USER MOD reduce.3.24.130724 H: found=0, std=0, add=732, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 738 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 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ -158:sc= 1.3 (180deg=1.14) USER MOD Single : A 48 MET CE :methyl -111:sc= -0.213 (180deg=-0.43) USER MOD Single : A 52 SER OG : rot -34:sc= 1.23 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=-0.0098) USER MOD Single : A 58 SER OG : rot 180:sc= -0.15 USER MOD Single : A 61 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= 0.694 K(o=0.69,f=-0.0074) USER MOD Single : A 72 MET CE :methyl 180:sc= -0.198 (180deg=-0.198) USER MOD Single : A 78 ASN : amide:sc= 0.89 K(o=0.89,f=-0.83) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 39 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot 180:sc= 0 USER MOD Single : B 45 LYS NZ :NH3+ -173:sc= 1.18 (180deg=1.09) USER MOD Single : B 48 MET CE :methyl -110:sc= -0.231 (180deg=-0.414) USER MOD Single : B 52 SER OG : rot -30:sc= 1.22 USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 TYR OH : rot 180:sc= 0 USER MOD Single : B 56 ASN : amide:sc=-0.00254 X(o=-0.0025,f=-0.016) USER MOD Single : B 58 SER OG : rot 180:sc= -0.168 USER MOD Single : B 61 ASN : amide:sc=-0.00586 K(o=-0.0059,f=-0.71) USER MOD Single : B 65 SER OG : rot 180:sc= 0 USER MOD Single : B 66 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 GLN : amide:sc= 0.692 K(o=0.69,f=-0.014) USER MOD Single : B 72 MET CE :methyl 180:sc= -0.188 (180deg=-0.188) USER MOD Single : B 78 ASN : amide:sc= 0.895 K(o=0.9,f=-0.85) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 38 -9.274 -11.163 -99.330 1.00 0.00 N ATOM 2 CA ASP A 38 -10.310 -10.990 -98.318 1.00 0.00 C ATOM 3 C ASP A 38 -9.897 -11.621 -96.994 1.00 0.00 C ATOM 4 O ASP A 38 -10.721 -11.800 -96.097 1.00 0.00 O ATOM 5 CB ASP A 38 -11.631 -11.603 -98.791 1.00 0.00 C ATOM 6 CG ASP A 38 -12.236 -10.862 -99.976 1.00 0.00 C ATOM 7 OD1 ASP A 38 -11.999 -9.684-100.099 1.00 0.00 O ATOM 8 OD2 ASP A 38 -12.929 -11.482-100.747 1.00 0.00 O ATOM 0 HA ASP A 38 -10.446 -9.919 -98.164 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -11.465 -12.644 -99.066 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -12.343 -11.601 -97.966 1.00 0.00 H new ATOM 13 N TYR A 39 -8.616 -11.956 -96.878 1.00 0.00 N ATOM 14 CA TYR A 39 -8.094 -12.578 -95.667 1.00 0.00 C ATOM 15 C TYR A 39 -7.106 -11.659 -94.959 1.00 0.00 C ATOM 16 O TYR A 39 -6.131 -11.202 -95.556 1.00 0.00 O ATOM 17 CB TYR A 39 -7.430 -13.916 -95.996 1.00 0.00 C ATOM 18 CG TYR A 39 -8.378 -14.939 -96.583 1.00 0.00 C ATOM 19 CD1 TYR A 39 -8.581 -14.989 -97.955 1.00 0.00 C ATOM 20 CD2 TYR A 39 -9.044 -15.826 -95.751 1.00 0.00 C ATOM 21 CE1 TYR A 39 -9.446 -15.923 -98.491 1.00 0.00 C ATOM 22 CE2 TYR A 39 -9.910 -16.759 -96.287 1.00 0.00 C ATOM 23 CZ TYR A 39 -10.111 -16.810 -97.651 1.00 0.00 C ATOM 24 OH TYR A 39 -10.973 -17.739 -98.186 1.00 0.00 O ATOM 0 H TYR A 39 -7.920 -11.807 -97.609 1.00 0.00 H new ATOM 0 HA TYR A 39 -8.933 -12.757 -94.994 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -6.615 -13.744 -96.699 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -6.986 -14.324 -95.088 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -8.063 -14.298 -98.603 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -8.886 -15.787 -94.683 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -9.605 -15.964 -99.558 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -10.430 -17.449 -95.638 1.00 0.00 H new ATOM 0 HH TYR A 39 -11.355 -18.283 -97.466 1.00 0.00 H new ATOM 34 N LEU A 40 -7.364 -11.391 -93.684 1.00 0.00 N ATOM 35 CA LEU A 40 -6.607 -10.390 -92.942 1.00 0.00 C ATOM 36 C LEU A 40 -5.144 -10.795 -92.808 1.00 0.00 C ATOM 37 O LEU A 40 -4.246 -9.966 -92.952 1.00 0.00 O ATOM 38 CB LEU A 40 -7.218 -10.187 -91.550 1.00 0.00 C ATOM 39 CG LEU A 40 -8.576 -9.475 -91.517 1.00 0.00 C ATOM 40 CD1 LEU A 40 -9.121 -9.484 -90.095 1.00 0.00 C ATOM 41 CD2 LEU A 40 -8.417 -8.052 -92.032 1.00 0.00 C ATOM 0 H LEU A 40 -8.093 -11.854 -93.142 1.00 0.00 H new ATOM 0 HA LEU A 40 -6.655 -9.454 -93.498 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -7.328 -11.162 -91.076 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.514 -9.616 -90.944 1.00 0.00 H new ATOM 0 HG LEU A 40 -9.285 -9.996 -92.160 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -10.086 -8.978 -90.072 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -9.243 -10.514 -89.759 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -8.424 -8.967 -89.435 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -9.382 -7.546 -92.008 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.710 -7.514 -91.401 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.045 -8.075 -93.056 1.00 0.00 H new ATOM 53 N PRO A 41 -4.912 -12.072 -92.530 1.00 0.00 N ATOM 54 CA PRO A 41 -3.557 -12.589 -92.378 1.00 0.00 C ATOM 55 C PRO A 41 -2.679 -12.188 -93.555 1.00 0.00 C ATOM 56 O PRO A 41 -1.550 -11.732 -93.373 1.00 0.00 O ATOM 57 CB PRO A 41 -3.771 -14.106 -92.324 1.00 0.00 C ATOM 58 CG PRO A 41 -5.101 -14.264 -91.670 1.00 0.00 C ATOM 59 CD PRO A 41 -5.942 -13.161 -92.257 1.00 0.00 C ATOM 0 HA PRO A 41 -3.043 -12.201 -91.498 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -3.763 -14.545 -93.322 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -2.985 -14.599 -91.752 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -5.531 -15.244 -91.876 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.024 -14.171 -90.587 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -6.449 -13.478 -93.168 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -6.713 -12.826 -91.564 1.00 0.00 H new ATOM 67 N THR A 42 -3.203 -12.360 -94.764 1.00 0.00 N ATOM 68 CA THR A 42 -2.482 -11.980 -95.973 1.00 0.00 C ATOM 69 C THR A 42 -2.392 -10.465 -96.107 1.00 0.00 C ATOM 70 O THR A 42 -1.348 -9.925 -96.473 1.00 0.00 O ATOM 71 CB THR A 42 -3.152 -12.571 -97.227 1.00 0.00 C ATOM 72 OG1 THR A 42 -3.168 -14.001 -97.134 1.00 0.00 O ATOM 73 CG2 THR A 42 -2.398 -12.155 -98.481 1.00 0.00 C ATOM 0 H THR A 42 -4.126 -12.761 -94.933 1.00 0.00 H new ATOM 0 HA THR A 42 -1.474 -12.385 -95.888 1.00 0.00 H new ATOM 0 HB THR A 42 -4.173 -12.193 -97.288 1.00 0.00 H new ATOM 0 HG1 THR A 42 -3.596 -14.376 -97.932 1.00 0.00 H new ATOM 0 HG21 THR A 42 -2.886 -12.582 -99.357 1.00 0.00 H new ATOM 0 HG22 THR A 42 -2.396 -11.068 -98.560 1.00 0.00 H new ATOM 0 HG23 THR A 42 -1.371 -12.517 -98.425 1.00 0.00 H new ATOM 81 N LEU A 43 -3.493 -9.783 -95.808 1.00 0.00 N ATOM 82 CA LEU A 43 -3.538 -8.328 -95.890 1.00 0.00 C ATOM 83 C LEU A 43 -2.542 -7.691 -94.930 1.00 0.00 C ATOM 84 O LEU A 43 -1.985 -6.630 -95.212 1.00 0.00 O ATOM 85 CB LEU A 43 -4.952 -7.823 -95.577 1.00 0.00 C ATOM 86 CG LEU A 43 -6.026 -8.170 -96.616 1.00 0.00 C ATOM 87 CD1 LEU A 43 -7.394 -7.751 -96.092 1.00 0.00 C ATOM 88 CD2 LEU A 43 -5.707 -7.471 -97.930 1.00 0.00 C ATOM 0 H LEU A 43 -4.366 -10.215 -95.507 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.267 -8.042 -96.906 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.259 -8.231 -94.614 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.915 -6.739 -95.467 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.039 -9.245 -96.793 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -8.157 -7.997 -96.830 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.605 -8.279 -95.162 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -7.400 -6.677 -95.909 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.470 -7.718 -98.668 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -5.689 -6.392 -97.773 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.733 -7.802 -98.291 1.00 0.00 H new ATOM 100 N ARG A 44 -2.320 -8.345 -93.794 1.00 0.00 N ATOM 101 CA ARG A 44 -1.353 -7.870 -92.813 1.00 0.00 C ATOM 102 C ARG A 44 0.065 -7.922 -93.367 1.00 0.00 C ATOM 103 O ARG A 44 0.836 -6.975 -93.217 1.00 0.00 O ATOM 104 CB ARG A 44 -1.429 -8.701 -91.541 1.00 0.00 C ATOM 105 CG ARG A 44 -2.647 -8.430 -90.672 1.00 0.00 C ATOM 106 CD ARG A 44 -2.879 -9.526 -89.696 1.00 0.00 C ATOM 107 NE ARG A 44 -1.784 -9.649 -88.748 1.00 0.00 N ATOM 108 CZ ARG A 44 -1.618 -10.685 -87.902 1.00 0.00 C ATOM 109 NH1 ARG A 44 -2.481 -11.675 -87.898 1.00 0.00 N ATOM 110 NH2 ARG A 44 -0.586 -10.704 -87.076 1.00 0.00 N ATOM 0 H ARG A 44 -2.798 -9.207 -93.531 1.00 0.00 H new ATOM 0 HA ARG A 44 -1.601 -6.834 -92.583 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -1.422 -9.757 -91.813 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -0.531 -8.518 -90.950 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -2.511 -7.490 -90.138 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -3.527 -8.313 -91.305 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -3.807 -9.341 -89.156 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -3.004 -10.468 -90.231 1.00 0.00 H new ATOM 0 HE ARG A 44 -1.093 -8.899 -88.721 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.277 -11.660 -88.535 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -2.355 -12.459 -87.258 1.00 0.00 H new ATOM 0 HH21 ARG A 44 0.084 -9.935 -87.079 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -0.460 -11.488 -86.435 1.00 0.00 H new ATOM 124 N LYS A 45 0.403 -9.036 -94.008 1.00 0.00 N ATOM 125 CA LYS A 45 1.685 -9.168 -94.689 1.00 0.00 C ATOM 126 C LYS A 45 1.836 -8.123 -95.786 1.00 0.00 C ATOM 127 O LYS A 45 2.876 -7.473 -95.900 1.00 0.00 O ATOM 128 CB LYS A 45 1.837 -10.572 -95.277 1.00 0.00 C ATOM 129 CG LYS A 45 3.160 -10.817 -95.990 1.00 0.00 C ATOM 130 CD LYS A 45 3.281 -12.261 -96.451 1.00 0.00 C ATOM 131 CE LYS A 45 4.633 -12.525 -97.098 1.00 0.00 C ATOM 132 NZ LYS A 45 4.734 -11.906 -98.448 1.00 0.00 N ATOM 0 H LYS A 45 -0.194 -9.861 -94.070 1.00 0.00 H new ATOM 0 HA LYS A 45 2.472 -9.005 -93.952 1.00 0.00 H new ATOM 0 HB2 LYS A 45 1.730 -11.302 -94.475 1.00 0.00 H new ATOM 0 HB3 LYS A 45 1.022 -10.749 -95.979 1.00 0.00 H new ATOM 0 HG2 LYS A 45 3.241 -10.151 -96.849 1.00 0.00 H new ATOM 0 HG3 LYS A 45 3.986 -10.576 -95.321 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.146 -12.929 -95.600 1.00 0.00 H new ATOM 0 HD3 LYS A 45 2.486 -12.486 -97.162 1.00 0.00 H new ATOM 0 HE2 LYS A 45 5.424 -12.133 -96.459 1.00 0.00 H new ATOM 0 HE3 LYS A 45 4.793 -13.600 -97.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 5.471 -12.392 -98.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 3.821 -11.993 -98.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 4.980 -10.900 -98.351 1.00 0.00 H new ATOM 146 N GLU A 46 0.793 -7.964 -96.593 1.00 0.00 N ATOM 147 CA GLU A 46 0.802 -6.985 -97.674 1.00 0.00 C ATOM 148 C GLU A 46 1.018 -5.575 -97.139 1.00 0.00 C ATOM 149 O GLU A 46 1.759 -4.785 -97.725 1.00 0.00 O ATOM 150 CB GLU A 46 -0.496 -7.058 -98.465 1.00 0.00 C ATOM 0 H GLU A 46 -0.071 -8.501 -96.519 1.00 0.00 H new ATOM 0 HA GLU A 46 1.633 -7.224 -98.337 1.00 0.00 H new ATOM 155 N LEU A 47 0.367 -5.265 -96.023 1.00 0.00 N ATOM 156 CA LEU A 47 0.480 -3.946 -95.412 1.00 0.00 C ATOM 157 C LEU A 47 1.905 -3.677 -94.942 1.00 0.00 C ATOM 158 O LEU A 47 2.431 -2.579 -95.123 1.00 0.00 O ATOM 159 CB LEU A 47 -0.486 -3.827 -94.227 1.00 0.00 C ATOM 160 CG LEU A 47 -0.575 -2.440 -93.577 1.00 0.00 C ATOM 161 CD1 LEU A 47 -1.098 -1.435 -94.594 1.00 0.00 C ATOM 162 CD2 LEU A 47 -1.482 -2.507 -92.358 1.00 0.00 C ATOM 0 H LEU A 47 -0.245 -5.910 -95.523 1.00 0.00 H new ATOM 0 HA LEU A 47 0.221 -3.204 -96.167 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -1.482 -4.115 -94.564 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -0.187 -4.547 -93.465 1.00 0.00 H new ATOM 0 HG LEU A 47 0.414 -2.117 -93.252 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.161 -0.450 -94.132 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.420 -1.394 -95.446 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.088 -1.741 -94.932 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.545 -1.521 -91.897 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -2.478 -2.829 -92.663 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -1.074 -3.218 -91.640 1.00 0.00 H new ATOM 174 N MET A 48 2.524 -4.685 -94.337 1.00 0.00 N ATOM 175 CA MET A 48 3.918 -4.591 -93.924 1.00 0.00 C ATOM 176 C MET A 48 4.823 -4.267 -95.106 1.00 0.00 C ATOM 177 O MET A 48 5.696 -3.403 -95.013 1.00 0.00 O ATOM 178 CB MET A 48 4.360 -5.892 -93.256 1.00 0.00 C ATOM 179 CG MET A 48 3.705 -6.162 -91.909 1.00 0.00 C ATOM 180 SD MET A 48 4.088 -7.802 -91.265 1.00 0.00 S ATOM 181 CE MET A 48 5.845 -7.644 -90.961 1.00 0.00 C ATOM 0 H MET A 48 2.081 -5.578 -94.122 1.00 0.00 H new ATOM 0 HA MET A 48 4.003 -3.777 -93.204 1.00 0.00 H new ATOM 0 HB2 MET A 48 4.140 -6.723 -93.926 1.00 0.00 H new ATOM 0 HB3 MET A 48 5.441 -5.868 -93.122 1.00 0.00 H new ATOM 0 HG2 MET A 48 4.033 -5.409 -91.193 1.00 0.00 H new ATOM 0 HG3 MET A 48 2.624 -6.058 -92.008 1.00 0.00 H new ATOM 0 HE1 MET A 48 6.394 -8.266 -91.668 1.00 0.00 H new ATOM 0 HE2 MET A 48 6.144 -6.603 -91.086 1.00 0.00 H new ATOM 0 HE3 MET A 48 6.069 -7.966 -89.944 1.00 0.00 H new ATOM 191 N GLU A 49 4.609 -4.964 -96.217 1.00 0.00 N ATOM 192 CA GLU A 49 5.414 -4.761 -97.415 1.00 0.00 C ATOM 193 C GLU A 49 5.282 -3.334 -97.933 1.00 0.00 C ATOM 194 O GLU A 49 6.268 -2.712 -98.326 1.00 0.00 O ATOM 195 CB GLU A 49 5.003 -5.751 -98.507 1.00 0.00 C ATOM 196 CG GLU A 49 5.348 -7.201 -98.204 1.00 0.00 C ATOM 197 CD GLU A 49 4.782 -8.161 -99.213 1.00 0.00 C ATOM 198 OE1 GLU A 49 4.080 -7.724-100.092 1.00 0.00 O ATOM 199 OE2 GLU A 49 5.053 -9.334 -99.104 1.00 0.00 O ATOM 0 H GLU A 49 3.884 -5.675 -96.312 1.00 0.00 H new ATOM 0 HA GLU A 49 6.457 -4.934 -97.149 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.928 -5.672 -98.666 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.485 -5.463 -99.441 1.00 0.00 H new ATOM 0 HG2 GLU A 49 6.432 -7.312 -98.173 1.00 0.00 H new ATOM 0 HG3 GLU A 49 4.972 -7.459 -97.214 1.00 0.00 H new ATOM 206 N VAL A 50 4.056 -2.821 -97.931 1.00 0.00 N ATOM 207 CA VAL A 50 3.800 -1.448 -98.348 1.00 0.00 C ATOM 208 C VAL A 50 4.573 -0.457 -97.487 1.00 0.00 C ATOM 209 O VAL A 50 5.132 0.515 -97.994 1.00 0.00 O ATOM 210 CB VAL A 50 2.294 -1.134 -98.260 1.00 0.00 C ATOM 211 CG1 VAL A 50 2.049 0.358 -98.429 1.00 0.00 C ATOM 212 CG2 VAL A 50 1.538 -1.928 -99.314 1.00 0.00 C ATOM 0 H VAL A 50 3.224 -3.336 -97.645 1.00 0.00 H new ATOM 0 HA VAL A 50 4.135 -1.348 -99.381 1.00 0.00 H new ATOM 0 HB VAL A 50 1.929 -1.425 -97.275 1.00 0.00 H new ATOM 0 HG11 VAL A 50 0.980 0.561 -98.364 1.00 0.00 H new ATOM 0 HG12 VAL A 50 2.570 0.904 -97.643 1.00 0.00 H new ATOM 0 HG13 VAL A 50 2.421 0.680 -99.402 1.00 0.00 H new ATOM 0 HG21 VAL A 50 0.474 -1.701 -99.246 1.00 0.00 H new ATOM 0 HG22 VAL A 50 1.904 -1.659-100.305 1.00 0.00 H new ATOM 0 HG23 VAL A 50 1.693 -2.994 -99.147 1.00 0.00 H new ATOM 222 N LEU A 51 4.599 -0.709 -96.183 1.00 0.00 N ATOM 223 CA LEU A 51 5.301 0.162 -95.248 1.00 0.00 C ATOM 224 C LEU A 51 6.809 0.081 -95.444 1.00 0.00 C ATOM 225 O LEU A 51 7.504 1.095 -95.415 1.00 0.00 O ATOM 226 CB LEU A 51 4.945 -0.214 -93.804 1.00 0.00 C ATOM 227 CG LEU A 51 5.657 0.594 -92.712 1.00 0.00 C ATOM 228 CD1 LEU A 51 5.408 2.080 -92.934 1.00 0.00 C ATOM 229 CD2 LEU A 51 5.155 0.154 -91.345 1.00 0.00 C ATOM 0 H LEU A 51 4.141 -1.511 -95.749 1.00 0.00 H new ATOM 0 HA LEU A 51 4.985 1.186 -95.444 1.00 0.00 H new ATOM 0 HB2 LEU A 51 3.869 -0.099 -93.673 1.00 0.00 H new ATOM 0 HB3 LEU A 51 5.173 -1.270 -93.656 1.00 0.00 H new ATOM 0 HG LEU A 51 6.731 0.415 -92.758 1.00 0.00 H new ATOM 0 HD11 LEU A 51 5.914 2.654 -92.158 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.794 2.372 -93.911 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.337 2.280 -92.893 1.00 0.00 H new ATOM 0 HD21 LEU A 51 5.661 0.728 -90.569 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.080 0.325 -91.280 1.00 0.00 H new ATOM 0 HD23 LEU A 51 5.363 -0.907 -91.205 1.00 0.00 H new ATOM 241 N SER A 52 7.310 -1.134 -95.644 1.00 0.00 N ATOM 242 CA SER A 52 8.737 -1.350 -95.852 1.00 0.00 C ATOM 243 C SER A 52 9.219 -0.654 -97.118 1.00 0.00 C ATOM 244 O SER A 52 10.391 -0.295 -97.232 1.00 0.00 O ATOM 245 CB SER A 52 9.033 -2.834 -95.935 1.00 0.00 C ATOM 246 OG SER A 52 8.522 -3.384 -97.119 1.00 0.00 O ATOM 0 H SER A 52 6.748 -1.985 -95.666 1.00 0.00 H new ATOM 0 HA SER A 52 9.270 -0.923 -95.003 1.00 0.00 H new ATOM 0 HB2 SER A 52 10.110 -2.996 -95.890 1.00 0.00 H new ATOM 0 HB3 SER A 52 8.597 -3.344 -95.076 1.00 0.00 H new ATOM 0 HG SER A 52 7.687 -2.929 -97.357 1.00 0.00 H new ATOM 252 N LYS A 53 8.310 -0.469 -98.069 1.00 0.00 N ATOM 253 CA LYS A 53 8.623 0.250 -99.299 1.00 0.00 C ATOM 254 C LYS A 53 8.615 1.756 -99.074 1.00 0.00 C ATOM 255 O LYS A 53 9.388 2.489 -99.690 1.00 0.00 O ATOM 256 CB LYS A 53 7.633 -0.123-100.403 1.00 0.00 C ATOM 257 CG LYS A 53 7.915 0.532-101.749 1.00 0.00 C ATOM 258 CD LYS A 53 6.988 -0.003-102.829 1.00 0.00 C ATOM 259 CE LYS A 53 7.301 0.615-104.184 1.00 0.00 C ATOM 260 NZ LYS A 53 6.420 0.079-105.257 1.00 0.00 N ATOM 0 H LYS A 53 7.349 -0.807 -98.012 1.00 0.00 H new ATOM 0 HA LYS A 53 9.626 -0.042 -99.610 1.00 0.00 H new ATOM 0 HB2 LYS A 53 7.641 -1.205-100.531 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.629 0.153-100.082 1.00 0.00 H new ATOM 0 HG2 LYS A 53 7.792 1.612-101.663 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.951 0.351-102.034 1.00 0.00 H new ATOM 0 HD2 LYS A 53 7.085 -1.087-102.890 1.00 0.00 H new ATOM 0 HD3 LYS A 53 5.953 0.209-102.561 1.00 0.00 H new ATOM 0 HE2 LYS A 53 7.184 1.697-104.125 1.00 0.00 H new ATOM 0 HE3 LYS A 53 8.343 0.421-104.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 6.666 0.526-106.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 6.550 -0.950-105.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 5.427 0.286-105.027 1.00 0.00 H new ATOM 274 N TYR A 54 7.736 2.212 -98.188 1.00 0.00 N ATOM 275 CA TYR A 54 7.607 3.636 -97.900 1.00 0.00 C ATOM 276 C TYR A 54 8.894 4.197 -97.309 1.00 0.00 C ATOM 277 O TYR A 54 9.328 5.291 -97.669 1.00 0.00 O ATOM 278 CB TYR A 54 6.433 3.885 -96.951 1.00 0.00 C ATOM 279 CG TYR A 54 5.082 3.851 -97.628 1.00 0.00 C ATOM 280 CD1 TYR A 54 5.000 3.836 -99.013 1.00 0.00 C ATOM 281 CD2 TYR A 54 3.923 3.833 -96.865 1.00 0.00 C ATOM 282 CE1 TYR A 54 3.765 3.805 -99.632 1.00 0.00 C ATOM 283 CE2 TYR A 54 2.689 3.800 -97.484 1.00 0.00 C ATOM 284 CZ TYR A 54 2.608 3.787 -98.862 1.00 0.00 C ATOM 285 OH TYR A 54 1.378 3.755 -99.478 1.00 0.00 O ATOM 0 H TYR A 54 7.102 1.616 -97.656 1.00 0.00 H new ATOM 0 HA TYR A 54 7.414 4.152 -98.840 1.00 0.00 H new ATOM 0 HB2 TYR A 54 6.452 3.135 -96.161 1.00 0.00 H new ATOM 0 HB3 TYR A 54 6.565 4.855 -96.472 1.00 0.00 H new ATOM 0 HD1 TYR A 54 5.902 3.849 -99.607 1.00 0.00 H new ATOM 0 HD2 TYR A 54 3.986 3.845 -95.787 1.00 0.00 H new ATOM 0 HE1 TYR A 54 3.699 3.795-100.710 1.00 0.00 H new ATOM 0 HE2 TYR A 54 1.787 3.784 -96.890 1.00 0.00 H new ATOM 0 HH TYR A 54 0.672 3.745 -98.798 1.00 0.00 H new ATOM 295 N VAL A 55 9.499 3.441 -96.399 1.00 0.00 N ATOM 296 CA VAL A 55 10.719 3.878 -95.730 1.00 0.00 C ATOM 297 C VAL A 55 11.904 3.004 -96.120 1.00 0.00 C ATOM 298 O VAL A 55 12.997 3.140 -95.570 1.00 0.00 O ATOM 299 CB VAL A 55 10.535 3.837 -94.202 1.00 0.00 C ATOM 300 CG1 VAL A 55 9.467 4.829 -93.767 1.00 0.00 C ATOM 301 CG2 VAL A 55 10.171 2.426 -93.763 1.00 0.00 C ATOM 0 H VAL A 55 9.164 2.523 -96.108 1.00 0.00 H new ATOM 0 HA VAL A 55 10.921 4.901 -96.046 1.00 0.00 H new ATOM 0 HB VAL A 55 11.473 4.121 -93.725 1.00 0.00 H new ATOM 0 HG11 VAL A 55 9.350 4.786 -92.684 1.00 0.00 H new ATOM 0 HG12 VAL A 55 9.764 5.836 -94.061 1.00 0.00 H new ATOM 0 HG13 VAL A 55 8.520 4.577 -94.244 1.00 0.00 H new ATOM 0 HG21 VAL A 55 10.042 2.403 -92.681 1.00 0.00 H new ATOM 0 HG22 VAL A 55 9.242 2.123 -94.245 1.00 0.00 H new ATOM 0 HG23 VAL A 55 10.968 1.739 -94.048 1.00 0.00 H new ATOM 311 N ASN A 56 11.681 2.104 -97.073 1.00 0.00 N ATOM 312 CA ASN A 56 12.772 1.366 -97.698 1.00 0.00 C ATOM 313 C ASN A 56 13.562 0.571 -96.667 1.00 0.00 C ATOM 314 O ASN A 56 14.793 0.536 -96.706 1.00 0.00 O ATOM 315 CB ASN A 56 13.686 2.307 -98.462 1.00 0.00 C ATOM 316 CG ASN A 56 12.990 2.977 -99.615 1.00 0.00 C ATOM 317 OD1 ASN A 56 12.434 2.310-100.494 1.00 0.00 O ATOM 318 ND2 ASN A 56 13.012 4.285 -99.628 1.00 0.00 N ATOM 0 H ASN A 56 10.755 1.869 -97.429 1.00 0.00 H new ATOM 0 HA ASN A 56 12.336 0.659 -98.403 1.00 0.00 H new ATOM 0 HB2 ASN A 56 14.069 3.068 -97.782 1.00 0.00 H new ATOM 0 HB3 ASN A 56 14.546 1.750 -98.835 1.00 0.00 H new ATOM 0 HD21 ASN A 56 12.558 4.795-100.385 1.00 0.00 H new ATOM 0 HD22 ASN A 56 13.483 4.795 -98.881 1.00 0.00 H new ATOM 325 N VAL A 57 12.849 -0.066 -95.745 1.00 0.00 N ATOM 326 CA VAL A 57 13.472 -0.958 -94.775 1.00 0.00 C ATOM 327 C VAL A 57 13.098 -2.411 -95.043 1.00 0.00 C ATOM 328 O VAL A 57 12.540 -2.735 -96.090 1.00 0.00 O ATOM 329 CB VAL A 57 13.045 -0.576 -93.345 1.00 0.00 C ATOM 330 CG1 VAL A 57 13.422 0.867 -93.044 1.00 0.00 C ATOM 331 CG2 VAL A 57 11.548 -0.789 -93.178 1.00 0.00 C ATOM 0 H VAL A 57 11.837 0.019 -95.649 1.00 0.00 H new ATOM 0 HA VAL A 57 14.552 -0.852 -94.874 1.00 0.00 H new ATOM 0 HB VAL A 57 13.570 -1.216 -92.636 1.00 0.00 H new ATOM 0 HG11 VAL A 57 13.113 1.120 -92.030 1.00 0.00 H new ATOM 0 HG12 VAL A 57 14.501 0.988 -93.135 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.922 1.529 -93.751 1.00 0.00 H new ATOM 0 HG21 VAL A 57 11.253 -0.517 -92.165 1.00 0.00 H new ATOM 0 HG22 VAL A 57 11.010 -0.166 -93.892 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.307 -1.837 -93.357 1.00 0.00 H new ATOM 341 N SER A 58 13.410 -3.282 -94.089 1.00 0.00 N ATOM 342 CA SER A 58 13.075 -4.696 -94.205 1.00 0.00 C ATOM 343 C SER A 58 11.899 -5.060 -93.309 1.00 0.00 C ATOM 344 O SER A 58 11.571 -4.331 -92.373 1.00 0.00 O ATOM 345 CB SER A 58 14.278 -5.548 -93.846 1.00 0.00 C ATOM 346 OG SER A 58 13.932 -6.904 -93.780 1.00 0.00 O ATOM 0 H SER A 58 13.895 -3.033 -93.227 1.00 0.00 H new ATOM 0 HA SER A 58 12.789 -4.890 -95.239 1.00 0.00 H new ATOM 0 HB2 SER A 58 15.063 -5.405 -94.588 1.00 0.00 H new ATOM 0 HB3 SER A 58 14.683 -5.225 -92.887 1.00 0.00 H new ATOM 0 HG SER A 58 14.724 -7.433 -93.549 1.00 0.00 H new ATOM 352 N LEU A 59 11.267 -6.191 -93.601 1.00 0.00 N ATOM 353 CA LEU A 59 10.126 -6.655 -92.820 1.00 0.00 C ATOM 354 C LEU A 59 10.549 -7.061 -91.414 1.00 0.00 C ATOM 355 O LEU A 59 9.713 -7.219 -90.525 1.00 0.00 O ATOM 356 CB LEU A 59 9.451 -7.841 -93.520 1.00 0.00 C ATOM 357 CG LEU A 59 8.808 -7.533 -94.878 1.00 0.00 C ATOM 358 CD1 LEU A 59 8.265 -8.820 -95.487 1.00 0.00 C ATOM 359 CD2 LEU A 59 7.701 -6.506 -94.695 1.00 0.00 C ATOM 0 H LEU A 59 11.526 -6.804 -94.374 1.00 0.00 H new ATOM 0 HA LEU A 59 9.418 -5.830 -92.741 1.00 0.00 H new ATOM 0 HB2 LEU A 59 10.193 -8.627 -93.660 1.00 0.00 H new ATOM 0 HB3 LEU A 59 8.684 -8.241 -92.858 1.00 0.00 H new ATOM 0 HG LEU A 59 9.553 -7.118 -95.557 1.00 0.00 H new ATOM 0 HD11 LEU A 59 7.808 -8.601 -96.452 1.00 0.00 H new ATOM 0 HD12 LEU A 59 9.081 -9.530 -95.624 1.00 0.00 H new ATOM 0 HD13 LEU A 59 7.517 -9.251 -94.821 1.00 0.00 H new ATOM 0 HD21 LEU A 59 7.244 -6.287 -95.660 1.00 0.00 H new ATOM 0 HD22 LEU A 59 6.945 -6.903 -94.017 1.00 0.00 H new ATOM 0 HD23 LEU A 59 8.119 -5.591 -94.276 1.00 0.00 H new ATOM 371 N ASP A 60 11.852 -7.230 -91.220 1.00 0.00 N ATOM 372 CA ASP A 60 12.391 -7.603 -89.917 1.00 0.00 C ATOM 373 C ASP A 60 12.217 -6.477 -88.906 1.00 0.00 C ATOM 374 O ASP A 60 12.242 -6.706 -87.697 1.00 0.00 O ATOM 375 CB ASP A 60 13.873 -7.969 -90.034 1.00 0.00 C ATOM 376 CG ASP A 60 14.102 -9.297 -90.742 1.00 0.00 C ATOM 377 OD1 ASP A 60 13.170 -10.057 -90.853 1.00 0.00 O ATOM 378 OD2 ASP A 60 15.207 -9.538 -91.166 1.00 0.00 O ATOM 0 H ASP A 60 12.556 -7.115 -91.949 1.00 0.00 H new ATOM 0 HA ASP A 60 11.834 -8.472 -89.565 1.00 0.00 H new ATOM 0 HB2 ASP A 60 14.395 -7.180 -90.575 1.00 0.00 H new ATOM 0 HB3 ASP A 60 14.310 -8.015 -89.037 1.00 0.00 H new ATOM 383 N ASN A 61 12.043 -5.259 -89.409 1.00 0.00 N ATOM 384 CA ASN A 61 11.896 -4.090 -88.550 1.00 0.00 C ATOM 385 C ASN A 61 10.429 -3.729 -88.359 1.00 0.00 C ATOM 386 O ASN A 61 10.105 -2.685 -87.792 1.00 0.00 O ATOM 387 CB ASN A 61 12.667 -2.911 -89.116 1.00 0.00 C ATOM 388 CG ASN A 61 14.154 -3.123 -89.080 1.00 0.00 C ATOM 389 OD1 ASN A 61 14.691 -3.692 -88.122 1.00 0.00 O ATOM 390 ND2 ASN A 61 14.833 -2.678 -90.107 1.00 0.00 N ATOM 0 H ASN A 61 12.000 -5.056 -90.408 1.00 0.00 H new ATOM 0 HA ASN A 61 12.310 -4.338 -87.573 1.00 0.00 H new ATOM 0 HB2 ASN A 61 12.353 -2.737 -90.145 1.00 0.00 H new ATOM 0 HB3 ASN A 61 12.418 -2.013 -88.550 1.00 0.00 H new ATOM 0 HD21 ASN A 61 15.846 -2.795 -90.138 1.00 0.00 H new ATOM 0 HD22 ASN A 61 14.349 -2.214 -90.876 1.00 0.00 H new ATOM 397 N ILE A 62 9.544 -4.598 -88.835 1.00 0.00 N ATOM 398 CA ILE A 62 8.110 -4.333 -88.792 1.00 0.00 C ATOM 399 C ILE A 62 7.366 -5.448 -88.069 1.00 0.00 C ATOM 400 O ILE A 62 7.635 -6.629 -88.284 1.00 0.00 O ATOM 401 CB ILE A 62 7.539 -4.172 -90.213 1.00 0.00 C ATOM 402 CG1 ILE A 62 8.256 -3.037 -90.950 1.00 0.00 C ATOM 403 CG2 ILE A 62 6.042 -3.913 -90.158 1.00 0.00 C ATOM 404 CD1 ILE A 62 7.894 -2.936 -92.414 1.00 0.00 C ATOM 0 H ILE A 62 9.794 -5.493 -89.256 1.00 0.00 H new ATOM 0 HA ILE A 62 7.968 -3.402 -88.243 1.00 0.00 H new ATOM 0 HB ILE A 62 7.706 -5.099 -90.762 1.00 0.00 H new ATOM 0 HG12 ILE A 62 8.019 -2.092 -90.461 1.00 0.00 H new ATOM 0 HG13 ILE A 62 9.333 -3.181 -90.861 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.655 -3.802 -91.171 1.00 0.00 H new ATOM 0 HG22 ILE A 62 5.545 -4.751 -89.670 1.00 0.00 H new ATOM 0 HG23 ILE A 62 5.851 -3.000 -89.594 1.00 0.00 H new ATOM 0 HD11 ILE A 62 8.441 -2.110 -92.868 1.00 0.00 H new ATOM 0 HD12 ILE A 62 8.157 -3.866 -92.919 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.823 -2.760 -92.513 1.00 0.00 H new ATOM 416 N ARG A 63 6.427 -5.064 -87.210 1.00 0.00 N ATOM 417 CA ARG A 63 5.593 -6.030 -86.505 1.00 0.00 C ATOM 418 C ARG A 63 4.116 -5.679 -86.631 1.00 0.00 C ATOM 419 O ARG A 63 3.743 -4.506 -86.606 1.00 0.00 O ATOM 420 CB ARG A 63 5.973 -6.092 -85.033 1.00 0.00 C ATOM 421 CG ARG A 63 7.388 -6.575 -84.757 1.00 0.00 C ATOM 422 CD ARG A 63 7.549 -8.016 -85.080 1.00 0.00 C ATOM 423 NE ARG A 63 8.880 -8.500 -84.753 1.00 0.00 N ATOM 424 CZ ARG A 63 9.951 -8.404 -85.566 1.00 0.00 C ATOM 425 NH1 ARG A 63 9.831 -7.842 -86.748 1.00 0.00 N ATOM 426 NH2 ARG A 63 11.121 -8.876 -85.174 1.00 0.00 N ATOM 0 H ARG A 63 6.225 -4.090 -86.985 1.00 0.00 H new ATOM 0 HA ARG A 63 5.762 -7.004 -86.964 1.00 0.00 H new ATOM 0 HB2 ARG A 63 5.853 -5.099 -84.600 1.00 0.00 H new ATOM 0 HB3 ARG A 63 5.273 -6.751 -84.519 1.00 0.00 H new ATOM 0 HG2 ARG A 63 8.094 -5.989 -85.346 1.00 0.00 H new ATOM 0 HG3 ARG A 63 7.632 -6.408 -83.708 1.00 0.00 H new ATOM 0 HD2 ARG A 63 6.807 -8.596 -84.531 1.00 0.00 H new ATOM 0 HD3 ARG A 63 7.356 -8.174 -86.141 1.00 0.00 H new ATOM 0 HE ARG A 63 9.013 -8.944 -83.844 1.00 0.00 H new ATOM 0 HH11 ARG A 63 8.927 -7.478 -87.050 1.00 0.00 H new ATOM 0 HH12 ARG A 63 10.642 -7.770 -87.363 1.00 0.00 H new ATOM 0 HH21 ARG A 63 11.213 -9.313 -84.257 1.00 0.00 H new ATOM 0 HH22 ARG A 63 11.932 -8.804 -85.789 1.00 0.00 H new ATOM 440 N ILE A 64 3.279 -6.701 -86.766 1.00 0.00 N ATOM 441 CA ILE A 64 1.836 -6.507 -86.833 1.00 0.00 C ATOM 442 C ILE A 64 1.094 -7.634 -86.126 1.00 0.00 C ATOM 443 O ILE A 64 1.446 -8.805 -86.266 1.00 0.00 O ATOM 444 CB ILE A 64 1.361 -6.417 -88.295 1.00 0.00 C ATOM 445 CG1 ILE A 64 -0.115 -6.016 -88.354 1.00 0.00 C ATOM 446 CG2 ILE A 64 1.584 -7.742 -89.008 1.00 0.00 C ATOM 447 CD1 ILE A 64 -0.561 -5.526 -89.713 1.00 0.00 C ATOM 0 H ILE A 64 3.576 -7.675 -86.831 1.00 0.00 H new ATOM 0 HA ILE A 64 1.612 -5.568 -86.327 1.00 0.00 H new ATOM 0 HB ILE A 64 1.946 -5.650 -88.803 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -0.726 -6.872 -88.068 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -0.299 -5.234 -87.618 1.00 0.00 H new ATOM 0 HG21 ILE A 64 1.243 -7.662 -90.040 1.00 0.00 H new ATOM 0 HG22 ILE A 64 2.646 -7.988 -88.995 1.00 0.00 H new ATOM 0 HG23 ILE A 64 1.023 -8.527 -88.501 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -1.618 -5.261 -89.675 1.00 0.00 H new ATOM 0 HD12 ILE A 64 0.023 -4.650 -89.994 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -0.411 -6.314 -90.451 1.00 0.00 H new ATOM 459 N SER A 65 0.067 -7.273 -85.365 1.00 0.00 N ATOM 460 CA SER A 65 -0.641 -8.233 -84.528 1.00 0.00 C ATOM 461 C SER A 65 -2.138 -7.950 -84.507 1.00 0.00 C ATOM 462 O SER A 65 -2.563 -6.800 -84.620 1.00 0.00 O ATOM 463 CB SER A 65 -0.092 -8.199 -83.115 1.00 0.00 C ATOM 464 OG SER A 65 -0.778 -9.097 -82.287 1.00 0.00 O ATOM 0 H SER A 65 -0.294 -6.321 -85.311 1.00 0.00 H new ATOM 0 HA SER A 65 -0.487 -9.225 -84.953 1.00 0.00 H new ATOM 0 HB2 SER A 65 0.969 -8.448 -83.127 1.00 0.00 H new ATOM 0 HB3 SER A 65 -0.177 -7.190 -82.712 1.00 0.00 H new ATOM 0 HG SER A 65 -0.405 -9.058 -81.382 1.00 0.00 H new ATOM 470 N GLN A 66 -2.933 -9.004 -84.363 1.00 0.00 N ATOM 471 CA GLN A 66 -4.379 -8.862 -84.241 1.00 0.00 C ATOM 472 C GLN A 66 -4.855 -9.250 -82.847 1.00 0.00 C ATOM 473 O GLN A 66 -4.470 -10.292 -82.317 1.00 0.00 O ATOM 474 CB GLN A 66 -5.092 -9.716 -85.293 1.00 0.00 C ATOM 475 CG GLN A 66 -6.606 -9.592 -85.275 1.00 0.00 C ATOM 476 CD GLN A 66 -7.267 -10.398 -86.377 1.00 0.00 C ATOM 477 OE1 GLN A 66 -6.623 -10.775 -87.361 1.00 0.00 O ATOM 478 NE2 GLN A 66 -8.557 -10.668 -86.218 1.00 0.00 N ATOM 0 H GLN A 66 -2.600 -9.967 -84.328 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.625 -7.813 -84.407 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -4.727 -9.434 -86.281 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -4.823 -10.761 -85.140 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -6.983 -9.926 -84.308 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -6.883 -8.543 -85.380 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -9.049 -10.336 -85.388 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -9.056 -11.207 -86.925 1.00 0.00 H new ATOM 487 N GLU A 67 -5.695 -8.406 -82.258 1.00 0.00 N ATOM 488 CA GLU A 67 -6.194 -8.637 -80.908 1.00 0.00 C ATOM 489 C GLU A 67 -7.663 -8.255 -80.790 1.00 0.00 C ATOM 490 O GLU A 67 -8.098 -7.244 -81.341 1.00 0.00 O ATOM 491 CB GLU A 67 -5.368 -7.845 -79.891 1.00 0.00 C ATOM 492 CG GLU A 67 -5.737 -8.110 -78.439 1.00 0.00 C ATOM 493 CD GLU A 67 -4.831 -7.407 -77.467 1.00 0.00 C ATOM 494 OE1 GLU A 67 -3.980 -6.670 -77.904 1.00 0.00 O ATOM 495 OE2 GLU A 67 -4.991 -7.605 -76.286 1.00 0.00 O ATOM 0 H GLU A 67 -6.045 -7.554 -82.696 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.099 -9.702 -80.696 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.314 -8.082 -80.034 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -5.486 -6.781 -80.095 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.765 -7.790 -78.266 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.701 -9.183 -78.250 1.00 0.00 H new ATOM 502 N LYS A 68 -8.426 -9.071 -80.068 1.00 0.00 N ATOM 503 CA LYS A 68 -9.848 -8.817 -79.874 1.00 0.00 C ATOM 504 C LYS A 68 -10.096 -8.021 -78.599 1.00 0.00 C ATOM 505 O LYS A 68 -9.668 -8.418 -77.515 1.00 0.00 O ATOM 506 CB LYS A 68 -10.626 -10.134 -79.832 1.00 0.00 C ATOM 507 CG LYS A 68 -12.136 -9.970 -79.728 1.00 0.00 C ATOM 508 CD LYS A 68 -12.841 -11.317 -79.753 1.00 0.00 C ATOM 509 CE LYS A 68 -14.350 -11.156 -79.634 1.00 0.00 C ATOM 510 NZ LYS A 68 -15.052 -12.467 -79.642 1.00 0.00 N ATOM 0 H LYS A 68 -8.082 -9.914 -79.608 1.00 0.00 H new ATOM 0 HA LYS A 68 -10.200 -8.225 -80.719 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -10.396 -10.706 -80.731 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -10.277 -10.721 -78.982 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -12.384 -9.444 -78.806 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -12.495 -9.354 -80.553 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -12.601 -11.838 -80.680 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -12.474 -11.937 -78.935 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -14.586 -10.624 -78.713 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -14.716 -10.544 -80.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -16.077 -12.312 -79.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -14.848 -12.965 -80.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -14.723 -13.042 -78.840 1.00 0.00 H new ATOM 524 N GLN A 69 -10.792 -6.897 -78.735 1.00 0.00 N ATOM 525 CA GLN A 69 -11.055 -6.018 -77.603 1.00 0.00 C ATOM 526 C GLN A 69 -12.454 -5.420 -77.683 1.00 0.00 C ATOM 527 O GLN A 69 -12.811 -4.782 -78.673 1.00 0.00 O ATOM 528 CB GLN A 69 -10.012 -4.899 -77.540 1.00 0.00 C ATOM 529 CG GLN A 69 -10.204 -3.933 -76.383 1.00 0.00 C ATOM 530 CD GLN A 69 -9.902 -4.572 -75.040 1.00 0.00 C ATOM 531 OE1 GLN A 69 -8.806 -5.095 -74.818 1.00 0.00 O ATOM 532 NE2 GLN A 69 -10.873 -4.533 -74.136 1.00 0.00 N ATOM 0 H GLN A 69 -11.184 -6.574 -79.619 1.00 0.00 H new ATOM 0 HA GLN A 69 -10.990 -6.617 -76.695 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -9.021 -5.346 -77.465 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -10.040 -4.339 -78.475 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -9.557 -3.068 -76.524 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -11.231 -3.567 -76.385 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -11.763 -4.090 -74.363 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -10.729 -4.946 -73.214 1.00 0.00 H new ATOM 541 N ASP A 70 -13.243 -5.633 -76.635 1.00 0.00 N ATOM 542 CA ASP A 70 -14.598 -5.098 -76.576 1.00 0.00 C ATOM 543 C ASP A 70 -15.457 -5.646 -77.708 1.00 0.00 C ATOM 544 O ASP A 70 -16.395 -4.991 -78.163 1.00 0.00 O ATOM 545 CB ASP A 70 -14.574 -3.568 -76.640 1.00 0.00 C ATOM 546 CG ASP A 70 -13.803 -2.939 -75.488 1.00 0.00 C ATOM 547 OD1 ASP A 70 -13.635 -3.591 -74.484 1.00 0.00 O ATOM 548 OD2 ASP A 70 -13.389 -1.812 -75.622 1.00 0.00 O ATOM 0 H ASP A 70 -12.967 -6.173 -75.815 1.00 0.00 H new ATOM 0 HA ASP A 70 -15.036 -5.411 -75.628 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.126 -3.256 -77.584 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -15.597 -3.193 -76.633 1.00 0.00 H new ATOM 553 N GLY A 71 -15.132 -6.852 -78.159 1.00 0.00 N ATOM 554 CA GLY A 71 -15.935 -7.537 -79.164 1.00 0.00 C ATOM 555 C GLY A 71 -15.383 -7.303 -80.564 1.00 0.00 C ATOM 556 O GLY A 71 -15.730 -8.016 -81.506 1.00 0.00 O ATOM 0 H GLY A 71 -14.316 -7.376 -77.844 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -15.954 -8.606 -78.952 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -16.965 -7.184 -79.113 1.00 0.00 H new ATOM 560 N MET A 72 -14.520 -6.302 -80.695 1.00 0.00 N ATOM 561 CA MET A 72 -14.012 -5.892 -81.999 1.00 0.00 C ATOM 562 C MET A 72 -12.600 -6.413 -82.228 1.00 0.00 C ATOM 563 O MET A 72 -11.842 -6.620 -81.279 1.00 0.00 O ATOM 564 CB MET A 72 -14.046 -4.370 -82.125 1.00 0.00 C ATOM 565 CG MET A 72 -15.416 -3.749 -81.886 1.00 0.00 C ATOM 566 SD MET A 72 -16.630 -4.245 -83.124 1.00 0.00 S ATOM 567 CE MET A 72 -16.086 -3.285 -84.534 1.00 0.00 C ATOM 0 H MET A 72 -14.157 -5.758 -79.912 1.00 0.00 H new ATOM 0 HA MET A 72 -14.657 -6.324 -82.765 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.338 -3.943 -81.415 1.00 0.00 H new ATOM 0 HB3 MET A 72 -13.704 -4.092 -83.122 1.00 0.00 H new ATOM 0 HG2 MET A 72 -15.773 -4.036 -80.897 1.00 0.00 H new ATOM 0 HG3 MET A 72 -15.324 -2.663 -81.888 1.00 0.00 H new ATOM 0 HE1 MET A 72 -16.740 -3.483 -85.383 1.00 0.00 H new ATOM 0 HE2 MET A 72 -16.123 -2.224 -84.288 1.00 0.00 H new ATOM 0 HE3 MET A 72 -15.064 -3.562 -84.790 1.00 0.00 H new ATOM 577 N ASP A 73 -12.249 -6.623 -83.492 1.00 0.00 N ATOM 578 CA ASP A 73 -10.913 -7.085 -83.851 1.00 0.00 C ATOM 579 C ASP A 73 -10.045 -5.931 -84.338 1.00 0.00 C ATOM 580 O ASP A 73 -10.362 -5.280 -85.333 1.00 0.00 O ATOM 581 CB ASP A 73 -10.991 -8.165 -84.933 1.00 0.00 C ATOM 582 CG ASP A 73 -11.572 -9.476 -84.420 1.00 0.00 C ATOM 583 OD1 ASP A 73 -11.539 -9.693 -83.232 1.00 0.00 O ATOM 584 OD2 ASP A 73 -12.044 -10.247 -85.222 1.00 0.00 O ATOM 0 H ASP A 73 -12.872 -6.480 -84.287 1.00 0.00 H new ATOM 0 HA ASP A 73 -10.457 -7.508 -82.956 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -11.602 -7.801 -85.759 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -9.993 -8.347 -85.331 1.00 0.00 H new ATOM 589 N VAL A 74 -8.947 -5.684 -83.630 1.00 0.00 N ATOM 590 CA VAL A 74 -8.097 -4.534 -83.913 1.00 0.00 C ATOM 591 C VAL A 74 -6.714 -4.972 -84.377 1.00 0.00 C ATOM 592 O VAL A 74 -6.066 -5.799 -83.735 1.00 0.00 O ATOM 593 CB VAL A 74 -7.959 -3.651 -82.658 1.00 0.00 C ATOM 594 CG1 VAL A 74 -7.020 -2.485 -82.929 1.00 0.00 C ATOM 595 CG2 VAL A 74 -9.328 -3.153 -82.221 1.00 0.00 C ATOM 0 H VAL A 74 -8.626 -6.265 -82.856 1.00 0.00 H new ATOM 0 HA VAL A 74 -8.568 -3.962 -84.713 1.00 0.00 H new ATOM 0 HB VAL A 74 -7.533 -4.247 -81.851 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -6.934 -1.871 -82.032 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -6.037 -2.866 -83.204 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -7.416 -1.881 -83.745 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -9.222 -2.530 -81.333 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -9.776 -2.568 -83.024 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -9.969 -4.004 -81.992 1.00 0.00 H new ATOM 605 N LEU A 75 -6.267 -4.413 -85.496 1.00 0.00 N ATOM 606 CA LEU A 75 -4.912 -4.645 -85.980 1.00 0.00 C ATOM 607 C LEU A 75 -3.960 -3.559 -85.496 1.00 0.00 C ATOM 608 O LEU A 75 -4.316 -2.381 -85.458 1.00 0.00 O ATOM 609 CB LEU A 75 -4.898 -4.700 -87.513 1.00 0.00 C ATOM 610 CG LEU A 75 -5.795 -5.770 -88.149 1.00 0.00 C ATOM 611 CD1 LEU A 75 -5.761 -5.626 -89.664 1.00 0.00 C ATOM 612 CD2 LEU A 75 -5.322 -7.150 -87.720 1.00 0.00 C ATOM 0 H LEU A 75 -6.825 -3.795 -86.086 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.574 -5.601 -85.580 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -5.200 -3.725 -87.896 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.873 -4.869 -87.843 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.824 -5.640 -87.814 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -6.398 -6.386 -90.116 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -6.122 -4.636 -89.944 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -4.738 -5.752 -90.019 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -5.959 -7.910 -88.172 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -4.293 -7.299 -88.046 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -5.374 -7.231 -86.634 1.00 0.00 H new ATOM 624 N GLU A 76 -2.749 -3.962 -85.126 1.00 0.00 N ATOM 625 CA GLU A 76 -1.733 -3.019 -84.674 1.00 0.00 C ATOM 626 C GLU A 76 -0.436 -3.190 -85.454 1.00 0.00 C ATOM 627 O GLU A 76 0.189 -4.250 -85.414 1.00 0.00 O ATOM 628 CB GLU A 76 -1.467 -3.200 -83.178 1.00 0.00 C ATOM 629 CG GLU A 76 -0.391 -2.281 -82.616 1.00 0.00 C ATOM 630 CD GLU A 76 -0.124 -2.517 -81.155 1.00 0.00 C ATOM 631 OE1 GLU A 76 -0.988 -3.039 -80.490 1.00 0.00 O ATOM 632 OE2 GLU A 76 0.944 -2.177 -80.704 1.00 0.00 O ATOM 0 H GLU A 76 -2.447 -4.936 -85.130 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.110 -2.012 -84.853 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.395 -3.029 -82.633 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.176 -4.234 -82.995 1.00 0.00 H new ATOM 0 HG2 GLU A 76 0.532 -2.426 -83.177 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.693 -1.244 -82.762 1.00 0.00 H new ATOM 639 N LEU A 77 -0.036 -2.141 -86.164 1.00 0.00 N ATOM 640 CA LEU A 77 1.175 -2.182 -86.975 1.00 0.00 C ATOM 641 C LEU A 77 2.228 -1.217 -86.441 1.00 0.00 C ATOM 642 O LEU A 77 1.968 -0.025 -86.285 1.00 0.00 O ATOM 643 CB LEU A 77 0.849 -1.836 -88.433 1.00 0.00 C ATOM 644 CG LEU A 77 2.054 -1.730 -89.377 1.00 0.00 C ATOM 645 CD1 LEU A 77 2.689 -3.102 -89.546 1.00 0.00 C ATOM 646 CD2 LEU A 77 1.601 -1.168 -90.717 1.00 0.00 C ATOM 0 H LEU A 77 -0.533 -1.251 -86.194 1.00 0.00 H new ATOM 0 HA LEU A 77 1.577 -3.194 -86.924 1.00 0.00 H new ATOM 0 HB2 LEU A 77 0.170 -2.594 -88.824 1.00 0.00 H new ATOM 0 HB3 LEU A 77 0.312 -0.887 -88.451 1.00 0.00 H new ATOM 0 HG LEU A 77 2.800 -1.056 -88.955 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.545 -3.027 -90.217 1.00 0.00 H new ATOM 0 HD12 LEU A 77 3.020 -3.472 -88.575 1.00 0.00 H new ATOM 0 HD13 LEU A 77 1.958 -3.792 -89.967 1.00 0.00 H new ATOM 0 HD21 LEU A 77 2.457 -1.093 -91.388 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.854 -1.830 -91.155 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.168 -0.179 -90.569 1.00 0.00 H new ATOM 658 N ASN A 78 3.416 -1.742 -86.163 1.00 0.00 N ATOM 659 CA ASN A 78 4.488 -0.944 -85.579 1.00 0.00 C ATOM 660 C ASN A 78 5.758 -1.030 -86.415 1.00 0.00 C ATOM 661 O ASN A 78 6.076 -2.082 -86.971 1.00 0.00 O ATOM 662 CB ASN A 78 4.758 -1.378 -84.150 1.00 0.00 C ATOM 663 CG ASN A 78 3.592 -1.121 -83.237 1.00 0.00 C ATOM 664 OD1 ASN A 78 3.027 -0.021 -83.225 1.00 0.00 O ATOM 665 ND2 ASN A 78 3.220 -2.115 -82.471 1.00 0.00 N ATOM 0 H ASN A 78 3.661 -2.717 -86.333 1.00 0.00 H new ATOM 0 HA ASN A 78 4.164 0.097 -85.570 1.00 0.00 H new ATOM 0 HB2 ASN A 78 4.998 -2.441 -84.136 1.00 0.00 H new ATOM 0 HB3 ASN A 78 5.633 -0.849 -83.773 1.00 0.00 H new ATOM 0 HD21 ASN A 78 2.434 -1.999 -81.831 1.00 0.00 H new ATOM 0 HD22 ASN A 78 3.716 -3.005 -82.514 1.00 0.00 H new ATOM 672 N ILE A 79 6.480 0.081 -86.500 1.00 0.00 N ATOM 673 CA ILE A 79 7.775 0.103 -87.171 1.00 0.00 C ATOM 674 C ILE A 79 8.758 1.008 -86.439 1.00 0.00 C ATOM 675 O ILE A 79 8.409 2.112 -86.021 1.00 0.00 O ATOM 676 CB ILE A 79 7.630 0.576 -88.629 1.00 0.00 C ATOM 677 CG1 ILE A 79 8.973 0.482 -89.357 1.00 0.00 C ATOM 678 CG2 ILE A 79 7.093 1.998 -88.677 1.00 0.00 C ATOM 679 CD1 ILE A 79 8.868 0.651 -90.856 1.00 0.00 C ATOM 0 H ILE A 79 6.191 0.979 -86.113 1.00 0.00 H new ATOM 0 HA ILE A 79 8.162 -0.916 -87.164 1.00 0.00 H new ATOM 0 HB ILE A 79 6.918 -0.076 -89.135 1.00 0.00 H new ATOM 0 HG12 ILE A 79 9.644 1.244 -88.961 1.00 0.00 H new ATOM 0 HG13 ILE A 79 9.426 -0.486 -89.141 1.00 0.00 H new ATOM 0 HG21 ILE A 79 6.997 2.316 -89.715 1.00 0.00 H new ATOM 0 HG22 ILE A 79 6.116 2.035 -88.194 1.00 0.00 H new ATOM 0 HG23 ILE A 79 7.780 2.664 -88.156 1.00 0.00 H new ATOM 0 HD11 ILE A 79 9.860 0.572 -91.301 1.00 0.00 H new ATOM 0 HD12 ILE A 79 8.223 -0.127 -91.266 1.00 0.00 H new ATOM 0 HD13 ILE A 79 8.445 1.630 -91.083 1.00 0.00 H new ATOM 691 N THR A 80 9.991 0.533 -86.288 1.00 0.00 N ATOM 692 CA THR A 80 11.037 1.311 -85.634 1.00 0.00 C ATOM 693 C THR A 80 11.915 2.023 -86.656 1.00 0.00 C ATOM 694 O THR A 80 12.592 1.382 -87.459 1.00 0.00 O ATOM 695 CB THR A 80 11.910 0.418 -84.733 1.00 0.00 C ATOM 696 OG1 THR A 80 11.097 -0.177 -83.713 1.00 0.00 O ATOM 697 CG2 THR A 80 13.015 1.236 -84.083 1.00 0.00 C ATOM 0 H THR A 80 10.290 -0.388 -86.610 1.00 0.00 H new ATOM 0 HA THR A 80 10.543 2.060 -85.015 1.00 0.00 H new ATOM 0 HB THR A 80 12.362 -0.361 -85.347 1.00 0.00 H new ATOM 0 HG1 THR A 80 11.654 -0.746 -83.142 1.00 0.00 H new ATOM 0 HG21 THR A 80 13.622 0.589 -83.450 1.00 0.00 H new ATOM 0 HG22 THR A 80 13.642 1.679 -84.856 1.00 0.00 H new ATOM 0 HG23 THR A 80 12.574 2.027 -83.476 1.00 0.00 H new ATOM 705 N LEU A 81 11.900 3.350 -86.619 1.00 0.00 N ATOM 706 CA LEU A 81 12.668 4.152 -87.564 1.00 0.00 C ATOM 707 C LEU A 81 13.720 4.988 -86.849 1.00 0.00 C ATOM 708 O LEU A 81 13.559 5.341 -85.681 1.00 0.00 O ATOM 709 CB LEU A 81 11.732 5.070 -88.363 1.00 0.00 C ATOM 710 CG LEU A 81 10.629 4.363 -89.160 1.00 0.00 C ATOM 711 CD1 LEU A 81 9.702 5.402 -89.775 1.00 0.00 C ATOM 712 CD2 LEU A 81 11.258 3.488 -90.234 1.00 0.00 C ATOM 0 H LEU A 81 11.363 3.894 -85.944 1.00 0.00 H new ATOM 0 HA LEU A 81 13.176 3.470 -88.246 1.00 0.00 H new ATOM 0 HB2 LEU A 81 11.263 5.771 -87.672 1.00 0.00 H new ATOM 0 HB3 LEU A 81 12.334 5.659 -89.055 1.00 0.00 H new ATOM 0 HG LEU A 81 10.042 3.726 -88.498 1.00 0.00 H new ATOM 0 HD11 LEU A 81 8.918 4.900 -90.342 1.00 0.00 H new ATOM 0 HD12 LEU A 81 9.251 6.001 -88.984 1.00 0.00 H new ATOM 0 HD13 LEU A 81 10.272 6.050 -90.441 1.00 0.00 H new ATOM 0 HD21 LEU A 81 10.473 2.986 -90.800 1.00 0.00 H new ATOM 0 HD22 LEU A 81 11.851 4.107 -90.907 1.00 0.00 H new ATOM 0 HD23 LEU A 81 11.901 2.743 -89.766 1.00 0.00 H new TER 724 LEU A 81 ATOM 725 N ASP B 38 9.274 11.163 -99.330 1.00 0.00 N ATOM 726 CA ASP B 38 10.310 10.990 -98.318 1.00 0.00 C ATOM 727 C ASP B 38 9.897 11.621 -96.994 1.00 0.00 C ATOM 728 O ASP B 38 10.721 11.800 -96.097 1.00 0.00 O ATOM 729 CB ASP B 38 11.631 11.603 -98.791 1.00 0.00 C ATOM 730 CG ASP B 38 12.236 10.862 -99.976 1.00 0.00 C ATOM 731 OD1 ASP B 38 11.999 9.684-100.099 1.00 0.00 O ATOM 732 OD2 ASP B 38 12.929 11.482-100.747 1.00 0.00 O ATOM 0 HA ASP B 38 10.446 9.919 -98.164 1.00 0.00 H new ATOM 0 HB2 ASP B 38 11.465 12.644 -99.066 1.00 0.00 H new ATOM 0 HB3 ASP B 38 12.343 11.601 -97.966 1.00 0.00 H new ATOM 737 N TYR B 39 8.616 11.956 -96.878 1.00 0.00 N ATOM 738 CA TYR B 39 8.094 12.578 -95.667 1.00 0.00 C ATOM 739 C TYR B 39 7.106 11.659 -94.959 1.00 0.00 C ATOM 740 O TYR B 39 6.131 11.202 -95.556 1.00 0.00 O ATOM 741 CB TYR B 39 7.430 13.916 -95.996 1.00 0.00 C ATOM 742 CG TYR B 39 8.378 14.939 -96.583 1.00 0.00 C ATOM 743 CD1 TYR B 39 8.581 14.989 -97.955 1.00 0.00 C ATOM 744 CD2 TYR B 39 9.044 15.826 -95.751 1.00 0.00 C ATOM 745 CE1 TYR B 39 9.446 15.923 -98.491 1.00 0.00 C ATOM 746 CE2 TYR B 39 9.910 16.759 -96.287 1.00 0.00 C ATOM 747 CZ TYR B 39 10.111 16.810 -97.651 1.00 0.00 C ATOM 748 OH TYR B 39 10.973 17.739 -98.186 1.00 0.00 O ATOM 0 H TYR B 39 7.920 11.807 -97.609 1.00 0.00 H new ATOM 0 HA TYR B 39 8.933 12.757 -94.994 1.00 0.00 H new ATOM 0 HB2 TYR B 39 6.615 13.744 -96.699 1.00 0.00 H new ATOM 0 HB3 TYR B 39 6.986 14.324 -95.088 1.00 0.00 H new ATOM 0 HD1 TYR B 39 8.063 14.298 -98.603 1.00 0.00 H new ATOM 0 HD2 TYR B 39 8.886 15.787 -94.683 1.00 0.00 H new ATOM 0 HE1 TYR B 39 9.605 15.964 -99.558 1.00 0.00 H new ATOM 0 HE2 TYR B 39 10.430 17.449 -95.638 1.00 0.00 H new ATOM 0 HH TYR B 39 11.355 18.283 -97.466 1.00 0.00 H new ATOM 758 N LEU B 40 7.364 11.391 -93.684 1.00 0.00 N ATOM 759 CA LEU B 40 6.607 10.390 -92.942 1.00 0.00 C ATOM 760 C LEU B 40 5.144 10.795 -92.808 1.00 0.00 C ATOM 761 O LEU B 40 4.246 9.966 -92.952 1.00 0.00 O ATOM 762 CB LEU B 40 7.218 10.187 -91.550 1.00 0.00 C ATOM 763 CG LEU B 40 8.576 9.475 -91.517 1.00 0.00 C ATOM 764 CD1 LEU B 40 9.121 9.484 -90.095 1.00 0.00 C ATOM 765 CD2 LEU B 40 8.417 8.052 -92.032 1.00 0.00 C ATOM 0 H LEU B 40 8.093 11.854 -93.142 1.00 0.00 H new ATOM 0 HA LEU B 40 6.655 9.454 -93.498 1.00 0.00 H new ATOM 0 HB2 LEU B 40 7.328 11.162 -91.076 1.00 0.00 H new ATOM 0 HB3 LEU B 40 6.514 9.616 -90.944 1.00 0.00 H new ATOM 0 HG LEU B 40 9.285 9.996 -92.160 1.00 0.00 H new ATOM 0 HD11 LEU B 40 10.086 8.978 -90.072 1.00 0.00 H new ATOM 0 HD12 LEU B 40 9.243 10.514 -89.759 1.00 0.00 H new ATOM 0 HD13 LEU B 40 8.424 8.967 -89.435 1.00 0.00 H new ATOM 0 HD21 LEU B 40 9.382 7.546 -92.008 1.00 0.00 H new ATOM 0 HD22 LEU B 40 7.710 7.514 -91.401 1.00 0.00 H new ATOM 0 HD23 LEU B 40 8.045 8.075 -93.056 1.00 0.00 H new ATOM 777 N PRO B 41 4.912 12.072 -92.530 1.00 0.00 N ATOM 778 CA PRO B 41 3.557 12.589 -92.378 1.00 0.00 C ATOM 779 C PRO B 41 2.679 12.188 -93.555 1.00 0.00 C ATOM 780 O PRO B 41 1.550 11.732 -93.373 1.00 0.00 O ATOM 781 CB PRO B 41 3.771 14.106 -92.324 1.00 0.00 C ATOM 782 CG PRO B 41 5.101 14.264 -91.670 1.00 0.00 C ATOM 783 CD PRO B 41 5.942 13.161 -92.257 1.00 0.00 C ATOM 0 HA PRO B 41 3.043 12.201 -91.498 1.00 0.00 H new ATOM 0 HB2 PRO B 41 3.763 14.545 -93.322 1.00 0.00 H new ATOM 0 HB3 PRO B 41 2.985 14.599 -91.752 1.00 0.00 H new ATOM 0 HG2 PRO B 41 5.531 15.244 -91.876 1.00 0.00 H new ATOM 0 HG3 PRO B 41 5.024 14.171 -90.587 1.00 0.00 H new ATOM 0 HD2 PRO B 41 6.449 13.478 -93.168 1.00 0.00 H new ATOM 0 HD3 PRO B 41 6.713 12.826 -91.564 1.00 0.00 H new ATOM 791 N THR B 42 3.203 12.360 -94.764 1.00 0.00 N ATOM 792 CA THR B 42 2.482 11.980 -95.973 1.00 0.00 C ATOM 793 C THR B 42 2.392 10.465 -96.107 1.00 0.00 C ATOM 794 O THR B 42 1.348 9.925 -96.473 1.00 0.00 O ATOM 795 CB THR B 42 3.152 12.571 -97.227 1.00 0.00 C ATOM 796 OG1 THR B 42 3.168 14.001 -97.134 1.00 0.00 O ATOM 797 CG2 THR B 42 2.398 12.155 -98.481 1.00 0.00 C ATOM 0 H THR B 42 4.126 12.761 -94.933 1.00 0.00 H new ATOM 0 HA THR B 42 1.474 12.385 -95.888 1.00 0.00 H new ATOM 0 HB THR B 42 4.173 12.193 -97.288 1.00 0.00 H new ATOM 0 HG1 THR B 42 3.596 14.376 -97.932 1.00 0.00 H new ATOM 0 HG21 THR B 42 2.886 12.582 -99.357 1.00 0.00 H new ATOM 0 HG22 THR B 42 2.396 11.068 -98.560 1.00 0.00 H new ATOM 0 HG23 THR B 42 1.371 12.517 -98.425 1.00 0.00 H new ATOM 805 N LEU B 43 3.493 9.783 -95.808 1.00 0.00 N ATOM 806 CA LEU B 43 3.538 8.328 -95.890 1.00 0.00 C ATOM 807 C LEU B 43 2.542 7.691 -94.930 1.00 0.00 C ATOM 808 O LEU B 43 1.985 6.630 -95.212 1.00 0.00 O ATOM 809 CB LEU B 43 4.952 7.823 -95.577 1.00 0.00 C ATOM 810 CG LEU B 43 6.026 8.170 -96.616 1.00 0.00 C ATOM 811 CD1 LEU B 43 7.394 7.751 -96.092 1.00 0.00 C ATOM 812 CD2 LEU B 43 5.707 7.471 -97.930 1.00 0.00 C ATOM 0 H LEU B 43 4.366 10.215 -95.507 1.00 0.00 H new ATOM 0 HA LEU B 43 3.267 8.042 -96.906 1.00 0.00 H new ATOM 0 HB2 LEU B 43 5.259 8.231 -94.614 1.00 0.00 H new ATOM 0 HB3 LEU B 43 4.915 6.739 -95.467 1.00 0.00 H new ATOM 0 HG LEU B 43 6.039 9.245 -96.793 1.00 0.00 H new ATOM 0 HD11 LEU B 43 8.157 7.997 -96.830 1.00 0.00 H new ATOM 0 HD12 LEU B 43 7.605 8.279 -95.162 1.00 0.00 H new ATOM 0 HD13 LEU B 43 7.400 6.677 -95.909 1.00 0.00 H new ATOM 0 HD21 LEU B 43 6.470 7.718 -98.668 1.00 0.00 H new ATOM 0 HD22 LEU B 43 5.689 6.392 -97.773 1.00 0.00 H new ATOM 0 HD23 LEU B 43 4.733 7.802 -98.291 1.00 0.00 H new ATOM 824 N ARG B 44 2.320 8.345 -93.794 1.00 0.00 N ATOM 825 CA ARG B 44 1.353 7.870 -92.813 1.00 0.00 C ATOM 826 C ARG B 44 -0.065 7.922 -93.367 1.00 0.00 C ATOM 827 O ARG B 44 -0.836 6.975 -93.217 1.00 0.00 O ATOM 828 CB ARG B 44 1.429 8.701 -91.541 1.00 0.00 C ATOM 829 CG ARG B 44 2.647 8.430 -90.672 1.00 0.00 C ATOM 830 CD ARG B 44 2.879 9.526 -89.696 1.00 0.00 C ATOM 831 NE ARG B 44 1.784 9.649 -88.748 1.00 0.00 N ATOM 832 CZ ARG B 44 1.618 10.685 -87.902 1.00 0.00 C ATOM 833 NH1 ARG B 44 2.481 11.675 -87.898 1.00 0.00 N ATOM 834 NH2 ARG B 44 0.586 10.704 -87.076 1.00 0.00 N ATOM 0 H ARG B 44 2.798 9.207 -93.531 1.00 0.00 H new ATOM 0 HA ARG B 44 1.601 6.834 -92.583 1.00 0.00 H new ATOM 0 HB2 ARG B 44 1.422 9.757 -91.813 1.00 0.00 H new ATOM 0 HB3 ARG B 44 0.531 8.518 -90.950 1.00 0.00 H new ATOM 0 HG2 ARG B 44 2.511 7.490 -90.138 1.00 0.00 H new ATOM 0 HG3 ARG B 44 3.527 8.313 -91.305 1.00 0.00 H new ATOM 0 HD2 ARG B 44 3.807 9.341 -89.156 1.00 0.00 H new ATOM 0 HD3 ARG B 44 3.004 10.468 -90.231 1.00 0.00 H new ATOM 0 HE ARG B 44 1.093 8.899 -88.721 1.00 0.00 H new ATOM 0 HH11 ARG B 44 3.277 11.660 -88.535 1.00 0.00 H new ATOM 0 HH12 ARG B 44 2.355 12.459 -87.258 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -0.084 9.935 -87.079 1.00 0.00 H new ATOM 0 HH22 ARG B 44 0.460 11.488 -86.435 1.00 0.00 H new ATOM 848 N LYS B 45 -0.403 9.036 -94.008 1.00 0.00 N ATOM 849 CA LYS B 45 -1.685 9.168 -94.689 1.00 0.00 C ATOM 850 C LYS B 45 -1.836 8.123 -95.786 1.00 0.00 C ATOM 851 O LYS B 45 -2.876 7.473 -95.900 1.00 0.00 O ATOM 852 CB LYS B 45 -1.837 10.572 -95.277 1.00 0.00 C ATOM 853 CG LYS B 45 -3.160 10.817 -95.990 1.00 0.00 C ATOM 854 CD LYS B 45 -3.281 12.261 -96.451 1.00 0.00 C ATOM 855 CE LYS B 45 -4.633 12.525 -97.098 1.00 0.00 C ATOM 856 NZ LYS B 45 -4.734 11.906 -98.448 1.00 0.00 N ATOM 0 H LYS B 45 0.194 9.861 -94.070 1.00 0.00 H new ATOM 0 HA LYS B 45 -2.472 9.005 -93.952 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -1.730 11.302 -94.475 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -1.022 10.749 -95.979 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -3.241 10.151 -96.849 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -3.986 10.576 -95.321 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -3.146 12.929 -95.600 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -2.486 12.486 -97.162 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -5.424 12.133 -96.459 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -4.793 13.600 -97.179 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -5.620 12.207 -98.902 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -3.927 12.208 -99.030 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -4.726 10.870 -98.356 1.00 0.00 H new ATOM 870 N GLU B 46 -0.793 7.964 -96.593 1.00 0.00 N ATOM 871 CA GLU B 46 -0.802 6.985 -97.674 1.00 0.00 C ATOM 872 C GLU B 46 -1.018 5.575 -97.139 1.00 0.00 C ATOM 873 O GLU B 46 -1.759 4.785 -97.725 1.00 0.00 O ATOM 874 CB GLU B 46 0.496 7.058 -98.465 1.00 0.00 C ATOM 0 H GLU B 46 0.071 8.501 -96.519 1.00 0.00 H new ATOM 0 HA GLU B 46 -1.633 7.224 -98.337 1.00 0.00 H new ATOM 879 N LEU B 47 -0.367 5.265 -96.023 1.00 0.00 N ATOM 880 CA LEU B 47 -0.480 3.946 -95.412 1.00 0.00 C ATOM 881 C LEU B 47 -1.905 3.677 -94.942 1.00 0.00 C ATOM 882 O LEU B 47 -2.431 2.579 -95.123 1.00 0.00 O ATOM 883 CB LEU B 47 0.486 3.827 -94.227 1.00 0.00 C ATOM 884 CG LEU B 47 0.575 2.440 -93.577 1.00 0.00 C ATOM 885 CD1 LEU B 47 1.098 1.435 -94.594 1.00 0.00 C ATOM 886 CD2 LEU B 47 1.482 2.507 -92.358 1.00 0.00 C ATOM 0 H LEU B 47 0.245 5.910 -95.523 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.221 3.204 -96.167 1.00 0.00 H new ATOM 0 HB2 LEU B 47 1.482 4.115 -94.564 1.00 0.00 H new ATOM 0 HB3 LEU B 47 0.187 4.547 -93.465 1.00 0.00 H new ATOM 0 HG LEU B 47 -0.414 2.117 -93.252 1.00 0.00 H new ATOM 0 HD11 LEU B 47 1.161 0.450 -94.132 1.00 0.00 H new ATOM 0 HD12 LEU B 47 0.420 1.394 -95.446 1.00 0.00 H new ATOM 0 HD13 LEU B 47 2.088 1.741 -94.932 1.00 0.00 H new ATOM 0 HD21 LEU B 47 1.545 1.521 -91.897 1.00 0.00 H new ATOM 0 HD22 LEU B 47 2.478 2.829 -92.663 1.00 0.00 H new ATOM 0 HD23 LEU B 47 1.074 3.218 -91.640 1.00 0.00 H new ATOM 898 N MET B 48 -2.524 4.685 -94.337 1.00 0.00 N ATOM 899 CA MET B 48 -3.918 4.591 -93.924 1.00 0.00 C ATOM 900 C MET B 48 -4.823 4.267 -95.106 1.00 0.00 C ATOM 901 O MET B 48 -5.696 3.403 -95.013 1.00 0.00 O ATOM 902 CB MET B 48 -4.360 5.892 -93.256 1.00 0.00 C ATOM 903 CG MET B 48 -3.705 6.162 -91.909 1.00 0.00 C ATOM 904 SD MET B 48 -4.088 7.802 -91.265 1.00 0.00 S ATOM 905 CE MET B 48 -5.845 7.644 -90.961 1.00 0.00 C ATOM 0 H MET B 48 -2.081 5.578 -94.122 1.00 0.00 H new ATOM 0 HA MET B 48 -4.003 3.777 -93.204 1.00 0.00 H new ATOM 0 HB2 MET B 48 -4.140 6.723 -93.926 1.00 0.00 H new ATOM 0 HB3 MET B 48 -5.441 5.868 -93.122 1.00 0.00 H new ATOM 0 HG2 MET B 48 -4.033 5.409 -91.193 1.00 0.00 H new ATOM 0 HG3 MET B 48 -2.624 6.058 -92.008 1.00 0.00 H new ATOM 0 HE1 MET B 48 -6.395 8.252 -91.679 1.00 0.00 H new ATOM 0 HE2 MET B 48 -6.140 6.600 -91.068 1.00 0.00 H new ATOM 0 HE3 MET B 48 -6.071 7.983 -89.950 1.00 0.00 H new ATOM 915 N GLU B 49 -4.609 4.964 -96.217 1.00 0.00 N ATOM 916 CA GLU B 49 -5.414 4.761 -97.415 1.00 0.00 C ATOM 917 C GLU B 49 -5.282 3.334 -97.933 1.00 0.00 C ATOM 918 O GLU B 49 -6.268 2.712 -98.326 1.00 0.00 O ATOM 919 CB GLU B 49 -5.003 5.751 -98.507 1.00 0.00 C ATOM 920 CG GLU B 49 -5.348 7.201 -98.204 1.00 0.00 C ATOM 921 CD GLU B 49 -4.782 8.161 -99.213 1.00 0.00 C ATOM 922 OE1 GLU B 49 -4.080 7.724-100.092 1.00 0.00 O ATOM 923 OE2 GLU B 49 -5.053 9.334 -99.104 1.00 0.00 O ATOM 0 H GLU B 49 -3.884 5.675 -96.312 1.00 0.00 H new ATOM 0 HA GLU B 49 -6.457 4.934 -97.149 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -3.928 5.672 -98.666 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -5.485 5.463 -99.441 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -6.432 7.312 -98.173 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -4.972 7.459 -97.214 1.00 0.00 H new ATOM 930 N VAL B 50 -4.056 2.821 -97.931 1.00 0.00 N ATOM 931 CA VAL B 50 -3.800 1.448 -98.348 1.00 0.00 C ATOM 932 C VAL B 50 -4.573 0.457 -97.487 1.00 0.00 C ATOM 933 O VAL B 50 -5.132 -0.515 -97.994 1.00 0.00 O ATOM 934 CB VAL B 50 -2.294 1.134 -98.260 1.00 0.00 C ATOM 935 CG1 VAL B 50 -2.049 -0.358 -98.429 1.00 0.00 C ATOM 936 CG2 VAL B 50 -1.538 1.928 -99.314 1.00 0.00 C ATOM 0 H VAL B 50 -3.224 3.336 -97.645 1.00 0.00 H new ATOM 0 HA VAL B 50 -4.135 1.348 -99.381 1.00 0.00 H new ATOM 0 HB VAL B 50 -1.929 1.425 -97.275 1.00 0.00 H new ATOM 0 HG11 VAL B 50 -0.980 -0.561 -98.364 1.00 0.00 H new ATOM 0 HG12 VAL B 50 -2.570 -0.904 -97.643 1.00 0.00 H new ATOM 0 HG13 VAL B 50 -2.421 -0.680 -99.402 1.00 0.00 H new ATOM 0 HG21 VAL B 50 -0.474 1.701 -99.246 1.00 0.00 H new ATOM 0 HG22 VAL B 50 -1.904 1.659-100.305 1.00 0.00 H new ATOM 0 HG23 VAL B 50 -1.693 2.994 -99.147 1.00 0.00 H new ATOM 946 N LEU B 51 -4.599 0.709 -96.183 1.00 0.00 N ATOM 947 CA LEU B 51 -5.301 -0.162 -95.248 1.00 0.00 C ATOM 948 C LEU B 51 -6.809 -0.081 -95.444 1.00 0.00 C ATOM 949 O LEU B 51 -7.504 -1.095 -95.415 1.00 0.00 O ATOM 950 CB LEU B 51 -4.945 0.214 -93.804 1.00 0.00 C ATOM 951 CG LEU B 51 -5.657 -0.594 -92.712 1.00 0.00 C ATOM 952 CD1 LEU B 51 -5.408 -2.080 -92.934 1.00 0.00 C ATOM 953 CD2 LEU B 51 -5.155 -0.154 -91.345 1.00 0.00 C ATOM 0 H LEU B 51 -4.141 1.511 -95.749 1.00 0.00 H new ATOM 0 HA LEU B 51 -4.985 -1.186 -95.444 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -3.869 0.099 -93.673 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -5.173 1.270 -93.656 1.00 0.00 H new ATOM 0 HG LEU B 51 -6.731 -0.415 -92.758 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -5.914 -2.654 -92.158 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -5.794 -2.372 -93.911 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -4.337 -2.280 -92.893 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -5.661 -0.728 -90.569 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.080 -0.325 -91.280 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -5.363 0.907 -91.205 1.00 0.00 H new ATOM 965 N SER B 52 -7.310 1.134 -95.644 1.00 0.00 N ATOM 966 CA SER B 52 -8.737 1.350 -95.852 1.00 0.00 C ATOM 967 C SER B 52 -9.219 0.654 -97.118 1.00 0.00 C ATOM 968 O SER B 52 -10.391 0.295 -97.232 1.00 0.00 O ATOM 969 CB SER B 52 -9.033 2.834 -95.935 1.00 0.00 C ATOM 970 OG SER B 52 -8.522 3.384 -97.119 1.00 0.00 O ATOM 0 H SER B 52 -6.748 1.985 -95.666 1.00 0.00 H new ATOM 0 HA SER B 52 -9.270 0.923 -95.003 1.00 0.00 H new ATOM 0 HB2 SER B 52 -10.110 2.996 -95.890 1.00 0.00 H new ATOM 0 HB3 SER B 52 -8.597 3.344 -95.076 1.00 0.00 H new ATOM 0 HG SER B 52 -7.722 2.888 -97.392 1.00 0.00 H new ATOM 976 N LYS B 53 -8.310 0.469 -98.069 1.00 0.00 N ATOM 977 CA LYS B 53 -8.623 -0.250 -99.299 1.00 0.00 C ATOM 978 C LYS B 53 -8.615 -1.756 -99.074 1.00 0.00 C ATOM 979 O LYS B 53 -9.388 -2.489 -99.690 1.00 0.00 O ATOM 980 CB LYS B 53 -7.633 0.123-100.403 1.00 0.00 C ATOM 981 CG LYS B 53 -7.915 -0.532-101.749 1.00 0.00 C ATOM 982 CD LYS B 53 -6.988 0.003-102.829 1.00 0.00 C ATOM 983 CE LYS B 53 -7.301 -0.615-104.184 1.00 0.00 C ATOM 984 NZ LYS B 53 -6.420 -0.079-105.257 1.00 0.00 N ATOM 0 H LYS B 53 -7.349 0.807 -98.012 1.00 0.00 H new ATOM 0 HA LYS B 53 -9.626 0.042 -99.610 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -7.641 1.205-100.531 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -6.629 -0.153-100.082 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -7.792 -1.612-101.663 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -8.951 -0.351-102.034 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -7.085 1.087-102.890 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -5.953 -0.209-102.561 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -7.184 -1.697-104.125 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -8.343 -0.421-104.439 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -6.666 -0.526-106.163 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -6.550 0.950-105.331 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -5.427 -0.286-105.027 1.00 0.00 H new ATOM 998 N TYR B 54 -7.736 -2.212 -98.188 1.00 0.00 N ATOM 999 CA TYR B 54 -7.607 -3.636 -97.900 1.00 0.00 C ATOM 1000 C TYR B 54 -8.894 -4.197 -97.309 1.00 0.00 C ATOM 1001 O TYR B 54 -9.328 -5.291 -97.669 1.00 0.00 O ATOM 1002 CB TYR B 54 -6.433 -3.885 -96.951 1.00 0.00 C ATOM 1003 CG TYR B 54 -5.082 -3.851 -97.628 1.00 0.00 C ATOM 1004 CD1 TYR B 54 -5.000 -3.836 -99.013 1.00 0.00 C ATOM 1005 CD2 TYR B 54 -3.923 -3.833 -96.865 1.00 0.00 C ATOM 1006 CE1 TYR B 54 -3.765 -3.805 -99.632 1.00 0.00 C ATOM 1007 CE2 TYR B 54 -2.689 -3.800 -97.484 1.00 0.00 C ATOM 1008 CZ TYR B 54 -2.608 -3.787 -98.862 1.00 0.00 C ATOM 1009 OH TYR B 54 -1.378 -3.755 -99.478 1.00 0.00 O ATOM 0 H TYR B 54 -7.102 -1.616 -97.656 1.00 0.00 H new ATOM 0 HA TYR B 54 -7.414 -4.152 -98.840 1.00 0.00 H new ATOM 0 HB2 TYR B 54 -6.452 -3.135 -96.161 1.00 0.00 H new ATOM 0 HB3 TYR B 54 -6.565 -4.855 -96.472 1.00 0.00 H new ATOM 0 HD1 TYR B 54 -5.902 -3.849 -99.607 1.00 0.00 H new ATOM 0 HD2 TYR B 54 -3.986 -3.845 -95.787 1.00 0.00 H new ATOM 0 HE1 TYR B 54 -3.699 -3.795-100.710 1.00 0.00 H new ATOM 0 HE2 TYR B 54 -1.787 -3.784 -96.890 1.00 0.00 H new ATOM 0 HH TYR B 54 -0.672 -3.745 -98.798 1.00 0.00 H new ATOM 1019 N VAL B 55 -9.499 -3.441 -96.399 1.00 0.00 N ATOM 1020 CA VAL B 55 -10.719 -3.878 -95.730 1.00 0.00 C ATOM 1021 C VAL B 55 -11.904 -3.004 -96.120 1.00 0.00 C ATOM 1022 O VAL B 55 -12.997 -3.140 -95.570 1.00 0.00 O ATOM 1023 CB VAL B 55 -10.535 -3.837 -94.202 1.00 0.00 C ATOM 1024 CG1 VAL B 55 -9.467 -4.829 -93.767 1.00 0.00 C ATOM 1025 CG2 VAL B 55 -10.171 -2.426 -93.763 1.00 0.00 C ATOM 0 H VAL B 55 -9.164 -2.523 -96.108 1.00 0.00 H new ATOM 0 HA VAL B 55 -10.921 -4.901 -96.046 1.00 0.00 H new ATOM 0 HB VAL B 55 -11.473 -4.121 -93.725 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -9.350 -4.786 -92.684 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -9.764 -5.836 -94.061 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -8.520 -4.577 -94.244 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -10.042 -2.403 -92.681 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -9.242 -2.123 -94.245 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -10.968 -1.739 -94.048 1.00 0.00 H new ATOM 1035 N ASN B 56 -11.681 -2.104 -97.073 1.00 0.00 N ATOM 1036 CA ASN B 56 -12.772 -1.366 -97.698 1.00 0.00 C ATOM 1037 C ASN B 56 -13.562 -0.571 -96.667 1.00 0.00 C ATOM 1038 O ASN B 56 -14.793 -0.536 -96.706 1.00 0.00 O ATOM 1039 CB ASN B 56 -13.686 -2.307 -98.462 1.00 0.00 C ATOM 1040 CG ASN B 56 -12.990 -2.977 -99.615 1.00 0.00 C ATOM 1041 OD1 ASN B 56 -12.434 -2.310-100.494 1.00 0.00 O ATOM 1042 ND2 ASN B 56 -13.012 -4.285 -99.628 1.00 0.00 N ATOM 0 H ASN B 56 -10.755 -1.869 -97.429 1.00 0.00 H new ATOM 0 HA ASN B 56 -12.336 -0.659 -98.403 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -14.069 -3.068 -97.782 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -14.546 -1.750 -98.835 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -12.558 -4.795-100.385 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -13.483 -4.795 -98.881 1.00 0.00 H new ATOM 1049 N VAL B 57 -12.849 0.066 -95.745 1.00 0.00 N ATOM 1050 CA VAL B 57 -13.472 0.958 -94.775 1.00 0.00 C ATOM 1051 C VAL B 57 -13.098 2.411 -95.043 1.00 0.00 C ATOM 1052 O VAL B 57 -12.540 2.735 -96.090 1.00 0.00 O ATOM 1053 CB VAL B 57 -13.045 0.576 -93.345 1.00 0.00 C ATOM 1054 CG1 VAL B 57 -13.422 -0.867 -93.044 1.00 0.00 C ATOM 1055 CG2 VAL B 57 -11.548 0.789 -93.178 1.00 0.00 C ATOM 0 H VAL B 57 -11.837 -0.019 -95.649 1.00 0.00 H new ATOM 0 HA VAL B 57 -14.552 0.852 -94.874 1.00 0.00 H new ATOM 0 HB VAL B 57 -13.570 1.216 -92.636 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -13.113 -1.120 -92.030 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -14.501 -0.988 -93.135 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -12.922 -1.529 -93.751 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -11.253 0.517 -92.165 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -11.010 0.166 -93.892 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -11.307 1.837 -93.357 1.00 0.00 H new ATOM 1065 N SER B 58 -13.410 3.282 -94.089 1.00 0.00 N ATOM 1066 CA SER B 58 -13.075 4.696 -94.205 1.00 0.00 C ATOM 1067 C SER B 58 -11.899 5.060 -93.309 1.00 0.00 C ATOM 1068 O SER B 58 -11.571 4.331 -92.373 1.00 0.00 O ATOM 1069 CB SER B 58 -14.278 5.548 -93.846 1.00 0.00 C ATOM 1070 OG SER B 58 -13.932 6.904 -93.780 1.00 0.00 O ATOM 0 H SER B 58 -13.895 3.033 -93.227 1.00 0.00 H new ATOM 0 HA SER B 58 -12.789 4.890 -95.239 1.00 0.00 H new ATOM 0 HB2 SER B 58 -15.063 5.405 -94.588 1.00 0.00 H new ATOM 0 HB3 SER B 58 -14.683 5.225 -92.887 1.00 0.00 H new ATOM 0 HG SER B 58 -14.724 7.433 -93.549 1.00 0.00 H new ATOM 1076 N LEU B 59 -11.267 6.191 -93.601 1.00 0.00 N ATOM 1077 CA LEU B 59 -10.126 6.655 -92.820 1.00 0.00 C ATOM 1078 C LEU B 59 -10.549 7.061 -91.414 1.00 0.00 C ATOM 1079 O LEU B 59 -9.713 7.219 -90.525 1.00 0.00 O ATOM 1080 CB LEU B 59 -9.451 7.841 -93.520 1.00 0.00 C ATOM 1081 CG LEU B 59 -8.808 7.533 -94.878 1.00 0.00 C ATOM 1082 CD1 LEU B 59 -8.265 8.820 -95.487 1.00 0.00 C ATOM 1083 CD2 LEU B 59 -7.701 6.506 -94.695 1.00 0.00 C ATOM 0 H LEU B 59 -11.526 6.804 -94.374 1.00 0.00 H new ATOM 0 HA LEU B 59 -9.418 5.830 -92.741 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -10.193 8.627 -93.660 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -8.684 8.241 -92.858 1.00 0.00 H new ATOM 0 HG LEU B 59 -9.553 7.118 -95.557 1.00 0.00 H new ATOM 0 HD11 LEU B 59 -7.808 8.601 -96.452 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -9.081 9.530 -95.624 1.00 0.00 H new ATOM 0 HD13 LEU B 59 -7.517 9.251 -94.821 1.00 0.00 H new ATOM 0 HD21 LEU B 59 -7.244 6.287 -95.660 1.00 0.00 H new ATOM 0 HD22 LEU B 59 -6.945 6.903 -94.017 1.00 0.00 H new ATOM 0 HD23 LEU B 59 -8.119 5.591 -94.276 1.00 0.00 H new ATOM 1095 N ASP B 60 -11.852 7.230 -91.220 1.00 0.00 N ATOM 1096 CA ASP B 60 -12.391 7.603 -89.917 1.00 0.00 C ATOM 1097 C ASP B 60 -12.217 6.477 -88.906 1.00 0.00 C ATOM 1098 O ASP B 60 -12.242 6.706 -87.697 1.00 0.00 O ATOM 1099 CB ASP B 60 -13.873 7.969 -90.034 1.00 0.00 C ATOM 1100 CG ASP B 60 -14.102 9.297 -90.742 1.00 0.00 C ATOM 1101 OD1 ASP B 60 -13.170 10.057 -90.853 1.00 0.00 O ATOM 1102 OD2 ASP B 60 -15.207 9.538 -91.166 1.00 0.00 O ATOM 0 H ASP B 60 -12.556 7.115 -91.949 1.00 0.00 H new ATOM 0 HA ASP B 60 -11.834 8.472 -89.565 1.00 0.00 H new ATOM 0 HB2 ASP B 60 -14.395 7.180 -90.575 1.00 0.00 H new ATOM 0 HB3 ASP B 60 -14.310 8.015 -89.037 1.00 0.00 H new ATOM 1107 N ASN B 61 -12.043 5.259 -89.409 1.00 0.00 N ATOM 1108 CA ASN B 61 -11.896 4.090 -88.550 1.00 0.00 C ATOM 1109 C ASN B 61 -10.429 3.729 -88.359 1.00 0.00 C ATOM 1110 O ASN B 61 -10.105 2.685 -87.792 1.00 0.00 O ATOM 1111 CB ASN B 61 -12.667 2.911 -89.116 1.00 0.00 C ATOM 1112 CG ASN B 61 -14.154 3.123 -89.080 1.00 0.00 C ATOM 1113 OD1 ASN B 61 -14.691 3.692 -88.122 1.00 0.00 O ATOM 1114 ND2 ASN B 61 -14.833 2.678 -90.107 1.00 0.00 N ATOM 0 H ASN B 61 -12.000 5.056 -90.408 1.00 0.00 H new ATOM 0 HA ASN B 61 -12.310 4.338 -87.573 1.00 0.00 H new ATOM 0 HB2 ASN B 61 -12.353 2.737 -90.145 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -12.418 2.013 -88.550 1.00 0.00 H new ATOM 0 HD21 ASN B 61 -15.846 2.795 -90.138 1.00 0.00 H new ATOM 0 HD22 ASN B 61 -14.349 2.214 -90.876 1.00 0.00 H new ATOM 1121 N ILE B 62 -9.544 4.598 -88.835 1.00 0.00 N ATOM 1122 CA ILE B 62 -8.110 4.333 -88.792 1.00 0.00 C ATOM 1123 C ILE B 62 -7.366 5.448 -88.069 1.00 0.00 C ATOM 1124 O ILE B 62 -7.635 6.629 -88.284 1.00 0.00 O ATOM 1125 CB ILE B 62 -7.539 4.172 -90.213 1.00 0.00 C ATOM 1126 CG1 ILE B 62 -8.256 3.037 -90.950 1.00 0.00 C ATOM 1127 CG2 ILE B 62 -6.042 3.913 -90.158 1.00 0.00 C ATOM 1128 CD1 ILE B 62 -7.894 2.936 -92.414 1.00 0.00 C ATOM 0 H ILE B 62 -9.794 5.493 -89.256 1.00 0.00 H new ATOM 0 HA ILE B 62 -7.968 3.402 -88.243 1.00 0.00 H new ATOM 0 HB ILE B 62 -7.706 5.099 -90.762 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -8.019 2.092 -90.461 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -9.333 3.181 -90.861 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -5.655 3.802 -91.171 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -5.545 4.751 -89.670 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -5.851 3.000 -89.594 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -8.441 2.110 -92.868 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -8.157 3.866 -92.919 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -6.823 2.760 -92.513 1.00 0.00 H new ATOM 1140 N ARG B 63 -6.427 5.064 -87.210 1.00 0.00 N ATOM 1141 CA ARG B 63 -5.593 6.030 -86.505 1.00 0.00 C ATOM 1142 C ARG B 63 -4.116 5.679 -86.631 1.00 0.00 C ATOM 1143 O ARG B 63 -3.743 4.506 -86.606 1.00 0.00 O ATOM 1144 CB ARG B 63 -5.973 6.092 -85.033 1.00 0.00 C ATOM 1145 CG ARG B 63 -7.388 6.575 -84.757 1.00 0.00 C ATOM 1146 CD ARG B 63 -7.549 8.016 -85.080 1.00 0.00 C ATOM 1147 NE ARG B 63 -8.880 8.500 -84.753 1.00 0.00 N ATOM 1148 CZ ARG B 63 -9.951 8.404 -85.566 1.00 0.00 C ATOM 1149 NH1 ARG B 63 -9.831 7.842 -86.748 1.00 0.00 N ATOM 1150 NH2 ARG B 63 -11.121 8.876 -85.174 1.00 0.00 N ATOM 0 H ARG B 63 -6.225 4.090 -86.985 1.00 0.00 H new ATOM 0 HA ARG B 63 -5.762 7.004 -86.964 1.00 0.00 H new ATOM 0 HB2 ARG B 63 -5.853 5.099 -84.600 1.00 0.00 H new ATOM 0 HB3 ARG B 63 -5.273 6.751 -84.519 1.00 0.00 H new ATOM 0 HG2 ARG B 63 -8.094 5.989 -85.346 1.00 0.00 H new ATOM 0 HG3 ARG B 63 -7.632 6.408 -83.708 1.00 0.00 H new ATOM 0 HD2 ARG B 63 -6.807 8.596 -84.531 1.00 0.00 H new ATOM 0 HD3 ARG B 63 -7.356 8.174 -86.141 1.00 0.00 H new ATOM 0 HE ARG B 63 -9.013 8.944 -83.844 1.00 0.00 H new ATOM 0 HH11 ARG B 63 -8.927 7.478 -87.050 1.00 0.00 H new ATOM 0 HH12 ARG B 63 -10.642 7.770 -87.363 1.00 0.00 H new ATOM 0 HH21 ARG B 63 -11.213 9.313 -84.257 1.00 0.00 H new ATOM 0 HH22 ARG B 63 -11.932 8.804 -85.789 1.00 0.00 H new ATOM 1164 N ILE B 64 -3.279 6.701 -86.766 1.00 0.00 N ATOM 1165 CA ILE B 64 -1.836 6.507 -86.833 1.00 0.00 C ATOM 1166 C ILE B 64 -1.094 7.634 -86.126 1.00 0.00 C ATOM 1167 O ILE B 64 -1.446 8.805 -86.266 1.00 0.00 O ATOM 1168 CB ILE B 64 -1.361 6.417 -88.295 1.00 0.00 C ATOM 1169 CG1 ILE B 64 0.115 6.016 -88.354 1.00 0.00 C ATOM 1170 CG2 ILE B 64 -1.584 7.742 -89.008 1.00 0.00 C ATOM 1171 CD1 ILE B 64 0.561 5.526 -89.713 1.00 0.00 C ATOM 0 H ILE B 64 -3.576 7.675 -86.831 1.00 0.00 H new ATOM 0 HA ILE B 64 -1.612 5.568 -86.327 1.00 0.00 H new ATOM 0 HB ILE B 64 -1.946 5.650 -88.803 1.00 0.00 H new ATOM 0 HG12 ILE B 64 0.726 6.872 -88.068 1.00 0.00 H new ATOM 0 HG13 ILE B 64 0.299 5.234 -87.618 1.00 0.00 H new ATOM 0 HG21 ILE B 64 -1.243 7.662 -90.040 1.00 0.00 H new ATOM 0 HG22 ILE B 64 -2.646 7.988 -88.995 1.00 0.00 H new ATOM 0 HG23 ILE B 64 -1.023 8.527 -88.501 1.00 0.00 H new ATOM 0 HD11 ILE B 64 1.618 5.261 -89.675 1.00 0.00 H new ATOM 0 HD12 ILE B 64 -0.023 4.650 -89.994 1.00 0.00 H new ATOM 0 HD13 ILE B 64 0.411 6.314 -90.451 1.00 0.00 H new ATOM 1183 N SER B 65 -0.067 7.273 -85.365 1.00 0.00 N ATOM 1184 CA SER B 65 0.641 8.233 -84.528 1.00 0.00 C ATOM 1185 C SER B 65 2.138 7.950 -84.507 1.00 0.00 C ATOM 1186 O SER B 65 2.563 6.800 -84.620 1.00 0.00 O ATOM 1187 CB SER B 65 0.092 8.199 -83.115 1.00 0.00 C ATOM 1188 OG SER B 65 0.778 9.097 -82.287 1.00 0.00 O ATOM 0 H SER B 65 0.294 6.321 -85.311 1.00 0.00 H new ATOM 0 HA SER B 65 0.487 9.225 -84.953 1.00 0.00 H new ATOM 0 HB2 SER B 65 -0.969 8.448 -83.127 1.00 0.00 H new ATOM 0 HB3 SER B 65 0.177 7.190 -82.712 1.00 0.00 H new ATOM 0 HG SER B 65 0.405 9.058 -81.382 1.00 0.00 H new ATOM 1194 N GLN B 66 2.933 9.004 -84.363 1.00 0.00 N ATOM 1195 CA GLN B 66 4.379 8.862 -84.241 1.00 0.00 C ATOM 1196 C GLN B 66 4.855 9.250 -82.847 1.00 0.00 C ATOM 1197 O GLN B 66 4.470 10.292 -82.317 1.00 0.00 O ATOM 1198 CB GLN B 66 5.092 9.716 -85.293 1.00 0.00 C ATOM 1199 CG GLN B 66 6.606 9.592 -85.275 1.00 0.00 C ATOM 1200 CD GLN B 66 7.267 10.398 -86.377 1.00 0.00 C ATOM 1201 OE1 GLN B 66 6.623 10.775 -87.361 1.00 0.00 O ATOM 1202 NE2 GLN B 66 8.557 10.668 -86.218 1.00 0.00 N ATOM 0 H GLN B 66 2.600 9.967 -84.328 1.00 0.00 H new ATOM 0 HA GLN B 66 4.625 7.813 -84.407 1.00 0.00 H new ATOM 0 HB2 GLN B 66 4.727 9.434 -86.281 1.00 0.00 H new ATOM 0 HB3 GLN B 66 4.823 10.761 -85.140 1.00 0.00 H new ATOM 0 HG2 GLN B 66 6.983 9.926 -84.308 1.00 0.00 H new ATOM 0 HG3 GLN B 66 6.883 8.543 -85.380 1.00 0.00 H new ATOM 0 HE21 GLN B 66 9.049 10.336 -85.388 1.00 0.00 H new ATOM 0 HE22 GLN B 66 9.056 11.207 -86.925 1.00 0.00 H new ATOM 1211 N GLU B 67 5.695 8.406 -82.258 1.00 0.00 N ATOM 1212 CA GLU B 67 6.194 8.637 -80.908 1.00 0.00 C ATOM 1213 C GLU B 67 7.663 8.255 -80.790 1.00 0.00 C ATOM 1214 O GLU B 67 8.098 7.244 -81.341 1.00 0.00 O ATOM 1215 CB GLU B 67 5.368 7.845 -79.891 1.00 0.00 C ATOM 1216 CG GLU B 67 5.737 8.110 -78.439 1.00 0.00 C ATOM 1217 CD GLU B 67 4.831 7.407 -77.467 1.00 0.00 C ATOM 1218 OE1 GLU B 67 3.980 6.670 -77.904 1.00 0.00 O ATOM 1219 OE2 GLU B 67 4.991 7.605 -76.286 1.00 0.00 O ATOM 0 H GLU B 67 6.045 7.554 -82.696 1.00 0.00 H new ATOM 0 HA GLU B 67 6.099 9.702 -80.696 1.00 0.00 H new ATOM 0 HB2 GLU B 67 4.314 8.082 -80.034 1.00 0.00 H new ATOM 0 HB3 GLU B 67 5.486 6.781 -80.095 1.00 0.00 H new ATOM 0 HG2 GLU B 67 6.765 7.790 -78.266 1.00 0.00 H new ATOM 0 HG3 GLU B 67 5.701 9.183 -78.250 1.00 0.00 H new ATOM 1226 N LYS B 68 8.426 9.071 -80.068 1.00 0.00 N ATOM 1227 CA LYS B 68 9.848 8.817 -79.874 1.00 0.00 C ATOM 1228 C LYS B 68 10.096 8.021 -78.599 1.00 0.00 C ATOM 1229 O LYS B 68 9.668 8.418 -77.515 1.00 0.00 O ATOM 1230 CB LYS B 68 10.626 10.134 -79.832 1.00 0.00 C ATOM 1231 CG LYS B 68 12.136 9.970 -79.728 1.00 0.00 C ATOM 1232 CD LYS B 68 12.841 11.317 -79.753 1.00 0.00 C ATOM 1233 CE LYS B 68 14.350 11.156 -79.634 1.00 0.00 C ATOM 1234 NZ LYS B 68 15.052 12.467 -79.642 1.00 0.00 N ATOM 0 H LYS B 68 8.082 9.914 -79.608 1.00 0.00 H new ATOM 0 HA LYS B 68 10.200 8.225 -80.719 1.00 0.00 H new ATOM 0 HB2 LYS B 68 10.396 10.706 -80.731 1.00 0.00 H new ATOM 0 HB3 LYS B 68 10.277 10.721 -78.982 1.00 0.00 H new ATOM 0 HG2 LYS B 68 12.384 9.444 -78.806 1.00 0.00 H new ATOM 0 HG3 LYS B 68 12.495 9.354 -80.553 1.00 0.00 H new ATOM 0 HD2 LYS B 68 12.601 11.838 -80.680 1.00 0.00 H new ATOM 0 HD3 LYS B 68 12.474 11.937 -78.935 1.00 0.00 H new ATOM 0 HE2 LYS B 68 14.586 10.624 -78.713 1.00 0.00 H new ATOM 0 HE3 LYS B 68 14.716 10.544 -80.458 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 16.077 12.312 -79.559 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 14.848 12.965 -80.532 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 14.723 13.042 -78.840 1.00 0.00 H new ATOM 1248 N GLN B 69 10.792 6.897 -78.735 1.00 0.00 N ATOM 1249 CA GLN B 69 11.055 6.018 -77.603 1.00 0.00 C ATOM 1250 C GLN B 69 12.454 5.420 -77.683 1.00 0.00 C ATOM 1251 O GLN B 69 12.811 4.782 -78.673 1.00 0.00 O ATOM 1252 CB GLN B 69 10.012 4.899 -77.540 1.00 0.00 C ATOM 1253 CG GLN B 69 10.204 3.933 -76.383 1.00 0.00 C ATOM 1254 CD GLN B 69 9.902 4.572 -75.040 1.00 0.00 C ATOM 1255 OE1 GLN B 69 8.806 5.095 -74.818 1.00 0.00 O ATOM 1256 NE2 GLN B 69 10.873 4.533 -74.136 1.00 0.00 N ATOM 0 H GLN B 69 11.184 6.574 -79.619 1.00 0.00 H new ATOM 0 HA GLN B 69 10.990 6.617 -76.695 1.00 0.00 H new ATOM 0 HB2 GLN B 69 9.021 5.346 -77.465 1.00 0.00 H new ATOM 0 HB3 GLN B 69 10.040 4.339 -78.475 1.00 0.00 H new ATOM 0 HG2 GLN B 69 9.557 3.068 -76.524 1.00 0.00 H new ATOM 0 HG3 GLN B 69 11.231 3.567 -76.385 1.00 0.00 H new ATOM 0 HE21 GLN B 69 11.763 4.090 -74.363 1.00 0.00 H new ATOM 0 HE22 GLN B 69 10.729 4.946 -73.214 1.00 0.00 H new ATOM 1265 N ASP B 70 13.243 5.633 -76.635 1.00 0.00 N ATOM 1266 CA ASP B 70 14.598 5.098 -76.576 1.00 0.00 C ATOM 1267 C ASP B 70 15.457 5.646 -77.708 1.00 0.00 C ATOM 1268 O ASP B 70 16.395 4.991 -78.163 1.00 0.00 O ATOM 1269 CB ASP B 70 14.574 3.568 -76.640 1.00 0.00 C ATOM 1270 CG ASP B 70 13.803 2.939 -75.488 1.00 0.00 C ATOM 1271 OD1 ASP B 70 13.635 3.591 -74.484 1.00 0.00 O ATOM 1272 OD2 ASP B 70 13.389 1.812 -75.622 1.00 0.00 O ATOM 0 H ASP B 70 12.967 6.173 -75.815 1.00 0.00 H new ATOM 0 HA ASP B 70 15.036 5.411 -75.628 1.00 0.00 H new ATOM 0 HB2 ASP B 70 14.126 3.256 -77.584 1.00 0.00 H new ATOM 0 HB3 ASP B 70 15.597 3.193 -76.633 1.00 0.00 H new ATOM 1277 N GLY B 71 15.132 6.852 -78.159 1.00 0.00 N ATOM 1278 CA GLY B 71 15.935 7.537 -79.164 1.00 0.00 C ATOM 1279 C GLY B 71 15.383 7.303 -80.564 1.00 0.00 C ATOM 1280 O GLY B 71 15.730 8.016 -81.506 1.00 0.00 O ATOM 0 H GLY B 71 14.316 7.376 -77.844 1.00 0.00 H new ATOM 0 HA2 GLY B 71 15.954 8.606 -78.952 1.00 0.00 H new ATOM 0 HA3 GLY B 71 16.965 7.184 -79.113 1.00 0.00 H new ATOM 1284 N MET B 72 14.520 6.302 -80.695 1.00 0.00 N ATOM 1285 CA MET B 72 14.012 5.892 -81.999 1.00 0.00 C ATOM 1286 C MET B 72 12.600 6.413 -82.228 1.00 0.00 C ATOM 1287 O MET B 72 11.842 6.620 -81.279 1.00 0.00 O ATOM 1288 CB MET B 72 14.046 4.370 -82.125 1.00 0.00 C ATOM 1289 CG MET B 72 15.416 3.749 -81.886 1.00 0.00 C ATOM 1290 SD MET B 72 16.630 4.245 -83.124 1.00 0.00 S ATOM 1291 CE MET B 72 16.086 3.285 -84.534 1.00 0.00 C ATOM 0 H MET B 72 14.157 5.758 -79.912 1.00 0.00 H new ATOM 0 HA MET B 72 14.657 6.324 -82.765 1.00 0.00 H new ATOM 0 HB2 MET B 72 13.338 3.943 -81.415 1.00 0.00 H new ATOM 0 HB3 MET B 72 13.704 4.092 -83.122 1.00 0.00 H new ATOM 0 HG2 MET B 72 15.773 4.036 -80.897 1.00 0.00 H new ATOM 0 HG3 MET B 72 15.324 2.663 -81.888 1.00 0.00 H new ATOM 0 HE1 MET B 72 16.740 3.483 -85.383 1.00 0.00 H new ATOM 0 HE2 MET B 72 16.123 2.224 -84.288 1.00 0.00 H new ATOM 0 HE3 MET B 72 15.064 3.562 -84.790 1.00 0.00 H new ATOM 1301 N ASP B 73 12.249 6.623 -83.492 1.00 0.00 N ATOM 1302 CA ASP B 73 10.913 7.085 -83.851 1.00 0.00 C ATOM 1303 C ASP B 73 10.045 5.931 -84.338 1.00 0.00 C ATOM 1304 O ASP B 73 10.362 5.280 -85.333 1.00 0.00 O ATOM 1305 CB ASP B 73 10.991 8.165 -84.933 1.00 0.00 C ATOM 1306 CG ASP B 73 11.572 9.476 -84.420 1.00 0.00 C ATOM 1307 OD1 ASP B 73 11.539 9.693 -83.232 1.00 0.00 O ATOM 1308 OD2 ASP B 73 12.044 10.247 -85.222 1.00 0.00 O ATOM 0 H ASP B 73 12.872 6.480 -84.287 1.00 0.00 H new ATOM 0 HA ASP B 73 10.457 7.508 -82.956 1.00 0.00 H new ATOM 0 HB2 ASP B 73 11.602 7.801 -85.759 1.00 0.00 H new ATOM 0 HB3 ASP B 73 9.993 8.347 -85.331 1.00 0.00 H new ATOM 1313 N VAL B 74 8.947 5.684 -83.630 1.00 0.00 N ATOM 1314 CA VAL B 74 8.097 4.534 -83.913 1.00 0.00 C ATOM 1315 C VAL B 74 6.714 4.972 -84.377 1.00 0.00 C ATOM 1316 O VAL B 74 6.066 5.799 -83.735 1.00 0.00 O ATOM 1317 CB VAL B 74 7.959 3.651 -82.658 1.00 0.00 C ATOM 1318 CG1 VAL B 74 7.020 2.485 -82.929 1.00 0.00 C ATOM 1319 CG2 VAL B 74 9.328 3.153 -82.221 1.00 0.00 C ATOM 0 H VAL B 74 8.626 6.265 -82.856 1.00 0.00 H new ATOM 0 HA VAL B 74 8.568 3.962 -84.713 1.00 0.00 H new ATOM 0 HB VAL B 74 7.533 4.247 -81.851 1.00 0.00 H new ATOM 0 HG11 VAL B 74 6.934 1.871 -82.032 1.00 0.00 H new ATOM 0 HG12 VAL B 74 6.037 2.866 -83.204 1.00 0.00 H new ATOM 0 HG13 VAL B 74 7.416 1.881 -83.745 1.00 0.00 H new ATOM 0 HG21 VAL B 74 9.222 2.530 -81.333 1.00 0.00 H new ATOM 0 HG22 VAL B 74 9.776 2.568 -83.024 1.00 0.00 H new ATOM 0 HG23 VAL B 74 9.969 4.004 -81.992 1.00 0.00 H new ATOM 1329 N LEU B 75 6.267 4.413 -85.496 1.00 0.00 N ATOM 1330 CA LEU B 75 4.912 4.645 -85.980 1.00 0.00 C ATOM 1331 C LEU B 75 3.960 3.559 -85.496 1.00 0.00 C ATOM 1332 O LEU B 75 4.316 2.381 -85.458 1.00 0.00 O ATOM 1333 CB LEU B 75 4.898 4.700 -87.513 1.00 0.00 C ATOM 1334 CG LEU B 75 5.795 5.770 -88.149 1.00 0.00 C ATOM 1335 CD1 LEU B 75 5.761 5.626 -89.664 1.00 0.00 C ATOM 1336 CD2 LEU B 75 5.322 7.150 -87.720 1.00 0.00 C ATOM 0 H LEU B 75 6.825 3.795 -86.086 1.00 0.00 H new ATOM 0 HA LEU B 75 4.574 5.601 -85.580 1.00 0.00 H new ATOM 0 HB2 LEU B 75 5.200 3.725 -87.896 1.00 0.00 H new ATOM 0 HB3 LEU B 75 3.873 4.869 -87.843 1.00 0.00 H new ATOM 0 HG LEU B 75 6.824 5.640 -87.814 1.00 0.00 H new ATOM 0 HD11 LEU B 75 6.398 6.386 -90.116 1.00 0.00 H new ATOM 0 HD12 LEU B 75 6.122 4.636 -89.944 1.00 0.00 H new ATOM 0 HD13 LEU B 75 4.738 5.752 -90.019 1.00 0.00 H new ATOM 0 HD21 LEU B 75 5.959 7.910 -88.172 1.00 0.00 H new ATOM 0 HD22 LEU B 75 4.293 7.299 -88.046 1.00 0.00 H new ATOM 0 HD23 LEU B 75 5.374 7.231 -86.634 1.00 0.00 H new ATOM 1348 N GLU B 76 2.749 3.962 -85.126 1.00 0.00 N ATOM 1349 CA GLU B 76 1.733 3.019 -84.674 1.00 0.00 C ATOM 1350 C GLU B 76 0.436 3.190 -85.454 1.00 0.00 C ATOM 1351 O GLU B 76 -0.189 4.250 -85.414 1.00 0.00 O ATOM 1352 CB GLU B 76 1.467 3.200 -83.178 1.00 0.00 C ATOM 1353 CG GLU B 76 0.391 2.281 -82.616 1.00 0.00 C ATOM 1354 CD GLU B 76 0.124 2.517 -81.155 1.00 0.00 C ATOM 1355 OE1 GLU B 76 0.988 3.039 -80.490 1.00 0.00 O ATOM 1356 OE2 GLU B 76 -0.944 2.177 -80.704 1.00 0.00 O ATOM 0 H GLU B 76 2.447 4.936 -85.130 1.00 0.00 H new ATOM 0 HA GLU B 76 2.110 2.012 -84.853 1.00 0.00 H new ATOM 0 HB2 GLU B 76 2.395 3.029 -82.633 1.00 0.00 H new ATOM 0 HB3 GLU B 76 1.176 4.234 -82.995 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.532 2.426 -83.177 1.00 0.00 H new ATOM 0 HG3 GLU B 76 0.693 1.244 -82.762 1.00 0.00 H new ATOM 1363 N LEU B 77 0.036 2.141 -86.164 1.00 0.00 N ATOM 1364 CA LEU B 77 -1.175 2.182 -86.975 1.00 0.00 C ATOM 1365 C LEU B 77 -2.228 1.217 -86.441 1.00 0.00 C ATOM 1366 O LEU B 77 -1.968 0.025 -86.285 1.00 0.00 O ATOM 1367 CB LEU B 77 -0.849 1.836 -88.433 1.00 0.00 C ATOM 1368 CG LEU B 77 -2.054 1.730 -89.377 1.00 0.00 C ATOM 1369 CD1 LEU B 77 -2.689 3.102 -89.546 1.00 0.00 C ATOM 1370 CD2 LEU B 77 -1.601 1.168 -90.717 1.00 0.00 C ATOM 0 H LEU B 77 0.533 1.251 -86.194 1.00 0.00 H new ATOM 0 HA LEU B 77 -1.577 3.194 -86.924 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -0.170 2.594 -88.824 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -0.312 0.887 -88.451 1.00 0.00 H new ATOM 0 HG LEU B 77 -2.800 1.056 -88.955 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -3.545 3.027 -90.217 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -3.020 3.472 -88.575 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -1.958 3.792 -89.967 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -2.457 1.093 -91.388 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -0.854 1.830 -91.155 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -1.168 0.179 -90.569 1.00 0.00 H new ATOM 1382 N ASN B 78 -3.416 1.742 -86.163 1.00 0.00 N ATOM 1383 CA ASN B 78 -4.488 0.944 -85.579 1.00 0.00 C ATOM 1384 C ASN B 78 -5.758 1.030 -86.415 1.00 0.00 C ATOM 1385 O ASN B 78 -6.076 2.082 -86.971 1.00 0.00 O ATOM 1386 CB ASN B 78 -4.758 1.378 -84.150 1.00 0.00 C ATOM 1387 CG ASN B 78 -3.592 1.121 -83.237 1.00 0.00 C ATOM 1388 OD1 ASN B 78 -3.027 0.021 -83.225 1.00 0.00 O ATOM 1389 ND2 ASN B 78 -3.220 2.115 -82.471 1.00 0.00 N ATOM 0 H ASN B 78 -3.661 2.717 -86.333 1.00 0.00 H new ATOM 0 HA ASN B 78 -4.164 -0.097 -85.570 1.00 0.00 H new ATOM 0 HB2 ASN B 78 -4.998 2.441 -84.136 1.00 0.00 H new ATOM 0 HB3 ASN B 78 -5.633 0.849 -83.773 1.00 0.00 H new ATOM 0 HD21 ASN B 78 -2.434 1.999 -81.831 1.00 0.00 H new ATOM 0 HD22 ASN B 78 -3.716 3.005 -82.514 1.00 0.00 H new ATOM 1396 N ILE B 79 -6.480 -0.081 -86.500 1.00 0.00 N ATOM 1397 CA ILE B 79 -7.775 -0.103 -87.171 1.00 0.00 C ATOM 1398 C ILE B 79 -8.758 -1.008 -86.439 1.00 0.00 C ATOM 1399 O ILE B 79 -8.409 -2.112 -86.021 1.00 0.00 O ATOM 1400 CB ILE B 79 -7.630 -0.576 -88.629 1.00 0.00 C ATOM 1401 CG1 ILE B 79 -8.973 -0.482 -89.357 1.00 0.00 C ATOM 1402 CG2 ILE B 79 -7.093 -1.998 -88.677 1.00 0.00 C ATOM 1403 CD1 ILE B 79 -8.868 -0.651 -90.856 1.00 0.00 C ATOM 0 H ILE B 79 -6.191 -0.979 -86.113 1.00 0.00 H new ATOM 0 HA ILE B 79 -8.162 0.916 -87.164 1.00 0.00 H new ATOM 0 HB ILE B 79 -6.918 0.076 -89.135 1.00 0.00 H new ATOM 0 HG12 ILE B 79 -9.644 -1.244 -88.961 1.00 0.00 H new ATOM 0 HG13 ILE B 79 -9.426 0.486 -89.141 1.00 0.00 H new ATOM 0 HG21 ILE B 79 -6.997 -2.316 -89.715 1.00 0.00 H new ATOM 0 HG22 ILE B 79 -6.116 -2.035 -88.194 1.00 0.00 H new ATOM 0 HG23 ILE B 79 -7.780 -2.664 -88.156 1.00 0.00 H new ATOM 0 HD11 ILE B 79 -9.860 -0.572 -91.301 1.00 0.00 H new ATOM 0 HD12 ILE B 79 -8.223 0.127 -91.266 1.00 0.00 H new ATOM 0 HD13 ILE B 79 -8.445 -1.630 -91.083 1.00 0.00 H new ATOM 1415 N THR B 80 -9.991 -0.533 -86.288 1.00 0.00 N ATOM 1416 CA THR B 80 -11.037 -1.311 -85.634 1.00 0.00 C ATOM 1417 C THR B 80 -11.915 -2.023 -86.656 1.00 0.00 C ATOM 1418 O THR B 80 -12.592 -1.382 -87.459 1.00 0.00 O ATOM 1419 CB THR B 80 -11.910 -0.418 -84.733 1.00 0.00 C ATOM 1420 OG1 THR B 80 -11.097 0.177 -83.713 1.00 0.00 O ATOM 1421 CG2 THR B 80 -13.015 -1.236 -84.083 1.00 0.00 C ATOM 0 H THR B 80 -10.290 0.388 -86.610 1.00 0.00 H new ATOM 0 HA THR B 80 -10.543 -2.060 -85.015 1.00 0.00 H new ATOM 0 HB THR B 80 -12.362 0.361 -85.347 1.00 0.00 H new ATOM 0 HG1 THR B 80 -11.654 0.746 -83.142 1.00 0.00 H new ATOM 0 HG21 THR B 80 -13.622 -0.589 -83.450 1.00 0.00 H new ATOM 0 HG22 THR B 80 -13.642 -1.679 -84.856 1.00 0.00 H new ATOM 0 HG23 THR B 80 -12.574 -2.027 -83.476 1.00 0.00 H new ATOM 1429 N LEU B 81 -11.900 -3.350 -86.619 1.00 0.00 N ATOM 1430 CA LEU B 81 -12.668 -4.152 -87.564 1.00 0.00 C ATOM 1431 C LEU B 81 -13.720 -4.988 -86.849 1.00 0.00 C ATOM 1432 O LEU B 81 -13.559 -5.341 -85.681 1.00 0.00 O ATOM 1433 CB LEU B 81 -11.732 -5.070 -88.363 1.00 0.00 C ATOM 1434 CG LEU B 81 -10.629 -4.363 -89.160 1.00 0.00 C ATOM 1435 CD1 LEU B 81 -9.702 -5.402 -89.775 1.00 0.00 C ATOM 1436 CD2 LEU B 81 -11.258 -3.488 -90.234 1.00 0.00 C ATOM 0 H LEU B 81 -11.363 -3.894 -85.944 1.00 0.00 H new ATOM 0 HA LEU B 81 -13.176 -3.470 -88.246 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -11.263 -5.771 -87.672 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -12.334 -5.659 -89.055 1.00 0.00 H new ATOM 0 HG LEU B 81 -10.042 -3.726 -88.498 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -8.918 -4.900 -90.342 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -9.251 -6.001 -88.984 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -10.272 -6.050 -90.441 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -10.473 -2.986 -90.800 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -11.851 -4.107 -90.907 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -11.901 -2.743 -89.766 1.00 0.00 H new TER 1448 LEU B 81