USER MOD reduce.3.24.130724 H: found=0, std=0, add=525, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 523 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 10 MET CE :methyl 176:sc= 0 (180deg=-0.0106) USER MOD Set 1.2: A 20 SER OG : rot 120:sc= -0.111 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 145:sc= 0.306 (180deg=-0.96!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 HIS : no HD1:sc= -7.25 K(o=-7.2,f=-9.4!) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 CYS SG : rot -150:sc=-0.00389 USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.0726 K(o=-0.073,f=-3!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 157:sc= -0.0171 (180deg=-0.242) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.353) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -0.019! C(o=-0.019!,f=-6!) USER MOD Single : A 47 SER OG : rot 70:sc= -1.17! USER MOD Single : A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 170:sc= -2.77 USER MOD Single : A 54 THR OG1 : rot -91:sc= -0.758 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= -1.28 (180deg=-1.28) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 150:sc= -1.75! USER MOD Single : A 61 THR OG1 : rot 81:sc= 0.154 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= -0.0642 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.139 -20.144 -22.176 1.00 0.00 N ATOM 2 CA MET A 1 -16.339 -18.941 -21.811 1.00 0.00 C ATOM 3 C MET A 1 -16.573 -17.843 -22.846 1.00 0.00 C ATOM 4 O MET A 1 -15.709 -17.566 -23.679 1.00 0.00 O ATOM 5 CB MET A 1 -14.856 -19.314 -21.769 1.00 0.00 C ATOM 6 CG MET A 1 -14.533 -19.984 -20.431 1.00 0.00 C ATOM 7 SD MET A 1 -15.410 -21.564 -20.319 1.00 0.00 S ATOM 8 CE MET A 1 -14.899 -21.990 -18.635 1.00 0.00 C ATOM 0 H1 MET A 1 -16.612 -21.003 -21.919 1.00 0.00 H new ATOM 0 H2 MET A 1 -18.044 -20.127 -21.664 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.320 -20.143 -23.200 1.00 0.00 H new ATOM 0 HA MET A 1 -16.645 -18.577 -20.830 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.617 -19.988 -22.592 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.243 -18.422 -21.898 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.459 -20.145 -20.343 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.826 -19.334 -19.607 1.00 0.00 H new ATOM 0 HE1 MET A 1 -15.335 -22.949 -18.354 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.812 -22.059 -18.591 1.00 0.00 H new ATOM 0 HE3 MET A 1 -15.242 -21.219 -17.945 1.00 0.00 H new ATOM 20 N PRO A 2 -17.721 -17.223 -22.805 1.00 0.00 N ATOM 21 CA PRO A 2 -18.090 -16.132 -23.752 1.00 0.00 C ATOM 22 C PRO A 2 -17.434 -14.801 -23.388 1.00 0.00 C ATOM 23 O PRO A 2 -17.211 -14.510 -22.213 1.00 0.00 O ATOM 24 CB PRO A 2 -19.610 -16.048 -23.616 1.00 0.00 C ATOM 25 CG PRO A 2 -19.906 -16.510 -22.227 1.00 0.00 C ATOM 26 CD PRO A 2 -18.800 -17.497 -21.843 1.00 0.00 C ATOM 0 HA PRO A 2 -17.754 -16.337 -24.769 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -19.964 -15.029 -23.776 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -20.107 -16.677 -24.354 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -19.929 -15.667 -21.536 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -20.884 -16.988 -22.179 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -18.467 -17.342 -20.817 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -19.145 -18.529 -21.914 1.00 0.00 H new ATOM 34 N LYS A 3 -17.131 -13.999 -24.403 1.00 0.00 N ATOM 35 CA LYS A 3 -16.503 -12.701 -24.180 1.00 0.00 C ATOM 36 C LYS A 3 -17.562 -11.613 -24.017 1.00 0.00 C ATOM 37 O LYS A 3 -18.654 -11.713 -24.576 1.00 0.00 O ATOM 38 CB LYS A 3 -15.584 -12.353 -25.353 1.00 0.00 C ATOM 39 CG LYS A 3 -15.143 -13.640 -26.053 1.00 0.00 C ATOM 40 CD LYS A 3 -13.753 -13.443 -26.664 1.00 0.00 C ATOM 41 CE LYS A 3 -13.861 -12.555 -27.905 1.00 0.00 C ATOM 42 NZ LYS A 3 -12.771 -12.904 -28.859 1.00 0.00 N ATOM 0 H LYS A 3 -17.308 -14.222 -25.382 1.00 0.00 H new ATOM 0 HA LYS A 3 -15.914 -12.758 -23.265 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -16.105 -11.703 -26.057 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -14.713 -11.803 -24.996 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -15.125 -14.465 -25.341 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -15.859 -13.906 -26.831 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -13.085 -12.986 -25.934 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -13.322 -14.408 -26.931 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -14.833 -12.691 -28.380 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -13.789 -11.505 -27.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -12.843 -12.301 -29.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -11.849 -12.753 -28.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -12.860 -13.902 -29.137 1.00 0.00 H new ATOM 56 N HIS A 4 -17.234 -10.579 -23.247 1.00 0.00 N ATOM 57 CA HIS A 4 -18.172 -9.486 -23.021 1.00 0.00 C ATOM 58 C HIS A 4 -17.650 -8.194 -23.641 1.00 0.00 C ATOM 59 O HIS A 4 -16.496 -7.817 -23.434 1.00 0.00 O ATOM 60 CB HIS A 4 -18.383 -9.285 -21.520 1.00 0.00 C ATOM 61 CG HIS A 4 -19.835 -9.002 -21.244 1.00 0.00 C ATOM 62 ND1 HIS A 4 -20.855 -9.575 -21.987 1.00 0.00 N ATOM 63 CD2 HIS A 4 -20.451 -8.211 -20.306 1.00 0.00 C ATOM 64 CE1 HIS A 4 -22.021 -9.125 -21.487 1.00 0.00 C ATOM 65 NE2 HIS A 4 -21.832 -8.290 -20.461 1.00 0.00 N ATOM 0 H HIS A 4 -16.336 -10.476 -22.774 1.00 0.00 H new ATOM 0 HA HIS A 4 -19.121 -9.742 -23.491 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -18.067 -10.175 -20.976 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -17.768 -8.459 -21.164 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -19.942 -7.618 -19.561 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -22.992 -9.405 -21.869 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -22.546 -7.813 -19.910 1.00 0.00 H new ATOM 73 N GLU A 5 -18.507 -7.517 -24.400 1.00 0.00 N ATOM 74 CA GLU A 5 -18.120 -6.267 -25.042 1.00 0.00 C ATOM 75 C GLU A 5 -18.752 -5.082 -24.322 1.00 0.00 C ATOM 76 O GLU A 5 -19.960 -5.060 -24.084 1.00 0.00 O ATOM 77 CB GLU A 5 -18.567 -6.274 -26.505 1.00 0.00 C ATOM 78 CG GLU A 5 -19.816 -7.144 -26.649 1.00 0.00 C ATOM 79 CD GLU A 5 -20.456 -6.920 -28.014 1.00 0.00 C ATOM 80 OE1 GLU A 5 -19.805 -6.335 -28.864 1.00 0.00 O ATOM 81 OE2 GLU A 5 -21.590 -7.336 -28.189 1.00 0.00 O ATOM 0 H GLU A 5 -19.466 -7.811 -24.584 1.00 0.00 H new ATOM 0 HA GLU A 5 -17.035 -6.173 -24.994 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -18.778 -5.258 -26.837 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -17.768 -6.658 -27.139 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -19.552 -8.195 -26.530 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -20.529 -6.903 -25.860 1.00 0.00 H new ATOM 88 N PHE A 6 -17.929 -4.099 -23.978 1.00 0.00 N ATOM 89 CA PHE A 6 -18.419 -2.915 -23.284 1.00 0.00 C ATOM 90 C PHE A 6 -17.662 -1.674 -23.746 1.00 0.00 C ATOM 91 O PHE A 6 -16.453 -1.721 -23.970 1.00 0.00 O ATOM 92 CB PHE A 6 -18.252 -3.095 -21.773 1.00 0.00 C ATOM 93 CG PHE A 6 -19.598 -3.375 -21.146 1.00 0.00 C ATOM 94 CD1 PHE A 6 -20.066 -4.691 -21.047 1.00 0.00 C ATOM 95 CD2 PHE A 6 -20.377 -2.317 -20.663 1.00 0.00 C ATOM 96 CE1 PHE A 6 -21.313 -4.948 -20.463 1.00 0.00 C ATOM 97 CE2 PHE A 6 -21.623 -2.574 -20.079 1.00 0.00 C ATOM 98 CZ PHE A 6 -22.091 -3.890 -19.980 1.00 0.00 C ATOM 0 H PHE A 6 -16.927 -4.098 -24.167 1.00 0.00 H new ATOM 0 HA PHE A 6 -19.476 -2.784 -23.517 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -17.566 -3.916 -21.568 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -17.815 -2.197 -21.335 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -19.466 -5.507 -21.421 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -20.017 -1.302 -20.741 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -21.674 -5.963 -20.386 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -22.223 -1.758 -19.705 1.00 0.00 H new ATOM 0 HZ PHE A 6 -23.053 -4.088 -19.531 1.00 0.00 H new ATOM 108 N SER A 7 -18.383 -0.566 -23.892 1.00 0.00 N ATOM 109 CA SER A 7 -17.766 0.681 -24.332 1.00 0.00 C ATOM 110 C SER A 7 -18.033 1.800 -23.330 1.00 0.00 C ATOM 111 O SER A 7 -19.183 2.161 -23.081 1.00 0.00 O ATOM 112 CB SER A 7 -18.317 1.081 -25.701 1.00 0.00 C ATOM 113 OG SER A 7 -18.255 2.495 -25.837 1.00 0.00 O ATOM 0 H SER A 7 -19.386 -0.506 -23.714 1.00 0.00 H new ATOM 0 HA SER A 7 -16.690 0.523 -24.403 1.00 0.00 H new ATOM 0 HB2 SER A 7 -17.740 0.602 -26.492 1.00 0.00 H new ATOM 0 HB3 SER A 7 -19.347 0.739 -25.806 1.00 0.00 H new ATOM 0 HG SER A 7 -18.606 2.755 -26.714 1.00 0.00 H new ATOM 119 N VAL A 8 -16.963 2.347 -22.763 1.00 0.00 N ATOM 120 CA VAL A 8 -17.093 3.428 -21.792 1.00 0.00 C ATOM 121 C VAL A 8 -16.162 4.582 -22.145 1.00 0.00 C ATOM 122 O VAL A 8 -14.985 4.373 -22.442 1.00 0.00 O ATOM 123 CB VAL A 8 -16.758 2.919 -20.388 1.00 0.00 C ATOM 124 CG1 VAL A 8 -15.484 2.074 -20.442 1.00 0.00 C ATOM 125 CG2 VAL A 8 -16.538 4.112 -19.453 1.00 0.00 C ATOM 0 H VAL A 8 -16.003 2.063 -22.957 1.00 0.00 H new ATOM 0 HA VAL A 8 -18.123 3.783 -21.815 1.00 0.00 H new ATOM 0 HB VAL A 8 -17.582 2.311 -20.016 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -15.245 1.711 -19.442 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -15.638 1.225 -21.109 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -14.659 2.682 -20.814 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -16.299 3.751 -18.453 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -15.713 4.719 -19.826 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -17.445 4.716 -19.414 1.00 0.00 H new ATOM 135 N ASP A 9 -16.691 5.801 -22.098 1.00 0.00 N ATOM 136 CA ASP A 9 -15.891 6.982 -22.403 1.00 0.00 C ATOM 137 C ASP A 9 -15.016 7.336 -21.208 1.00 0.00 C ATOM 138 O ASP A 9 -15.518 7.566 -20.108 1.00 0.00 O ATOM 139 CB ASP A 9 -16.802 8.165 -22.742 1.00 0.00 C ATOM 140 CG ASP A 9 -16.478 8.692 -24.136 1.00 0.00 C ATOM 141 OD1 ASP A 9 -15.363 9.149 -24.331 1.00 0.00 O ATOM 142 OD2 ASP A 9 -17.349 8.633 -24.988 1.00 0.00 O ATOM 0 H ASP A 9 -17.662 5.996 -21.854 1.00 0.00 H new ATOM 0 HA ASP A 9 -15.258 6.764 -23.263 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -17.846 7.855 -22.695 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -16.671 8.958 -22.005 1.00 0.00 H new ATOM 147 N MET A 10 -13.705 7.371 -21.423 1.00 0.00 N ATOM 148 CA MET A 10 -12.783 7.689 -20.343 1.00 0.00 C ATOM 149 C MET A 10 -12.526 9.190 -20.267 1.00 0.00 C ATOM 150 O MET A 10 -11.980 9.785 -21.196 1.00 0.00 O ATOM 151 CB MET A 10 -11.457 6.956 -20.555 1.00 0.00 C ATOM 152 CG MET A 10 -11.678 5.447 -20.419 1.00 0.00 C ATOM 153 SD MET A 10 -10.520 4.779 -19.200 1.00 0.00 S ATOM 154 CE MET A 10 -10.040 3.302 -20.128 1.00 0.00 C ATOM 0 H MET A 10 -13.263 7.186 -22.323 1.00 0.00 H new ATOM 0 HA MET A 10 -13.236 7.366 -19.406 1.00 0.00 H new ATOM 0 HB2 MET A 10 -11.055 7.188 -21.541 1.00 0.00 H new ATOM 0 HB3 MET A 10 -10.722 7.294 -19.824 1.00 0.00 H new ATOM 0 HG2 MET A 10 -12.704 5.245 -20.112 1.00 0.00 H new ATOM 0 HG3 MET A 10 -11.532 4.958 -21.382 1.00 0.00 H new ATOM 0 HE1 MET A 10 -9.263 2.766 -19.583 1.00 0.00 H new ATOM 0 HE2 MET A 10 -10.907 2.654 -20.255 1.00 0.00 H new ATOM 0 HE3 MET A 10 -9.660 3.595 -21.107 1.00 0.00 H new ATOM 164 N THR A 11 -12.914 9.789 -19.148 1.00 0.00 N ATOM 165 CA THR A 11 -12.713 11.217 -18.943 1.00 0.00 C ATOM 166 C THR A 11 -11.643 11.444 -17.883 1.00 0.00 C ATOM 167 O THR A 11 -10.969 12.474 -17.871 1.00 0.00 O ATOM 168 CB THR A 11 -14.024 11.873 -18.503 1.00 0.00 C ATOM 169 OG1 THR A 11 -13.848 13.282 -18.447 1.00 0.00 O ATOM 170 CG2 THR A 11 -14.418 11.351 -17.121 1.00 0.00 C ATOM 0 H THR A 11 -13.368 9.309 -18.371 1.00 0.00 H new ATOM 0 HA THR A 11 -12.388 11.666 -19.882 1.00 0.00 H new ATOM 0 HB THR A 11 -14.811 11.632 -19.217 1.00 0.00 H new ATOM 0 HG1 THR A 11 -14.686 13.706 -18.167 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.352 11.818 -16.808 1.00 0.00 H new ATOM 0 HG22 THR A 11 -14.550 10.270 -17.164 1.00 0.00 H new ATOM 0 HG23 THR A 11 -13.633 11.592 -16.404 1.00 0.00 H new ATOM 178 N CYS A 12 -11.493 10.466 -16.995 1.00 0.00 N ATOM 179 CA CYS A 12 -10.503 10.551 -15.930 1.00 0.00 C ATOM 180 C CYS A 12 -9.242 9.788 -16.315 1.00 0.00 C ATOM 181 O CYS A 12 -8.554 9.246 -15.454 1.00 0.00 O ATOM 182 CB CYS A 12 -11.085 9.981 -14.634 1.00 0.00 C ATOM 183 SG CYS A 12 -11.737 11.333 -13.622 1.00 0.00 S ATOM 0 H CYS A 12 -12.044 9.608 -16.993 1.00 0.00 H new ATOM 0 HA CYS A 12 -10.242 11.598 -15.776 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -11.877 9.267 -14.861 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -10.315 9.439 -14.084 1.00 0.00 H new ATOM 0 HG CYS A 12 -11.643 11.018 -12.364 1.00 0.00 H new ATOM 189 N GLY A 13 -8.946 9.759 -17.614 1.00 0.00 N ATOM 190 CA GLY A 13 -7.760 9.065 -18.114 1.00 0.00 C ATOM 191 C GLY A 13 -6.762 8.814 -16.991 1.00 0.00 C ATOM 192 O GLY A 13 -6.281 7.695 -16.812 1.00 0.00 O ATOM 0 H GLY A 13 -9.509 10.207 -18.337 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -8.052 8.117 -18.565 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.290 9.659 -18.898 1.00 0.00 H new ATOM 196 N GLY A 14 -6.464 9.862 -16.230 1.00 0.00 N ATOM 197 CA GLY A 14 -5.532 9.745 -15.116 1.00 0.00 C ATOM 198 C GLY A 14 -6.084 8.806 -14.047 1.00 0.00 C ATOM 199 O GLY A 14 -5.424 7.848 -13.648 1.00 0.00 O ATOM 0 H GLY A 14 -6.852 10.796 -16.363 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -4.573 9.371 -15.475 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -5.349 10.729 -14.684 1.00 0.00 H new ATOM 203 N CYS A 15 -7.302 9.088 -13.592 1.00 0.00 N ATOM 204 CA CYS A 15 -7.940 8.263 -12.572 1.00 0.00 C ATOM 205 C CYS A 15 -8.659 7.080 -13.217 1.00 0.00 C ATOM 206 O CYS A 15 -8.587 5.955 -12.722 1.00 0.00 O ATOM 207 CB CYS A 15 -8.942 9.100 -11.772 1.00 0.00 C ATOM 208 SG CYS A 15 -8.670 8.840 -10.001 1.00 0.00 S ATOM 0 H CYS A 15 -7.864 9.877 -13.912 1.00 0.00 H new ATOM 0 HA CYS A 15 -7.169 7.885 -11.901 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -8.827 10.156 -12.017 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -9.961 8.820 -12.039 1.00 0.00 H new ATOM 0 HG CYS A 15 -9.519 9.553 -9.322 1.00 0.00 H new ATOM 214 N ALA A 16 -9.348 7.339 -14.325 1.00 0.00 N ATOM 215 CA ALA A 16 -10.069 6.282 -15.027 1.00 0.00 C ATOM 216 C ALA A 16 -9.125 5.135 -15.376 1.00 0.00 C ATOM 217 O ALA A 16 -9.528 3.972 -15.401 1.00 0.00 O ATOM 218 CB ALA A 16 -10.689 6.835 -16.311 1.00 0.00 C ATOM 0 H ALA A 16 -9.422 8.262 -14.753 1.00 0.00 H new ATOM 0 HA ALA A 16 -10.857 5.910 -14.373 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -11.225 6.039 -16.828 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -11.383 7.638 -16.063 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -9.902 7.222 -16.958 1.00 0.00 H new ATOM 224 N GLU A 17 -7.868 5.471 -15.648 1.00 0.00 N ATOM 225 CA GLU A 17 -6.875 4.461 -15.998 1.00 0.00 C ATOM 226 C GLU A 17 -6.672 3.491 -14.838 1.00 0.00 C ATOM 227 O GLU A 17 -6.615 2.277 -15.035 1.00 0.00 O ATOM 228 CB GLU A 17 -5.548 5.136 -16.348 1.00 0.00 C ATOM 229 CG GLU A 17 -4.416 4.108 -16.291 1.00 0.00 C ATOM 230 CD GLU A 17 -3.219 4.606 -17.093 1.00 0.00 C ATOM 231 OE1 GLU A 17 -2.501 5.453 -16.587 1.00 0.00 O ATOM 232 OE2 GLU A 17 -3.038 4.134 -18.203 1.00 0.00 O ATOM 0 H GLU A 17 -7.514 6.428 -15.633 1.00 0.00 H new ATOM 0 HA GLU A 17 -7.234 3.903 -16.863 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -5.604 5.575 -17.344 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -5.348 5.950 -15.652 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.123 3.934 -15.256 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -4.760 3.154 -16.690 1.00 0.00 H new ATOM 239 N ALA A 18 -6.572 4.033 -13.628 1.00 0.00 N ATOM 240 CA ALA A 18 -6.387 3.201 -12.445 1.00 0.00 C ATOM 241 C ALA A 18 -7.636 2.363 -12.194 1.00 0.00 C ATOM 242 O ALA A 18 -7.561 1.259 -11.655 1.00 0.00 O ATOM 243 CB ALA A 18 -6.102 4.079 -11.226 1.00 0.00 C ATOM 0 H ALA A 18 -6.615 5.035 -13.442 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.539 2.537 -12.613 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.965 3.448 -10.347 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -5.196 4.660 -11.400 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.941 4.755 -11.060 1.00 0.00 H new ATOM 249 N VAL A 19 -8.785 2.898 -12.596 1.00 0.00 N ATOM 250 CA VAL A 19 -10.051 2.198 -12.421 1.00 0.00 C ATOM 251 C VAL A 19 -10.071 0.909 -13.240 1.00 0.00 C ATOM 252 O VAL A 19 -10.629 -0.101 -12.812 1.00 0.00 O ATOM 253 CB VAL A 19 -11.211 3.096 -12.855 1.00 0.00 C ATOM 254 CG1 VAL A 19 -12.475 2.251 -13.009 1.00 0.00 C ATOM 255 CG2 VAL A 19 -11.446 4.176 -11.795 1.00 0.00 C ATOM 0 H VAL A 19 -8.864 3.811 -13.044 1.00 0.00 H new ATOM 0 HA VAL A 19 -10.160 1.947 -11.366 1.00 0.00 H new ATOM 0 HB VAL A 19 -10.969 3.569 -13.807 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -13.303 2.888 -13.318 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -12.309 1.481 -13.763 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -12.716 1.780 -12.056 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -12.273 4.816 -12.104 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -11.689 3.704 -10.843 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -10.544 4.778 -11.682 1.00 0.00 H new ATOM 265 N SER A 20 -9.467 0.957 -14.423 1.00 0.00 N ATOM 266 CA SER A 20 -9.429 -0.207 -15.303 1.00 0.00 C ATOM 267 C SER A 20 -8.792 -1.400 -14.596 1.00 0.00 C ATOM 268 O SER A 20 -9.229 -2.539 -14.768 1.00 0.00 O ATOM 269 CB SER A 20 -8.632 0.125 -16.564 1.00 0.00 C ATOM 270 OG SER A 20 -9.448 0.878 -17.452 1.00 0.00 O ATOM 0 H SER A 20 -8.999 1.784 -14.794 1.00 0.00 H new ATOM 0 HA SER A 20 -10.452 -0.468 -15.573 1.00 0.00 H new ATOM 0 HB2 SER A 20 -7.738 0.692 -16.304 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.298 -0.792 -17.049 1.00 0.00 H new ATOM 0 HG SER A 20 -9.033 1.750 -17.618 1.00 0.00 H new ATOM 276 N ARG A 21 -7.766 -1.137 -13.797 1.00 0.00 N ATOM 277 CA ARG A 21 -7.090 -2.204 -13.064 1.00 0.00 C ATOM 278 C ARG A 21 -8.029 -2.800 -12.020 1.00 0.00 C ATOM 279 O ARG A 21 -8.062 -4.014 -11.817 1.00 0.00 O ATOM 280 CB ARG A 21 -5.838 -1.655 -12.376 1.00 0.00 C ATOM 281 CG ARG A 21 -5.041 -0.800 -13.365 1.00 0.00 C ATOM 282 CD ARG A 21 -3.592 -0.684 -12.888 1.00 0.00 C ATOM 283 NE ARG A 21 -3.514 -0.917 -11.451 1.00 0.00 N ATOM 284 CZ ARG A 21 -2.515 -0.420 -10.727 1.00 0.00 C ATOM 285 NH1 ARG A 21 -1.590 0.301 -11.299 1.00 0.00 N ATOM 286 NH2 ARG A 21 -2.460 -0.650 -9.444 1.00 0.00 N ATOM 0 H ARG A 21 -7.385 -0.204 -13.640 1.00 0.00 H new ATOM 0 HA ARG A 21 -6.800 -2.983 -13.769 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -6.120 -1.058 -11.509 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -5.222 -2.477 -12.011 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -5.073 -1.249 -14.358 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -5.488 0.191 -13.448 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -2.969 -1.407 -13.415 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -3.202 0.306 -13.125 1.00 0.00 H new ATOM 0 HE ARG A 21 -4.238 -1.471 -10.993 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -1.633 0.484 -12.302 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -0.824 0.682 -10.744 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -3.184 -1.212 -8.995 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -1.693 -0.268 -8.890 1.00 0.00 H new ATOM 300 N VAL A 22 -8.790 -1.930 -11.366 1.00 0.00 N ATOM 301 CA VAL A 22 -9.736 -2.352 -10.338 1.00 0.00 C ATOM 302 C VAL A 22 -10.759 -3.342 -10.897 1.00 0.00 C ATOM 303 O VAL A 22 -11.416 -4.058 -10.140 1.00 0.00 O ATOM 304 CB VAL A 22 -10.465 -1.133 -9.771 1.00 0.00 C ATOM 305 CG1 VAL A 22 -11.614 -1.597 -8.875 1.00 0.00 C ATOM 306 CG2 VAL A 22 -9.485 -0.291 -8.949 1.00 0.00 C ATOM 0 H VAL A 22 -8.770 -0.923 -11.530 1.00 0.00 H new ATOM 0 HA VAL A 22 -9.174 -2.848 -9.547 1.00 0.00 H new ATOM 0 HB VAL A 22 -10.863 -0.533 -10.590 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -12.134 -0.728 -8.471 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -12.311 -2.198 -9.459 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -11.217 -2.196 -8.056 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -10.003 0.578 -8.544 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -9.088 -0.891 -8.130 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -8.665 0.040 -9.587 1.00 0.00 H new ATOM 316 N LEU A 23 -10.909 -3.367 -12.217 1.00 0.00 N ATOM 317 CA LEU A 23 -11.878 -4.260 -12.850 1.00 0.00 C ATOM 318 C LEU A 23 -11.590 -5.717 -12.502 1.00 0.00 C ATOM 319 O LEU A 23 -12.510 -6.521 -12.355 1.00 0.00 O ATOM 320 CB LEU A 23 -11.834 -4.087 -14.369 1.00 0.00 C ATOM 321 CG LEU A 23 -13.260 -4.051 -14.923 1.00 0.00 C ATOM 322 CD1 LEU A 23 -13.218 -3.816 -16.433 1.00 0.00 C ATOM 323 CD2 LEU A 23 -13.956 -5.384 -14.638 1.00 0.00 C ATOM 0 H LEU A 23 -10.378 -2.786 -12.866 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.868 -4.000 -12.476 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.310 -3.166 -14.625 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.277 -4.907 -14.823 1.00 0.00 H new ATOM 0 HG LEU A 23 -13.811 -3.242 -14.443 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -14.234 -3.791 -16.826 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -12.725 -2.866 -16.640 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -12.664 -4.624 -16.912 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -14.971 -5.356 -15.033 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -13.403 -6.193 -15.115 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -13.990 -5.554 -13.562 1.00 0.00 H new ATOM 335 N ASN A 24 -10.313 -6.055 -12.369 1.00 0.00 N ATOM 336 CA ASN A 24 -9.927 -7.421 -12.037 1.00 0.00 C ATOM 337 C ASN A 24 -10.536 -7.843 -10.701 1.00 0.00 C ATOM 338 O ASN A 24 -10.815 -9.021 -10.480 1.00 0.00 O ATOM 339 CB ASN A 24 -8.404 -7.524 -11.960 1.00 0.00 C ATOM 340 CG ASN A 24 -7.924 -7.113 -10.573 1.00 0.00 C ATOM 341 OD1 ASN A 24 -8.002 -7.900 -9.629 1.00 0.00 O ATOM 342 ND2 ASN A 24 -7.429 -5.920 -10.391 1.00 0.00 N ATOM 0 H ASN A 24 -9.533 -5.408 -12.485 1.00 0.00 H new ATOM 0 HA ASN A 24 -10.300 -8.085 -12.817 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -8.089 -8.545 -12.175 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -7.949 -6.884 -12.716 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -7.106 -5.638 -9.466 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -7.365 -5.269 -11.174 1.00 0.00 H new ATOM 349 N LYS A 25 -10.728 -6.873 -9.812 1.00 0.00 N ATOM 350 CA LYS A 25 -11.293 -7.154 -8.495 1.00 0.00 C ATOM 351 C LYS A 25 -12.743 -7.619 -8.604 1.00 0.00 C ATOM 352 O LYS A 25 -13.145 -8.581 -7.950 1.00 0.00 O ATOM 353 CB LYS A 25 -11.225 -5.896 -7.627 1.00 0.00 C ATOM 354 CG LYS A 25 -11.955 -6.146 -6.306 1.00 0.00 C ATOM 355 CD LYS A 25 -11.160 -5.527 -5.155 1.00 0.00 C ATOM 356 CE LYS A 25 -11.971 -5.633 -3.863 1.00 0.00 C ATOM 357 NZ LYS A 25 -11.074 -6.031 -2.742 1.00 0.00 N ATOM 0 H LYS A 25 -10.503 -5.892 -9.977 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.709 -7.953 -8.038 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.186 -5.630 -7.435 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.678 -5.055 -8.151 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.955 -5.714 -6.344 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.076 -7.217 -6.143 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.205 -6.040 -5.041 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.937 -4.483 -5.373 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.446 -4.678 -3.640 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.769 -6.366 -3.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.627 -6.103 -1.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -10.641 -6.952 -2.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.328 -5.316 -2.624 1.00 0.00 H new ATOM 371 N LEU A 26 -13.527 -6.927 -9.426 1.00 0.00 N ATOM 372 CA LEU A 26 -14.931 -7.276 -9.601 1.00 0.00 C ATOM 373 C LEU A 26 -15.080 -8.485 -10.519 1.00 0.00 C ATOM 374 O LEU A 26 -15.917 -9.357 -10.280 1.00 0.00 O ATOM 375 CB LEU A 26 -15.684 -6.088 -10.199 1.00 0.00 C ATOM 376 CG LEU A 26 -16.984 -5.860 -9.428 1.00 0.00 C ATOM 377 CD1 LEU A 26 -17.783 -7.163 -9.377 1.00 0.00 C ATOM 378 CD2 LEU A 26 -16.657 -5.407 -8.004 1.00 0.00 C ATOM 0 H LEU A 26 -13.216 -6.127 -9.977 1.00 0.00 H new ATOM 0 HA LEU A 26 -15.348 -7.526 -8.626 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -15.063 -5.193 -10.157 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -15.902 -6.275 -11.250 1.00 0.00 H new ATOM 0 HG LEU A 26 -17.574 -5.092 -9.929 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -18.710 -7.000 -8.827 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -18.015 -7.487 -10.391 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -17.194 -7.931 -8.876 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -17.583 -5.244 -7.452 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -16.067 -6.175 -7.504 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -16.087 -4.478 -8.039 1.00 0.00 H new ATOM 390 N GLY A 27 -14.271 -8.530 -11.570 1.00 0.00 N ATOM 391 CA GLY A 27 -14.334 -9.635 -12.517 1.00 0.00 C ATOM 392 C GLY A 27 -13.271 -10.684 -12.212 1.00 0.00 C ATOM 393 O GLY A 27 -13.587 -11.851 -11.985 1.00 0.00 O ATOM 0 H GLY A 27 -13.570 -7.821 -11.787 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -15.322 -10.093 -12.480 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -14.196 -9.257 -13.530 1.00 0.00 H new ATOM 397 N GLY A 28 -12.009 -10.265 -12.219 1.00 0.00 N ATOM 398 CA GLY A 28 -10.913 -11.189 -11.953 1.00 0.00 C ATOM 399 C GLY A 28 -10.731 -12.139 -13.128 1.00 0.00 C ATOM 400 O GLY A 28 -10.349 -13.297 -12.955 1.00 0.00 O ATOM 0 H GLY A 28 -11.723 -9.304 -12.404 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -9.992 -10.632 -11.780 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -11.118 -11.756 -11.045 1.00 0.00 H new ATOM 404 N VAL A 29 -11.015 -11.638 -14.324 1.00 0.00 N ATOM 405 CA VAL A 29 -10.889 -12.442 -15.531 1.00 0.00 C ATOM 406 C VAL A 29 -10.194 -11.653 -16.631 1.00 0.00 C ATOM 407 O VAL A 29 -9.729 -10.535 -16.414 1.00 0.00 O ATOM 408 CB VAL A 29 -12.272 -12.878 -16.012 1.00 0.00 C ATOM 409 CG1 VAL A 29 -12.224 -14.347 -16.438 1.00 0.00 C ATOM 410 CG2 VAL A 29 -13.282 -12.708 -14.875 1.00 0.00 C ATOM 0 H VAL A 29 -11.333 -10.682 -14.483 1.00 0.00 H new ATOM 0 HA VAL A 29 -10.290 -13.322 -15.297 1.00 0.00 H new ATOM 0 HB VAL A 29 -12.573 -12.264 -16.861 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -13.210 -14.659 -16.781 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.503 -14.468 -17.247 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.924 -14.962 -15.590 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -14.270 -13.019 -15.216 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -12.981 -13.322 -14.026 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -13.315 -11.662 -14.571 1.00 0.00 H new ATOM 420 N LYS A 30 -10.127 -12.254 -17.808 1.00 0.00 N ATOM 421 CA LYS A 30 -9.485 -11.615 -18.948 1.00 0.00 C ATOM 422 C LYS A 30 -10.011 -10.199 -19.142 1.00 0.00 C ATOM 423 O LYS A 30 -11.220 -9.970 -19.177 1.00 0.00 O ATOM 424 CB LYS A 30 -9.734 -12.428 -20.219 1.00 0.00 C ATOM 425 CG LYS A 30 -8.456 -12.451 -21.059 1.00 0.00 C ATOM 426 CD LYS A 30 -8.751 -13.073 -22.425 1.00 0.00 C ATOM 427 CE LYS A 30 -7.518 -13.834 -22.913 1.00 0.00 C ATOM 428 NZ LYS A 30 -7.384 -15.105 -22.146 1.00 0.00 N ATOM 0 H LYS A 30 -10.508 -13.181 -18.000 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.414 -11.569 -18.750 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -10.033 -13.444 -19.962 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.552 -11.990 -20.791 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -8.073 -11.438 -21.184 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -7.682 -13.023 -20.547 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -9.604 -13.748 -22.353 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -9.019 -12.296 -23.141 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -7.607 -14.047 -23.978 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -6.625 -13.223 -22.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -6.824 -15.786 -22.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -6.906 -14.916 -21.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -8.328 -15.501 -21.963 1.00 0.00 H new ATOM 442 N TYR A 31 -9.090 -9.254 -19.272 1.00 0.00 N ATOM 443 CA TYR A 31 -9.460 -7.858 -19.468 1.00 0.00 C ATOM 444 C TYR A 31 -8.445 -7.161 -20.370 1.00 0.00 C ATOM 445 O TYR A 31 -7.278 -7.551 -20.425 1.00 0.00 O ATOM 446 CB TYR A 31 -9.534 -7.142 -18.115 1.00 0.00 C ATOM 447 CG TYR A 31 -8.196 -6.517 -17.792 1.00 0.00 C ATOM 448 CD1 TYR A 31 -7.048 -7.314 -17.725 1.00 0.00 C ATOM 449 CD2 TYR A 31 -8.105 -5.137 -17.565 1.00 0.00 C ATOM 450 CE1 TYR A 31 -5.808 -6.733 -17.430 1.00 0.00 C ATOM 451 CE2 TYR A 31 -6.865 -4.557 -17.272 1.00 0.00 C ATOM 452 CZ TYR A 31 -5.717 -5.355 -17.204 1.00 0.00 C ATOM 453 OH TYR A 31 -4.495 -4.782 -16.914 1.00 0.00 O ATOM 0 H TYR A 31 -8.085 -9.427 -19.246 1.00 0.00 H new ATOM 0 HA TYR A 31 -10.438 -7.820 -19.947 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -10.307 -6.374 -18.141 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -9.813 -7.849 -17.334 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -7.118 -8.377 -17.901 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -8.991 -4.521 -17.616 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -4.922 -7.349 -17.377 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -6.794 -3.493 -17.098 1.00 0.00 H new ATOM 0 HH TYR A 31 -4.608 -3.817 -16.786 1.00 0.00 H new ATOM 463 N ASP A 32 -8.896 -6.129 -21.073 1.00 0.00 N ATOM 464 CA ASP A 32 -8.019 -5.384 -21.968 1.00 0.00 C ATOM 465 C ASP A 32 -8.613 -4.013 -22.269 1.00 0.00 C ATOM 466 O ASP A 32 -9.805 -3.891 -22.551 1.00 0.00 O ATOM 467 CB ASP A 32 -7.822 -6.160 -23.272 1.00 0.00 C ATOM 468 CG ASP A 32 -7.555 -7.631 -22.968 1.00 0.00 C ATOM 469 OD1 ASP A 32 -8.514 -8.359 -22.772 1.00 0.00 O ATOM 470 OD2 ASP A 32 -6.394 -8.007 -22.935 1.00 0.00 O ATOM 0 H ASP A 32 -9.858 -5.791 -21.041 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.053 -5.251 -21.480 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.708 -6.065 -23.899 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.988 -5.739 -23.833 1.00 0.00 H new ATOM 475 N ILE A 33 -7.779 -2.981 -22.202 1.00 0.00 N ATOM 476 CA ILE A 33 -8.240 -1.624 -22.463 1.00 0.00 C ATOM 477 C ILE A 33 -7.523 -1.029 -23.670 1.00 0.00 C ATOM 478 O ILE A 33 -6.294 -1.041 -23.742 1.00 0.00 O ATOM 479 CB ILE A 33 -7.996 -0.743 -21.233 1.00 0.00 C ATOM 480 CG1 ILE A 33 -7.354 -1.582 -20.125 1.00 0.00 C ATOM 481 CG2 ILE A 33 -9.325 -0.175 -20.732 1.00 0.00 C ATOM 482 CD1 ILE A 33 -8.376 -2.583 -19.583 1.00 0.00 C ATOM 0 H ILE A 33 -6.788 -3.057 -21.971 1.00 0.00 H new ATOM 0 HA ILE A 33 -9.308 -1.662 -22.678 1.00 0.00 H new ATOM 0 HB ILE A 33 -7.332 0.077 -21.504 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -6.483 -2.110 -20.513 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -7.003 -0.934 -19.322 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -9.147 0.451 -19.857 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -9.785 0.423 -21.519 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -9.992 -0.994 -20.462 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -7.918 -3.180 -18.794 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -9.234 -2.045 -19.179 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -8.706 -3.239 -20.389 1.00 0.00 H new ATOM 494 N ASP A 34 -8.301 -0.504 -24.612 1.00 0.00 N ATOM 495 CA ASP A 34 -7.730 0.104 -25.810 1.00 0.00 C ATOM 496 C ASP A 34 -7.949 1.613 -25.793 1.00 0.00 C ATOM 497 O ASP A 34 -9.036 2.097 -26.108 1.00 0.00 O ATOM 498 CB ASP A 34 -8.382 -0.496 -27.058 1.00 0.00 C ATOM 499 CG ASP A 34 -8.020 -1.971 -27.179 1.00 0.00 C ATOM 500 OD1 ASP A 34 -6.922 -2.257 -27.627 1.00 0.00 O ATOM 501 OD2 ASP A 34 -8.847 -2.795 -26.823 1.00 0.00 O ATOM 0 H ASP A 34 -9.320 -0.487 -24.570 1.00 0.00 H new ATOM 0 HA ASP A 34 -6.659 -0.098 -25.828 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.465 -0.382 -27.003 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.050 0.042 -27.946 1.00 0.00 H new ATOM 506 N LEU A 35 -6.909 2.350 -25.418 1.00 0.00 N ATOM 507 CA LEU A 35 -6.991 3.805 -25.354 1.00 0.00 C ATOM 508 C LEU A 35 -7.314 4.400 -26.722 1.00 0.00 C ATOM 509 O LEU A 35 -8.145 5.301 -26.838 1.00 0.00 O ATOM 510 CB LEU A 35 -5.662 4.375 -24.853 1.00 0.00 C ATOM 511 CG LEU A 35 -5.926 5.414 -23.763 1.00 0.00 C ATOM 512 CD1 LEU A 35 -6.098 4.711 -22.416 1.00 0.00 C ATOM 513 CD2 LEU A 35 -4.739 6.376 -23.686 1.00 0.00 C ATOM 0 H LEU A 35 -6.002 1.965 -25.154 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.793 4.070 -24.665 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -5.036 3.573 -24.461 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -5.116 4.831 -25.679 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.834 5.968 -24.000 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -6.286 5.453 -21.640 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.940 4.021 -22.470 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.190 4.157 -22.176 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -4.923 7.119 -22.910 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -3.833 5.818 -23.447 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.614 6.877 -24.646 1.00 0.00 H new ATOM 525 N PRO A 36 -6.662 3.924 -27.748 1.00 0.00 N ATOM 526 CA PRO A 36 -6.864 4.427 -29.141 1.00 0.00 C ATOM 527 C PRO A 36 -8.321 4.352 -29.595 1.00 0.00 C ATOM 528 O PRO A 36 -8.769 5.166 -30.402 1.00 0.00 O ATOM 529 CB PRO A 36 -5.986 3.508 -29.997 1.00 0.00 C ATOM 530 CG PRO A 36 -4.984 2.920 -29.061 1.00 0.00 C ATOM 531 CD PRO A 36 -5.658 2.853 -27.693 1.00 0.00 C ATOM 0 HA PRO A 36 -6.601 5.482 -29.223 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -6.582 2.729 -30.473 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -5.496 4.066 -30.795 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -4.679 1.927 -29.392 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -4.084 3.533 -29.021 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -6.119 1.880 -27.521 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -4.943 3.015 -26.886 1.00 0.00 H new ATOM 539 N ASN A 37 -9.053 3.370 -29.083 1.00 0.00 N ATOM 540 CA ASN A 37 -10.454 3.205 -29.462 1.00 0.00 C ATOM 541 C ASN A 37 -11.383 3.642 -28.333 1.00 0.00 C ATOM 542 O ASN A 37 -12.596 3.731 -28.519 1.00 0.00 O ATOM 543 CB ASN A 37 -10.728 1.743 -29.821 1.00 0.00 C ATOM 544 CG ASN A 37 -11.268 1.645 -31.246 1.00 0.00 C ATOM 545 OD1 ASN A 37 -12.479 1.557 -31.447 1.00 0.00 O ATOM 546 ND2 ASN A 37 -10.436 1.657 -32.251 1.00 0.00 N ATOM 0 H ASN A 37 -8.707 2.683 -28.413 1.00 0.00 H new ATOM 0 HA ASN A 37 -10.648 3.836 -30.329 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -9.811 1.160 -29.730 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -11.447 1.317 -29.121 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -10.789 1.593 -33.206 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.433 1.730 -32.082 1.00 0.00 H new ATOM 553 N LYS A 38 -10.810 3.911 -27.167 1.00 0.00 N ATOM 554 CA LYS A 38 -11.605 4.335 -26.021 1.00 0.00 C ATOM 555 C LYS A 38 -12.687 3.308 -25.710 1.00 0.00 C ATOM 556 O LYS A 38 -13.812 3.662 -25.361 1.00 0.00 O ATOM 557 CB LYS A 38 -12.255 5.687 -26.309 1.00 0.00 C ATOM 558 CG LYS A 38 -11.304 6.540 -27.149 1.00 0.00 C ATOM 559 CD LYS A 38 -11.647 8.018 -26.964 1.00 0.00 C ATOM 560 CE LYS A 38 -10.491 8.878 -27.476 1.00 0.00 C ATOM 561 NZ LYS A 38 -10.197 8.523 -28.892 1.00 0.00 N ATOM 0 H LYS A 38 -9.808 3.844 -26.990 1.00 0.00 H new ATOM 0 HA LYS A 38 -10.944 4.424 -25.159 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.197 5.544 -26.839 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -12.489 6.197 -25.374 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -10.272 6.355 -26.850 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.385 6.266 -28.201 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -12.562 8.260 -27.505 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -11.833 8.230 -25.911 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -10.749 9.934 -27.401 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -9.606 8.721 -26.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -9.629 9.277 -29.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -9.667 7.629 -28.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -11.089 8.415 -29.415 1.00 0.00 H new ATOM 575 N LYS A 39 -12.337 2.034 -25.836 1.00 0.00 N ATOM 576 CA LYS A 39 -13.287 0.963 -25.563 1.00 0.00 C ATOM 577 C LYS A 39 -12.679 -0.050 -24.601 1.00 0.00 C ATOM 578 O LYS A 39 -11.471 -0.045 -24.364 1.00 0.00 O ATOM 579 CB LYS A 39 -13.684 0.265 -26.866 1.00 0.00 C ATOM 580 CG LYS A 39 -12.544 -0.644 -27.332 1.00 0.00 C ATOM 581 CD LYS A 39 -12.915 -1.283 -28.672 1.00 0.00 C ATOM 582 CE LYS A 39 -12.033 -2.511 -28.916 1.00 0.00 C ATOM 583 NZ LYS A 39 -11.959 -2.787 -30.379 1.00 0.00 N ATOM 0 H LYS A 39 -11.410 1.719 -26.123 1.00 0.00 H new ATOM 0 HA LYS A 39 -14.176 1.397 -25.106 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -14.591 -0.321 -26.714 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -13.908 1.006 -27.633 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -11.624 -0.068 -27.434 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -12.355 -1.418 -26.588 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -13.966 -1.572 -28.670 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -12.784 -0.562 -29.479 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -11.033 -2.339 -28.516 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -12.441 -3.375 -28.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -11.360 -3.621 -30.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -12.915 -2.968 -30.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -11.550 -1.965 -30.867 1.00 0.00 H new ATOM 597 N VAL A 40 -13.520 -0.917 -24.052 1.00 0.00 N ATOM 598 CA VAL A 40 -13.043 -1.929 -23.119 1.00 0.00 C ATOM 599 C VAL A 40 -13.723 -3.267 -23.383 1.00 0.00 C ATOM 600 O VAL A 40 -14.948 -3.378 -23.312 1.00 0.00 O ATOM 601 CB VAL A 40 -13.324 -1.490 -21.682 1.00 0.00 C ATOM 602 CG1 VAL A 40 -12.548 -2.386 -20.713 1.00 0.00 C ATOM 603 CG2 VAL A 40 -12.882 -0.036 -21.499 1.00 0.00 C ATOM 0 H VAL A 40 -14.523 -0.941 -24.233 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.969 -2.046 -23.261 1.00 0.00 H new ATOM 0 HB VAL A 40 -14.391 -1.574 -21.478 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -12.748 -2.073 -19.688 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -12.862 -3.422 -20.844 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -11.480 -2.302 -20.916 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -13.082 0.279 -20.475 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -11.815 0.048 -21.703 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -13.435 0.602 -22.189 1.00 0.00 H new ATOM 613 N CYS A 41 -12.920 -4.284 -23.676 1.00 0.00 N ATOM 614 CA CYS A 41 -13.451 -5.614 -23.935 1.00 0.00 C ATOM 615 C CYS A 41 -12.968 -6.580 -22.865 1.00 0.00 C ATOM 616 O CYS A 41 -11.772 -6.846 -22.749 1.00 0.00 O ATOM 617 CB CYS A 41 -12.998 -6.101 -25.310 1.00 0.00 C ATOM 618 SG CYS A 41 -14.289 -5.752 -26.529 1.00 0.00 S ATOM 0 H CYS A 41 -11.905 -4.212 -23.740 1.00 0.00 H new ATOM 0 HA CYS A 41 -14.540 -5.569 -23.914 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -12.070 -5.606 -25.595 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -12.792 -7.171 -25.279 1.00 0.00 H new ATOM 0 HG CYS A 41 -13.903 -6.164 -27.700 1.00 0.00 H new ATOM 624 N ILE A 42 -13.902 -7.088 -22.071 1.00 0.00 N ATOM 625 CA ILE A 42 -13.554 -8.009 -20.997 1.00 0.00 C ATOM 626 C ILE A 42 -14.369 -9.292 -21.075 1.00 0.00 C ATOM 627 O ILE A 42 -15.582 -9.259 -21.282 1.00 0.00 O ATOM 628 CB ILE A 42 -13.807 -7.344 -19.647 1.00 0.00 C ATOM 629 CG1 ILE A 42 -13.246 -8.226 -18.528 1.00 0.00 C ATOM 630 CG2 ILE A 42 -15.311 -7.166 -19.444 1.00 0.00 C ATOM 631 CD1 ILE A 42 -13.965 -7.902 -17.217 1.00 0.00 C ATOM 0 H ILE A 42 -14.898 -6.880 -22.149 1.00 0.00 H new ATOM 0 HA ILE A 42 -12.499 -8.261 -21.105 1.00 0.00 H new ATOM 0 HB ILE A 42 -13.316 -6.371 -19.624 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.379 -9.279 -18.778 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -12.175 -8.057 -18.419 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -15.494 -6.691 -18.480 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -15.714 -6.539 -20.240 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -15.799 -8.140 -19.467 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.567 -8.529 -16.419 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -13.809 -6.853 -16.966 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -15.032 -8.093 -17.330 1.00 0.00 H new ATOM 643 N GLU A 43 -13.697 -10.418 -20.874 1.00 0.00 N ATOM 644 CA GLU A 43 -14.370 -11.705 -20.887 1.00 0.00 C ATOM 645 C GLU A 43 -14.434 -12.236 -19.463 1.00 0.00 C ATOM 646 O GLU A 43 -13.404 -12.515 -18.854 1.00 0.00 O ATOM 647 CB GLU A 43 -13.604 -12.693 -21.769 1.00 0.00 C ATOM 648 CG GLU A 43 -14.061 -14.119 -21.450 1.00 0.00 C ATOM 649 CD GLU A 43 -13.471 -15.095 -22.462 1.00 0.00 C ATOM 650 OE1 GLU A 43 -13.892 -15.059 -23.606 1.00 0.00 O ATOM 651 OE2 GLU A 43 -12.606 -15.867 -22.078 1.00 0.00 O ATOM 0 H GLU A 43 -12.693 -10.464 -20.701 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.376 -11.586 -21.289 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.780 -12.470 -22.821 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -12.532 -12.596 -21.597 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -13.748 -14.393 -20.443 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -15.149 -14.174 -21.471 1.00 0.00 H new ATOM 658 N SER A 44 -15.642 -12.361 -18.929 1.00 0.00 N ATOM 659 CA SER A 44 -15.802 -12.842 -17.565 1.00 0.00 C ATOM 660 C SER A 44 -16.964 -13.817 -17.457 1.00 0.00 C ATOM 661 O SER A 44 -17.799 -13.913 -18.356 1.00 0.00 O ATOM 662 CB SER A 44 -16.034 -11.663 -16.620 1.00 0.00 C ATOM 663 OG SER A 44 -17.013 -10.798 -17.181 1.00 0.00 O ATOM 0 H SER A 44 -16.513 -12.140 -19.412 1.00 0.00 H new ATOM 0 HA SER A 44 -14.888 -13.365 -17.283 1.00 0.00 H new ATOM 0 HB2 SER A 44 -16.365 -12.022 -15.646 1.00 0.00 H new ATOM 0 HB3 SER A 44 -15.102 -11.121 -16.460 1.00 0.00 H new ATOM 0 HG SER A 44 -17.166 -10.042 -16.577 1.00 0.00 H new ATOM 669 N GLU A 45 -17.000 -14.544 -16.349 1.00 0.00 N ATOM 670 CA GLU A 45 -18.047 -15.521 -16.109 1.00 0.00 C ATOM 671 C GLU A 45 -19.390 -14.836 -15.875 1.00 0.00 C ATOM 672 O GLU A 45 -20.437 -15.359 -16.257 1.00 0.00 O ATOM 673 CB GLU A 45 -17.679 -16.362 -14.888 1.00 0.00 C ATOM 674 CG GLU A 45 -16.229 -16.846 -15.013 1.00 0.00 C ATOM 675 CD GLU A 45 -16.202 -18.333 -15.349 1.00 0.00 C ATOM 676 OE1 GLU A 45 -17.049 -18.763 -16.114 1.00 0.00 O ATOM 677 OE2 GLU A 45 -15.334 -19.020 -14.836 1.00 0.00 O ATOM 0 H GLU A 45 -16.311 -14.473 -15.600 1.00 0.00 H new ATOM 0 HA GLU A 45 -18.138 -16.159 -16.988 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.799 -15.773 -13.979 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.352 -17.216 -14.806 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.714 -16.280 -15.789 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.695 -16.666 -14.080 1.00 0.00 H new ATOM 684 N HIS A 46 -19.356 -13.666 -15.245 1.00 0.00 N ATOM 685 CA HIS A 46 -20.582 -12.927 -14.968 1.00 0.00 C ATOM 686 C HIS A 46 -20.939 -12.021 -16.139 1.00 0.00 C ATOM 687 O HIS A 46 -21.947 -12.229 -16.814 1.00 0.00 O ATOM 688 CB HIS A 46 -20.410 -12.085 -13.701 1.00 0.00 C ATOM 689 CG HIS A 46 -19.229 -12.591 -12.918 1.00 0.00 C ATOM 690 ND1 HIS A 46 -17.939 -12.553 -13.421 1.00 0.00 N ATOM 691 CD2 HIS A 46 -19.127 -13.146 -11.667 1.00 0.00 C ATOM 692 CE1 HIS A 46 -17.123 -13.071 -12.485 1.00 0.00 C ATOM 693 NE2 HIS A 46 -17.796 -13.448 -11.394 1.00 0.00 N ATOM 0 H HIS A 46 -18.502 -13.213 -14.920 1.00 0.00 H new ATOM 0 HA HIS A 46 -21.390 -13.644 -14.820 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -20.263 -11.038 -13.965 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -21.313 -12.137 -13.092 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -19.955 -13.322 -10.996 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -16.054 -13.170 -12.601 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -17.416 -13.867 -10.545 1.00 0.00 H new ATOM 701 N SER A 47 -20.104 -11.021 -16.375 1.00 0.00 N ATOM 702 CA SER A 47 -20.330 -10.084 -17.469 1.00 0.00 C ATOM 703 C SER A 47 -21.651 -9.342 -17.285 1.00 0.00 C ATOM 704 O SER A 47 -22.707 -9.958 -17.146 1.00 0.00 O ATOM 705 CB SER A 47 -20.350 -10.835 -18.801 1.00 0.00 C ATOM 706 OG SER A 47 -20.559 -12.219 -18.558 1.00 0.00 O ATOM 0 H SER A 47 -19.265 -10.836 -15.826 1.00 0.00 H new ATOM 0 HA SER A 47 -19.518 -9.357 -17.469 1.00 0.00 H new ATOM 0 HB2 SER A 47 -21.141 -10.443 -19.440 1.00 0.00 H new ATOM 0 HB3 SER A 47 -19.409 -10.685 -19.330 1.00 0.00 H new ATOM 0 HG SER A 47 -21.474 -12.360 -18.238 1.00 0.00 H new ATOM 712 N MET A 48 -21.580 -8.015 -17.292 1.00 0.00 N ATOM 713 CA MET A 48 -22.774 -7.191 -17.132 1.00 0.00 C ATOM 714 C MET A 48 -23.064 -6.931 -15.657 1.00 0.00 C ATOM 715 O MET A 48 -24.210 -7.018 -15.215 1.00 0.00 O ATOM 716 CB MET A 48 -23.978 -7.880 -17.780 1.00 0.00 C ATOM 717 CG MET A 48 -24.945 -6.821 -18.316 1.00 0.00 C ATOM 718 SD MET A 48 -26.578 -7.563 -18.560 1.00 0.00 S ATOM 719 CE MET A 48 -27.522 -6.021 -18.639 1.00 0.00 C ATOM 0 H MET A 48 -20.714 -7.489 -17.406 1.00 0.00 H new ATOM 0 HA MET A 48 -22.595 -6.235 -17.624 1.00 0.00 H new ATOM 0 HB2 MET A 48 -23.646 -8.529 -18.591 1.00 0.00 H new ATOM 0 HB3 MET A 48 -24.483 -8.514 -17.051 1.00 0.00 H new ATOM 0 HG2 MET A 48 -25.013 -5.988 -17.616 1.00 0.00 H new ATOM 0 HG3 MET A 48 -24.573 -6.417 -19.257 1.00 0.00 H new ATOM 0 HE1 MET A 48 -28.578 -6.248 -18.789 1.00 0.00 H new ATOM 0 HE2 MET A 48 -27.398 -5.470 -17.707 1.00 0.00 H new ATOM 0 HE3 MET A 48 -27.160 -5.415 -19.469 1.00 0.00 H new ATOM 729 N ASP A 49 -22.020 -6.604 -14.901 1.00 0.00 N ATOM 730 CA ASP A 49 -22.176 -6.324 -13.477 1.00 0.00 C ATOM 731 C ASP A 49 -20.862 -5.822 -12.892 1.00 0.00 C ATOM 732 O ASP A 49 -20.847 -4.931 -12.042 1.00 0.00 O ATOM 733 CB ASP A 49 -22.619 -7.588 -12.739 1.00 0.00 C ATOM 734 CG ASP A 49 -22.383 -7.429 -11.240 1.00 0.00 C ATOM 735 OD1 ASP A 49 -22.744 -6.391 -10.711 1.00 0.00 O ATOM 736 OD2 ASP A 49 -21.845 -8.347 -10.645 1.00 0.00 O ATOM 0 H ASP A 49 -21.064 -6.527 -15.247 1.00 0.00 H new ATOM 0 HA ASP A 49 -22.937 -5.553 -13.355 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -23.675 -7.779 -12.931 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -22.066 -8.450 -13.113 1.00 0.00 H new ATOM 741 N THR A 50 -19.764 -6.401 -13.357 1.00 0.00 N ATOM 742 CA THR A 50 -18.441 -6.014 -12.883 1.00 0.00 C ATOM 743 C THR A 50 -17.984 -4.719 -13.547 1.00 0.00 C ATOM 744 O THR A 50 -17.295 -3.902 -12.935 1.00 0.00 O ATOM 745 CB THR A 50 -17.431 -7.123 -13.199 1.00 0.00 C ATOM 746 OG1 THR A 50 -16.148 -6.547 -13.395 1.00 0.00 O ATOM 747 CG2 THR A 50 -17.852 -7.866 -14.471 1.00 0.00 C ATOM 0 H THR A 50 -19.762 -7.139 -14.061 1.00 0.00 H new ATOM 0 HA THR A 50 -18.498 -5.858 -11.806 1.00 0.00 H new ATOM 0 HB THR A 50 -17.398 -7.826 -12.367 1.00 0.00 H new ATOM 0 HG1 THR A 50 -15.474 -7.257 -13.437 1.00 0.00 H new ATOM 0 HG21 THR A 50 -17.129 -8.652 -14.689 1.00 0.00 H new ATOM 0 HG22 THR A 50 -18.837 -8.309 -14.325 1.00 0.00 H new ATOM 0 HG23 THR A 50 -17.889 -7.166 -15.306 1.00 0.00 H new ATOM 755 N LEU A 51 -18.359 -4.555 -14.808 1.00 0.00 N ATOM 756 CA LEU A 51 -17.976 -3.377 -15.575 1.00 0.00 C ATOM 757 C LEU A 51 -18.588 -2.092 -15.018 1.00 0.00 C ATOM 758 O LEU A 51 -17.886 -1.101 -14.811 1.00 0.00 O ATOM 759 CB LEU A 51 -18.419 -3.565 -17.023 1.00 0.00 C ATOM 760 CG LEU A 51 -18.083 -4.988 -17.472 1.00 0.00 C ATOM 761 CD1 LEU A 51 -19.354 -5.841 -17.475 1.00 0.00 C ATOM 762 CD2 LEU A 51 -17.496 -4.945 -18.881 1.00 0.00 C ATOM 0 H LEU A 51 -18.930 -5.225 -15.323 1.00 0.00 H new ATOM 0 HA LEU A 51 -16.893 -3.274 -15.509 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -19.490 -3.386 -17.114 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -17.919 -2.841 -17.666 1.00 0.00 H new ATOM 0 HG LEU A 51 -17.358 -5.425 -16.785 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -19.111 -6.854 -17.795 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -19.776 -5.869 -16.470 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -20.081 -5.408 -18.162 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -17.255 -5.957 -19.206 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -18.224 -4.508 -19.565 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -16.590 -4.339 -18.879 1.00 0.00 H new ATOM 774 N LEU A 52 -19.900 -2.099 -14.809 1.00 0.00 N ATOM 775 CA LEU A 52 -20.591 -0.911 -14.315 1.00 0.00 C ATOM 776 C LEU A 52 -19.992 -0.404 -13.005 1.00 0.00 C ATOM 777 O LEU A 52 -19.658 0.774 -12.887 1.00 0.00 O ATOM 778 CB LEU A 52 -22.077 -1.216 -14.108 1.00 0.00 C ATOM 779 CG LEU A 52 -22.258 -2.694 -13.754 1.00 0.00 C ATOM 780 CD1 LEU A 52 -23.518 -2.858 -12.898 1.00 0.00 C ATOM 781 CD2 LEU A 52 -22.404 -3.523 -15.034 1.00 0.00 C ATOM 0 H LEU A 52 -20.503 -2.906 -14.972 1.00 0.00 H new ATOM 0 HA LEU A 52 -20.470 -0.130 -15.066 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -22.479 -0.590 -13.311 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -22.636 -0.978 -15.013 1.00 0.00 H new ATOM 0 HG LEU A 52 -21.386 -3.040 -13.200 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -23.651 -3.910 -12.644 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -23.415 -2.274 -11.984 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -24.386 -2.508 -13.457 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -22.532 -4.574 -14.774 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -23.274 -3.179 -15.593 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -21.510 -3.407 -15.646 1.00 0.00 H new ATOM 793 N ALA A 53 -19.868 -1.286 -12.019 1.00 0.00 N ATOM 794 CA ALA A 53 -19.320 -0.888 -10.725 1.00 0.00 C ATOM 795 C ALA A 53 -17.879 -0.407 -10.861 1.00 0.00 C ATOM 796 O ALA A 53 -17.507 0.630 -10.311 1.00 0.00 O ATOM 797 CB ALA A 53 -19.376 -2.067 -9.750 1.00 0.00 C ATOM 0 H ALA A 53 -20.135 -2.268 -12.087 1.00 0.00 H new ATOM 0 HA ALA A 53 -19.923 -0.065 -10.342 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -18.966 -1.763 -8.787 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -20.411 -2.383 -9.620 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -18.791 -2.896 -10.148 1.00 0.00 H new ATOM 803 N THR A 54 -17.073 -1.170 -11.585 1.00 0.00 N ATOM 804 CA THR A 54 -15.673 -0.825 -11.782 1.00 0.00 C ATOM 805 C THR A 54 -15.519 0.421 -12.650 1.00 0.00 C ATOM 806 O THR A 54 -14.793 1.346 -12.295 1.00 0.00 O ATOM 807 CB THR A 54 -14.961 -1.996 -12.449 1.00 0.00 C ATOM 808 OG1 THR A 54 -15.623 -2.313 -13.665 1.00 0.00 O ATOM 809 CG2 THR A 54 -14.997 -3.205 -11.517 1.00 0.00 C ATOM 0 H THR A 54 -17.365 -2.032 -12.046 1.00 0.00 H new ATOM 0 HA THR A 54 -15.232 -0.614 -10.808 1.00 0.00 H new ATOM 0 HB THR A 54 -13.925 -1.729 -12.657 1.00 0.00 H new ATOM 0 HG1 THR A 54 -16.314 -2.987 -13.495 1.00 0.00 H new ATOM 0 HG21 THR A 54 -14.489 -4.045 -11.991 1.00 0.00 H new ATOM 0 HG22 THR A 54 -14.495 -2.958 -10.581 1.00 0.00 H new ATOM 0 HG23 THR A 54 -16.033 -3.476 -11.313 1.00 0.00 H new ATOM 817 N LEU A 55 -16.188 0.427 -13.796 1.00 0.00 N ATOM 818 CA LEU A 55 -16.097 1.553 -14.716 1.00 0.00 C ATOM 819 C LEU A 55 -16.652 2.836 -14.098 1.00 0.00 C ATOM 820 O LEU A 55 -16.049 3.902 -14.224 1.00 0.00 O ATOM 821 CB LEU A 55 -16.864 1.228 -15.997 1.00 0.00 C ATOM 822 CG LEU A 55 -16.160 0.087 -16.735 1.00 0.00 C ATOM 823 CD1 LEU A 55 -16.940 -0.263 -18.004 1.00 0.00 C ATOM 824 CD2 LEU A 55 -14.744 0.525 -17.113 1.00 0.00 C ATOM 0 H LEU A 55 -16.796 -0.330 -14.109 1.00 0.00 H new ATOM 0 HA LEU A 55 -15.043 1.719 -14.940 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -17.889 0.944 -15.758 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -16.918 2.110 -16.635 1.00 0.00 H new ATOM 0 HG LEU A 55 -16.112 -0.788 -16.087 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -16.437 -1.076 -18.528 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -17.950 -0.574 -17.736 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -16.990 0.611 -18.653 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -14.240 -0.286 -17.639 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -14.795 1.401 -17.760 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -14.187 0.773 -16.210 1.00 0.00 H new ATOM 836 N LYS A 56 -17.806 2.736 -13.447 1.00 0.00 N ATOM 837 CA LYS A 56 -18.427 3.907 -12.833 1.00 0.00 C ATOM 838 C LYS A 56 -17.536 4.498 -11.742 1.00 0.00 C ATOM 839 O LYS A 56 -17.662 5.675 -11.401 1.00 0.00 O ATOM 840 CB LYS A 56 -19.786 3.528 -12.235 1.00 0.00 C ATOM 841 CG LYS A 56 -20.804 3.309 -13.359 1.00 0.00 C ATOM 842 CD LYS A 56 -20.943 4.589 -14.184 1.00 0.00 C ATOM 843 CE LYS A 56 -22.390 4.740 -14.662 1.00 0.00 C ATOM 844 NZ LYS A 56 -22.426 5.594 -15.883 1.00 0.00 N ATOM 0 H LYS A 56 -18.327 1.867 -13.331 1.00 0.00 H new ATOM 0 HA LYS A 56 -18.565 4.659 -13.610 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -19.690 2.622 -11.637 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -20.132 4.316 -11.567 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -20.484 2.486 -13.998 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -21.770 3.029 -12.939 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -20.656 5.453 -13.584 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -20.269 4.557 -15.040 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -22.816 3.760 -14.878 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -22.999 5.186 -13.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -23.409 5.696 -16.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -22.035 6.532 -15.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -21.859 5.151 -16.634 1.00 0.00 H new ATOM 858 N LYS A 57 -16.641 3.683 -11.194 1.00 0.00 N ATOM 859 CA LYS A 57 -15.747 4.148 -10.142 1.00 0.00 C ATOM 860 C LYS A 57 -15.375 5.615 -10.350 1.00 0.00 C ATOM 861 O LYS A 57 -15.496 6.429 -9.435 1.00 0.00 O ATOM 862 CB LYS A 57 -14.481 3.296 -10.127 1.00 0.00 C ATOM 863 CG LYS A 57 -14.757 1.978 -9.402 1.00 0.00 C ATOM 864 CD LYS A 57 -14.304 2.094 -7.946 1.00 0.00 C ATOM 865 CE LYS A 57 -14.723 0.837 -7.182 1.00 0.00 C ATOM 866 NZ LYS A 57 -13.800 0.622 -6.031 1.00 0.00 N ATOM 0 H LYS A 57 -16.516 2.706 -11.458 1.00 0.00 H new ATOM 0 HA LYS A 57 -16.264 4.055 -9.187 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.151 3.099 -11.147 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -13.674 3.834 -9.629 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -15.820 1.742 -9.446 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -14.229 1.162 -9.895 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -13.222 2.218 -7.899 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -14.746 2.977 -7.485 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -15.748 0.940 -6.825 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -14.702 -0.028 -7.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -14.086 -0.233 -5.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -12.828 0.505 -6.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -13.842 1.443 -5.395 1.00 0.00 H new ATOM 880 N THR A 58 -14.916 5.946 -11.554 1.00 0.00 N ATOM 881 CA THR A 58 -14.524 7.317 -11.858 1.00 0.00 C ATOM 882 C THR A 58 -15.735 8.150 -12.268 1.00 0.00 C ATOM 883 O THR A 58 -15.673 9.380 -12.291 1.00 0.00 O ATOM 884 CB THR A 58 -13.496 7.324 -12.993 1.00 0.00 C ATOM 885 OG1 THR A 58 -13.325 6.002 -13.482 1.00 0.00 O ATOM 886 CG2 THR A 58 -12.157 7.850 -12.475 1.00 0.00 C ATOM 0 H THR A 58 -14.807 5.290 -12.328 1.00 0.00 H new ATOM 0 HA THR A 58 -14.086 7.754 -10.961 1.00 0.00 H new ATOM 0 HB THR A 58 -13.851 7.970 -13.796 1.00 0.00 H new ATOM 0 HG1 THR A 58 -13.091 6.033 -14.433 1.00 0.00 H new ATOM 0 HG21 THR A 58 -11.429 7.853 -13.286 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.286 8.865 -12.099 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.801 7.207 -11.670 1.00 0.00 H new ATOM 894 N GLY A 59 -16.833 7.478 -12.594 1.00 0.00 N ATOM 895 CA GLY A 59 -18.046 8.175 -13.002 1.00 0.00 C ATOM 896 C GLY A 59 -18.176 8.200 -14.522 1.00 0.00 C ATOM 897 O GLY A 59 -18.949 8.983 -15.076 1.00 0.00 O ATOM 0 H GLY A 59 -16.908 6.461 -12.584 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -18.916 7.683 -12.567 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -18.031 9.195 -12.618 1.00 0.00 H new ATOM 901 N ALA A 60 -17.411 7.342 -15.193 1.00 0.00 N ATOM 902 CA ALA A 60 -17.447 7.277 -16.650 1.00 0.00 C ATOM 903 C ALA A 60 -18.713 6.569 -17.122 1.00 0.00 C ATOM 904 O ALA A 60 -19.083 5.521 -16.596 1.00 0.00 O ATOM 905 CB ALA A 60 -16.217 6.530 -17.170 1.00 0.00 C ATOM 0 H ALA A 60 -16.764 6.687 -14.754 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.445 8.294 -17.042 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -16.251 6.486 -18.259 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -15.314 7.054 -16.856 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -16.208 5.518 -16.766 1.00 0.00 H new ATOM 911 N THR A 61 -19.376 7.156 -18.113 1.00 0.00 N ATOM 912 CA THR A 61 -20.606 6.580 -18.644 1.00 0.00 C ATOM 913 C THR A 61 -20.361 5.177 -19.195 1.00 0.00 C ATOM 914 O THR A 61 -19.383 4.938 -19.900 1.00 0.00 O ATOM 915 CB THR A 61 -21.162 7.476 -19.756 1.00 0.00 C ATOM 916 OG1 THR A 61 -20.401 8.675 -19.818 1.00 0.00 O ATOM 917 CG2 THR A 61 -22.626 7.812 -19.464 1.00 0.00 C ATOM 0 H THR A 61 -19.085 8.024 -18.562 1.00 0.00 H new ATOM 0 HA THR A 61 -21.328 6.511 -17.830 1.00 0.00 H new ATOM 0 HB THR A 61 -21.098 6.953 -20.710 1.00 0.00 H new ATOM 0 HG1 THR A 61 -19.575 8.513 -20.320 1.00 0.00 H new ATOM 0 HG21 THR A 61 -23.018 8.449 -20.257 1.00 0.00 H new ATOM 0 HG22 THR A 61 -23.208 6.892 -19.417 1.00 0.00 H new ATOM 0 HG23 THR A 61 -22.696 8.335 -18.510 1.00 0.00 H new ATOM 925 N VAL A 62 -21.267 4.259 -18.872 1.00 0.00 N ATOM 926 CA VAL A 62 -21.153 2.884 -19.344 1.00 0.00 C ATOM 927 C VAL A 62 -22.310 2.555 -20.282 1.00 0.00 C ATOM 928 O VAL A 62 -23.416 3.071 -20.118 1.00 0.00 O ATOM 929 CB VAL A 62 -21.164 1.915 -18.161 1.00 0.00 C ATOM 930 CG1 VAL A 62 -22.611 1.574 -17.791 1.00 0.00 C ATOM 931 CG2 VAL A 62 -20.426 0.633 -18.551 1.00 0.00 C ATOM 0 H VAL A 62 -22.084 4.441 -18.289 1.00 0.00 H new ATOM 0 HA VAL A 62 -20.211 2.780 -19.882 1.00 0.00 H new ATOM 0 HB VAL A 62 -20.670 2.378 -17.307 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -22.618 0.883 -16.948 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -23.141 2.486 -17.517 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -23.105 1.110 -18.644 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -20.432 -0.060 -17.710 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -20.923 0.172 -19.405 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -19.396 0.872 -18.817 1.00 0.00 H new ATOM 941 N SER A 63 -22.051 1.699 -21.262 1.00 0.00 N ATOM 942 CA SER A 63 -23.088 1.321 -22.215 1.00 0.00 C ATOM 943 C SER A 63 -23.055 -0.179 -22.489 1.00 0.00 C ATOM 944 O SER A 63 -22.068 -0.704 -23.003 1.00 0.00 O ATOM 945 CB SER A 63 -22.892 2.087 -23.524 1.00 0.00 C ATOM 946 OG SER A 63 -23.466 3.381 -23.399 1.00 0.00 O ATOM 0 H SER A 63 -21.145 1.258 -21.418 1.00 0.00 H new ATOM 0 HA SER A 63 -24.057 1.573 -21.785 1.00 0.00 H new ATOM 0 HB2 SER A 63 -21.830 2.168 -23.756 1.00 0.00 H new ATOM 0 HB3 SER A 63 -23.358 1.547 -24.348 1.00 0.00 H new ATOM 0 HG SER A 63 -23.341 3.876 -24.235 1.00 0.00 H new ATOM 952 N TYR A 64 -24.142 -0.863 -22.145 1.00 0.00 N ATOM 953 CA TYR A 64 -24.230 -2.302 -22.364 1.00 0.00 C ATOM 954 C TYR A 64 -24.537 -2.596 -23.830 1.00 0.00 C ATOM 955 O TYR A 64 -25.657 -2.386 -24.293 1.00 0.00 O ATOM 956 CB TYR A 64 -25.324 -2.898 -21.475 1.00 0.00 C ATOM 957 CG TYR A 64 -25.643 -4.303 -21.932 1.00 0.00 C ATOM 958 CD1 TYR A 64 -24.631 -5.270 -21.983 1.00 0.00 C ATOM 959 CD2 TYR A 64 -26.950 -4.638 -22.303 1.00 0.00 C ATOM 960 CE1 TYR A 64 -24.930 -6.572 -22.404 1.00 0.00 C ATOM 961 CE2 TYR A 64 -27.248 -5.939 -22.724 1.00 0.00 C ATOM 962 CZ TYR A 64 -26.238 -6.906 -22.776 1.00 0.00 C ATOM 963 OH TYR A 64 -26.531 -8.189 -23.190 1.00 0.00 O ATOM 0 H TYR A 64 -24.969 -0.447 -21.716 1.00 0.00 H new ATOM 0 HA TYR A 64 -23.272 -2.755 -22.107 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -24.996 -2.909 -20.436 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -26.220 -2.279 -21.520 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -23.622 -5.012 -21.698 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -27.730 -3.892 -22.264 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -24.151 -7.319 -22.442 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -28.257 -6.197 -23.009 1.00 0.00 H new ATOM 0 HH TYR A 64 -27.484 -8.252 -23.410 1.00 0.00 H new ATOM 973 N LEU A 65 -23.529 -3.071 -24.556 1.00 0.00 N ATOM 974 CA LEU A 65 -23.697 -3.379 -25.973 1.00 0.00 C ATOM 975 C LEU A 65 -24.386 -4.726 -26.164 1.00 0.00 C ATOM 976 O LEU A 65 -25.368 -4.832 -26.900 1.00 0.00 O ATOM 977 CB LEU A 65 -22.335 -3.404 -26.668 1.00 0.00 C ATOM 978 CG LEU A 65 -21.434 -2.326 -26.065 1.00 0.00 C ATOM 979 CD1 LEU A 65 -20.152 -2.209 -26.891 1.00 0.00 C ATOM 980 CD2 LEU A 65 -22.173 -0.987 -26.079 1.00 0.00 C ATOM 0 H LEU A 65 -22.594 -3.250 -24.190 1.00 0.00 H new ATOM 0 HA LEU A 65 -24.322 -2.602 -26.414 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -21.874 -4.385 -26.552 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -22.458 -3.234 -27.738 1.00 0.00 H new ATOM 0 HG LEU A 65 -21.179 -2.594 -25.040 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -19.511 -1.440 -26.460 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -19.627 -3.164 -26.886 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -20.403 -1.939 -27.917 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -21.535 -0.215 -25.650 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -22.424 -0.721 -27.106 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -23.087 -1.070 -25.491 1.00 0.00 H new ATOM 992 N GLY A 66 -23.863 -5.756 -25.507 1.00 0.00 N ATOM 993 CA GLY A 66 -24.439 -7.089 -25.623 1.00 0.00 C ATOM 994 C GLY A 66 -23.459 -8.150 -25.135 1.00 0.00 C ATOM 995 O GLY A 66 -22.405 -7.832 -24.586 1.00 0.00 O ATOM 0 H GLY A 66 -23.049 -5.694 -24.895 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -25.359 -7.144 -25.042 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -24.706 -7.285 -26.661 1.00 0.00 H new ATOM 999 N LEU A 67 -23.816 -9.414 -25.342 1.00 0.00 N ATOM 1000 CA LEU A 67 -22.961 -10.516 -24.921 1.00 0.00 C ATOM 1001 C LEU A 67 -22.584 -11.384 -26.117 1.00 0.00 C ATOM 1002 O LEU A 67 -23.447 -11.798 -26.892 1.00 0.00 O ATOM 1003 CB LEU A 67 -23.684 -11.366 -23.874 1.00 0.00 C ATOM 1004 CG LEU A 67 -22.665 -12.218 -23.116 1.00 0.00 C ATOM 1005 CD1 LEU A 67 -23.304 -12.759 -21.835 1.00 0.00 C ATOM 1006 CD2 LEU A 67 -22.215 -13.390 -23.994 1.00 0.00 C ATOM 0 H LEU A 67 -24.685 -9.698 -25.795 1.00 0.00 H new ATOM 0 HA LEU A 67 -22.051 -10.103 -24.485 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -24.225 -10.724 -23.179 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -24.422 -12.007 -24.357 1.00 0.00 H new ATOM 0 HG LEU A 67 -21.801 -11.604 -22.863 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -22.578 -13.366 -21.295 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -23.620 -11.926 -21.206 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -24.170 -13.370 -22.090 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -21.489 -13.994 -23.450 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -23.078 -14.004 -24.252 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -21.757 -13.007 -24.906 1.00 0.00 H new ATOM 1018 N GLU A 68 -21.291 -11.653 -26.264 1.00 0.00 N ATOM 1019 CA GLU A 68 -20.812 -12.471 -27.372 1.00 0.00 C ATOM 1020 C GLU A 68 -20.028 -13.672 -26.851 1.00 0.00 C ATOM 1021 O GLU A 68 -19.210 -13.482 -25.967 1.00 0.00 O ATOM 1022 CB GLU A 68 -19.920 -11.634 -28.292 1.00 0.00 C ATOM 1023 CG GLU A 68 -19.526 -12.465 -29.515 1.00 0.00 C ATOM 1024 CD GLU A 68 -18.069 -12.898 -29.403 1.00 0.00 C ATOM 1025 OE1 GLU A 68 -17.638 -13.180 -28.297 1.00 0.00 O ATOM 1026 OE2 GLU A 68 -17.405 -12.944 -30.426 1.00 0.00 O ATOM 1027 OXT GLU A 68 -20.258 -14.763 -27.345 1.00 0.00 O ATOM 0 H GLU A 68 -20.561 -11.319 -25.635 1.00 0.00 H new ATOM 0 HA GLU A 68 -21.674 -12.831 -27.933 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -20.447 -10.733 -28.606 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -19.028 -11.311 -27.756 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -20.170 -13.341 -29.592 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -19.672 -11.881 -30.424 1.00 0.00 H new TER 1034 GLU A 68