 2.21 H new ATOM 0 HA LYS A 33 -4.669 -26.891 0.007 1.00 3.02 H new ATOM 0 HB2 LYS A 33 -4.490 -27.477 2.355 1.00 34.02 H new ATOM 0 HB3 LYS A 33 -2.938 -26.770 1.952 1.00 34.02 H new ATOM 0 HG2 LYS A 33 -4.473 -24.527 2.642 1.00 31.50 H new ATOM 0 HG3 LYS A 33 -5.052 -25.746 3.760 1.00 31.50 H new ATOM 0 HD2 LYS A 33 -2.113 -25.834 3.467 1.00 62.14 H new ATOM 0 HD3 LYS A 33 -2.666 -24.262 4.012 1.00 62.14 H new ATOM 0 HE2 LYS A 33 -4.183 -26.274 5.458 1.00 65.23 H new ATOM 0 HE3 LYS A 33 -2.487 -26.704 5.561 1.00 65.23 H new ATOM 0 HZ1 LYS A 33 -3.252 -24.990 7.231 1.00 11.30 H new ATOM 0 HZ2 LYS A 33 -1.921 -24.508 6.292 1.00 11.30 H new ATOM 0 HZ3 LYS A 33 -3.470 -23.908 5.941 1.00 11.30 H new ATOM 550 N LYS A 34 -6.976 -26.274 0.920 1.00 0.33 N ATOM 551 CA LYS A 34 -8.359 -25.741 1.089 1.00 64.23 C ATOM 552 C LYS A 34 -8.658 -25.464 2.568 1.00 51.52 C ATOM 553 O LYS A 34 -9.556 -26.045 3.143 1.00 52.14 O ATOM 554 CB LYS A 34 -9.273 -26.845 0.557 1.00 61.15 C ATOM 555 CG LYS A 34 -9.205 -28.060 1.482 1.00 44.01 C ATOM 556 CD LYS A 34 -9.276 -29.342 0.650 1.00 72.21 C ATOM 557 CE LYS A 34 -7.895 -29.997 0.604 1.00 3.34 C ATOM 558 NZ LYS A 34 -8.151 -31.451 0.804 1.00 5.33 N ATOM 0 H LYS A 34 -6.911 -27.287 0.823 1.00 0.33 H new ATOM 0 HA LYS A 34 -8.500 -24.798 0.561 1.00 64.23 H new ATOM 0 HB2 LYS A 34 -10.299 -26.482 0.493 1.00 61.15 H new ATOM 0 HB3 LYS A 34 -8.971 -27.126 -0.452 1.00 61.15 H new ATOM 0 HG2 LYS A 34 -8.280 -28.039 2.059 1.00 44.01 H new ATOM 0 HG3 LYS A 34 -10.027 -28.032 2.197 1.00 44.01 H new ATOM 0 HD2 LYS A 34 -10.002 -30.030 1.083 1.00 72.21 H new ATOM 0 HD3 LYS A 34 -9.616 -29.114 -0.360 1.00 72.21 H new ATOM 0 HE2 LYS A 34 -7.401 -29.811 -0.350 1.00 3.34 H new ATOM 0 HE3 LYS A 34 -7.244 -29.600 1.383 1.00 3.34 H new ATOM 0 HZ1 LYS A 34 -7.249 -31.968 0.785 1.00 5.33 H new ATOM 0 HZ2 LYS A 34 -8.615 -31.599 1.723 1.00 5.33 H new ATOM 0 HZ3 LYS A 34 -8.768 -31.803 0.044 1.00 5.33 H new ATOM 572 N ASP A 35 -7.920 -24.581 3.189 1.00 33.24 N ATOM 573 CA ASP A 35 -8.189 -24.287 4.629 1.00 11.41 C ATOM 574 C ASP A 35 -8.966 -22.973 4.785 1.00 64.03 C ATOM 575 O ASP A 35 -10.135 -22.976 5.118 1.00 31.21 O ATOM 576 CB ASP A 35 -6.816 -24.200 5.316 1.00 61.13 C ATOM 577 CG ASP A 35 -5.802 -23.482 4.420 1.00 1.04 C ATOM 578 OD1 ASP A 35 -6.221 -22.884 3.442 1.00 40.52 O ATOM 579 OD2 ASP A 35 -4.625 -23.532 4.734 1.00 3.32 O ATOM 0 H ASP A 35 -7.153 -24.057 2.769 1.00 33.24 H new ATOM 0 HA ASP A 35 -8.805 -25.065 5.080 1.00 11.41 H new ATOM 0 HB2 ASP A 35 -6.911 -23.668 6.263 1.00 61.13 H new ATOM 0 HB3 ASP A 35 -6.457 -25.203 5.548 1.00 61.13 H new ATOM 584 N ASP A 36 -8.340 -21.851 4.555 1.00 72.14 N ATOM 585 CA ASP A 36 -9.061 -20.555 4.701 1.00 32.12 C ATOM 586 C ASP A 36 -8.257 -19.413 4.073 1.00 32.21 C ATOM 587 O ASP A 36 -7.117 -19.575 3.684 1.00 3.42 O ATOM 588 CB ASP A 36 -9.199 -20.339 6.206 1.00 61.24 C ATOM 589 CG ASP A 36 -10.495 -20.983 6.701 1.00 12.32 C ATOM 590 OD1 ASP A 36 -11.403 -21.132 5.900 1.00 14.14 O ATOM 591 OD2 ASP A 36 -10.557 -21.320 7.872 1.00 3.14 O ATOM 0 H ASP A 36 -7.363 -21.776 4.273 1.00 72.14 H new ATOM 0 HA ASP A 36 -10.028 -20.574 4.198 1.00 32.12 H new ATOM 0 HB2 ASP A 36 -8.344 -20.772 6.725 1.00 61.24 H new ATOM 0 HB3 ASP A 36 -9.202 -19.273 6.432 1.00 61.24 H new ATOM 596 N PHE A 37 -8.848 -18.254 3.988 1.00 75.11 N ATOM 597 CA PHE A 37 -8.135 -17.082 3.401 1.00 4.31 C ATOM 598 C PHE A 37 -8.105 -15.939 4.420 1.00 42.52 C ATOM 599 O PHE A 37 -9.083 -15.244 4.617 1.00 15.20 O ATOM 600 CB PHE A 37 -8.977 -16.687 2.190 1.00 22.33 C ATOM 601 CG PHE A 37 -8.691 -17.622 1.040 1.00 13.13 C ATOM 602 CD1 PHE A 37 -9.373 -18.840 0.943 1.00 20.14 C ATOM 603 CD2 PHE A 37 -7.752 -17.265 0.066 1.00 65.12 C ATOM 604 CE1 PHE A 37 -9.113 -19.703 -0.128 1.00 75.34 C ATOM 605 CE2 PHE A 37 -7.492 -18.129 -1.004 1.00 11.10 C ATOM 606 CZ PHE A 37 -8.173 -19.347 -1.102 1.00 72.21 C ATOM 0 H PHE A 37 -9.800 -18.066 4.302 1.00 75.11 H new ATOM 0 HA PHE A 37 -7.103 -17.306 3.130 1.00 4.31 H new ATOM 0 HB2 PHE A 37 -10.036 -16.723 2.445 1.00 22.33 H new ATOM 0 HB3 PHE A 37 -8.754 -15.660 1.900 1.00 22.33 H new ATOM 0 HD1 PHE A 37 -10.099 -19.114 1.694 1.00 20.14 H new ATOM 0 HD2 PHE A 37 -7.228 -16.323 0.140 1.00 65.12 H new ATOM 0 HE1 PHE A 37 -9.638 -20.644 -0.203 1.00 75.34 H new ATOM 0 HE2 PHE A 37 -6.765 -17.855 -1.754 1.00 11.10 H new ATOM 0 HZ PHE A 37 -7.974 -20.012 -1.929 1.00 72.21 H new ATOM 616 N SER A 38 -6.996 -15.747 5.076 1.00 72.52 N ATOM 617 CA SER A 38 -6.910 -14.655 6.091 1.00 51.22 C ATOM 618 C SER A 38 -5.972 -13.543 5.622 1.00 13.41 C ATOM 619 O SER A 38 -5.844 -12.518 6.263 1.00 41.22 O ATOM 620 CB SER A 38 -6.355 -15.327 7.346 1.00 51.23 C ATOM 621 OG SER A 38 -5.506 -14.414 8.030 1.00 44.11 O ATOM 0 H SER A 38 -6.145 -16.297 4.956 1.00 72.52 H new ATOM 0 HA SER A 38 -7.879 -14.187 6.265 1.00 51.22 H new ATOM 0 HB2 SER A 38 -7.172 -15.640 7.997 1.00 51.23 H new ATOM 0 HB3 SER A 38 -5.800 -16.226 7.076 1.00 51.23 H new ATOM 0 HG SER A 38 -5.703 -13.500 7.735 1.00 44.11 H new ATOM 627 N ARG A 39 -5.301 -13.732 4.518 1.00 22.25 N ATOM 628 CA ARG A 39 -4.365 -12.673 4.038 1.00 4.14 C ATOM 629 C ARG A 39 -4.999 -11.854 2.911 1.00 41.21 C ATOM 630 O ARG A 39 -4.517 -10.795 2.560 1.00 51.34 O ATOM 631 CB ARG A 39 -3.135 -13.422 3.528 1.00 70.11 C ATOM 632 CG ARG A 39 -1.939 -12.468 3.507 1.00 34.11 C ATOM 633 CD ARG A 39 -1.018 -12.771 4.690 1.00 14.20 C ATOM 634 NE ARG A 39 -0.991 -11.510 5.483 1.00 13.13 N ATOM 635 CZ ARG A 39 0.112 -11.133 6.072 1.00 2.12 C ATOM 636 NH1 ARG A 39 0.678 -11.907 6.957 1.00 51.41 N ATOM 637 NH2 ARG A 39 0.649 -9.981 5.773 1.00 51.04 N ATOM 0 H ARG A 39 -5.359 -14.565 3.932 1.00 22.25 H new ATOM 0 HA ARG A 39 -4.115 -11.969 4.831 1.00 4.14 H new ATOM 0 HB2 ARG A 39 -2.923 -14.277 4.170 1.00 70.11 H new ATOM 0 HB3 ARG A 39 -3.321 -13.813 2.528 1.00 70.11 H new ATOM 0 HG2 ARG A 39 -1.392 -12.576 2.571 1.00 34.11 H new ATOM 0 HG3 ARG A 39 -2.284 -11.435 3.557 1.00 34.11 H new ATOM 0 HD2 ARG A 39 -1.397 -13.603 5.283 1.00 14.20 H new ATOM 0 HD3 ARG A 39 -0.019 -13.048 4.353 1.00 14.20 H new ATOM 0 HE ARG A 39 -1.834 -10.941 5.566 1.00 13.13 H new ATOM 0 HH11 ARG A 39 0.259 -12.807 7.189 1.00 51.41 H new ATOM 0 HH12 ARG A 39 1.539 -11.612 7.416 1.00 51.41 H new ATOM 0 HH21 ARG A 39 0.207 -9.377 5.080 1.00 51.04 H new ATOM 0 HH22 ARG A 39 1.510 -9.685 6.232 1.00 51.04 H new ATOM 651 N VAL A 40 -6.072 -12.329 2.344 1.00 20.04 N ATOM 652 CA VAL A 40 -6.725 -11.564 1.246 1.00 30.31 C ATOM 653 C VAL A 40 -7.273 -10.240 1.789 1.00 61.31 C ATOM 654 O VAL A 40 -7.906 -10.207 2.826 1.00 32.22 O ATOM 655 CB VAL A 40 -7.856 -12.464 0.754 1.00 64.22 C ATOM 656 CG1 VAL A 40 -8.813 -12.761 1.908 1.00 32.30 C ATOM 657 CG2 VAL A 40 -8.618 -11.758 -0.369 1.00 44.10 C ATOM 0 H VAL A 40 -6.523 -13.209 2.592 1.00 20.04 H new ATOM 0 HA VAL A 40 -6.034 -11.314 0.441 1.00 30.31 H new ATOM 0 HB VAL A 40 -7.438 -13.398 0.380 1.00 64.22 H new ATOM 0 HG11 VAL A 40 -9.620 -13.403 1.555 1.00 32.30 H new ATOM 0 HG12 VAL A 40 -8.272 -13.265 2.709 1.00 32.30 H new ATOM 0 HG13 VAL A 40 -9.231 -11.827 2.284 1.00 32.30 H new ATOM 0 HG21 VAL A 40 -9.425 -12.400 -0.720 1.00 44.10 H new ATOM 0 HG22 VAL A 40 -9.035 -10.823 0.006 1.00 44.10 H new ATOM 0 HG23 VAL A 40 -7.937 -11.547 -1.194 1.00 44.10 H new ATOM 667 N PRO A 41 -6.994 -9.188 1.070 1.00 12.24 N ATOM 668 CA PRO A 41 -7.447 -7.833 1.477 1.00 42.22 C ATOM 669 C PRO A 41 -8.968 -7.700 1.350 1.00 45.11 C ATOM 670 O PRO A 41 -9.568 -8.187 0.412 1.00 54.10 O ATOM 671 CB PRO A 41 -6.737 -6.908 0.490 1.00 1.14 C ATOM 672 CG PRO A 41 -6.464 -7.765 -0.703 1.00 55.22 C ATOM 673 CD PRO A 41 -6.241 -9.161 -0.186 1.00 34.31 C ATOM 0 HA PRO A 41 -7.216 -7.605 2.517 1.00 42.22 H new ATOM 0 HB2 PRO A 41 -7.361 -6.053 0.229 1.00 1.14 H new ATOM 0 HB3 PRO A 41 -5.814 -6.512 0.913 1.00 1.14 H new ATOM 0 HG2 PRO A 41 -7.302 -7.739 -1.399 1.00 55.22 H new ATOM 0 HG3 PRO A 41 -5.588 -7.408 -1.245 1.00 55.22 H new ATOM 0 HD2 PRO A 41 -6.605 -9.911 -0.888 1.00 34.31 H new ATOM 0 HD3 PRO A 41 -5.182 -9.364 -0.023 1.00 34.31 H new ATOM 681 N GLU A 42 -9.593 -7.040 2.288 1.00 71.40 N ATOM 682 CA GLU A 42 -11.072 -6.873 2.225 1.00 71.25 C ATOM 683 C GLU A 42 -11.451 -6.043 0.994 1.00 71.42 C ATOM 684 O GLU A 42 -12.604 -5.960 0.620 1.00 11.22 O ATOM 685 CB GLU A 42 -11.444 -6.129 3.509 1.00 74.21 C ATOM 686 CG GLU A 42 -12.781 -6.654 4.034 1.00 43.13 C ATOM 687 CD GLU A 42 -12.682 -6.888 5.543 1.00 34.11 C ATOM 688 OE1 GLU A 42 -11.714 -6.434 6.130 1.00 44.11 O ATOM 689 OE2 GLU A 42 -13.579 -7.512 6.084 1.00 73.33 O ATOM 0 H GLU A 42 -9.142 -6.609 3.095 1.00 71.40 H new ATOM 0 HA GLU A 42 -11.595 -7.826 2.144 1.00 71.25 H new ATOM 0 HB2 GLU A 42 -10.667 -6.268 4.260 1.00 74.21 H new ATOM 0 HB3 GLU A 42 -11.513 -5.059 3.315 1.00 74.21 H new ATOM 0 HG2 GLU A 42 -13.575 -5.939 3.818 1.00 43.13 H new ATOM 0 HG3 GLU A 42 -13.043 -7.583 3.528 1.00 43.13 H new ATOM 696 N GLU A 43 -10.487 -5.432 0.363 1.00 4.51 N ATOM 697 CA GLU A 43 -10.789 -4.614 -0.846 1.00 30.52 C ATOM 698 C GLU A 43 -11.169 -5.531 -2.007 1.00 63.03 C ATOM 699 O GLU A 43 -12.041 -5.225 -2.797 1.00 20.15 O ATOM 700 CB GLU A 43 -9.486 -3.872 -1.159 1.00 64.22 C ATOM 701 CG GLU A 43 -9.115 -2.961 0.012 1.00 1.45 C ATOM 702 CD GLU A 43 -8.031 -1.978 -0.430 1.00 21.21 C ATOM 703 OE1 GLU A 43 -7.252 -2.338 -1.298 1.00 74.42 O ATOM 704 OE2 GLU A 43 -7.997 -0.882 0.106 1.00 41.03 O ATOM 0 H GLU A 43 -9.504 -5.463 0.632 1.00 4.51 H new ATOM 0 HA GLU A 43 -11.620 -3.927 -0.688 1.00 30.52 H new ATOM 0 HB2 GLU A 43 -8.685 -4.587 -1.343 1.00 64.22 H new ATOM 0 HB3 GLU A 43 -9.602 -3.282 -2.068 1.00 64.22 H new ATOM 0 HG2 GLU A 43 -9.995 -2.418 0.357 1.00 1.45 H new ATOM 0 HG3 GLU A 43 -8.759 -3.557 0.852 1.00 1.45 H new ATOM 711 N LEU A 44 -10.517 -6.653 -2.114 1.00 3.04 N ATOM 712 CA LEU A 44 -10.830 -7.599 -3.222 1.00 63.23 C ATOM 713 C LEU A 44 -11.851 -8.643 -2.760 1.00 71.13 C ATOM 714 O LEU A 44 -12.854 -8.871 -3.407 1.00 52.30 O ATOM 715 CB LEU A 44 -9.496 -8.267 -3.551 1.00 33.33 C ATOM 716 CG LEU A 44 -9.177 -8.073 -5.035 1.00 64.13 C ATOM 717 CD1 LEU A 44 -7.768 -8.591 -5.327 1.00 51.32 C ATOM 718 CD2 LEU A 44 -10.190 -8.851 -5.878 1.00 14.02 C ATOM 0 H LEU A 44 -9.778 -6.958 -1.480 1.00 3.04 H new ATOM 0 HA LEU A 44 -11.264 -7.095 -4.086 1.00 63.23 H new ATOM 0 HB2 LEU A 44 -8.702 -7.838 -2.939 1.00 33.33 H new ATOM 0 HB3 LEU A 44 -9.542 -9.330 -3.314 1.00 33.33 H new ATOM 0 HG LEU A 44 -9.232 -7.013 -5.283 1.00 64.13 H new ATOM 0 HD11 LEU A 44 -7.541 -8.453 -6.384 1.00 51.32 H new ATOM 0 HD12 LEU A 44 -7.046 -8.039 -4.726 1.00 51.32 H new ATOM 0 HD13 LEU A 44 -7.712 -9.651 -5.080 1.00 51.32 H new ATOM 0 HD21 LEU A 44 -9.965 -8.714 -6.936 1.00 14.02 H new ATOM 0 HD22 LEU A 44 -10.133 -9.911 -5.629 1.00 14.02 H new ATOM 0 HD23 LEU A 44 -11.195 -8.483 -5.671 1.00 14.02 H new ATOM 730 N MET A 45 -11.605 -9.284 -1.648 1.00 62.31 N ATOM 731 CA MET A 45 -12.565 -10.315 -1.158 1.00 34.12 C ATOM 732 C MET A 45 -13.993 -9.758 -1.150 1.00 71.22 C ATOM 733 O MET A 45 -14.949 -10.480 -1.355 1.00 62.21 O ATOM 734 CB MET A 45 -12.112 -10.642 0.264 1.00 74.02 C ATOM 735 CG MET A 45 -13.077 -11.655 0.884 1.00 74.31 C ATOM 736 SD MET A 45 -12.218 -12.617 2.153 1.00 30.40 S ATOM 737 CE MET A 45 -11.647 -13.958 1.077 1.00 74.33 C ATOM 0 H MET A 45 -10.784 -9.139 -1.060 1.00 62.31 H new ATOM 0 HA MET A 45 -12.574 -11.198 -1.796 1.00 34.12 H new ATOM 0 HB2 MET A 45 -11.100 -11.048 0.251 1.00 74.02 H new ATOM 0 HB3 MET A 45 -12.084 -9.734 0.866 1.00 74.02 H new ATOM 0 HG2 MET A 45 -13.931 -11.138 1.322 1.00 74.31 H new ATOM 0 HG3 MET A 45 -13.468 -12.319 0.113 1.00 74.31 H new ATOM 0 HE1 MET A 45 -11.112 -14.699 1.671 1.00 74.33 H new ATOM 0 HE2 MET A 45 -12.504 -14.429 0.596 1.00 74.33 H new ATOM 0 HE3 MET A 45 -10.980 -13.554 0.315 1.00 74.33 H new ATOM 747 N LYS A 46 -14.148 -8.483 -0.916 1.00 55.23 N ATOM 748 CA LYS A 46 -15.519 -7.895 -0.898 1.00 40.11 C ATOM 749 C LYS A 46 -16.321 -8.401 -2.099 1.00 70.33 C ATOM 750 O LYS A 46 -17.502 -8.658 -2.005 1.00 64.33 O ATOM 751 CB LYS A 46 -15.314 -6.381 -0.988 1.00 41.31 C ATOM 752 CG LYS A 46 -16.650 -5.674 -0.749 1.00 23.10 C ATOM 753 CD LYS A 46 -16.624 -4.291 -1.402 1.00 25.11 C ATOM 754 CE LYS A 46 -17.759 -3.439 -0.830 1.00 22.32 C ATOM 755 NZ LYS A 46 -17.862 -2.267 -1.744 1.00 12.02 N ATOM 0 H LYS A 46 -13.389 -7.825 -0.737 1.00 55.23 H new ATOM 0 HA LYS A 46 -16.073 -8.172 -0.001 1.00 40.11 H new ATOM 0 HB2 LYS A 46 -14.581 -6.057 -0.249 1.00 41.31 H new ATOM 0 HB3 LYS A 46 -14.918 -6.114 -1.968 1.00 41.31 H new ATOM 0 HG2 LYS A 46 -17.466 -6.267 -1.163 1.00 23.10 H new ATOM 0 HG3 LYS A 46 -16.836 -5.579 0.321 1.00 23.10 H new ATOM 0 HD2 LYS A 46 -15.664 -3.808 -1.219 1.00 25.11 H new ATOM 0 HD3 LYS A 46 -16.733 -4.384 -2.482 1.00 25.11 H new ATOM 0 HE2 LYS A 46 -18.694 -3.998 -0.798 1.00 22.32 H new ATOM 0 HE3 LYS A 46 -17.541 -3.125 0.191 1.00 22.32 H new ATOM 0 HZ1 LYS A 46 -18.621 -1.636 -1.416 1.00 12.02 H new ATOM 0 HZ2 LYS A 46 -16.960 -1.750 -1.749 1.00 12.02 H new ATOM 0 HZ3 LYS A 46 -18.078 -2.596 -2.707 1.00 12.02 H new ATOM 769 N GLY A 47 -15.681 -8.555 -3.226 1.00 74.11 N ATOM 770 CA GLY A 47 -16.404 -9.052 -4.430 1.00 34.22 C ATOM 771 C GLY A 47 -16.502 -10.575 -4.359 1.00 35.11 C ATOM 772 O GLY A 47 -17.481 -11.166 -4.770 1.00 2.21 O ATOM 0 H GLY A 47 -14.690 -8.358 -3.365 1.00 74.11 H new ATOM 0 HA2 GLY A 47 -17.400 -8.613 -4.479 1.00 34.22 H new ATOM 0 HA3 GLY A 47 -15.878 -8.751 -5.336 1.00 34.22 H new ATOM 776 N PHE A 48 -15.492 -11.217 -3.834 1.00 14.04 N ATOM 777 CA PHE A 48 -15.523 -12.703 -3.730 1.00 4.00 C ATOM 778 C PHE A 48 -16.540 -13.133 -2.671 1.00 11.15 C ATOM 779 O PHE A 48 -17.411 -13.941 -2.922 1.00 42.32 O ATOM 780 CB PHE A 48 -14.108 -13.100 -3.306 1.00 1.25 C ATOM 781 CG PHE A 48 -13.707 -14.373 -4.010 1.00 62.52 C ATOM 782 CD1 PHE A 48 -14.572 -15.474 -4.015 1.00 50.42 C ATOM 783 CD2 PHE A 48 -12.467 -14.455 -4.655 1.00 43.22 C ATOM 784 CE1 PHE A 48 -14.199 -16.654 -4.668 1.00 20.42 C ATOM 785 CE2 PHE A 48 -12.094 -15.636 -5.307 1.00 71.44 C ATOM 786 CZ PHE A 48 -12.960 -16.736 -5.315 1.00 20.31 C ATOM 0 H PHE A 48 -14.647 -10.775 -3.473 1.00 14.04 H new ATOM 0 HA PHE A 48 -15.816 -13.178 -4.666 1.00 4.00 H new ATOM 0 HB2 PHE A 48 -13.407 -12.302 -3.550 1.00 1.25 H new ATOM 0 HB3 PHE A 48 -14.067 -13.241 -2.226 1.00 1.25 H new ATOM 0 HD1 PHE A 48 -15.527 -15.412 -3.515 1.00 50.42 H new ATOM 0 HD2 PHE A 48 -11.798 -13.607 -4.649 1.00 43.22 H new ATOM 0 HE1 PHE A 48 -14.867 -17.502 -4.673 1.00 20.42 H new ATOM 0 HE2 PHE A 48 -11.137 -15.699 -5.804 1.00 71.44 H new ATOM 0 HZ PHE A 48 -12.673 -17.647 -5.820 1.00 20.31 H new ATOM 796 N GLY A 49 -16.433 -12.597 -1.484 1.00 2.31 N ATOM 797 CA GLY A 49 -17.391 -12.973 -0.406 1.00 21.10 C ATOM 798 C GLY A 49 -17.126 -14.413 0.032 1.00 41.53 C ATOM 799 O GLY A 49 -16.186 -14.692 0.749 1.00 60.35 O ATOM 0 H GLY A 49 -15.723 -11.915 -1.215 1.00 2.31 H new ATOM 0 HA2 GLY A 49 -17.283 -12.298 0.443 1.00 21.10 H new ATOM 0 HA3 GLY A 49 -18.416 -12.873 -0.764 1.00 21.10 H new ATOM 803 N GLN A 50 -17.952 -15.332 -0.392 1.00 21.22 N ATOM 804 CA GLN A 50 -17.749 -16.755 -0.002 1.00 61.15 C ATOM 805 C GLN A 50 -17.173 -17.545 -1.181 1.00 4.14 C ATOM 806 O GLN A 50 -17.826 -17.715 -2.192 1.00 51.41 O ATOM 807 CB GLN A 50 -19.145 -17.265 0.354 1.00 1.24 C ATOM 808 CG GLN A 50 -19.289 -17.350 1.877 1.00 32.04 C ATOM 809 CD GLN A 50 -19.580 -15.958 2.442 1.00 14.10 C ATOM 810 OE1 GLN A 50 -20.721 -15.611 2.672 1.00 11.15 O ATOM 811 NE2 GLN A 50 -18.591 -15.142 2.676 1.00 11.31 N ATOM 0 H GLN A 50 -18.758 -15.157 -0.992 1.00 21.22 H new ATOM 0 HA GLN A 50 -17.050 -16.865 0.827 1.00 61.15 H new ATOM 0 HB2 GLN A 50 -19.903 -16.597 -0.056 1.00 1.24 H new ATOM 0 HB3 GLN A 50 -19.309 -18.246 -0.092 1.00 1.24 H new ATOM 0 HG2 GLN A 50 -20.095 -18.036 2.139 1.00 32.04 H new ATOM 0 HG3 GLN A 50 -18.375 -17.749 2.317 1.00 32.04 H new ATOM 0 HE21 GLN A 50 -17.633 -15.433 2.483 1.00 11.31 H new ATOM 0 HE22 GLN A 50 -18.775 -14.212 3.052 1.00 11.31 H new ATOM 820 N PRO A 51 -15.961 -18.002 -1.014 1.00 1.14 N ATOM 821 CA PRO A 51 -15.289 -18.783 -2.080 1.00 24.02 C ATOM 822 C PRO A 51 -15.883 -20.189 -2.168 1.00 15.31 C ATOM 823 O PRO A 51 -16.390 -20.720 -1.199 1.00 75.12 O ATOM 824 CB PRO A 51 -13.834 -18.833 -1.624 1.00 65.24 C ATOM 825 CG PRO A 51 -13.886 -18.658 -0.140 1.00 72.32 C ATOM 826 CD PRO A 51 -15.113 -17.840 0.172 1.00 10.34 C ATOM 0 HA PRO A 51 -15.404 -18.344 -3.071 1.00 24.02 H new ATOM 0 HB2 PRO A 51 -13.369 -19.781 -1.893 1.00 65.24 H new ATOM 0 HB3 PRO A 51 -13.246 -18.045 -2.094 1.00 65.24 H new ATOM 0 HG2 PRO A 51 -13.932 -19.626 0.360 1.00 72.32 H new ATOM 0 HG3 PRO A 51 -12.988 -18.156 0.219 1.00 72.32 H new ATOM 0 HD2 PRO A 51 -15.613 -18.198 1.072 1.00 10.34 H new ATOM 0 HD3 PRO A 51 -14.862 -16.793 0.343 1.00 10.34 H new ATOM 834 N GLN A 52 -15.820 -20.800 -3.318 1.00 21.31 N ATOM 835 CA GLN A 52 -16.379 -22.175 -3.465 1.00 54.31 C ATOM 836 C GLN A 52 -15.352 -23.087 -4.143 1.00 42.41 C ATOM 837 O GLN A 52 -14.464 -22.631 -4.831 1.00 70.23 O ATOM 838 CB GLN A 52 -17.619 -22.011 -4.347 1.00 53.31 C ATOM 839 CG GLN A 52 -18.440 -20.813 -3.865 1.00 63.13 C ATOM 840 CD GLN A 52 -19.080 -21.138 -2.516 1.00 62.14 C ATOM 841 OE1 GLN A 52 -19.839 -22.082 -2.401 1.00 53.13 O ATOM 842 NE2 GLN A 52 -18.808 -20.392 -1.480 1.00 4.20 N ATOM 0 H GLN A 52 -15.406 -20.407 -4.163 1.00 21.31 H new ATOM 0 HA GLN A 52 -16.624 -22.628 -2.504 1.00 54.31 H new ATOM 0 HB2 GLN A 52 -17.322 -21.866 -5.386 1.00 53.31 H new ATOM 0 HB3 GLN A 52 -18.224 -22.917 -4.312 1.00 53.31 H new ATOM 0 HG2 GLN A 52 -17.801 -19.935 -3.773 1.00 63.13 H new ATOM 0 HG3 GLN A 52 -19.212 -20.571 -4.596 1.00 63.13 H new ATOM 0 HE21 GLN A 52 -18.172 -19.600 -1.575 1.00 4.20 H new ATOM 0 HE22 GLN A 52 -19.231 -20.601 -0.576 1.00 4.20 H new ATOM 851 N LEU A 53 -15.466 -24.373 -3.949 1.00 11.11 N ATOM 852 CA LEU A 53 -14.491 -25.310 -4.580 1.00 71.04 C ATOM 853 C LEU A 53 -14.951 -25.686 -5.992 1.00 1.23 C ATOM 854 O LEU A 53 -15.894 -26.432 -6.169 1.00 63.04 O ATOM 855 CB LEU A 53 -14.482 -26.542 -3.674 1.00 71.23 C ATOM 856 CG LEU A 53 -13.132 -27.249 -3.785 1.00 42.44 C ATOM 857 CD1 LEU A 53 -12.944 -27.771 -5.209 1.00 15.10 C ATOM 858 CD2 LEU A 53 -12.011 -26.259 -3.453 1.00 0.44 C ATOM 0 H LEU A 53 -16.190 -24.815 -3.382 1.00 11.11 H new ATOM 0 HA LEU A 53 -13.500 -24.867 -4.678 1.00 71.04 H new ATOM 0 HB2 LEU A 53 -14.666 -26.248 -2.641 1.00 71.23 H new ATOM 0 HB3 LEU A 53 -15.285 -27.222 -3.959 1.00 71.23 H new ATOM 0 HG LEU A 53 -13.101 -28.084 -3.086 1.00 42.44 H new ATOM 0 HD11 LEU A 53 -11.981 -28.275 -5.288 1.00 15.10 H new ATOM 0 HD12 LEU A 53 -13.742 -28.474 -5.447 1.00 15.10 H new ATOM 0 HD13 LEU A 53 -12.975 -26.936 -5.909 1.00 15.10 H new ATOM 0 HD21 LEU A 53 -11.047 -26.761 -3.532 1.00 0.44 H new ATOM 0 HD22 LEU A 53 -12.043 -25.424 -4.153 1.00 0.44 H new ATOM 0 HD23 LEU A 53 -12.144 -25.886 -2.438 1.00 0.44 H new ATOM 870 N ALA A 54 -14.291 -25.179 -6.997 1.00 32.20 N ATOM 871 CA ALA A 54 -14.690 -25.510 -8.395 1.00 62.04 C ATOM 872 C ALA A 54 -13.656 -26.441 -9.032 1.00 4.42 C ATOM 873 O ALA A 54 -13.996 -27.385 -9.719 1.00 63.23 O ATOM 874 CB ALA A 54 -14.725 -24.167 -9.125 1.00 62.54 C ATOM 0 H ALA A 54 -13.493 -24.550 -6.911 1.00 32.20 H new ATOM 0 HA ALA A 54 -15.650 -26.023 -8.441 1.00 62.04 H new ATOM 0 HB1 ALA A 54 -15.012 -24.325 -10.165 1.00 62.54 H new ATOM 0 HB2 ALA A 54 -15.450 -23.511 -8.645 1.00 62.54 H new ATOM 0 HB3 ALA A 54 -13.738 -23.706 -9.087 1.00 62.54 H new ATOM 880 N MET A 55 -12.398 -26.181 -8.811 1.00 65.12 N ATOM 881 CA MET A 55 -11.341 -27.049 -9.404 1.00 63.03 C ATOM 882 C MET A 55 -10.159 -27.166 -8.439 1.00 4.15 C ATOM 883 O MET A 55 -9.765 -26.206 -7.805 1.00 73.30 O ATOM 884 CB MET A 55 -10.918 -26.333 -10.687 1.00 20.12 C ATOM 885 CG MET A 55 -10.084 -27.282 -11.549 1.00 13.33 C ATOM 886 SD MET A 55 -8.403 -26.633 -11.706 1.00 32.42 S ATOM 887 CE MET A 55 -8.810 -25.204 -12.741 1.00 50.21 C ATOM 0 H MET A 55 -12.055 -25.405 -8.245 1.00 65.12 H new ATOM 0 HA MET A 55 -11.694 -28.061 -9.601 1.00 63.03 H new ATOM 0 HB2 MET A 55 -11.798 -26.002 -11.239 1.00 20.12 H new ATOM 0 HB3 MET A 55 -10.340 -25.441 -10.445 1.00 20.12 H new ATOM 0 HG2 MET A 55 -10.062 -28.274 -11.099 1.00 13.33 H new ATOM 0 HG3 MET A 55 -10.538 -27.389 -12.534 1.00 13.33 H new ATOM 0 HE1 MET A 55 -8.274 -25.276 -13.687 1.00 50.21 H new ATOM 0 HE2 MET A 55 -9.883 -25.187 -12.932 1.00 50.21 H new ATOM 0 HE3 MET A 55 -8.519 -24.288 -12.227 1.00 50.21 H new ATOM 897 N ILE A 56 -9.591 -28.332 -8.323 1.00 75.22 N ATOM 898 CA ILE A 56 -8.435 -28.510 -7.397 1.00 35.13 C ATOM 899 C ILE A 56 -7.182 -28.892 -8.187 1.00 20.35 C ATOM 900 O ILE A 56 -7.215 -29.743 -9.052 1.00 32.31 O ATOM 901 CB ILE A 56 -8.851 -29.644 -6.464 1.00 41.40 C ATOM 902 CG1 ILE A 56 -10.234 -29.342 -5.882 1.00 3.52 C ATOM 903 CG2 ILE A 56 -7.837 -29.766 -5.327 1.00 73.40 C ATOM 904 CD1 ILE A 56 -11.301 -30.095 -6.680 1.00 53.32 C ATOM 0 H ILE A 56 -9.876 -29.171 -8.828 1.00 75.22 H new ATOM 0 HA ILE A 56 -8.197 -27.599 -6.848 1.00 35.13 H new ATOM 0 HB ILE A 56 -8.886 -30.580 -7.022 1.00 41.40 H new ATOM 0 HG12 ILE A 56 -10.272 -29.639 -4.834 1.00 3.52 H new ATOM 0 HG13 ILE A 56 -10.428 -28.270 -5.917 1.00 3.52 H new ATOM 0 HG21 ILE A 56 -8.134 -30.576 -4.660 1.00 73.40 H new ATOM 0 HG22 ILE A 56 -6.851 -29.979 -5.740 1.00 73.40 H new ATOM 0 HG23 ILE A 56 -7.802 -28.831 -4.769 1.00 73.40 H new ATOM 0 HD11 ILE A 56 -12.286 -29.879 -6.265 1.00 53.32 H new ATOM 0 HD12 ILE A 56 -11.269 -29.776 -7.722 1.00 53.32 H new ATOM 0 HD13 ILE A 56 -11.110 -31.167 -6.622 1.00 53.32 H new ATOM 916 N LEU A 57 -6.076 -28.266 -7.894 1.00 24.22 N ATOM 917 CA LEU A 57 -4.820 -28.585 -8.626 1.00 21.45 C ATOM 918 C LEU A 57 -3.941 -29.524 -7.793 1.00 43.12 C ATOM 919 O LEU A 57 -3.657 -29.252 -6.643 1.00 70.21 O ATOM 920 CB LEU A 57 -4.130 -27.238 -8.825 1.00 65.43 C ATOM 921 CG LEU A 57 -2.757 -27.459 -9.455 1.00 20.15 C ATOM 922 CD1 LEU A 57 -2.768 -26.943 -10.896 1.00 62.21 C ATOM 923 CD2 LEU A 57 -1.699 -26.698 -8.658 1.00 73.20 C ATOM 0 H LEU A 57 -5.989 -27.546 -7.177 1.00 24.22 H new ATOM 0 HA LEU A 57 -5.010 -29.091 -9.572 1.00 21.45 H new ATOM 0 HB2 LEU A 57 -4.737 -26.597 -9.465 1.00 65.43 H new ATOM 0 HB3 LEU A 57 -4.025 -26.726 -7.868 1.00 65.43 H new ATOM 0 HG LEU A 57 -2.525 -28.524 -9.447 1.00 20.15 H new ATOM 0 HD11 LEU A 57 -1.788 -27.100 -11.346 1.00 62.21 H new ATOM 0 HD12 LEU A 57 -3.522 -27.482 -11.470 1.00 62.21 H new ATOM 0 HD13 LEU A 57 -3.002 -25.878 -10.899 1.00 62.21 H new ATOM 0 HD21 LEU A 57 -0.720 -26.857 -9.109 1.00 73.20 H new ATOM 0 HD22 LEU A 57 -1.934 -25.634 -8.666 1.00 73.20 H new ATOM 0 HD23 LEU A 57 -1.688 -27.060 -7.630 1.00 73.20 H new ATOM 935 N PRO A 58 -3.543 -30.604 -8.407 1.00 52.22 N ATOM 936 CA PRO A 58 -2.693 -31.607 -7.724 1.00 43.23 C ATOM 937 C PRO A 58 -1.252 -31.104 -7.607 1.00 74.22 C ATOM 938 O PRO A 58 -0.899 -30.062 -8.124 1.00 51.13 O ATOM 939 CB PRO A 58 -2.758 -32.819 -8.648 1.00 1.11 C ATOM 940 CG PRO A 58 -3.070 -32.258 -9.998 1.00 21.42 C ATOM 941 CD PRO A 58 -3.851 -30.988 -9.784 1.00 3.04 C ATOM 0 HA PRO A 58 -3.026 -31.823 -6.709 1.00 43.23 H new ATOM 0 HB2 PRO A 58 -1.813 -33.362 -8.655 1.00 1.11 H new ATOM 0 HB3 PRO A 58 -3.526 -33.521 -8.325 1.00 1.11 H new ATOM 0 HG2 PRO A 58 -2.153 -32.057 -10.552 1.00 21.42 H new ATOM 0 HG3 PRO A 58 -3.648 -32.971 -10.586 1.00 21.42 H new ATOM 0 HD2 PRO A 58 -3.552 -30.213 -10.490 1.00 3.04 H new ATOM 0 HD3 PRO A 58 -4.920 -31.150 -9.923 1.00 3.04 H new ATOM 949 N LEU A 59 -0.420 -31.847 -6.934 1.00 41.11 N ATOM 950 CA LEU A 59 1.006 -31.433 -6.776 1.00 54.12 C ATOM 951 C LEU A 59 1.935 -32.459 -7.433 1.00 63.05 C ATOM 952 O LEU A 59 2.856 -32.956 -6.815 1.00 51.52 O ATOM 953 CB LEU A 59 1.258 -31.386 -5.269 1.00 42.33 C ATOM 954 CG LEU A 59 0.524 -32.535 -4.571 1.00 51.41 C ATOM 955 CD1 LEU A 59 0.969 -33.870 -5.166 1.00 72.11 C ATOM 956 CD2 LEU A 59 0.852 -32.513 -3.075 1.00 51.42 C ATOM 0 H LEU A 59 -0.665 -32.728 -6.483 1.00 41.11 H new ATOM 0 HA LEU A 59 1.199 -30.471 -7.250 1.00 54.12 H new ATOM 0 HB2 LEU A 59 2.327 -31.455 -5.070 1.00 42.33 H new ATOM 0 HB3 LEU A 59 0.919 -30.431 -4.866 1.00 42.33 H new ATOM 0 HG LEU A 59 -0.550 -32.416 -4.714 1.00 51.41 H new ATOM 0 HD11 LEU A 59 0.444 -34.684 -4.666 1.00 72.11 H new ATOM 0 HD12 LEU A 59 0.738 -33.889 -6.231 1.00 72.11 H new ATOM 0 HD13 LEU A 59 2.043 -33.991 -5.026 1.00 72.11 H new ATOM 0 HD21 LEU A 59 0.331 -33.330 -2.576 1.00 51.42 H new ATOM 0 HD22 LEU A 59 1.927 -32.630 -2.936 1.00 51.42 H new ATOM 0 HD23 LEU A 59 0.532 -31.563 -2.646 1.00 51.42 H new ATOM 968 N ASP A 60 1.699 -32.783 -8.671 1.00 63.32 N ATOM 969 CA ASP A 60 2.570 -33.780 -9.354 1.00 62.31 C ATOM 970 C ASP A 60 3.359 -33.118 -10.487 1.00 11.35 C ATOM 971 O ASP A 60 4.508 -33.438 -10.725 1.00 34.54 O ATOM 972 CB ASP A 60 1.601 -34.825 -9.912 1.00 53.14 C ATOM 973 CG ASP A 60 2.191 -36.223 -9.722 1.00 15.42 C ATOM 974 OD1 ASP A 60 3.100 -36.567 -10.461 1.00 62.35 O ATOM 975 OD2 ASP A 60 1.726 -36.928 -8.843 1.00 51.23 O ATOM 0 H ASP A 60 0.943 -32.403 -9.240 1.00 63.32 H new ATOM 0 HA ASP A 60 3.305 -34.218 -8.678 1.00 62.31 H new ATOM 0 HB2 ASP A 60 0.640 -34.753 -9.404 1.00 53.14 H new ATOM 0 HB3 ASP A 60 1.417 -34.637 -10.970 1.00 53.14 H new ATOM 980 N GLY A 61 2.755 -32.198 -11.189 1.00 61.24 N ATOM 981 CA GLY A 61 3.475 -31.518 -12.303 1.00 13.40 C ATOM 982 C GLY A 61 2.535 -31.352 -13.499 1.00 21.13 C ATOM 983 O GLY A 61 2.796 -31.844 -14.579 1.00 24.12 O ATOM 0 H GLY A 61 1.795 -31.888 -11.039 1.00 61.24 H new ATOM 0 HA2 GLY A 61 3.836 -30.544 -11.974 1.00 13.40 H new ATOM 0 HA3 GLY A 61 4.349 -32.101 -12.593 1.00 13.40 H new ATOM 987 N ARG A 62 1.443 -30.664 -13.315 1.00 2.24 N ATOM 988 CA ARG A 62 0.484 -30.468 -14.440 1.00 61.15 C ATOM 989 C ARG A 62 0.791 -29.159 -15.176 1.00 1.40 C ATOM 990 O ARG A 62 1.663 -28.409 -14.786 1.00 52.25 O ATOM 991 CB ARG A 62 -0.894 -30.403 -13.779 1.00 22.25 C ATOM 992 CG ARG A 62 -1.732 -31.597 -14.237 1.00 51.40 C ATOM 993 CD ARG A 62 -3.131 -31.122 -14.637 1.00 75.31 C ATOM 994 NE ARG A 62 -3.952 -31.264 -13.403 1.00 51.50 N ATOM 995 CZ ARG A 62 -5.061 -30.588 -13.275 1.00 2.43 C ATOM 996 NH1 ARG A 62 -5.134 -29.360 -13.715 1.00 33.52 N ATOM 997 NH2 ARG A 62 -6.099 -31.139 -12.708 1.00 50.21 N ATOM 0 H ARG A 62 1.172 -30.228 -12.434 1.00 2.24 H new ATOM 0 HA ARG A 62 0.544 -31.268 -15.178 1.00 61.15 H new ATOM 0 HB2 ARG A 62 -0.790 -30.412 -12.694 1.00 22.25 H new ATOM 0 HB3 ARG A 62 -1.393 -29.471 -14.044 1.00 22.25 H new ATOM 0 HG2 ARG A 62 -1.250 -32.090 -15.081 1.00 51.40 H new ATOM 0 HG3 ARG A 62 -1.802 -32.333 -13.436 1.00 51.40 H new ATOM 0 HD2 ARG A 62 -3.113 -30.088 -14.983 1.00 75.31 H new ATOM 0 HD3 ARG A 62 -3.535 -31.724 -15.451 1.00 75.31 H new ATOM 0 HE ARG A 62 -3.648 -31.890 -12.657 1.00 51.50 H new ATOM 0 HH11 ARG A 62 -4.324 -28.928 -14.159 1.00 33.52 H new ATOM 0 HH12 ARG A 62 -6.001 -28.833 -13.614 1.00 33.52 H new ATOM 0 HH21 ARG A 62 -6.044 -32.098 -12.365 1.00 50.21 H new ATOM 0 HH22 ARG A 62 -6.966 -30.611 -12.608 1.00 50.21 H new ATOM 1011 N LYS A 63 0.085 -28.883 -16.238 1.00 70.13 N ATOM 1012 CA LYS A 63 0.343 -27.626 -16.997 1.00 12.03 C ATOM 1013 C LYS A 63 -0.291 -26.431 -16.278 1.00 64.51 C ATOM 1014 O LYS A 63 -1.023 -26.589 -15.320 1.00 2.52 O ATOM 1015 CB LYS A 63 -0.318 -27.843 -18.359 1.00 71.11 C ATOM 1016 CG LYS A 63 0.726 -28.339 -19.362 1.00 62.34 C ATOM 1017 CD LYS A 63 1.300 -27.149 -20.134 1.00 64.31 C ATOM 1018 CE LYS A 63 2.534 -27.597 -20.918 1.00 2.34 C ATOM 1019 NZ LYS A 63 2.753 -26.529 -21.934 1.00 23.14 N ATOM 0 H LYS A 63 -0.658 -29.472 -16.613 1.00 70.13 H new ATOM 0 HA LYS A 63 1.408 -27.412 -17.089 1.00 12.03 H new ATOM 0 HB2 LYS A 63 -1.126 -28.569 -18.271 1.00 71.11 H new ATOM 0 HB3 LYS A 63 -0.762 -26.912 -18.711 1.00 71.11 H new ATOM 0 HG2 LYS A 63 1.525 -28.867 -18.840 1.00 62.34 H new ATOM 0 HG3 LYS A 63 0.273 -29.050 -20.053 1.00 62.34 H new ATOM 0 HD2 LYS A 63 0.549 -26.747 -20.815 1.00 64.31 H new ATOM 0 HD3 LYS A 63 1.565 -26.348 -19.444 1.00 64.31 H new ATOM 0 HE2 LYS A 63 3.400 -27.704 -20.264 1.00 2.34 H new ATOM 0 HE3 LYS A 63 2.371 -28.565 -21.392 1.00 2.34 H new ATOM 0 HZ1 LYS A 63 3.584 -26.765 -22.512 1.00 23.14 H new ATOM 0 HZ2 LYS A 63 1.915 -26.455 -22.546 1.00 23.14 H new ATOM 0 HZ3 LYS A 63 2.912 -25.620 -21.454 1.00 23.14 H new ATOM 1033 N LYS A 64 -0.010 -25.240 -16.730 1.00 72.41 N ATOM 1034 CA LYS A 64 -0.591 -24.033 -16.070 1.00 30.45 C ATOM 1035 C LYS A 64 -2.040 -23.826 -16.518 1.00 23.50 C ATOM 1036 O LYS A 64 -2.476 -24.367 -17.518 1.00 4.43 O ATOM 1037 CB LYS A 64 0.285 -22.872 -16.541 1.00 12.21 C ATOM 1038 CG LYS A 64 0.039 -22.618 -18.030 1.00 21.21 C ATOM 1039 CD LYS A 64 1.321 -22.902 -18.816 1.00 55.03 C ATOM 1040 CE LYS A 64 1.624 -21.725 -19.745 1.00 21.24 C ATOM 1041 NZ LYS A 64 3.058 -21.406 -19.510 1.00 2.32 N ATOM 0 H LYS A 64 0.596 -25.049 -17.527 1.00 72.41 H new ATOM 0 HA LYS A 64 -0.607 -24.123 -14.984 1.00 30.45 H new ATOM 0 HB2 LYS A 64 0.058 -21.974 -15.966 1.00 12.21 H new ATOM 0 HB3 LYS A 64 1.336 -23.103 -16.369 1.00 12.21 H new ATOM 0 HG2 LYS A 64 -0.769 -23.255 -18.390 1.00 21.21 H new ATOM 0 HG3 LYS A 64 -0.275 -21.586 -18.187 1.00 21.21 H new ATOM 0 HD2 LYS A 64 2.153 -23.060 -18.130 1.00 55.03 H new ATOM 0 HD3 LYS A 64 1.208 -23.817 -19.397 1.00 55.03 H new ATOM 0 HE2 LYS A 64 1.444 -21.989 -20.787 1.00 21.24 H new ATOM 0 HE3 LYS A 64 0.987 -20.870 -19.518 1.00 21.24 H new ATOM 0 HZ1 LYS A 64 3.339 -20.607 -20.113 1.00 2.32 H new ATOM 0 HZ2 LYS A 64 3.198 -21.152 -18.511 1.00 2.32 H new ATOM 0 HZ3 LYS A 64 3.641 -22.236 -19.741 1.00 2.32 H new ATOM 1055 N LEU A 65 -2.789 -23.045 -15.789 1.00 52.25 N ATOM 1056 CA LEU A 65 -4.209 -22.801 -16.173 1.00 73.12 C ATOM 1057 C LEU A 65 -4.292 -21.616 -17.138 1.00 62.25 C ATOM 1058 O LEU A 65 -3.360 -20.846 -17.272 1.00 62.32 O ATOM 1059 CB LEU A 65 -4.926 -22.474 -14.863 1.00 63.14 C ATOM 1060 CG LEU A 65 -4.600 -23.543 -13.819 1.00 71.42 C ATOM 1061 CD1 LEU A 65 -4.154 -22.870 -12.520 1.00 71.01 C ATOM 1062 CD2 LEU A 65 -5.842 -24.392 -13.552 1.00 1.15 C ATOM 0 H LEU A 65 -2.479 -22.565 -14.944 1.00 52.25 H new ATOM 0 HA LEU A 65 -4.655 -23.659 -16.676 1.00 73.12 H new ATOM 0 HB2 LEU A 65 -4.617 -21.493 -14.502 1.00 63.14 H new ATOM 0 HB3 LEU A 65 -6.003 -22.428 -15.028 1.00 63.14 H new ATOM 0 HG LEU A 65 -3.798 -24.180 -14.192 1.00 71.42 H new ATOM 0 HD11 LEU A 65 -3.922 -23.632 -11.776 1.00 71.01 H new ATOM 0 HD12 LEU A 65 -3.267 -22.266 -12.709 1.00 71.01 H new ATOM 0 HD13 LEU A 65 -4.955 -22.232 -12.147 1.00 71.01 H new ATOM 0 HD21 LEU A 65 -5.609 -25.154 -12.808 1.00 1.15 H new ATOM 0 HD22 LEU A 65 -6.645 -23.755 -13.180 1.00 1.15 H new ATOM 0 HD23 LEU A 65 -6.159 -24.874 -14.477 1.00 1.15 H new ATOM 1074 N VAL A 66 -5.397 -21.465 -17.811 1.00 41.50 N ATOM 1075 CA VAL A 66 -5.535 -20.329 -18.767 1.00 15.44 C ATOM 1076 C VAL A 66 -5.992 -19.066 -18.027 1.00 21.31 C ATOM 1077 O VAL A 66 -6.094 -18.003 -18.604 1.00 41.12 O ATOM 1078 CB VAL A 66 -6.591 -20.787 -19.779 1.00 13.33 C ATOM 1079 CG1 VAL A 66 -7.991 -20.637 -19.177 1.00 74.30 C ATOM 1080 CG2 VAL A 66 -6.487 -19.934 -21.045 1.00 72.14 C ATOM 0 H VAL A 66 -6.210 -22.077 -17.742 1.00 41.50 H new ATOM 0 HA VAL A 66 -4.593 -20.079 -19.255 1.00 15.44 H new ATOM 0 HB VAL A 66 -6.418 -21.834 -20.027 1.00 13.33 H new ATOM 0 HG11 VAL A 66 -8.736 -20.964 -19.902 1.00 74.30 H new ATOM 0 HG12 VAL A 66 -8.068 -21.248 -18.277 1.00 74.30 H new ATOM 0 HG13 VAL A 66 -8.167 -19.592 -18.922 1.00 74.30 H new ATOM 0 HG21 VAL A 66 -7.238 -20.259 -21.765 1.00 72.14 H new ATOM 0 HG22 VAL A 66 -6.655 -18.887 -20.793 1.00 72.14 H new ATOM 0 HG23 VAL A 66 -5.494 -20.048 -21.480 1.00 72.14 H new ATOM 1090 N ASN A 67 -6.267 -19.178 -16.755 1.00 4.04 N ATOM 1091 CA ASN A 67 -6.717 -17.981 -15.986 1.00 10.43 C ATOM 1092 C ASN A 67 -5.537 -17.363 -15.233 1.00 41.44 C ATOM 1093 O ASN A 67 -5.184 -16.221 -15.445 1.00 63.34 O ATOM 1094 CB ASN A 67 -7.764 -18.504 -15.005 1.00 41.41 C ATOM 1095 CG ASN A 67 -9.139 -18.498 -15.675 1.00 32.13 C ATOM 1096 OD1 ASN A 67 -9.636 -17.460 -16.060 1.00 61.43 O ATOM 1097 ND2 ASN A 67 -9.779 -19.626 -15.831 1.00 12.22 N ATOM 0 H ASN A 67 -6.200 -20.042 -16.217 1.00 4.04 H new ATOM 0 HA ASN A 67 -7.123 -17.205 -16.635 1.00 10.43 H new ATOM 0 HB2 ASN A 67 -7.507 -19.514 -14.687 1.00 41.41 H new ATOM 0 HB3 ASN A 67 -7.781 -17.883 -14.110 1.00 41.41 H new ATOM 0 HD21 ASN A 67 -10.697 -19.634 -16.276 1.00 12.22 H new ATOM 0 HD22 ASN A 67 -9.361 -20.498 -15.507 1.00 12.22 H new ATOM 1104 N ALA A 68 -4.927 -18.108 -14.353 1.00 30.21 N ATOM 1105 CA ALA A 68 -3.773 -17.554 -13.588 1.00 64.15 C ATOM 1106 C ALA A 68 -2.531 -18.419 -13.797 1.00 11.21 C ATOM 1107 O ALA A 68 -2.622 -19.596 -14.083 1.00 25.10 O ATOM 1108 CB ALA A 68 -4.214 -17.596 -12.122 1.00 3.32 C ATOM 0 H ALA A 68 -5.176 -19.072 -14.131 1.00 30.21 H new ATOM 0 HA ALA A 68 -3.513 -16.545 -13.909 1.00 64.15 H new ATOM 0 HB1 ALA A 68 -3.417 -17.203 -11.491 1.00 3.32 H new ATOM 0 HB2 ALA A 68 -5.110 -16.989 -11.994 1.00 3.32 H new ATOM 0 HB3 ALA A 68 -4.429 -18.626 -11.836 1.00 3.32 H new ATOM 1114 N ASP A 69 -1.368 -17.846 -13.652 1.00 62.25 N ATOM 1115 CA ASP A 69 -0.124 -18.641 -13.836 1.00 42.14 C ATOM 1116 C ASP A 69 0.211 -19.373 -12.538 1.00 42.34 C ATOM 1117 O ASP A 69 0.582 -18.772 -11.550 1.00 32.24 O ATOM 1118 CB ASP A 69 0.956 -17.613 -14.175 1.00 13.11 C ATOM 1119 CG ASP A 69 0.559 -16.855 -15.443 1.00 23.11 C ATOM 1120 OD1 ASP A 69 -0.616 -16.863 -15.772 1.00 72.52 O ATOM 1121 OD2 ASP A 69 1.436 -16.277 -16.064 1.00 30.50 O ATOM 0 H ASP A 69 -1.227 -16.864 -13.415 1.00 62.25 H new ATOM 0 HA ASP A 69 -0.217 -19.396 -14.617 1.00 42.14 H new ATOM 0 HB2 ASP A 69 1.082 -16.916 -13.347 1.00 13.11 H new ATOM 0 HB3 ASP A 69 1.914 -18.111 -14.321 1.00 13.11 H new ATOM 1126 N ILE A 70 0.075 -20.669 -12.530 1.00 22.20 N ATOM 1127 CA ILE A 70 0.377 -21.442 -11.292 1.00 63.22 C ATOM 1128 C ILE A 70 1.759 -21.054 -10.752 1.00 30.21 C ATOM 1129 O ILE A 70 2.011 -21.114 -9.564 1.00 1.31 O ATOM 1130 CB ILE A 70 0.314 -22.919 -11.726 1.00 21.43 C ATOM 1131 CG1 ILE A 70 -0.369 -23.740 -10.629 1.00 4.20 C ATOM 1132 CG2 ILE A 70 1.721 -23.478 -11.978 1.00 22.02 C ATOM 1133 CD1 ILE A 70 0.225 -23.369 -9.267 1.00 43.15 C ATOM 0 H ILE A 70 -0.232 -21.227 -13.327 1.00 22.20 H new ATOM 0 HA ILE A 70 -0.324 -21.243 -10.482 1.00 63.22 H new ATOM 0 HB ILE A 70 -0.255 -22.984 -12.654 1.00 21.43 H new ATOM 0 HG12 ILE A 70 -1.442 -23.550 -10.633 1.00 4.20 H new ATOM 0 HG13 ILE A 70 -0.233 -24.805 -10.819 1.00 4.20 H new ATOM 0 HG21 ILE A 70 1.649 -24.522 -12.283 1.00 22.02 H new ATOM 0 HG22 ILE A 70 2.205 -22.902 -12.767 1.00 22.02 H new ATOM 0 HG23 ILE A 70 2.310 -23.407 -11.063 1.00 22.02 H new ATOM 0 HD11 ILE A 70 -0.262 -23.954 -8.486 1.00 43.15 H new ATOM 0 HD12 ILE A 70 1.294 -23.581 -9.266 1.00 43.15 H new ATOM 0 HD13 ILE A 70 0.066 -22.307 -9.078 1.00 43.15 H new ATOM 1145 N GLU A 71 2.657 -20.654 -11.614 1.00 10.41 N ATOM 1146 CA GLU A 71 4.017 -20.264 -11.140 1.00 22.13 C ATOM 1147 C GLU A 71 3.976 -18.885 -10.472 1.00 10.13 C ATOM 1148 O GLU A 71 4.652 -18.645 -9.491 1.00 2.11 O ATOM 1149 CB GLU A 71 4.914 -20.252 -12.389 1.00 11.41 C ATOM 1150 CG GLU A 71 4.225 -19.524 -13.546 1.00 4.21 C ATOM 1151 CD GLU A 71 5.215 -18.557 -14.198 1.00 30.11 C ATOM 1152 OE1 GLU A 71 6.130 -19.027 -14.852 1.00 13.11 O ATOM 1153 OE2 GLU A 71 5.041 -17.360 -14.032 1.00 64.01 O ATOM 0 H GLU A 71 2.508 -20.581 -12.620 1.00 10.41 H new ATOM 0 HA GLU A 71 4.399 -20.960 -10.393 1.00 22.13 H new ATOM 0 HB2 GLU A 71 5.860 -19.763 -12.158 1.00 11.41 H new ATOM 0 HB3 GLU A 71 5.147 -21.275 -12.684 1.00 11.41 H new ATOM 0 HG2 GLU A 71 3.865 -20.244 -14.281 1.00 4.21 H new ATOM 0 HG3 GLU A 71 3.354 -18.979 -13.181 1.00 4.21 H new ATOM 1160 N LYS A 72 3.189 -17.975 -10.985 1.00 4.30 N ATOM 1161 CA LYS A 72 3.113 -16.621 -10.363 1.00 20.00 C ATOM 1162 C LYS A 72 2.438 -16.718 -8.994 1.00 64.13 C ATOM 1163 O LYS A 72 2.557 -15.836 -8.167 1.00 72.03 O ATOM 1164 CB LYS A 72 2.265 -15.787 -11.325 1.00 74.22 C ATOM 1165 CG LYS A 72 3.012 -15.608 -12.648 1.00 70.04 C ATOM 1166 CD LYS A 72 4.136 -14.583 -12.471 1.00 41.32 C ATOM 1167 CE LYS A 72 3.545 -13.171 -12.484 1.00 5.11 C ATOM 1168 NZ LYS A 72 4.689 -12.280 -12.823 1.00 61.43 N ATOM 0 H LYS A 72 2.598 -18.111 -11.805 1.00 4.30 H new ATOM 0 HA LYS A 72 4.096 -16.178 -10.206 1.00 20.00 H new ATOM 0 HB2 LYS A 72 1.308 -16.278 -11.500 1.00 74.22 H new ATOM 0 HB3 LYS A 72 2.048 -14.814 -10.884 1.00 74.22 H new ATOM 0 HG2 LYS A 72 3.425 -16.562 -12.976 1.00 70.04 H new ATOM 0 HG3 LYS A 72 2.323 -15.276 -13.424 1.00 70.04 H new ATOM 0 HD2 LYS A 72 4.660 -14.761 -11.532 1.00 41.32 H new ATOM 0 HD3 LYS A 72 4.869 -14.689 -13.271 1.00 41.32 H new ATOM 0 HE2 LYS A 72 2.745 -13.084 -13.219 1.00 5.11 H new ATOM 0 HE3 LYS A 72 3.117 -12.913 -11.515 1.00 5.11 H new ATOM 0 HZ1 LYS A 72 4.364 -11.293 -12.851 1.00 61.43 H new ATOM 0 HZ2 LYS A 72 5.432 -12.379 -12.102 1.00 61.43 H new ATOM 0 HZ3 LYS A 72 5.072 -12.545 -13.753 1.00 61.43 H new ATOM 1182 N VAL A 73 1.733 -17.789 -8.749 1.00 40.43 N ATOM 1183 CA VAL A 73 1.052 -17.951 -7.433 1.00 50.01 C ATOM 1184 C VAL A 73 2.028 -18.528 -6.405 1.00 10.41 C ATOM 1185 O VAL A 73 1.868 -18.353 -5.214 1.00 53.13 O ATOM 1186 CB VAL A 73 -0.090 -18.932 -7.698 1.00 21.42 C ATOM 1187 CG1 VAL A 73 -0.872 -19.167 -6.404 1.00 40.41 C ATOM 1188 CG2 VAL A 73 -1.024 -18.352 -8.761 1.00 61.12 C ATOM 0 H VAL A 73 1.599 -18.559 -9.404 1.00 40.43 H new ATOM 0 HA VAL A 73 0.690 -17.004 -7.033 1.00 50.01 H new ATOM 0 HB VAL A 73 0.319 -19.879 -8.052 1.00 21.42 H new ATOM 0 HG11 VAL A 73 -1.686 -19.866 -6.593 1.00 40.41 H new ATOM 0 HG12 VAL A 73 -0.206 -19.581 -5.647 1.00 40.41 H new ATOM 0 HG13 VAL A 73 -1.281 -18.221 -6.049 1.00 40.41 H new ATOM 0 HG21 VAL A 73 -1.838 -19.051 -8.950 1.00 61.12 H new ATOM 0 HG22 VAL A 73 -1.433 -17.405 -8.408 1.00 61.12 H new ATOM 0 HG23 VAL A 73 -0.467 -18.186 -9.683 1.00 61.12 H new ATOM 1198 N LYS A 74 3.040 -19.214 -6.861 1.00 73.31 N ATOM 1199 CA LYS A 74 4.032 -19.804 -5.916 1.00 4.31 C ATOM 1200 C LYS A 74 4.577 -18.721 -4.982 1.00 64.03 C ATOM 1201 O LYS A 74 4.636 -18.895 -3.778 1.00 62.20 O ATOM 1202 CB LYS A 74 5.147 -20.356 -6.804 1.00 53.15 C ATOM 1203 CG LYS A 74 4.585 -21.442 -7.724 1.00 41.20 C ATOM 1204 CD LYS A 74 4.386 -22.734 -6.929 1.00 51.40 C ATOM 1205 CE LYS A 74 2.891 -22.988 -6.729 1.00 0.23 C ATOM 1206 NZ LYS A 74 2.784 -23.612 -5.381 1.00 45.00 N ATOM 0 H LYS A 74 3.224 -19.392 -7.848 1.00 73.31 H new ATOM 0 HA LYS A 74 3.593 -20.578 -5.286 1.00 4.31 H new ATOM 0 HB2 LYS A 74 5.583 -19.553 -7.398 1.00 53.15 H new ATOM 0 HB3 LYS A 74 5.946 -20.767 -6.187 1.00 53.15 H new ATOM 0 HG2 LYS A 74 3.637 -21.116 -8.151 1.00 41.20 H new ATOM 0 HG3 LYS A 74 5.267 -21.616 -8.556 1.00 41.20 H new ATOM 0 HD2 LYS A 74 4.840 -23.572 -7.458 1.00 51.40 H new ATOM 0 HD3 LYS A 74 4.885 -22.659 -5.963 1.00 51.40 H new ATOM 0 HE2 LYS A 74 2.322 -22.059 -6.781 1.00 0.23 H new ATOM 0 HE3 LYS A 74 2.496 -23.647 -7.502 1.00 0.23 H new ATOM 0 HZ1 LYS A 74 1.786 -23.816 -5.171 1.00 45.00 H new ATOM 0 HZ2 LYS A 74 3.330 -24.497 -5.364 1.00 45.00 H new ATOM 0 HZ3 LYS A 74 3.162 -22.959 -4.665 1.00 45.00 H new ATOM 1220 N GLN A 75 4.977 -17.606 -5.524 1.00 20.03 N ATOM 1221 CA GLN A 75 5.520 -16.512 -4.672 1.00 71.14 C ATOM 1222 C GLN A 75 4.414 -15.938 -3.784 1.00 64.10 C ATOM 1223 O GLN A 75 4.673 -15.211 -2.844 1.00 41.42 O ATOM 1224 CB GLN A 75 6.025 -15.456 -5.655 1.00 42.24 C ATOM 1225 CG GLN A 75 4.866 -14.981 -6.536 1.00 61.21 C ATOM 1226 CD GLN A 75 4.126 -13.836 -5.843 1.00 11.24 C ATOM 1227 OE1 GLN A 75 4.719 -12.829 -5.510 1.00 35.13 O ATOM 1228 NE2 GLN A 75 2.848 -13.953 -5.607 1.00 71.32 N ATOM 0 H GLN A 75 4.951 -17.404 -6.523 1.00 20.03 H new ATOM 0 HA GLN A 75 6.312 -16.859 -4.008 1.00 71.14 H new ATOM 0 HB2 GLN A 75 6.452 -14.613 -5.112 1.00 42.24 H new ATOM 0 HB3 GLN A 75 6.820 -15.871 -6.274 1.00 42.24 H new ATOM 0 HG2 GLN A 75 5.244 -14.650 -7.503 1.00 61.21 H new ATOM 0 HG3 GLN A 75 4.180 -15.806 -6.728 1.00 61.21 H new ATOM 0 HE21 GLN A 75 2.353 -14.799 -5.888 1.00 71.32 H new ATOM 0 HE22 GLN A 75 2.344 -13.198 -5.142 1.00 71.32 H new ATOM 1237 N ALA A 76 3.184 -16.255 -4.074 1.00 60.41 N ATOM 1238 CA ALA A 76 2.061 -15.728 -3.249 1.00 63.32 C ATOM 1239 C ALA A 76 1.768 -16.677 -2.085 1.00 61.42 C ATOM 1240 O ALA A 76 1.637 -16.262 -0.951 1.00 53.23 O ATOM 1241 CB ALA A 76 0.864 -15.669 -4.197 1.00 12.31 C ATOM 0 H ALA A 76 2.907 -16.858 -4.849 1.00 60.41 H new ATOM 0 HA ALA A 76 2.291 -14.754 -2.818 1.00 63.32 H new ATOM 0 HB1 ALA A 76 -0.006 -15.289 -3.661 1.00 12.31 H new ATOM 0 HB2 ALA A 76 1.093 -15.007 -5.032 1.00 12.31 H new ATOM 0 HB3 ALA A 76 0.649 -16.669 -4.575 1.00 12.31 H new ATOM 1247 N LEU A 77 1.661 -17.948 -2.359 1.00 40.34 N ATOM 1248 CA LEU A 77 1.371 -18.922 -1.268 1.00 34.10 C ATOM 1249 C LEU A 77 2.610 -19.117 -0.389 1.00 53.05 C ATOM 1250 O LEU A 77 2.509 -19.445 0.775 1.00 55.12 O ATOM 1251 CB LEU A 77 1.001 -20.220 -1.980 1.00 0.23 C ATOM 1252 CG LEU A 77 -0.157 -19.959 -2.945 1.00 31.42 C ATOM 1253 CD1 LEU A 77 -0.694 -21.292 -3.472 1.00 12.41 C ATOM 1254 CD2 LEU A 77 -1.273 -19.216 -2.209 1.00 62.43 C ATOM 0 H LEU A 77 1.762 -18.354 -3.289 1.00 40.34 H new ATOM 0 HA LEU A 77 0.571 -18.581 -0.611 1.00 34.10 H new ATOM 0 HB2 LEU A 77 1.862 -20.607 -2.525 1.00 0.23 H new ATOM 0 HB3 LEU A 77 0.717 -20.979 -1.251 1.00 0.23 H new ATOM 0 HG LEU A 77 0.195 -19.354 -3.781 1.00 31.42 H new ATOM 0 HD11 LEU A 77 -1.519 -21.106 -4.159 1.00 12.41 H new ATOM 0 HD12 LEU A 77 0.101 -21.823 -3.995 1.00 12.41 H new ATOM 0 HD13 LEU A 77 -1.047 -21.898 -2.637 1.00 12.41 H new ATOM 0 HD21 LEU A 77 -2.099 -19.029 -2.895 1.00 62.43 H new ATOM 0 HD22 LEU A 77 -1.625 -19.822 -1.374 1.00 62.43 H new ATOM 0 HD23 LEU A 77 -0.892 -18.267 -1.833 1.00 62.43 H new ATOM 1266 N THR A 78 3.779 -18.911 -0.937 1.00 1.25 N ATOM 1267 CA THR A 78 5.015 -19.083 -0.125 1.00 32.22 C ATOM 1268 C THR A 78 5.289 -17.803 0.676 1.00 72.05 C ATOM 1269 O THR A 78 5.837 -17.841 1.760 1.00 0.04 O ATOM 1270 CB THR A 78 6.130 -19.346 -1.143 1.00 61.04 C ATOM 1271 OG1 THR A 78 7.236 -19.946 -0.486 1.00 10.41 O ATOM 1272 CG2 THR A 78 6.571 -18.030 -1.788 1.00 22.41 C ATOM 0 H THR A 78 3.929 -18.633 -1.907 1.00 1.25 H new ATOM 0 HA THR A 78 4.936 -19.898 0.595 1.00 32.22 H new ATOM 0 HB THR A 78 5.757 -20.015 -1.918 1.00 61.04 H new ATOM 0 HG1 THR A 78 7.949 -20.116 -1.136 1.00 10.41 H new ATOM 0 HG21 THR A 78 7.364 -18.226 -2.510 1.00 22.41 H new ATOM 0 HG22 THR A 78 5.723 -17.572 -2.296 1.00 22.41 H new ATOM 0 HG23 THR A 78 6.941 -17.353 -1.018 1.00 22.41 H new ATOM 1280 N GLU A 79 4.904 -16.672 0.148 1.00 11.12 N ATOM 1281 CA GLU A 79 5.130 -15.390 0.875 1.00 71.45 C ATOM 1282 C GLU A 79 3.921 -15.078 1.756 1.00 63.51 C ATOM 1283 O GLU A 79 4.052 -14.638 2.882 1.00 54.11 O ATOM 1284 CB GLU A 79 5.279 -14.330 -0.217 1.00 40.30 C ATOM 1285 CG GLU A 79 6.586 -14.554 -0.977 1.00 63.14 C ATOM 1286 CD GLU A 79 7.672 -13.646 -0.401 1.00 33.03 C ATOM 1287 OE1 GLU A 79 7.361 -12.876 0.492 1.00 43.23 O ATOM 1288 OE2 GLU A 79 8.800 -13.737 -0.860 1.00 62.41 O ATOM 0 H GLU A 79 4.442 -16.581 -0.757 1.00 11.12 H new ATOM 0 HA GLU A 79 6.006 -15.429 1.523 1.00 71.45 H new ATOM 0 HB2 GLU A 79 4.434 -14.381 -0.904 1.00 40.30 H new ATOM 0 HB3 GLU A 79 5.271 -13.334 0.226 1.00 40.30 H new ATOM 0 HG2 GLU A 79 6.890 -15.598 -0.899 1.00 63.14 H new ATOM 0 HG3 GLU A 79 6.444 -14.342 -2.037 1.00 63.14 H new ATOM 1295 N GLN A 80 2.741 -15.305 1.247 1.00 0.23 N ATOM 1296 CA GLN A 80 1.515 -15.024 2.048 1.00 1.24 C ATOM 1297 C GLN A 80 0.772 -16.330 2.329 1.00 2.42 C ATOM 1298 O GLN A 80 0.530 -16.693 3.462 1.00 74.20 O ATOM 1299 CB GLN A 80 0.646 -14.115 1.172 1.00 44.03 C ATOM 1300 CG GLN A 80 1.512 -13.130 0.380 1.00 63.01 C ATOM 1301 CD GLN A 80 0.665 -12.487 -0.720 1.00 65.14 C ATOM 1302 OE1 GLN A 80 0.725 -11.290 -0.928 1.00 61.40 O ATOM 1303 NE2 GLN A 80 -0.129 -13.236 -1.437 1.00 11.32 N ATOM 0 H GLN A 80 2.572 -15.673 0.311 1.00 0.23 H new ATOM 0 HA GLN A 80 1.754 -14.559 3.004 1.00 1.24 H new ATOM 0 HB2 GLN A 80 0.056 -14.721 0.485 1.00 44.03 H new ATOM 0 HB3 GLN A 80 -0.058 -13.566 1.797 1.00 44.03 H new ATOM 0 HG2 GLN A 80 1.911 -12.363 1.044 1.00 63.01 H new ATOM 0 HG3 GLN A 80 2.365 -13.648 -0.058 1.00 63.01 H new ATOM 0 HE21 GLN A 80 -0.179 -14.240 -1.262 1.00 11.32 H new ATOM 0 HE22 GLN A 80 -0.699 -12.817 -2.172 1.00 11.32 H new ATOM 1312 N GLY A 81 0.410 -17.039 1.294 1.00 14.22 N ATOM 1313 CA GLY A 81 -0.319 -18.322 1.484 1.00 60.01 C ATOM 1314 C GLY A 81 -1.611 -18.303 0.663 1.00 52.14 C ATOM 1315 O GLY A 81 -2.397 -19.229 0.705 1.00 33.22 O ATOM 0 H GLY A 81 0.589 -16.783 0.323 1.00 14.22 H new ATOM 0 HA2 GLY A 81 0.308 -19.158 1.175 1.00 60.01 H new ATOM 0 HA3 GLY A 81 -0.549 -18.469 2.539 1.00 60.01 H new ATOM 1319 N TYR A 82 -1.836 -17.257 -0.086 1.00 22.11 N ATOM 1320 CA TYR A 82 -3.081 -17.186 -0.909 1.00 21.22 C ATOM 1321 C TYR A 82 -2.842 -16.314 -2.146 1.00 65.21 C ATOM 1322 O TYR A 82 -2.075 -15.372 -2.115 1.00 0.44 O ATOM 1323 CB TYR A 82 -4.152 -16.542 -0.012 1.00 11.14 C ATOM 1324 CG TYR A 82 -3.897 -16.873 1.442 1.00 41.34 C ATOM 1325 CD1 TYR A 82 -2.908 -16.181 2.152 1.00 11.40 C ATOM 1326 CD2 TYR A 82 -4.648 -17.867 2.080 1.00 20.24 C ATOM 1327 CE1 TYR A 82 -2.668 -16.484 3.496 1.00 20.14 C ATOM 1328 CE2 TYR A 82 -4.410 -18.170 3.425 1.00 53.15 C ATOM 1329 CZ TYR A 82 -3.420 -17.478 4.134 1.00 61.03 C ATOM 1330 OH TYR A 82 -3.183 -17.778 5.461 1.00 1.24 O ATOM 0 H TYR A 82 -1.215 -16.451 -0.164 1.00 22.11 H new ATOM 0 HA TYR A 82 -3.389 -18.174 -1.252 1.00 21.22 H new ATOM 0 HB2 TYR A 82 -4.148 -15.461 -0.151 1.00 11.14 H new ATOM 0 HB3 TYR A 82 -5.140 -16.897 -0.304 1.00 11.14 H new ATOM 0 HD1 TYR A 82 -2.330 -15.412 1.661 1.00 11.40 H new ATOM 0 HD2 TYR A 82 -5.412 -18.400 1.534 1.00 20.24 H new ATOM 0 HE1 TYR A 82 -1.903 -15.952 4.042 1.00 20.14 H new ATOM 0 HE2 TYR A 82 -4.990 -18.937 3.916 1.00 53.15 H new ATOM 0 HH TYR A 82 -3.792 -18.490 5.749 1.00 1.24 H new ATOM 1340 N TYR A 83 -3.503 -16.613 -3.230 1.00 34.12 N ATOM 1341 CA TYR A 83 -3.320 -15.796 -4.465 1.00 42.34 C ATOM 1342 C TYR A 83 -4.657 -15.655 -5.199 1.00 50.12 C ATOM 1343 O TYR A 83 -5.366 -16.622 -5.409 1.00 71.02 O ATOM 1344 CB TYR A 83 -2.316 -16.575 -5.318 1.00 4.21 C ATOM 1345 CG TYR A 83 -2.160 -15.898 -6.659 1.00 72.31 C ATOM 1346 CD1 TYR A 83 -3.207 -15.928 -7.586 1.00 62.23 C ATOM 1347 CD2 TYR A 83 -0.963 -15.240 -6.974 1.00 70.03 C ATOM 1348 CE1 TYR A 83 -3.060 -15.299 -8.830 1.00 65.43 C ATOM 1349 CE2 TYR A 83 -0.815 -14.613 -8.215 1.00 13.44 C ATOM 1350 CZ TYR A 83 -1.864 -14.641 -9.144 1.00 50.13 C ATOM 1351 OH TYR A 83 -1.720 -14.024 -10.369 1.00 11.30 O ATOM 0 H TYR A 83 -4.162 -17.387 -3.315 1.00 34.12 H new ATOM 0 HA TYR A 83 -2.965 -14.789 -4.247 1.00 42.34 H new ATOM 0 HB2 TYR A 83 -1.353 -16.625 -4.810 1.00 4.21 H new ATOM 0 HB3 TYR A 83 -2.658 -17.601 -5.455 1.00 4.21 H new ATOM 0 HD1 TYR A 83 -4.129 -16.436 -7.343 1.00 62.23 H new ATOM 0 HD2 TYR A 83 -0.155 -15.217 -6.258 1.00 70.03 H new ATOM 0 HE1 TYR A 83 -3.868 -15.322 -9.546 1.00 65.43 H new ATOM 0 HE2 TYR A 83 0.108 -14.107 -8.458 1.00 13.44 H new ATOM 0 HH TYR A 83 -0.832 -13.614 -10.426 1.00 11.30 H new ATOM 1361 N LEU A 84 -5.012 -14.460 -5.585 1.00 10.15 N ATOM 1362 CA LEU A 84 -6.307 -14.260 -6.296 1.00 63.30 C ATOM 1363 C LEU A 84 -6.062 -13.981 -7.780 1.00 3.12 C ATOM 1364 O LEU A 84 -5.209 -13.194 -8.140 1.00 3.21 O ATOM 1365 CB LEU A 84 -6.944 -13.047 -5.618 1.00 61.24 C ATOM 1366 CG LEU A 84 -8.273 -12.716 -6.296 1.00 12.32 C ATOM 1367 CD1 LEU A 84 -9.098 -13.994 -6.456 1.00 73.31 C ATOM 1368 CD2 LEU A 84 -9.050 -11.717 -5.434 1.00 12.34 C ATOM 0 H LEU A 84 -4.462 -13.614 -5.439 1.00 10.15 H new ATOM 0 HA LEU A 84 -6.947 -15.141 -6.244 1.00 63.30 H new ATOM 0 HB2 LEU A 84 -7.106 -13.253 -4.560 1.00 61.24 H new ATOM 0 HB3 LEU A 84 -6.272 -12.191 -5.677 1.00 61.24 H new ATOM 0 HG LEU A 84 -8.080 -12.281 -7.277 1.00 12.32 H new ATOM 0 HD11 LEU A 84 -10.046 -13.757 -6.940 1.00 73.31 H new ATOM 0 HD12 LEU A 84 -8.547 -14.709 -7.068 1.00 73.31 H new ATOM 0 HD13 LEU A 84 -9.290 -14.428 -5.475 1.00 73.31 H new ATOM 0 HD21 LEU A 84 -9.998 -11.480 -5.917 1.00 12.34 H new ATOM 0 HD22 LEU A 84 -9.241 -12.154 -4.454 1.00 12.34 H new ATOM 0 HD23 LEU A 84 -8.465 -10.805 -5.317 1.00 12.34 H new ATOM 1380 N GLN A 85 -6.804 -14.620 -8.645 1.00 74.11 N ATOM 1381 CA GLN A 85 -6.604 -14.384 -10.102 1.00 23.30 C ATOM 1382 C GLN A 85 -7.819 -13.664 -10.700 1.00 61.41 C ATOM 1383 O GLN A 85 -8.956 -14.025 -10.452 1.00 12.03 O ATOM 1384 CB GLN A 85 -6.431 -15.781 -10.718 1.00 2.14 C ATOM 1385 CG GLN A 85 -7.799 -16.414 -10.992 1.00 51.32 C ATOM 1386 CD GLN A 85 -8.349 -15.944 -12.346 1.00 53.30 C ATOM 1387 OE1 GLN A 85 -9.352 -16.448 -12.807 1.00 21.42 O ATOM 1388 NE2 GLN A 85 -7.735 -14.998 -13.009 1.00 41.43 N ATOM 0 H GLN A 85 -7.535 -15.290 -8.407 1.00 74.11 H new ATOM 0 HA GLN A 85 -5.740 -13.749 -10.301 1.00 23.30 H new ATOM 0 HB2 GLN A 85 -5.864 -15.709 -11.646 1.00 2.14 H new ATOM 0 HB3 GLN A 85 -5.858 -16.416 -10.042 1.00 2.14 H new ATOM 0 HG2 GLN A 85 -7.711 -17.500 -10.986 1.00 51.32 H new ATOM 0 HG3 GLN A 85 -8.496 -16.146 -10.197 1.00 51.32 H new ATOM 0 HE21 GLN A 85 -6.892 -14.571 -12.626 1.00 41.43 H new ATOM 0 HE22 GLN A 85 -8.100 -14.687 -13.909 1.00 41.43 H new ATOM 1397 N LEU A 86 -7.580 -12.651 -11.491 1.00 51.13 N ATOM 1398 CA LEU A 86 -8.704 -11.899 -12.118 1.00 31.20 C ATOM 1399 C LEU A 86 -8.448 -11.743 -13.620 1.00 41.24 C ATOM 1400 O LEU A 86 -7.413 -11.251 -14.025 1.00 73.42 O ATOM 1401 CB LEU A 86 -8.699 -10.534 -11.428 1.00 75.00 C ATOM 1402 CG LEU A 86 -10.108 -10.196 -10.934 1.00 21.12 C ATOM 1403 CD1 LEU A 86 -11.020 -9.936 -12.133 1.00 32.23 C ATOM 1404 CD2 LEU A 86 -10.658 -11.370 -10.117 1.00 20.13 C ATOM 0 H LEU A 86 -6.648 -12.311 -11.730 1.00 51.13 H new ATOM 0 HA LEU A 86 -9.662 -12.407 -12.005 1.00 31.20 H new ATOM 0 HB2 LEU A 86 -8.002 -10.543 -10.590 1.00 75.00 H new ATOM 0 HB3 LEU A 86 -8.353 -9.767 -12.121 1.00 75.00 H new ATOM 0 HG LEU A 86 -10.070 -9.305 -10.308 1.00 21.12 H new ATOM 0 HD11 LEU A 86 -12.023 -9.695 -11.782 1.00 32.23 H new ATOM 0 HD12 LEU A 86 -10.629 -9.100 -12.713 1.00 32.23 H new ATOM 0 HD13 LEU A 86 -11.059 -10.827 -12.760 1.00 32.23 H new ATOM 0 HD21 LEU A 86 -11.661 -11.130 -9.765 1.00 20.13 H new ATOM 0 HD22 LEU A 86 -10.697 -12.262 -10.742 1.00 20.13 H new ATOM 0 HD23 LEU A 86 -10.008 -11.554 -9.262 1.00 20.13 H new ATOM 1416 N PRO A 87 -9.402 -12.176 -14.402 1.00 14.14 N ATOM 1417 CA PRO A 87 -9.274 -12.091 -15.880 1.00 31.42 C ATOM 1418 C PRO A 87 -9.373 -10.636 -16.351 1.00 25.11 C ATOM 1419 O PRO A 87 -9.654 -9.747 -15.572 1.00 40.12 O ATOM 1420 CB PRO A 87 -10.453 -12.913 -16.388 1.00 52.32 C ATOM 1421 CG PRO A 87 -11.454 -12.881 -15.278 1.00 60.23 C ATOM 1422 CD PRO A 87 -10.675 -12.780 -13.994 1.00 50.52 C ATOM 0 HA PRO A 87 -8.315 -12.457 -16.247 1.00 31.42 H new ATOM 0 HB2 PRO A 87 -10.865 -12.488 -17.303 1.00 52.32 H new ATOM 0 HB3 PRO A 87 -10.152 -13.935 -16.618 1.00 52.32 H new ATOM 0 HG2 PRO A 87 -12.128 -12.032 -15.389 1.00 60.23 H new ATOM 0 HG3 PRO A 87 -12.070 -13.780 -15.287 1.00 60.23 H new ATOM 0 HD2 PRO A 87 -11.193 -12.163 -13.260 1.00 50.52 H new ATOM 0 HD3 PRO A 87 -10.525 -13.759 -13.539 1.00 50.52 H new ATOM 1430 N PRO A 88 -9.134 -10.447 -17.621 1.00 11.15 N ATOM 1431 CA PRO A 88 -9.189 -9.090 -18.219 1.00 61.02 C ATOM 1432 C PRO A 88 -10.639 -8.606 -18.334 1.00 44.03 C ATOM 1433 O PRO A 88 -11.431 -9.181 -19.055 1.00 4.22 O ATOM 1434 CB PRO A 88 -8.572 -9.282 -19.600 1.00 62.25 C ATOM 1435 CG PRO A 88 -8.783 -10.727 -19.920 1.00 25.03 C ATOM 1436 CD PRO A 88 -8.792 -11.473 -18.612 1.00 72.13 C ATOM 0 HA PRO A 88 -8.668 -8.341 -17.622 1.00 61.02 H new ATOM 0 HB2 PRO A 88 -9.051 -8.640 -20.339 1.00 62.25 H new ATOM 0 HB3 PRO A 88 -7.512 -9.029 -19.597 1.00 62.25 H new ATOM 0 HG2 PRO A 88 -9.724 -10.870 -20.452 1.00 25.03 H new ATOM 0 HG3 PRO A 88 -7.990 -11.098 -20.569 1.00 25.03 H new ATOM 0 HD2 PRO A 88 -9.523 -12.281 -18.618 1.00 72.13 H new ATOM 0 HD3 PRO A 88 -7.822 -11.923 -18.402 1.00 72.13 H new ATOM 1444 N PRO A 89 -10.935 -7.557 -17.614 1.00 22.31 N ATOM 1445 CA PRO A 89 -12.302 -6.978 -17.630 1.00 20.11 C ATOM 1446 C PRO A 89 -12.551 -6.229 -18.941 1.00 4.23 C ATOM 1447 O PRO A 89 -11.661 -6.097 -19.759 1.00 62.42 O ATOM 1448 CB PRO A 89 -12.288 -6.010 -16.447 1.00 34.12 C ATOM 1449 CG PRO A 89 -10.851 -5.651 -16.252 1.00 5.11 C ATOM 1450 CD PRO A 89 -10.031 -6.821 -16.726 1.00 53.11 C ATOM 0 HA PRO A 89 -13.088 -7.729 -17.556 1.00 20.11 H new ATOM 0 HB2 PRO A 89 -12.890 -5.126 -16.655 1.00 34.12 H new ATOM 0 HB3 PRO A 89 -12.703 -6.475 -15.553 1.00 34.12 H new ATOM 0 HG2 PRO A 89 -10.599 -4.752 -16.815 1.00 5.11 H new ATOM 0 HG3 PRO A 89 -10.647 -5.438 -15.203 1.00 5.11 H new ATOM 0 HD2 PRO A 89 -9.135 -6.492 -17.253 1.00 53.11 H new ATOM 0 HD3 PRO A 89 -9.701 -7.440 -15.892 1.00 53.11 H new ATOM 1458 N PRO A 90 -13.757 -5.753 -19.095 1.00 22.22 N ATOM 1459 CA PRO A 90 -14.134 -4.996 -20.317 1.00 4.04 C ATOM 1460 C PRO A 90 -13.398 -3.655 -20.353 1.00 12.20 C ATOM 1461 O PRO A 90 -13.431 -2.939 -21.334 1.00 71.15 O ATOM 1462 CB PRO A 90 -15.637 -4.786 -20.157 1.00 50.24 C ATOM 1463 CG PRO A 90 -15.870 -4.868 -18.685 1.00 63.02 C ATOM 1464 CD PRO A 90 -14.880 -5.868 -18.158 1.00 32.30 C ATOM 0 HA PRO A 90 -13.878 -5.513 -21.242 1.00 4.04 H new ATOM 0 HB2 PRO A 90 -15.948 -3.820 -20.555 1.00 50.24 H new ATOM 0 HB3 PRO A 90 -16.204 -5.548 -20.692 1.00 50.24 H new ATOM 0 HG2 PRO A 90 -15.729 -3.895 -18.214 1.00 63.02 H new ATOM 0 HG3 PRO A 90 -16.892 -5.181 -18.470 1.00 63.02 H new ATOM 0 HD2 PRO A 90 -14.578 -5.636 -17.137 1.00 32.30 H new ATOM 0 HD3 PRO A 90 -15.293 -6.876 -18.147 1.00 32.30 H new ATOM 1472 N GLU A 91 -12.727 -3.315 -19.288 1.00 23.24 N ATOM 1473 CA GLU A 91 -11.982 -2.028 -19.251 1.00 62.11 C ATOM 1474 C GLU A 91 -10.786 -2.105 -20.196 1.00 15.21 C ATOM 1475 O GLU A 91 -10.805 -2.829 -21.173 1.00 62.24 O ATOM 1476 CB GLU A 91 -11.516 -1.885 -17.800 1.00 23.03 C ATOM 1477 CG GLU A 91 -12.066 -0.583 -17.212 1.00 62.31 C ATOM 1478 CD GLU A 91 -13.590 -0.674 -17.108 1.00 41.33 C ATOM 1479 OE1 GLU A 91 -14.188 -1.272 -17.989 1.00 65.31 O ATOM 1480 OE2 GLU A 91 -14.131 -0.149 -16.151 1.00 51.22 O ATOM 0 H GLU A 91 -12.663 -3.876 -18.439 1.00 23.24 H new ATOM 0 HA GLU A 91 -12.589 -1.179 -19.565 1.00 62.11 H new ATOM 0 HB2 GLU A 91 -11.859 -2.736 -17.211 1.00 23.03 H new ATOM 0 HB3 GLU A 91 -10.427 -1.885 -17.755 1.00 23.03 H new ATOM 0 HG2 GLU A 91 -11.634 -0.405 -16.227 1.00 62.31 H new ATOM 0 HG3 GLU A 91 -11.783 0.261 -17.842 1.00 62.31 H new ATOM 1487 N ASP A 92 -9.744 -1.374 -19.920 1.00 70.11 N ATOM 1488 CA ASP A 92 -8.557 -1.429 -20.816 1.00 61.31 C ATOM 1489 C ASP A 92 -7.272 -1.543 -19.992 1.00 11.51 C ATOM 1490 O ASP A 92 -6.293 -0.876 -20.259 1.00 14.24 O ATOM 1491 CB ASP A 92 -8.585 -0.114 -21.596 1.00 31.52 C ATOM 1492 CG ASP A 92 -8.953 -0.394 -23.054 1.00 21.41 C ATOM 1493 OD1 ASP A 92 -9.482 -1.462 -23.315 1.00 23.41 O ATOM 1494 OD2 ASP A 92 -8.697 0.462 -23.884 1.00 24.11 O ATOM 0 H ASP A 92 -9.662 -0.746 -19.120 1.00 70.11 H new ATOM 0 HA ASP A 92 -8.582 -2.294 -21.479 1.00 61.31 H new ATOM 0 HB2 ASP A 92 -9.309 0.569 -21.152 1.00 31.52 H new ATOM 0 HB3 ASP A 92 -7.612 0.374 -21.543 1.00 31.52 H new ATOM 1499 N LEU A 93 -7.265 -2.386 -18.997 1.00 62.42 N ATOM 1500 CA LEU A 93 -6.040 -2.543 -18.162 1.00 32.03 C ATOM 1501 C LEU A 93 -5.097 -3.564 -18.802 1.00 51.41 C ATOM 1502 O LEU A 93 -5.521 -4.450 -19.519 1.00 21.21 O ATOM 1503 CB LEU A 93 -6.541 -3.060 -16.815 1.00 31.32 C ATOM 1504 CG LEU A 93 -7.464 -2.023 -16.179 1.00 62.24 C ATOM 1505 CD1 LEU A 93 -8.528 -2.734 -15.343 1.00 5.11 C ATOM 1506 CD2 LEU A 93 -6.643 -1.096 -15.282 1.00 65.20 C ATOM 0 H LEU A 93 -8.054 -2.973 -18.726 1.00 62.42 H new ATOM 0 HA LEU A 93 -5.487 -1.609 -18.062 1.00 32.03 H new ATOM 0 HB2 LEU A 93 -7.074 -4.001 -16.951 1.00 31.32 H new ATOM 0 HB3 LEU A 93 -5.697 -3.264 -16.156 1.00 31.32 H new ATOM 0 HG LEU A 93 -7.949 -1.437 -16.960 1.00 62.24 H new ATOM 0 HD11 LEU A 93 -9.188 -1.995 -14.888 1.00 5.11 H new ATOM 0 HD12 LEU A 93 -9.111 -3.396 -15.983 1.00 5.11 H new ATOM 0 HD13 LEU A 93 -8.045 -3.319 -14.560 1.00 5.11 H new ATOM 0 HD21 LEU A 93 -7.300 -0.355 -14.827 1.00 65.20 H new ATOM 0 HD22 LEU A 93 -6.159 -1.681 -14.500 1.00 65.20 H new ATOM 0 HD23 LEU A 93 -5.884 -0.590 -15.879 1.00 65.20 H new ATOM 1518 N LEU A 94 -3.824 -3.452 -18.548 1.00 15.11 N ATOM 1519 CA LEU A 94 -2.864 -4.423 -19.141 1.00 63.10 C ATOM 1520 C LEU A 94 -1.466 -4.229 -18.543 1.00 54.20 C ATOM 1521 O LEU A 94 -1.088 -4.898 -17.603 1.00 50.40 O ATOM 1522 CB LEU A 94 -2.855 -4.111 -20.639 1.00 11.30 C ATOM 1523 CG LEU A 94 -1.732 -4.898 -21.315 1.00 74.41 C ATOM 1524 CD1 LEU A 94 -2.001 -6.397 -21.172 1.00 53.12 C ATOM 1525 CD2 LEU A 94 -1.676 -4.532 -22.800 1.00 72.51 C ATOM 0 H LEU A 94 -3.407 -2.732 -17.957 1.00 15.11 H new ATOM 0 HA LEU A 94 -3.151 -5.455 -18.941 1.00 63.10 H new ATOM 0 HB2 LEU A 94 -3.816 -4.373 -21.082 1.00 11.30 H new ATOM 0 HB3 LEU A 94 -2.712 -3.042 -20.798 1.00 11.30 H new ATOM 0 HG LEU A 94 -0.781 -4.652 -20.842 1.00 74.41 H new ATOM 0 HD11 LEU A 94 -1.200 -6.958 -21.654 1.00 53.12 H new ATOM 0 HD12 LEU A 94 -2.043 -6.660 -20.115 1.00 53.12 H new ATOM 0 HD13 LEU A 94 -2.952 -6.643 -21.645 1.00 53.12 H new ATOM 0 HD21 LEU A 94 -0.876 -5.093 -23.283 1.00 72.51 H new ATOM 0 HD22 LEU A 94 -2.627 -4.778 -23.272 1.00 72.51 H new ATOM 0 HD23 LEU A 94 -1.485 -3.464 -22.905 1.00 72.51 H new ATOM 1537 N LYS A 95 -0.699 -3.324 -19.082 1.00 22.23 N ATOM 1538 CA LYS A 95 0.673 -3.097 -18.542 1.00 52.30 C ATOM 1539 C LYS A 95 0.807 -1.669 -18.001 1.00 13.30 C ATOM 1540 O LYS A 95 1.469 -0.834 -18.583 1.00 13.24 O ATOM 1541 CB LYS A 95 1.609 -3.306 -19.734 1.00 73.24 C ATOM 1542 CG LYS A 95 2.246 -4.693 -19.644 1.00 72.03 C ATOM 1543 CD LYS A 95 3.015 -4.988 -20.932 1.00 11.32 C ATOM 1544 CE LYS A 95 4.517 -4.825 -20.680 1.00 11.23 C ATOM 1545 NZ LYS A 95 5.110 -4.599 -22.028 1.00 43.23 N ATOM 0 H LYS A 95 -0.960 -2.732 -19.871 1.00 22.23 H new ATOM 0 HA LYS A 95 0.904 -3.770 -17.716 1.00 52.30 H new ATOM 0 HB2 LYS A 95 1.054 -3.209 -20.667 1.00 73.24 H new ATOM 0 HB3 LYS A 95 2.383 -2.538 -19.742 1.00 73.24 H new ATOM 0 HG2 LYS A 95 2.919 -4.741 -18.788 1.00 72.03 H new ATOM 0 HG3 LYS A 95 1.476 -5.448 -19.487 1.00 72.03 H new ATOM 0 HD2 LYS A 95 2.801 -6.001 -21.272 1.00 11.32 H new ATOM 0 HD3 LYS A 95 2.693 -4.311 -21.723 1.00 11.32 H new ATOM 0 HE2 LYS A 95 4.717 -3.985 -20.015 1.00 11.23 H new ATOM 0 HE3 LYS A 95 4.937 -5.713 -20.208 1.00 11.23 H new ATOM 0 HZ1 LYS A 95 6.139 -4.478 -21.939 1.00 43.23 H new ATOM 0 HZ2 LYS A 95 4.909 -5.418 -22.637 1.00 43.23 H new ATOM 0 HZ3 LYS A 95 4.696 -3.743 -22.450 1.00 43.23 H new ATOM 1559 N GLN A 96 0.187 -1.386 -16.889 1.00 73.33 N ATOM 1560 CA GLN A 96 0.284 -0.016 -16.310 1.00 42.23 C ATOM 1561 C GLN A 96 1.684 0.207 -15.735 1.00 13.02 C ATOM 1562 O GLN A 96 2.613 -0.516 -16.040 1.00 52.03 O ATOM 1563 CB GLN A 96 -0.767 0.019 -15.200 1.00 5.04 C ATOM 1564 CG GLN A 96 -2.077 -0.576 -15.721 1.00 22.32 C ATOM 1565 CD GLN A 96 -3.239 -0.101 -14.848 1.00 52.42 C ATOM 1566 OE1 GLN A 96 -3.610 -0.760 -13.897 1.00 74.12 O ATOM 1567 NE2 GLN A 96 -3.836 1.024 -15.131 1.00 3.30 N ATOM 0 H GLN A 96 -0.382 -2.043 -16.356 1.00 73.33 H new ATOM 0 HA GLN A 96 0.115 0.764 -17.052 1.00 42.23 H new ATOM 0 HB2 GLN A 96 -0.417 -0.545 -14.335 1.00 5.04 H new ATOM 0 HB3 GLN A 96 -0.927 1.045 -14.868 1.00 5.04 H new ATOM 0 HG2 GLN A 96 -2.239 -0.274 -16.756 1.00 22.32 H new ATOM 0 HG3 GLN A 96 -2.023 -1.665 -15.711 1.00 22.32 H new ATOM 0 HE21 GLN A 96 -3.526 1.579 -15.929 1.00 3.30 H new ATOM 0 HE22 GLN A 96 -4.612 1.349 -14.554 1.00 3.30 H new ATOM 1576 N HIS A 97 1.849 1.196 -14.902 1.00 12.41 N ATOM 1577 CA HIS A 97 3.194 1.452 -14.312 1.00 70.13 C ATOM 1578 C HIS A 97 3.810 0.134 -13.835 1.00 71.13 C ATOM 1579 O HIS A 97 4.905 -0.227 -14.220 1.00 43.21 O ATOM 1580 CB HIS A 97 2.940 2.386 -13.130 1.00 5.12 C ATOM 1581 CG HIS A 97 2.263 3.637 -13.621 1.00 72.05 C ATOM 1582 ND1 HIS A 97 2.448 4.122 -14.909 1.00 5.33 N ATOM 1583 CD2 HIS A 97 1.402 4.514 -13.011 1.00 31.41 C ATOM 1584 CE1 HIS A 97 1.713 5.241 -15.029 1.00 44.02 C ATOM 1585 NE2 HIS A 97 1.055 5.527 -13.900 1.00 60.11 N ATOM 0 H HIS A 97 1.114 1.837 -14.604 1.00 12.41 H new ATOM 0 HA HIS A 97 3.887 1.890 -15.030 1.00 70.13 H new ATOM 0 HB2 HIS A 97 2.317 1.889 -12.387 1.00 5.12 H new ATOM 0 HB3 HIS A 97 3.881 2.636 -12.641 1.00 5.12 H new ATOM 0 HD2 HIS A 97 1.047 4.431 -11.994 1.00 31.41 H new ATOM 0 HE1 HIS A 97 1.660 5.837 -15.928 1.00 44.02 H new ATOM 0 HE2 HIS A 97 0.433 6.317 -13.728 1.00 60.11 H new ATOM 1593 N LEU A 98 3.111 -0.589 -13.005 1.00 62.24 N ATOM 1594 CA LEU A 98 3.646 -1.889 -12.503 1.00 70.41 C ATOM 1595 C LEU A 98 5.136 -1.761 -12.173 1.00 32.20 C ATOM 1596 O LEU A 98 5.987 -2.227 -12.906 1.00 11.20 O ATOM 1597 CB LEU A 98 3.436 -2.873 -13.653 1.00 42.12 C ATOM 1598 CG LEU A 98 2.903 -4.196 -13.101 1.00 33.22 C ATOM 1599 CD1 LEU A 98 1.605 -4.567 -13.818 1.00 22.41 C ATOM 1600 CD2 LEU A 98 3.943 -5.295 -13.329 1.00 2.31 C ATOM 0 H LEU A 98 2.189 -0.336 -12.651 1.00 62.24 H new ATOM 0 HA LEU A 98 3.147 -2.214 -11.590 1.00 70.41 H new ATOM 0 HB2 LEU A 98 2.733 -2.459 -14.376 1.00 42.12 H new ATOM 0 HB3 LEU A 98 4.376 -3.039 -14.180 1.00 42.12 H new ATOM 0 HG LEU A 98 2.708 -4.091 -12.034 1.00 33.22 H new ATOM 0 HD11 LEU A 98 1.228 -5.510 -13.423 1.00 22.41 H new ATOM 0 HD12 LEU A 98 0.864 -3.784 -13.658 1.00 22.41 H new ATOM 0 HD13 LEU A 98 1.796 -4.672 -14.886 1.00 22.41 H new ATOM 0 HD21 LEU A 98 3.566 -6.240 -12.937 1.00 2.31 H new ATOM 0 HD22 LEU A 98 4.136 -5.397 -14.397 1.00 2.31 H new ATOM 0 HD23 LEU A 98 4.868 -5.032 -12.816 1.00 2.31 H new ATOM 1612 N SER A 99 5.457 -1.135 -11.077 1.00 51.13 N ATOM 1613 CA SER A 99 6.892 -0.981 -10.699 1.00 61.04 C ATOM 1614 C SER A 99 7.164 -1.709 -9.380 1.00 73.41 C ATOM 1615 O SER A 99 8.055 -1.348 -8.633 1.00 30.50 O ATOM 1616 CB SER A 99 7.101 0.524 -10.536 1.00 52.00 C ATOM 1617 OG SER A 99 6.649 1.189 -11.707 1.00 25.21 O ATOM 0 H SER A 99 4.790 -0.723 -10.425 1.00 51.13 H new ATOM 0 HA SER A 99 7.566 -1.404 -11.444 1.00 61.04 H new ATOM 0 HB2 SER A 99 6.556 0.886 -9.664 1.00 52.00 H new ATOM 0 HB3 SER A 99 8.156 0.740 -10.365 1.00 52.00 H new ATOM 0 HG SER A 99 6.780 2.155 -11.606 1.00 25.21 H new ATOM 1623 N VAL A 100 6.406 -2.728 -9.088 1.00 5.23 N ATOM 1624 CA VAL A 100 6.622 -3.480 -7.819 1.00 12.53 C ATOM 1625 C VAL A 100 6.392 -4.976 -8.045 1.00 1.23 C ATOM 1626 O VAL A 100 5.280 -5.461 -7.968 1.00 0.41 O ATOM 1627 CB VAL A 100 5.584 -2.919 -6.848 1.00 50.45 C ATOM 1628 CG1 VAL A 100 4.199 -2.957 -7.498 1.00 31.52 C ATOM 1629 CG2 VAL A 100 5.569 -3.766 -5.573 1.00 12.53 C ATOM 0 H VAL A 100 5.645 -3.074 -9.673 1.00 5.23 H new ATOM 0 HA VAL A 100 7.638 -3.369 -7.440 1.00 12.53 H new ATOM 0 HB VAL A 100 5.841 -1.889 -6.600 1.00 50.45 H new ATOM 0 HG11 VAL A 100 3.460 -2.557 -6.804 1.00 31.52 H new ATOM 0 HG12 VAL A 100 4.207 -2.355 -8.407 1.00 31.52 H new ATOM 0 HG13 VAL A 100 3.942 -3.987 -7.747 1.00 31.52 H new ATOM 0 HG21 VAL A 100 4.829 -3.367 -4.880 1.00 12.53 H new ATOM 0 HG22 VAL A 100 5.313 -4.796 -5.823 1.00 12.53 H new ATOM 0 HG23 VAL A 100 6.554 -3.740 -5.107 1.00 12.53 H new ATOM 1639 N MET A 101 7.432 -5.711 -8.320 1.00 33.20 N ATOM 1640 CA MET A 101 7.271 -7.176 -8.549 1.00 54.13 C ATOM 1641 C MET A 101 8.287 -7.958 -7.714 1.00 72.40 C ATOM 1642 O MET A 101 7.945 -8.591 -6.737 1.00 71.02 O ATOM 1643 CB MET A 101 7.531 -7.376 -10.042 1.00 11.54 C ATOM 1644 CG MET A 101 6.345 -6.838 -10.843 1.00 42.14 C ATOM 1645 SD MET A 101 6.951 -5.924 -12.281 1.00 5.33 S ATOM 1646 CE MET A 101 7.162 -7.346 -13.382 1.00 42.43 C ATOM 0 H MET A 101 8.387 -5.362 -8.396 1.00 33.20 H new ATOM 0 HA MET A 101 6.283 -7.533 -8.258 1.00 54.13 H new ATOM 0 HB2 MET A 101 8.445 -6.860 -10.335 1.00 11.54 H new ATOM 0 HB3 MET A 101 7.679 -8.434 -10.258 1.00 11.54 H new ATOM 0 HG2 MET A 101 5.707 -7.661 -11.165 1.00 42.14 H new ATOM 0 HG3 MET A 101 5.735 -6.188 -10.216 1.00 42.14 H new ATOM 0 HE1 MET A 101 7.536 -7.006 -14.348 1.00 42.43 H new ATOM 0 HE2 MET A 101 7.874 -8.044 -12.942 1.00 42.43 H new ATOM 0 HE3 MET A 101 6.203 -7.845 -13.520 1.00 42.43 H new ATOM 1656 N GLY A 102 9.538 -7.918 -8.090 1.00 60.14 N ATOM 1657 CA GLY A 102 10.571 -8.660 -7.314 1.00 0.23 C ATOM 1658 C GLY A 102 11.956 -8.084 -7.617 1.00 42.20 C ATOM 1659 O GLY A 102 12.159 -7.430 -8.621 1.00 5.33 O ATOM 0 H GLY A 102 9.887 -7.405 -8.899 1.00 60.14 H new ATOM 0 HA2 GLY A 102 10.361 -8.586 -6.247 1.00 0.23 H new ATOM 0 HA3 GLY A 102 10.542 -9.719 -7.572 1.00 0.23 H new ATOM 1663 N GLN A 103 12.910 -8.323 -6.758 1.00 71.03 N ATOM 1664 CA GLN A 103 14.279 -7.787 -6.999 1.00 54.20 C ATOM 1665 C GLN A 103 15.274 -8.938 -7.188 1.00 41.01 C ATOM 1666 O GLN A 103 14.980 -10.080 -6.894 1.00 12.21 O ATOM 1667 CB GLN A 103 14.619 -6.983 -5.740 1.00 30.53 C ATOM 1668 CG GLN A 103 14.957 -7.938 -4.594 1.00 52.41 C ATOM 1669 CD GLN A 103 14.738 -7.226 -3.258 1.00 51.52 C ATOM 1670 OE1 GLN A 103 15.622 -7.190 -2.424 1.00 4.12 O ATOM 1671 NE2 GLN A 103 13.590 -6.655 -3.017 1.00 71.43 N ATOM 0 H GLN A 103 12.800 -8.865 -5.901 1.00 71.03 H new ATOM 0 HA GLN A 103 14.329 -7.174 -7.899 1.00 54.20 H new ATOM 0 HB2 GLN A 103 15.463 -6.322 -5.936 1.00 30.53 H new ATOM 0 HB3 GLN A 103 13.776 -6.350 -5.462 1.00 30.53 H new ATOM 0 HG2 GLN A 103 14.331 -8.828 -4.651 1.00 52.41 H new ATOM 0 HG3 GLN A 103 15.992 -8.270 -4.676 1.00 52.41 H new ATOM 0 HE21 GLN A 103 12.848 -6.685 -3.717 1.00 71.43 H new ATOM 0 HE22 GLN A 103 13.434 -6.178 -2.129 1.00 71.43 H new ATOM 1680 N LYS A 104 16.447 -8.645 -7.677 1.00 34.31 N ATOM 1681 CA LYS A 104 17.459 -9.720 -7.883 1.00 31.23 C ATOM 1682 C LYS A 104 18.598 -9.571 -6.868 1.00 52.13 C ATOM 1683 O LYS A 104 18.688 -8.584 -6.165 1.00 72.11 O ATOM 1684 CB LYS A 104 17.975 -9.509 -9.307 1.00 23.40 C ATOM 1685 CG LYS A 104 19.110 -10.494 -9.594 1.00 75.23 C ATOM 1686 CD LYS A 104 19.360 -10.559 -11.102 1.00 12.32 C ATOM 1687 CE LYS A 104 20.252 -11.762 -11.422 1.00 75.42 C ATOM 1688 NZ LYS A 104 19.451 -12.953 -11.022 1.00 11.32 N ATOM 0 H LYS A 104 16.749 -7.708 -7.943 1.00 34.31 H new ATOM 0 HA LYS A 104 17.040 -10.717 -7.747 1.00 31.23 H new ATOM 0 HB2 LYS A 104 17.166 -9.653 -10.023 1.00 23.40 H new ATOM 0 HB3 LYS A 104 18.329 -8.485 -9.428 1.00 23.40 H new ATOM 0 HG2 LYS A 104 20.017 -10.181 -9.077 1.00 75.23 H new ATOM 0 HG3 LYS A 104 18.852 -11.483 -9.214 1.00 75.23 H new ATOM 0 HD2 LYS A 104 18.413 -10.644 -11.635 1.00 12.32 H new ATOM 0 HD3 LYS A 104 19.836 -9.639 -11.442 1.00 12.32 H new ATOM 0 HE2 LYS A 104 20.506 -11.795 -12.482 1.00 75.42 H new ATOM 0 HE3 LYS A 104 21.191 -11.715 -10.871 1.00 75.42 H new ATOM 0 HZ1 LYS A 104 19.618 -13.726 -11.697 1.00 11.32 H new ATOM 0 HZ2 LYS A 104 19.734 -13.258 -10.069 1.00 11.32 H new ATOM 0 HZ3 LYS A 104 18.440 -12.707 -11.021 1.00 11.32 H new ATOM 1702 N THR A 105 19.463 -10.545 -6.785 1.00 21.20 N ATOM 1703 CA THR A 105 20.591 -10.459 -5.812 1.00 62.34 C ATOM 1704 C THR A 105 21.932 -10.525 -6.548 1.00 70.23 C ATOM 1705 O THR A 105 22.067 -11.190 -7.555 1.00 2.42 O ATOM 1706 CB THR A 105 20.420 -11.674 -4.900 1.00 12.50 C ATOM 1707 OG1 THR A 105 21.486 -11.712 -3.961 1.00 2.40 O ATOM 1708 CG2 THR A 105 20.434 -12.950 -5.742 1.00 44.32 C ATOM 0 H THR A 105 19.438 -11.396 -7.348 1.00 21.20 H new ATOM 0 HA THR A 105 20.583 -9.524 -5.252 1.00 62.34 H new ATOM 0 HB THR A 105 19.470 -11.601 -4.370 1.00 12.50 H new ATOM 0 HG1 THR A 105 21.377 -12.489 -3.374 1.00 2.40 H new ATOM 0 HG21 THR A 105 20.312 -13.816 -5.092 1.00 44.32 H new ATOM 0 HG22 THR A 105 19.617 -12.919 -6.463 1.00 44.32 H new ATOM 0 HG23 THR A 105 21.383 -13.025 -6.273 1.00 44.32 H new ATOM 1716 N ASP A 106 22.926 -9.843 -6.049 1.00 51.52 N ATOM 1717 CA ASP A 106 24.258 -9.869 -6.718 1.00 31.13 C ATOM 1718 C ASP A 106 25.377 -9.830 -5.673 1.00 62.30 C ATOM 1719 O ASP A 106 25.156 -10.079 -4.505 1.00 62.53 O ATOM 1720 CB ASP A 106 24.295 -8.609 -7.586 1.00 10.35 C ATOM 1721 CG ASP A 106 24.569 -8.996 -9.040 1.00 33.00 C ATOM 1722 OD1 ASP A 106 24.481 -10.173 -9.349 1.00 22.52 O ATOM 1723 OD2 ASP A 106 24.861 -8.106 -9.823 1.00 41.31 O ATOM 0 H ASP A 106 22.874 -9.269 -5.207 1.00 51.52 H new ATOM 0 HA ASP A 106 24.403 -10.774 -7.307 1.00 31.13 H new ATOM 0 HB2 ASP A 106 23.346 -8.077 -7.513 1.00 10.35 H new ATOM 0 HB3 ASP A 106 25.069 -7.931 -7.227 1.00 10.35 H new ATOM 1728 N ASP A 107 26.575 -9.523 -6.087 1.00 21.33 N ATOM 1729 CA ASP A 107 27.706 -9.468 -5.117 1.00 32.14 C ATOM 1730 C ASP A 107 27.656 -8.166 -4.316 1.00 61.22 C ATOM 1731 O ASP A 107 27.101 -8.114 -3.233 1.00 10.14 O ATOM 1732 CB ASP A 107 28.967 -9.514 -5.979 1.00 15.34 C ATOM 1733 CG ASP A 107 29.587 -10.912 -5.906 1.00 1.32 C ATOM 1734 OD1 ASP A 107 30.267 -11.187 -4.932 1.00 63.14 O ATOM 1735 OD2 ASP A 107 29.367 -11.684 -6.824 1.00 1.21 O ATOM 0 H ASP A 107 26.820 -9.308 -7.053 1.00 21.33 H new ATOM 0 HA ASP A 107 27.671 -10.285 -4.397 1.00 32.14 H new ATOM 0 HB2 ASP A 107 28.723 -9.267 -7.012 1.00 15.34 H new ATOM 0 HB3 ASP A 107 29.683 -8.769 -5.634 1.00 15.34 H new ATOM 1740 N THR A 108 28.230 -7.115 -4.834 1.00 63.15 N ATOM 1741 CA THR A 108 28.214 -5.819 -4.099 1.00 31.42 C ATOM 1742 C THR A 108 28.521 -6.048 -2.618 1.00 42.34 C ATOM 1743 O THR A 108 27.789 -5.619 -1.747 1.00 22.40 O ATOM 1744 CB THR A 108 26.793 -5.279 -4.278 1.00 13.32 C ATOM 1745 OG1 THR A 108 26.376 -5.494 -5.618 1.00 63.51 O ATOM 1746 CG2 THR A 108 26.771 -3.781 -3.968 1.00 51.22 C ATOM 0 H THR A 108 28.709 -7.098 -5.734 1.00 63.15 H new ATOM 0 HA THR A 108 28.964 -5.122 -4.473 1.00 31.42 H new ATOM 0 HB THR A 108 26.117 -5.797 -3.598 1.00 13.32 H new ATOM 0 HG1 THR A 108 25.466 -5.151 -5.736 1.00 63.51 H new ATOM 0 HG21 THR A 108 25.759 -3.398 -4.096 1.00 51.22 H new ATOM 0 HG22 THR A 108 27.094 -3.617 -2.940 1.00 51.22 H new ATOM 0 HG23 THR A 108 27.445 -3.259 -4.647 1.00 51.22 H new ATOM 1754 N ASN A 109 29.599 -6.720 -2.322 1.00 31.41 N ATOM 1755 CA ASN A 109 29.952 -6.977 -0.897 1.00 43.21 C ATOM 1756 C ASN A 109 30.191 -5.650 -0.169 1.00 12.15 C ATOM 1757 O ASN A 109 29.869 -4.591 -0.668 1.00 44.10 O ATOM 1758 CB ASN A 109 31.239 -7.802 -0.948 1.00 53.24 C ATOM 1759 CG ASN A 109 30.898 -9.282 -1.146 1.00 52.34 C ATOM 1760 OD1 ASN A 109 31.719 -10.143 -0.895 1.00 22.15 O ATOM 1761 ND2 ASN A 109 29.716 -9.618 -1.587 1.00 4.31 N ATOM 0 H ASN A 109 30.252 -7.103 -3.006 1.00 31.41 H new ATOM 0 HA ASN A 109 29.159 -7.498 -0.360 1.00 43.21 H new ATOM 0 HB2 ASN A 109 31.874 -7.453 -1.763 1.00 53.24 H new ATOM 0 HB3 ASN A 109 31.804 -7.670 -0.025 1.00 53.24 H new ATOM 0 HD21 ASN A 109 29.482 -10.602 -1.721 1.00 4.31 H new ATOM 0 HD22 ASN A 109 29.026 -8.897 -1.798 1.00 4.31 H new ATOM 1768 N LYS A 110 30.756 -5.700 1.006 1.00 64.03 N ATOM 1769 CA LYS A 110 31.015 -4.442 1.762 1.00 12.41 C ATOM 1770 C LYS A 110 32.461 -3.982 1.548 1.00 43.10 C ATOM 1771 O LYS A 110 33.192 -4.693 0.878 1.00 40.15 O ATOM 1772 CB LYS A 110 30.783 -4.807 3.228 1.00 72.15 C ATOM 1773 CG LYS A 110 31.846 -5.811 3.678 1.00 11.52 C ATOM 1774 CD LYS A 110 31.721 -6.050 5.184 1.00 10.14 C ATOM 1775 CE LYS A 110 32.313 -4.859 5.942 1.00 1.42 C ATOM 1776 NZ LYS A 110 32.394 -5.309 7.360 1.00 40.23 N ATOM 0 H LYS A 110 31.049 -6.557 1.475 1.00 64.03 H new ATOM 0 HA LYS A 110 30.370 -3.626 1.436 1.00 12.41 H new ATOM 0 HB2 LYS A 110 30.827 -3.912 3.848 1.00 72.15 H new ATOM 0 HB3 LYS A 110 29.788 -5.233 3.355 1.00 72.15 H new ATOM 0 HG2 LYS A 110 31.725 -6.751 3.139 1.00 11.52 H new ATOM 0 HG3 LYS A 110 32.841 -5.434 3.441 1.00 11.52 H new ATOM 0 HD2 LYS A 110 30.674 -6.183 5.456 1.00 10.14 H new ATOM 0 HD3 LYS A 110 32.242 -6.966 5.462 1.00 10.14 H new ATOM 0 HE2 LYS A 110 33.297 -4.594 5.555 1.00 1.42 H new ATOM 0 HE3 LYS A 110 31.683 -3.975 5.843 1.00 1.42 H new ATOM 0 HZ1 LYS A 110 32.791 -4.546 7.944 1.00 40.23 H new ATOM 0 HZ2 LYS A 110 31.442 -5.548 7.703 1.00 40.23 H new ATOM 0 HZ3 LYS A 110 33.006 -6.148 7.424 1.00 40.23 H new TER 1790 LYS A 110