USER MOD reduce.3.24.130724 H: found=0, std=0, add=853, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 850 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 SER OG : rot -156:sc= -1.75! USER MOD Set 1.2: A 16 THR OG1 : rot 47:sc= 1.59 USER MOD Set 1.3: A 84 TYR OH : rot -47:sc= 0.124 USER MOD Set 2.1: A 5 HIS : no HD1:sc= -2.36 K(o=-1.7,f=-8!) USER MOD Set 2.2: A 7 TYR OH : rot 166:sc= 0.608 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -170:sc= -0.488 (180deg=-0.791!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= -0.173 USER MOD Single : A 14 MET CE :methyl -147:sc= 0 (180deg=-0.082) USER MOD Single : A 15 SER OG : rot 179:sc= -0.449 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 MET CE :methyl 143:sc= -8.63! (180deg=-15.3!) USER MOD Single : A 26 GLN : amide:sc= -11.8! C(o=-12!,f=-15!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.421 X(o=-0.42,f=-0.13) USER MOD Single : A 50 ASN : amide:sc= -0.127 X(o=-0.13,f=-0.06) USER MOD Single : A 59 GLN : amide:sc= -6.47! C(o=-6.5!,f=-8.8!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl -154:sc= -2 (180deg=-3.56!) USER MOD Single : A 68 GLN : amide:sc= -7.22! C(o=-7.2!,f=-12!) USER MOD Single : A 73 ASN : amide:sc= -0.182 X(o=-0.18,f=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.422 18.019 4.530 1.00 0.00 N ATOM 2 CA MET A 1 6.976 17.752 4.812 1.00 0.00 C ATOM 3 C MET A 1 6.814 16.484 5.685 1.00 0.00 C ATOM 4 O MET A 1 6.488 15.414 5.215 1.00 0.00 O ATOM 5 CB MET A 1 6.193 17.612 3.530 1.00 0.00 C ATOM 6 CG MET A 1 7.059 17.698 2.250 1.00 0.00 C ATOM 7 SD MET A 1 7.858 16.091 1.816 1.00 0.00 S ATOM 8 CE MET A 1 9.357 16.691 1.056 1.00 0.00 C ATOM 0 H1 MET A 1 8.523 18.957 4.092 1.00 0.00 H new ATOM 0 H2 MET A 1 8.960 17.993 5.420 1.00 0.00 H new ATOM 0 H3 MET A 1 8.789 17.293 3.882 1.00 0.00 H new ATOM 0 HA MET A 1 6.578 18.604 5.363 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.670 16.656 3.539 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.432 18.391 3.494 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.437 18.025 1.417 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.830 18.456 2.389 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.964 15.846 0.732 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.106 17.309 0.194 1.00 0.00 H new ATOM 0 HE3 MET A 1 9.918 17.285 1.777 1.00 0.00 H new ATOM 18 N GLU A 2 7.150 16.666 6.986 1.00 0.00 N ATOM 19 CA GLU A 2 7.118 15.621 8.031 1.00 0.00 C ATOM 20 C GLU A 2 7.284 14.223 7.418 1.00 0.00 C ATOM 21 O GLU A 2 8.421 13.821 7.102 1.00 0.00 O ATOM 22 CB GLU A 2 5.843 15.702 8.863 1.00 0.00 C ATOM 23 CG GLU A 2 4.635 16.232 8.085 1.00 0.00 C ATOM 24 CD GLU A 2 3.811 17.293 8.823 1.00 0.00 C ATOM 25 OE1 GLU A 2 3.585 17.094 10.064 1.00 0.00 O ATOM 26 OE2 GLU A 2 3.427 18.297 8.155 1.00 0.00 O ATOM 0 H GLU A 2 7.459 17.570 7.344 1.00 0.00 H new ATOM 0 HA GLU A 2 7.960 15.800 8.699 1.00 0.00 H new ATOM 0 HB2 GLU A 2 5.608 14.711 9.250 1.00 0.00 H new ATOM 0 HB3 GLU A 2 6.021 16.346 9.724 1.00 0.00 H new ATOM 0 HG2 GLU A 2 4.984 16.654 7.143 1.00 0.00 H new ATOM 0 HG3 GLU A 2 3.984 15.394 7.837 1.00 0.00 H new ATOM 33 N LYS A 3 6.189 13.444 7.390 1.00 0.00 N ATOM 34 CA LYS A 3 6.193 11.975 7.145 1.00 0.00 C ATOM 35 C LYS A 3 4.751 11.423 7.054 1.00 0.00 C ATOM 36 O LYS A 3 3.856 11.878 7.782 1.00 0.00 O ATOM 37 CB LYS A 3 6.951 11.243 8.260 1.00 0.00 C ATOM 38 CG LYS A 3 6.817 12.023 9.605 1.00 0.00 C ATOM 39 CD LYS A 3 7.056 11.226 10.876 1.00 0.00 C ATOM 40 CE LYS A 3 8.176 10.195 10.685 1.00 0.00 C ATOM 41 NZ LYS A 3 8.359 9.402 11.926 1.00 0.00 N ATOM 0 H LYS A 3 5.252 13.818 7.539 1.00 0.00 H new ATOM 0 HA LYS A 3 6.697 11.801 6.194 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.556 10.234 8.376 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.003 11.145 7.991 1.00 0.00 H new ATOM 0 HG2 LYS A 3 7.519 12.857 9.588 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.816 12.451 9.653 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.317 11.903 11.689 1.00 0.00 H new ATOM 0 HD3 LYS A 3 6.137 10.718 11.167 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.933 9.533 9.854 1.00 0.00 H new ATOM 0 HE3 LYS A 3 9.106 10.701 10.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 9.120 8.707 11.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 8.611 10.037 12.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 7.474 8.905 12.154 1.00 0.00 H new ATOM 55 N LYS A 4 4.551 10.510 6.066 1.00 0.00 N ATOM 56 CA LYS A 4 3.255 9.875 5.801 1.00 0.00 C ATOM 57 C LYS A 4 3.361 8.334 5.676 1.00 0.00 C ATOM 58 O LYS A 4 4.434 7.750 5.889 1.00 0.00 O ATOM 59 CB LYS A 4 2.632 10.465 4.508 1.00 0.00 C ATOM 60 CG LYS A 4 1.799 11.691 4.885 1.00 0.00 C ATOM 61 CD LYS A 4 1.767 12.788 3.766 1.00 0.00 C ATOM 62 CE LYS A 4 0.687 13.826 4.110 1.00 0.00 C ATOM 63 NZ LYS A 4 1.202 14.778 5.120 1.00 0.00 N ATOM 0 H LYS A 4 5.292 10.201 5.437 1.00 0.00 H new ATOM 0 HA LYS A 4 2.613 10.087 6.656 1.00 0.00 H new ATOM 0 HB2 LYS A 4 3.415 10.742 3.803 1.00 0.00 H new ATOM 0 HB3 LYS A 4 2.008 9.720 4.015 1.00 0.00 H new ATOM 0 HG2 LYS A 4 0.779 11.375 5.103 1.00 0.00 H new ATOM 0 HG3 LYS A 4 2.201 12.127 5.800 1.00 0.00 H new ATOM 0 HD2 LYS A 4 2.741 13.271 3.685 1.00 0.00 H new ATOM 0 HD3 LYS A 4 1.556 12.332 2.799 1.00 0.00 H new ATOM 0 HE2 LYS A 4 0.389 14.364 3.210 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -0.202 13.325 4.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 0.465 15.476 5.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 1.465 14.260 5.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 2.038 15.267 4.741 1.00 0.00 H new ATOM 77 N HIS A 5 2.212 7.712 5.376 1.00 0.00 N ATOM 78 CA HIS A 5 1.968 6.288 5.363 1.00 0.00 C ATOM 79 C HIS A 5 1.606 5.658 4.014 1.00 0.00 C ATOM 80 O HIS A 5 0.691 6.093 3.306 1.00 0.00 O ATOM 81 CB HIS A 5 0.920 5.909 6.444 1.00 0.00 C ATOM 82 CG HIS A 5 1.189 6.505 7.812 1.00 0.00 C ATOM 83 ND1 HIS A 5 0.286 6.976 8.703 1.00 0.00 N ATOM 84 CD2 HIS A 5 2.410 6.760 8.331 1.00 0.00 C ATOM 85 CE1 HIS A 5 0.943 7.404 9.799 1.00 0.00 C ATOM 86 NE2 HIS A 5 2.274 7.249 9.540 1.00 0.00 N ATOM 0 H HIS A 5 1.378 8.241 5.120 1.00 0.00 H new ATOM 0 HA HIS A 5 2.942 5.855 5.593 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -0.065 6.233 6.107 1.00 0.00 H new ATOM 0 HB3 HIS A 5 0.885 4.823 6.534 1.00 0.00 H new ATOM 0 HD2 HIS A 5 3.351 6.588 7.829 1.00 0.00 H new ATOM 0 HE1 HIS A 5 0.503 7.793 10.705 1.00 0.00 H new ATOM 0 HE2 HIS A 5 3.035 7.476 10.180 1.00 0.00 H new ATOM 94 N ILE A 6 2.299 4.529 3.720 1.00 0.00 N ATOM 95 CA ILE A 6 1.962 3.525 2.666 1.00 0.00 C ATOM 96 C ILE A 6 1.368 2.279 3.356 1.00 0.00 C ATOM 97 O ILE A 6 2.053 1.579 4.117 1.00 0.00 O ATOM 98 CB ILE A 6 3.237 3.201 1.807 1.00 0.00 C ATOM 99 CG1 ILE A 6 3.800 4.439 1.126 1.00 0.00 C ATOM 100 CG2 ILE A 6 3.062 1.984 0.915 1.00 0.00 C ATOM 101 CD1 ILE A 6 5.277 4.281 0.633 1.00 0.00 C ATOM 0 H ILE A 6 3.146 4.278 4.230 1.00 0.00 H new ATOM 0 HA ILE A 6 1.216 3.916 1.973 1.00 0.00 H new ATOM 0 HB ILE A 6 4.023 2.892 2.496 1.00 0.00 H new ATOM 0 HG12 ILE A 6 3.169 4.691 0.274 1.00 0.00 H new ATOM 0 HG13 ILE A 6 3.748 5.278 1.820 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.977 1.814 0.348 1.00 0.00 H new ATOM 0 HG22 ILE A 6 2.848 1.110 1.530 1.00 0.00 H new ATOM 0 HG23 ILE A 6 2.235 2.154 0.226 1.00 0.00 H new ATOM 0 HD11 ILE A 6 5.603 5.207 0.159 1.00 0.00 H new ATOM 0 HD12 ILE A 6 5.923 4.061 1.483 1.00 0.00 H new ATOM 0 HD13 ILE A 6 5.335 3.465 -0.087 1.00 0.00 H new ATOM 113 N TYR A 7 0.051 2.055 3.164 1.00 0.00 N ATOM 114 CA TYR A 7 -0.785 1.010 3.759 1.00 0.00 C ATOM 115 C TYR A 7 -1.402 0.100 2.691 1.00 0.00 C ATOM 116 O TYR A 7 -2.080 0.546 1.772 1.00 0.00 O ATOM 117 CB TYR A 7 -1.931 1.688 4.615 1.00 0.00 C ATOM 118 CG TYR A 7 -1.384 2.490 5.807 1.00 0.00 C ATOM 119 CD1 TYR A 7 -0.566 1.868 6.756 1.00 0.00 C ATOM 120 CD2 TYR A 7 -1.744 3.844 5.900 1.00 0.00 C ATOM 121 CE1 TYR A 7 -0.166 2.583 7.897 1.00 0.00 C ATOM 122 CE2 TYR A 7 -1.420 4.533 7.084 1.00 0.00 C ATOM 123 CZ TYR A 7 -0.636 3.887 8.074 1.00 0.00 C ATOM 124 OH TYR A 7 -0.320 4.569 9.197 1.00 0.00 O ATOM 0 H TYR A 7 -0.491 2.651 2.538 1.00 0.00 H new ATOM 0 HA TYR A 7 -0.155 0.389 4.396 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.515 2.349 3.975 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -2.610 0.918 4.981 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -0.245 0.847 6.613 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -2.254 4.341 5.088 1.00 0.00 H new ATOM 0 HE1 TYR A 7 0.493 2.133 8.625 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -1.765 5.545 7.237 1.00 0.00 H new ATOM 0 HH TYR A 7 -0.524 5.519 9.071 1.00 0.00 H new ATOM 134 N LEU A 8 -1.160 -1.238 2.826 1.00 0.00 N ATOM 135 CA LEU A 8 -1.336 -2.275 1.867 1.00 0.00 C ATOM 136 C LEU A 8 -2.406 -3.313 2.289 1.00 0.00 C ATOM 137 O LEU A 8 -2.120 -4.183 3.100 1.00 0.00 O ATOM 138 CB LEU A 8 0.018 -3.042 1.765 1.00 0.00 C ATOM 139 CG LEU A 8 0.899 -2.655 0.531 1.00 0.00 C ATOM 140 CD1 LEU A 8 1.083 -1.110 0.426 1.00 0.00 C ATOM 141 CD2 LEU A 8 2.204 -3.425 0.490 1.00 0.00 C ATOM 0 H LEU A 8 -0.805 -1.610 3.707 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.656 -1.815 0.932 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.591 -2.861 2.674 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.188 -4.112 1.726 1.00 0.00 H new ATOM 0 HG LEU A 8 0.361 -2.959 -0.367 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.700 -0.875 -0.442 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.108 -0.634 0.318 1.00 0.00 H new ATOM 0 HD13 LEU A 8 1.570 -0.739 1.328 1.00 0.00 H new ATOM 0 HD21 LEU A 8 2.779 -3.120 -0.385 1.00 0.00 H new ATOM 0 HD22 LEU A 8 2.778 -3.216 1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.995 -4.493 0.432 1.00 0.00 H new ATOM 153 N PHE A 9 -3.633 -3.175 1.738 1.00 0.00 N ATOM 154 CA PHE A 9 -4.914 -3.679 2.269 1.00 0.00 C ATOM 155 C PHE A 9 -5.382 -4.910 1.517 1.00 0.00 C ATOM 156 O PHE A 9 -5.921 -4.825 0.417 1.00 0.00 O ATOM 157 CB PHE A 9 -5.933 -2.477 2.069 1.00 0.00 C ATOM 158 CG PHE A 9 -5.449 -1.174 2.763 1.00 0.00 C ATOM 159 CD1 PHE A 9 -4.703 -1.305 3.924 1.00 0.00 C ATOM 160 CD2 PHE A 9 -5.735 0.099 2.240 1.00 0.00 C ATOM 161 CE1 PHE A 9 -4.567 -0.202 4.786 1.00 0.00 C ATOM 162 CE2 PHE A 9 -5.537 1.245 3.066 1.00 0.00 C ATOM 163 CZ PHE A 9 -4.822 1.087 4.269 1.00 0.00 C ATOM 0 H PHE A 9 -3.760 -2.678 0.857 1.00 0.00 H new ATOM 0 HA PHE A 9 -4.827 -3.983 3.312 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -6.067 -2.291 1.003 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.907 -2.759 2.468 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -4.230 -2.246 4.165 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -6.099 0.208 1.229 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -4.275 -0.337 5.817 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -5.926 2.210 2.776 1.00 0.00 H new ATOM 0 HZ PHE A 9 -4.466 1.958 4.800 1.00 0.00 H new ATOM 173 N SER A 10 -5.036 -6.157 2.007 1.00 0.00 N ATOM 174 CA SER A 10 -4.745 -7.328 1.164 1.00 0.00 C ATOM 175 C SER A 10 -5.024 -8.653 1.911 1.00 0.00 C ATOM 176 O SER A 10 -5.504 -8.704 3.028 1.00 0.00 O ATOM 177 CB SER A 10 -3.251 -7.268 0.773 1.00 0.00 C ATOM 178 OG SER A 10 -3.024 -7.532 -0.603 1.00 0.00 O ATOM 0 H SER A 10 -4.958 -6.352 3.005 1.00 0.00 H new ATOM 0 HA SER A 10 -5.389 -7.303 0.285 1.00 0.00 H new ATOM 0 HB2 SER A 10 -2.857 -6.281 1.017 1.00 0.00 H new ATOM 0 HB3 SER A 10 -2.696 -7.990 1.372 1.00 0.00 H new ATOM 0 HG SER A 10 -2.109 -7.859 -0.727 1.00 0.00 H new ATOM 184 N SER A 11 -4.671 -9.752 1.210 1.00 0.00 N ATOM 185 CA SER A 11 -5.301 -11.075 1.342 1.00 0.00 C ATOM 186 C SER A 11 -4.233 -12.205 1.316 1.00 0.00 C ATOM 187 O SER A 11 -4.537 -13.346 0.929 1.00 0.00 O ATOM 188 CB SER A 11 -6.259 -11.289 0.155 1.00 0.00 C ATOM 189 OG SER A 11 -7.624 -11.020 0.481 1.00 0.00 O ATOM 0 H SER A 11 -3.920 -9.739 0.520 1.00 0.00 H new ATOM 0 HA SER A 11 -5.835 -11.111 2.292 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.955 -10.645 -0.670 1.00 0.00 H new ATOM 0 HB3 SER A 11 -6.171 -12.318 -0.194 1.00 0.00 H new ATOM 0 HG SER A 11 -8.185 -11.170 -0.309 1.00 0.00 H new ATOM 195 N ALA A 12 -3.022 -11.869 1.794 1.00 0.00 N ATOM 196 CA ALA A 12 -1.838 -12.722 1.837 1.00 0.00 C ATOM 197 C ALA A 12 -0.678 -12.094 2.604 1.00 0.00 C ATOM 198 O ALA A 12 0.230 -11.446 2.014 1.00 0.00 O ATOM 199 CB ALA A 12 -1.366 -13.063 0.393 1.00 0.00 C ATOM 0 H ALA A 12 -2.841 -10.942 2.180 1.00 0.00 H new ATOM 0 HA ALA A 12 -2.132 -13.628 2.367 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -0.482 -13.700 0.440 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -2.163 -13.586 -0.136 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -1.122 -12.142 -0.137 1.00 0.00 H new ATOM 205 N GLY A 13 -0.696 -12.220 3.936 1.00 0.00 N ATOM 206 CA GLY A 13 0.340 -11.719 4.851 1.00 0.00 C ATOM 207 C GLY A 13 1.772 -12.089 4.433 1.00 0.00 C ATOM 208 O GLY A 13 2.727 -11.452 4.865 1.00 0.00 O ATOM 0 H GLY A 13 -1.458 -12.690 4.425 1.00 0.00 H new ATOM 0 HA2 GLY A 13 0.260 -10.634 4.916 1.00 0.00 H new ATOM 0 HA3 GLY A 13 0.150 -12.113 5.850 1.00 0.00 H new ATOM 212 N MET A 14 1.885 -13.128 3.569 1.00 0.00 N ATOM 213 CA MET A 14 3.133 -13.605 2.955 1.00 0.00 C ATOM 214 C MET A 14 3.157 -13.267 1.437 1.00 0.00 C ATOM 215 O MET A 14 3.731 -13.958 0.609 1.00 0.00 O ATOM 216 CB MET A 14 3.357 -15.091 3.192 1.00 0.00 C ATOM 217 CG MET A 14 2.420 -15.739 4.172 1.00 0.00 C ATOM 218 SD MET A 14 3.143 -15.897 5.914 1.00 0.00 S ATOM 219 CE MET A 14 4.276 -17.242 5.611 1.00 0.00 C ATOM 0 H MET A 14 1.074 -13.672 3.275 1.00 0.00 H new ATOM 0 HA MET A 14 3.958 -13.082 3.439 1.00 0.00 H new ATOM 0 HB2 MET A 14 3.272 -15.610 2.237 1.00 0.00 H new ATOM 0 HB3 MET A 14 4.379 -15.235 3.543 1.00 0.00 H new ATOM 0 HG2 MET A 14 1.499 -15.158 4.221 1.00 0.00 H new ATOM 0 HG3 MET A 14 2.153 -16.731 3.806 1.00 0.00 H new ATOM 0 HE1 MET A 14 4.357 -17.858 6.506 1.00 0.00 H new ATOM 0 HE2 MET A 14 3.907 -17.849 4.784 1.00 0.00 H new ATOM 0 HE3 MET A 14 5.257 -16.841 5.357 1.00 0.00 H new ATOM 229 N SER A 15 2.450 -12.154 1.105 1.00 0.00 N ATOM 230 CA SER A 15 2.646 -11.341 -0.075 1.00 0.00 C ATOM 231 C SER A 15 2.640 -9.834 0.205 1.00 0.00 C ATOM 232 O SER A 15 2.884 -8.990 -0.669 1.00 0.00 O ATOM 233 CB SER A 15 1.579 -11.679 -1.127 1.00 0.00 C ATOM 234 OG SER A 15 1.487 -13.104 -1.330 1.00 0.00 O ATOM 0 H SER A 15 1.697 -11.802 1.696 1.00 0.00 H new ATOM 0 HA SER A 15 3.641 -11.581 -0.449 1.00 0.00 H new ATOM 0 HB2 SER A 15 0.612 -11.290 -0.807 1.00 0.00 H new ATOM 0 HB3 SER A 15 1.824 -11.189 -2.069 1.00 0.00 H new ATOM 0 HG SER A 15 0.786 -13.296 -1.987 1.00 0.00 H new ATOM 240 N THR A 16 2.372 -9.458 1.492 1.00 0.00 N ATOM 241 CA THR A 16 2.037 -8.152 2.039 1.00 0.00 C ATOM 242 C THR A 16 3.007 -7.695 3.149 1.00 0.00 C ATOM 243 O THR A 16 3.591 -6.612 3.112 1.00 0.00 O ATOM 244 CB THR A 16 0.613 -7.969 2.555 1.00 0.00 C ATOM 245 OG1 THR A 16 -0.229 -9.106 2.211 1.00 0.00 O ATOM 246 CG2 THR A 16 -0.008 -6.630 2.184 1.00 0.00 C ATOM 0 H THR A 16 2.394 -10.157 2.234 1.00 0.00 H new ATOM 0 HA THR A 16 2.134 -7.526 1.152 1.00 0.00 H new ATOM 0 HB THR A 16 0.683 -7.941 3.642 1.00 0.00 H new ATOM 0 HG1 THR A 16 0.241 -9.938 2.427 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.020 -6.574 2.586 1.00 0.00 H new ATOM 0 HG22 THR A 16 0.593 -5.822 2.601 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.043 -6.533 1.099 1.00 0.00 H new ATOM 254 N SER A 17 3.066 -8.547 4.210 1.00 0.00 N ATOM 255 CA SER A 17 3.959 -8.253 5.390 1.00 0.00 C ATOM 256 C SER A 17 5.386 -7.978 4.879 1.00 0.00 C ATOM 257 O SER A 17 5.951 -6.872 5.074 1.00 0.00 O ATOM 258 CB SER A 17 3.887 -9.407 6.354 1.00 0.00 C ATOM 259 OG SER A 17 3.720 -8.990 7.720 1.00 0.00 O ATOM 0 H SER A 17 2.532 -9.413 4.283 1.00 0.00 H new ATOM 0 HA SER A 17 3.633 -7.363 5.928 1.00 0.00 H new ATOM 0 HB2 SER A 17 3.057 -10.056 6.074 1.00 0.00 H new ATOM 0 HB3 SER A 17 4.797 -10.000 6.270 1.00 0.00 H new ATOM 0 HG SER A 17 3.678 -9.779 8.300 1.00 0.00 H new ATOM 265 N LEU A 18 5.933 -8.970 4.130 1.00 0.00 N ATOM 266 CA LEU A 18 7.346 -9.036 3.686 1.00 0.00 C ATOM 267 C LEU A 18 7.496 -8.017 2.506 1.00 0.00 C ATOM 268 O LEU A 18 8.609 -7.859 2.017 1.00 0.00 O ATOM 269 CB LEU A 18 7.585 -10.445 3.184 1.00 0.00 C ATOM 270 CG LEU A 18 8.889 -11.206 3.473 1.00 0.00 C ATOM 271 CD1 LEU A 18 8.858 -12.706 3.068 1.00 0.00 C ATOM 272 CD2 LEU A 18 10.129 -10.470 2.882 1.00 0.00 C ATOM 0 H LEU A 18 5.385 -9.769 3.810 1.00 0.00 H new ATOM 0 HA LEU A 18 8.054 -8.798 4.480 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.772 -11.058 3.572 1.00 0.00 H new ATOM 0 HB3 LEU A 18 7.473 -10.415 2.100 1.00 0.00 H new ATOM 0 HG LEU A 18 8.984 -11.209 4.559 1.00 0.00 H new ATOM 0 HD11 LEU A 18 9.817 -13.167 3.306 1.00 0.00 H new ATOM 0 HD12 LEU A 18 8.065 -13.214 3.616 1.00 0.00 H new ATOM 0 HD13 LEU A 18 8.671 -12.790 1.997 1.00 0.00 H new ATOM 0 HD21 LEU A 18 11.031 -11.039 3.107 1.00 0.00 H new ATOM 0 HD22 LEU A 18 10.017 -10.379 1.802 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.207 -9.476 3.323 1.00 0.00 H new ATOM 284 N LEU A 19 6.377 -7.417 2.061 1.00 0.00 N ATOM 285 CA LEU A 19 6.297 -6.517 0.878 1.00 0.00 C ATOM 286 C LEU A 19 6.240 -5.068 1.406 1.00 0.00 C ATOM 287 O LEU A 19 6.790 -4.168 0.750 1.00 0.00 O ATOM 288 CB LEU A 19 4.975 -6.890 0.171 1.00 0.00 C ATOM 289 CG LEU A 19 4.093 -5.723 -0.372 1.00 0.00 C ATOM 290 CD1 LEU A 19 4.894 -4.554 -0.991 1.00 0.00 C ATOM 291 CD2 LEU A 19 2.999 -6.225 -1.332 1.00 0.00 C ATOM 0 H LEU A 19 5.475 -7.543 2.521 1.00 0.00 H new ATOM 0 HA LEU A 19 7.141 -6.610 0.195 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.215 -7.547 -0.665 1.00 0.00 H new ATOM 0 HB3 LEU A 19 4.372 -7.470 0.870 1.00 0.00 H new ATOM 0 HG LEU A 19 3.606 -5.308 0.511 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.205 -3.787 -1.343 1.00 0.00 H new ATOM 0 HD12 LEU A 19 5.557 -4.128 -0.238 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.486 -4.922 -1.829 1.00 0.00 H new ATOM 0 HD21 LEU A 19 2.409 -5.379 -1.686 1.00 0.00 H new ATOM 0 HD22 LEU A 19 3.463 -6.725 -2.182 1.00 0.00 H new ATOM 0 HD23 LEU A 19 2.350 -6.927 -0.809 1.00 0.00 H new ATOM 303 N VAL A 20 5.594 -4.828 2.568 1.00 0.00 N ATOM 304 CA VAL A 20 5.718 -3.587 3.365 1.00 0.00 C ATOM 305 C VAL A 20 7.065 -3.684 4.153 1.00 0.00 C ATOM 306 O VAL A 20 7.629 -2.689 4.608 1.00 0.00 O ATOM 307 CB VAL A 20 4.495 -3.498 4.304 1.00 0.00 C ATOM 308 CG1 VAL A 20 4.838 -3.231 5.784 1.00 0.00 C ATOM 309 CG2 VAL A 20 3.520 -2.357 3.797 1.00 0.00 C ATOM 0 H VAL A 20 4.958 -5.506 2.987 1.00 0.00 H new ATOM 0 HA VAL A 20 5.733 -2.686 2.752 1.00 0.00 H new ATOM 0 HB VAL A 20 4.026 -4.481 4.267 1.00 0.00 H new ATOM 0 HG11 VAL A 20 3.919 -3.184 6.368 1.00 0.00 H new ATOM 0 HG12 VAL A 20 5.468 -4.036 6.162 1.00 0.00 H new ATOM 0 HG13 VAL A 20 5.370 -2.283 5.869 1.00 0.00 H new ATOM 0 HG21 VAL A 20 2.657 -2.295 4.460 1.00 0.00 H new ATOM 0 HG22 VAL A 20 4.046 -1.403 3.796 1.00 0.00 H new ATOM 0 HG23 VAL A 20 3.185 -2.588 2.786 1.00 0.00 H new ATOM 319 N SER A 21 7.482 -4.932 4.408 1.00 0.00 N ATOM 320 CA SER A 21 8.694 -5.266 5.220 1.00 0.00 C ATOM 321 C SER A 21 9.914 -5.514 4.320 1.00 0.00 C ATOM 322 O SER A 21 11.060 -5.655 4.785 1.00 0.00 O ATOM 323 CB SER A 21 8.385 -6.546 6.015 1.00 0.00 C ATOM 324 OG SER A 21 8.012 -6.220 7.389 1.00 0.00 O ATOM 0 H SER A 21 6.993 -5.757 4.060 1.00 0.00 H new ATOM 0 HA SER A 21 8.928 -4.432 5.882 1.00 0.00 H new ATOM 0 HB2 SER A 21 7.575 -7.094 5.533 1.00 0.00 H new ATOM 0 HB3 SER A 21 9.257 -7.200 6.015 1.00 0.00 H new ATOM 0 HG SER A 21 7.817 -7.046 7.880 1.00 0.00 H new ATOM 330 N LYS A 22 9.648 -5.528 2.992 1.00 0.00 N ATOM 331 CA LYS A 22 10.709 -5.439 1.949 1.00 0.00 C ATOM 332 C LYS A 22 10.786 -3.939 1.442 1.00 0.00 C ATOM 333 O LYS A 22 11.806 -3.338 1.371 1.00 0.00 O ATOM 334 CB LYS A 22 10.379 -6.340 0.762 1.00 0.00 C ATOM 335 CG LYS A 22 11.421 -6.093 -0.372 1.00 0.00 C ATOM 336 CD LYS A 22 11.594 -7.369 -1.265 1.00 0.00 C ATOM 337 CE LYS A 22 12.333 -8.406 -0.372 1.00 0.00 C ATOM 338 NZ LYS A 22 13.452 -8.997 -1.172 1.00 0.00 N ATOM 0 H LYS A 22 8.704 -5.600 2.612 1.00 0.00 H new ATOM 0 HA LYS A 22 11.658 -5.759 2.378 1.00 0.00 H new ATOM 0 HB2 LYS A 22 10.397 -7.386 1.068 1.00 0.00 H new ATOM 0 HB3 LYS A 22 9.372 -6.131 0.400 1.00 0.00 H new ATOM 0 HG2 LYS A 22 11.100 -5.254 -0.989 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.381 -5.818 0.065 1.00 0.00 H new ATOM 0 HD2 LYS A 22 10.628 -7.752 -1.593 1.00 0.00 H new ATOM 0 HD3 LYS A 22 12.169 -7.144 -2.163 1.00 0.00 H new ATOM 0 HE2 LYS A 22 12.720 -7.926 0.527 1.00 0.00 H new ATOM 0 HE3 LYS A 22 11.645 -9.186 -0.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 13.961 -9.695 -0.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 13.066 -9.464 -2.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 14.107 -8.243 -1.462 1.00 0.00 H new ATOM 352 N MET A 23 9.532 -3.459 1.092 1.00 0.00 N ATOM 353 CA MET A 23 9.243 -2.017 0.970 1.00 0.00 C ATOM 354 C MET A 23 9.951 -1.196 2.079 1.00 0.00 C ATOM 355 O MET A 23 10.729 -0.305 1.805 1.00 0.00 O ATOM 356 CB MET A 23 7.722 -1.780 1.000 1.00 0.00 C ATOM 357 CG MET A 23 7.200 -1.703 -0.442 1.00 0.00 C ATOM 358 SD MET A 23 5.833 -0.543 -0.737 1.00 0.00 S ATOM 359 CE MET A 23 6.643 1.014 -0.606 1.00 0.00 C ATOM 0 H MET A 23 8.732 -4.061 0.897 1.00 0.00 H new ATOM 0 HA MET A 23 9.636 -1.673 0.013 1.00 0.00 H new ATOM 0 HB2 MET A 23 7.226 -2.588 1.538 1.00 0.00 H new ATOM 0 HB3 MET A 23 7.495 -0.856 1.532 1.00 0.00 H new ATOM 0 HG2 MET A 23 8.030 -1.428 -1.093 1.00 0.00 H new ATOM 0 HG3 MET A 23 6.876 -2.699 -0.743 1.00 0.00 H new ATOM 0 HE1 MET A 23 6.221 1.706 -1.334 1.00 0.00 H new ATOM 0 HE2 MET A 23 6.503 1.414 0.398 1.00 0.00 H new ATOM 0 HE3 MET A 23 7.708 0.888 -0.801 1.00 0.00 H new ATOM 369 N ARG A 24 9.594 -1.559 3.328 1.00 0.00 N ATOM 370 CA ARG A 24 10.225 -0.970 4.537 1.00 0.00 C ATOM 371 C ARG A 24 11.769 -1.206 4.482 1.00 0.00 C ATOM 372 O ARG A 24 12.540 -0.318 4.742 1.00 0.00 O ATOM 373 CB ARG A 24 9.663 -1.558 5.811 1.00 0.00 C ATOM 374 CG ARG A 24 8.586 -0.772 6.553 1.00 0.00 C ATOM 375 CD ARG A 24 7.761 -1.700 7.510 1.00 0.00 C ATOM 376 NE ARG A 24 6.857 -0.869 8.314 1.00 0.00 N ATOM 377 CZ ARG A 24 7.007 -0.522 9.591 1.00 0.00 C ATOM 378 NH1 ARG A 24 8.153 -0.755 10.283 1.00 0.00 N ATOM 379 NH2 ARG A 24 6.022 0.133 10.256 1.00 0.00 N ATOM 0 H ARG A 24 8.875 -2.254 3.530 1.00 0.00 H new ATOM 0 HA ARG A 24 10.007 0.098 4.544 1.00 0.00 H new ATOM 0 HB2 ARG A 24 9.254 -2.540 5.573 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.493 -1.717 6.499 1.00 0.00 H new ATOM 0 HG2 ARG A 24 9.049 0.029 7.130 1.00 0.00 H new ATOM 0 HG3 ARG A 24 7.916 -0.300 5.834 1.00 0.00 H new ATOM 0 HD2 ARG A 24 7.191 -2.427 6.931 1.00 0.00 H new ATOM 0 HD3 ARG A 24 8.431 -2.264 8.158 1.00 0.00 H new ATOM 0 HE ARG A 24 6.023 -0.519 7.843 1.00 0.00 H new ATOM 0 HH11 ARG A 24 8.941 -1.212 9.825 1.00 0.00 H new ATOM 0 HH12 ARG A 24 8.225 -0.472 11.260 1.00 0.00 H new ATOM 0 HH21 ARG A 24 5.152 0.366 9.778 1.00 0.00 H new ATOM 0 HH22 ARG A 24 6.152 0.392 11.234 1.00 0.00 H new ATOM 393 N ALA A 25 12.080 -2.524 4.216 1.00 0.00 N ATOM 394 CA ALA A 25 13.484 -2.939 3.959 1.00 0.00 C ATOM 395 C ALA A 25 14.245 -1.785 3.276 1.00 0.00 C ATOM 396 O ALA A 25 15.256 -1.322 3.791 1.00 0.00 O ATOM 397 CB ALA A 25 13.558 -4.216 3.162 1.00 0.00 C ATOM 0 H ALA A 25 11.397 -3.280 4.178 1.00 0.00 H new ATOM 0 HA ALA A 25 13.964 -3.154 4.914 1.00 0.00 H new ATOM 0 HB1 ALA A 25 14.602 -4.482 2.997 1.00 0.00 H new ATOM 0 HB2 ALA A 25 13.062 -5.017 3.711 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.064 -4.074 2.201 1.00 0.00 H new ATOM 403 N GLN A 26 13.704 -1.311 2.134 1.00 0.00 N ATOM 404 CA GLN A 26 13.873 0.045 1.598 1.00 0.00 C ATOM 405 C GLN A 26 13.781 1.115 2.675 1.00 0.00 C ATOM 406 O GLN A 26 14.804 1.557 3.292 1.00 0.00 O ATOM 407 CB GLN A 26 13.012 0.298 0.413 1.00 0.00 C ATOM 408 CG GLN A 26 12.386 -0.669 -0.462 1.00 0.00 C ATOM 409 CD GLN A 26 12.896 -2.047 -0.693 1.00 0.00 C ATOM 410 OE1 GLN A 26 12.271 -2.894 -1.413 1.00 0.00 O ATOM 411 NE2 GLN A 26 14.084 -2.458 -0.202 1.00 0.00 N ATOM 0 H GLN A 26 13.113 -1.892 1.539 1.00 0.00 H new ATOM 0 HA GLN A 26 14.895 0.113 1.224 1.00 0.00 H new ATOM 0 HB2 GLN A 26 12.194 0.915 0.784 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.613 0.927 -0.244 1.00 0.00 H new ATOM 0 HG2 GLN A 26 11.362 -0.781 -0.105 1.00 0.00 H new ATOM 0 HG3 GLN A 26 12.332 -0.198 -1.444 1.00 0.00 H new ATOM 0 HE21 GLN A 26 14.638 -1.832 0.382 1.00 0.00 H new ATOM 0 HE22 GLN A 26 14.427 -3.394 -0.415 1.00 0.00 H new ATOM 420 N ALA A 27 12.563 1.658 2.958 1.00 0.00 N ATOM 421 CA ALA A 27 12.240 2.851 3.663 1.00 0.00 C ATOM 422 C ALA A 27 13.151 3.258 4.792 1.00 0.00 C ATOM 423 O ALA A 27 13.324 4.490 5.013 1.00 0.00 O ATOM 424 CB ALA A 27 10.761 2.866 4.135 1.00 0.00 C ATOM 0 H ALA A 27 11.714 1.187 2.645 1.00 0.00 H new ATOM 0 HA ALA A 27 12.405 3.613 2.902 1.00 0.00 H new ATOM 0 HB1 ALA A 27 10.559 3.795 4.668 1.00 0.00 H new ATOM 0 HB2 ALA A 27 10.102 2.794 3.270 1.00 0.00 H new ATOM 0 HB3 ALA A 27 10.582 2.020 4.799 1.00 0.00 H new ATOM 430 N GLU A 28 13.678 2.312 5.571 1.00 0.00 N ATOM 431 CA GLU A 28 14.616 2.567 6.708 1.00 0.00 C ATOM 432 C GLU A 28 16.087 2.410 6.242 1.00 0.00 C ATOM 433 O GLU A 28 16.977 3.190 6.606 1.00 0.00 O ATOM 434 CB GLU A 28 14.269 1.670 7.897 1.00 0.00 C ATOM 435 CG GLU A 28 15.254 0.534 8.118 1.00 0.00 C ATOM 436 CD GLU A 28 14.834 -0.501 9.180 1.00 0.00 C ATOM 437 OE1 GLU A 28 13.966 -0.140 10.018 1.00 0.00 O ATOM 438 OE2 GLU A 28 15.406 -1.614 9.137 1.00 0.00 O ATOM 0 H GLU A 28 13.472 1.322 5.441 1.00 0.00 H new ATOM 0 HA GLU A 28 14.503 3.597 7.048 1.00 0.00 H new ATOM 0 HB2 GLU A 28 14.224 2.280 8.799 1.00 0.00 H new ATOM 0 HB3 GLU A 28 13.274 1.251 7.746 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.407 0.017 7.171 1.00 0.00 H new ATOM 0 HG3 GLU A 28 16.215 0.959 8.408 1.00 0.00 H new ATOM 445 N LYS A 29 16.333 1.330 5.458 1.00 0.00 N ATOM 446 CA LYS A 29 17.612 1.215 4.640 1.00 0.00 C ATOM 447 C LYS A 29 17.857 2.526 3.864 1.00 0.00 C ATOM 448 O LYS A 29 18.953 2.787 3.327 1.00 0.00 O ATOM 449 CB LYS A 29 17.445 0.031 3.687 1.00 0.00 C ATOM 450 CG LYS A 29 18.314 0.168 2.430 1.00 0.00 C ATOM 451 CD LYS A 29 18.484 -1.122 1.607 1.00 0.00 C ATOM 452 CE LYS A 29 17.242 -1.240 0.663 1.00 0.00 C ATOM 453 NZ LYS A 29 17.679 -1.629 -0.670 1.00 0.00 N ATOM 0 H LYS A 29 15.697 0.538 5.362 1.00 0.00 H new ATOM 0 HA LYS A 29 18.476 1.050 5.284 1.00 0.00 H new ATOM 0 HB2 LYS A 29 17.705 -0.891 4.207 1.00 0.00 H new ATOM 0 HB3 LYS A 29 16.398 -0.053 3.395 1.00 0.00 H new ATOM 0 HG2 LYS A 29 17.879 0.934 1.789 1.00 0.00 H new ATOM 0 HG3 LYS A 29 19.301 0.523 2.727 1.00 0.00 H new ATOM 0 HD2 LYS A 29 19.406 -1.088 1.026 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.552 -1.990 2.263 1.00 0.00 H new ATOM 0 HE2 LYS A 29 16.542 -1.977 1.057 1.00 0.00 H new ATOM 0 HE3 LYS A 29 16.713 -0.288 0.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 16.853 -1.707 -1.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 18.331 -0.911 -1.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 18.165 -2.547 -0.622 1.00 0.00 H new ATOM 467 N TYR A 30 16.759 3.304 3.718 1.00 0.00 N ATOM 468 CA TYR A 30 16.838 4.769 3.362 1.00 0.00 C ATOM 469 C TYR A 30 16.246 5.536 4.552 1.00 0.00 C ATOM 470 O TYR A 30 15.621 4.972 5.458 1.00 0.00 O ATOM 471 CB TYR A 30 15.941 4.944 2.081 1.00 0.00 C ATOM 472 CG TYR A 30 16.550 4.203 0.855 1.00 0.00 C ATOM 473 CD1 TYR A 30 17.678 4.742 0.283 1.00 0.00 C ATOM 474 CD2 TYR A 30 15.998 2.982 0.410 1.00 0.00 C ATOM 475 CE1 TYR A 30 18.213 4.149 -0.865 1.00 0.00 C ATOM 476 CE2 TYR A 30 16.676 2.265 -0.577 1.00 0.00 C ATOM 477 CZ TYR A 30 17.754 2.876 -1.238 1.00 0.00 C ATOM 478 OH TYR A 30 18.370 2.205 -2.253 1.00 0.00 O ATOM 0 H TYR A 30 15.807 2.959 3.837 1.00 0.00 H new ATOM 0 HA TYR A 30 17.848 5.129 3.164 1.00 0.00 H new ATOM 0 HB2 TYR A 30 14.941 4.560 2.280 1.00 0.00 H new ATOM 0 HB3 TYR A 30 15.835 6.004 1.851 1.00 0.00 H new ATOM 0 HD1 TYR A 30 18.146 5.614 0.716 1.00 0.00 H new ATOM 0 HD2 TYR A 30 15.072 2.611 0.824 1.00 0.00 H new ATOM 0 HE1 TYR A 30 18.963 4.659 -1.452 1.00 0.00 H new ATOM 0 HE2 TYR A 30 16.377 1.258 -0.828 1.00 0.00 H new ATOM 0 HH TYR A 30 17.932 1.338 -2.385 1.00 0.00 H new ATOM 488 N GLU A 31 16.462 6.864 4.525 1.00 0.00 N ATOM 489 CA GLU A 31 15.848 7.841 5.473 1.00 0.00 C ATOM 490 C GLU A 31 14.483 8.331 4.892 1.00 0.00 C ATOM 491 O GLU A 31 14.073 9.462 5.204 1.00 0.00 O ATOM 492 CB GLU A 31 16.772 9.062 5.632 1.00 0.00 C ATOM 493 CG GLU A 31 17.146 9.691 4.261 1.00 0.00 C ATOM 494 CD GLU A 31 17.106 11.206 4.206 1.00 0.00 C ATOM 495 OE1 GLU A 31 16.321 11.792 5.047 1.00 0.00 O ATOM 496 OE2 GLU A 31 17.797 11.814 3.373 1.00 0.00 O ATOM 0 H GLU A 31 17.075 7.305 3.839 1.00 0.00 H new ATOM 0 HA GLU A 31 15.701 7.357 6.439 1.00 0.00 H new ATOM 0 HB2 GLU A 31 16.280 9.811 6.252 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.681 8.763 6.154 1.00 0.00 H new ATOM 0 HG2 GLU A 31 18.149 9.361 3.991 1.00 0.00 H new ATOM 0 HG3 GLU A 31 16.467 9.299 3.504 1.00 0.00 H new ATOM 503 N VAL A 32 13.892 7.521 4.009 1.00 0.00 N ATOM 504 CA VAL A 32 12.523 7.739 3.456 1.00 0.00 C ATOM 505 C VAL A 32 11.555 8.118 4.587 1.00 0.00 C ATOM 506 O VAL A 32 11.372 7.381 5.563 1.00 0.00 O ATOM 507 CB VAL A 32 12.129 6.510 2.634 1.00 0.00 C ATOM 508 CG1 VAL A 32 10.628 6.337 2.387 1.00 0.00 C ATOM 509 CG2 VAL A 32 12.934 6.336 1.352 1.00 0.00 C ATOM 0 H VAL A 32 14.343 6.682 3.645 1.00 0.00 H new ATOM 0 HA VAL A 32 12.487 8.585 2.770 1.00 0.00 H new ATOM 0 HB VAL A 32 12.406 5.690 3.297 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.458 5.437 1.796 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.110 6.247 3.342 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.246 7.203 1.847 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.594 5.443 0.827 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.794 7.208 0.713 1.00 0.00 H new ATOM 0 HG23 VAL A 32 13.991 6.232 1.597 1.00 0.00 H new ATOM 519 N PRO A 33 10.972 9.317 4.445 1.00 0.00 N ATOM 520 CA PRO A 33 9.938 9.885 5.308 1.00 0.00 C ATOM 521 C PRO A 33 8.449 9.531 5.049 1.00 0.00 C ATOM 522 O PRO A 33 7.574 10.374 4.976 1.00 0.00 O ATOM 523 CB PRO A 33 10.183 11.394 5.305 1.00 0.00 C ATOM 524 CG PRO A 33 10.577 11.605 3.814 1.00 0.00 C ATOM 525 CD PRO A 33 11.476 10.382 3.526 1.00 0.00 C ATOM 0 HA PRO A 33 10.055 9.410 6.282 1.00 0.00 H new ATOM 0 HB2 PRO A 33 9.295 11.960 5.585 1.00 0.00 H new ATOM 0 HB3 PRO A 33 10.977 11.688 5.991 1.00 0.00 H new ATOM 0 HG2 PRO A 33 9.703 11.628 3.163 1.00 0.00 H new ATOM 0 HG3 PRO A 33 11.110 12.544 3.665 1.00 0.00 H new ATOM 0 HD2 PRO A 33 11.402 10.073 2.483 1.00 0.00 H new ATOM 0 HD3 PRO A 33 12.525 10.607 3.718 1.00 0.00 H new ATOM 533 N VAL A 34 8.227 8.177 5.147 1.00 0.00 N ATOM 534 CA VAL A 34 6.913 7.543 5.173 1.00 0.00 C ATOM 535 C VAL A 34 6.971 6.127 5.740 1.00 0.00 C ATOM 536 O VAL A 34 8.010 5.440 5.696 1.00 0.00 O ATOM 537 CB VAL A 34 6.130 7.737 3.883 1.00 0.00 C ATOM 538 CG1 VAL A 34 6.902 8.367 2.714 1.00 0.00 C ATOM 539 CG2 VAL A 34 5.413 6.407 3.410 1.00 0.00 C ATOM 0 H VAL A 34 8.991 7.504 5.210 1.00 0.00 H new ATOM 0 HA VAL A 34 6.294 8.077 5.894 1.00 0.00 H new ATOM 0 HB VAL A 34 5.381 8.477 4.164 1.00 0.00 H new ATOM 0 HG11 VAL A 34 6.244 8.456 1.850 1.00 0.00 H new ATOM 0 HG12 VAL A 34 7.257 9.356 3.003 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.754 7.736 2.458 1.00 0.00 H new ATOM 0 HG21 VAL A 34 4.867 6.597 2.486 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.160 5.632 3.238 1.00 0.00 H new ATOM 0 HG23 VAL A 34 4.717 6.075 4.180 1.00 0.00 H new ATOM 549 N ILE A 35 5.848 5.675 6.320 1.00 0.00 N ATOM 550 CA ILE A 35 5.655 4.365 7.034 1.00 0.00 C ATOM 551 C ILE A 35 4.636 3.485 6.318 1.00 0.00 C ATOM 552 O ILE A 35 3.588 3.940 5.812 1.00 0.00 O ATOM 553 CB ILE A 35 5.356 4.618 8.541 1.00 0.00 C ATOM 554 CG1 ILE A 35 6.393 5.506 9.216 1.00 0.00 C ATOM 555 CG2 ILE A 35 4.911 3.399 9.337 1.00 0.00 C ATOM 556 CD1 ILE A 35 7.467 4.875 10.098 1.00 0.00 C ATOM 0 H ILE A 35 4.993 6.231 6.313 1.00 0.00 H new ATOM 0 HA ILE A 35 6.580 3.789 7.004 1.00 0.00 H new ATOM 0 HB ILE A 35 4.444 5.215 8.544 1.00 0.00 H new ATOM 0 HG12 ILE A 35 6.903 6.066 8.432 1.00 0.00 H new ATOM 0 HG13 ILE A 35 5.854 6.231 9.826 1.00 0.00 H new ATOM 0 HG21 ILE A 35 4.730 3.687 10.373 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.994 2.998 8.906 1.00 0.00 H new ATOM 0 HG23 ILE A 35 5.691 2.638 9.303 1.00 0.00 H new ATOM 0 HD11 ILE A 35 8.117 5.655 10.495 1.00 0.00 H new ATOM 0 HD12 ILE A 35 6.994 4.343 10.923 1.00 0.00 H new ATOM 0 HD13 ILE A 35 8.059 4.176 9.507 1.00 0.00 H new ATOM 568 N ILE A 36 4.943 2.170 6.240 1.00 0.00 N ATOM 569 CA ILE A 36 4.313 1.130 5.366 1.00 0.00 C ATOM 570 C ILE A 36 3.842 -0.025 6.314 1.00 0.00 C ATOM 571 O ILE A 36 4.649 -0.514 7.116 1.00 0.00 O ATOM 572 CB ILE A 36 5.296 0.640 4.274 1.00 0.00 C ATOM 573 CG1 ILE A 36 6.478 1.646 4.073 1.00 0.00 C ATOM 574 CG2 ILE A 36 4.658 0.196 2.992 1.00 0.00 C ATOM 575 CD1 ILE A 36 7.642 1.141 3.205 1.00 0.00 C ATOM 0 H ILE A 36 5.683 1.772 6.819 1.00 0.00 H new ATOM 0 HA ILE A 36 3.461 1.535 4.820 1.00 0.00 H new ATOM 0 HB ILE A 36 5.722 -0.285 4.663 1.00 0.00 H new ATOM 0 HG12 ILE A 36 6.083 2.557 3.624 1.00 0.00 H new ATOM 0 HG13 ILE A 36 6.871 1.917 5.053 1.00 0.00 H new ATOM 0 HG21 ILE A 36 5.430 -0.128 2.294 1.00 0.00 H new ATOM 0 HG22 ILE A 36 3.979 -0.633 3.192 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.100 1.025 2.557 1.00 0.00 H new ATOM 0 HD11 ILE A 36 8.405 1.916 3.132 1.00 0.00 H new ATOM 0 HD12 ILE A 36 8.074 0.249 3.659 1.00 0.00 H new ATOM 0 HD13 ILE A 36 7.274 0.899 2.208 1.00 0.00 H new ATOM 587 N GLU A 37 2.558 -0.338 6.226 1.00 0.00 N ATOM 588 CA GLU A 37 1.864 -1.311 7.111 1.00 0.00 C ATOM 589 C GLU A 37 0.622 -1.878 6.368 1.00 0.00 C ATOM 590 O GLU A 37 -0.192 -1.117 5.858 1.00 0.00 O ATOM 591 CB GLU A 37 1.422 -0.662 8.436 1.00 0.00 C ATOM 592 CG GLU A 37 2.652 -0.054 9.186 1.00 0.00 C ATOM 593 CD GLU A 37 2.511 -0.231 10.711 1.00 0.00 C ATOM 594 OE1 GLU A 37 1.252 -0.253 11.102 1.00 0.00 O ATOM 595 OE2 GLU A 37 3.465 -0.368 11.459 1.00 0.00 O ATOM 0 H GLU A 37 1.941 0.077 5.528 1.00 0.00 H new ATOM 0 HA GLU A 37 2.562 -2.113 7.351 1.00 0.00 H new ATOM 0 HB2 GLU A 37 0.687 0.118 8.238 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.935 -1.405 9.067 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.567 -0.537 8.843 1.00 0.00 H new ATOM 0 HG3 GLU A 37 2.742 1.005 8.946 1.00 0.00 H new ATOM 602 N ALA A 38 0.597 -3.226 6.210 1.00 0.00 N ATOM 603 CA ALA A 38 -0.192 -3.961 5.230 1.00 0.00 C ATOM 604 C ALA A 38 -1.381 -4.722 5.877 1.00 0.00 C ATOM 605 O ALA A 38 -1.246 -5.639 6.648 1.00 0.00 O ATOM 606 CB ALA A 38 0.725 -5.017 4.537 1.00 0.00 C ATOM 0 H ALA A 38 1.157 -3.844 6.797 1.00 0.00 H new ATOM 0 HA ALA A 38 -0.591 -3.234 4.522 1.00 0.00 H new ATOM 0 HB1 ALA A 38 0.146 -5.574 3.801 1.00 0.00 H new ATOM 0 HB2 ALA A 38 1.552 -4.510 4.040 1.00 0.00 H new ATOM 0 HB3 ALA A 38 1.118 -5.705 5.286 1.00 0.00 H new ATOM 612 N PHE A 39 -2.603 -4.210 5.547 1.00 0.00 N ATOM 613 CA PHE A 39 -3.848 -4.311 6.299 1.00 0.00 C ATOM 614 C PHE A 39 -4.939 -5.014 5.489 1.00 0.00 C ATOM 615 O PHE A 39 -4.798 -5.259 4.326 1.00 0.00 O ATOM 616 CB PHE A 39 -4.301 -2.937 6.836 1.00 0.00 C ATOM 617 CG PHE A 39 -3.282 -2.185 7.679 1.00 0.00 C ATOM 618 CD1 PHE A 39 -2.151 -2.858 8.214 1.00 0.00 C ATOM 619 CD2 PHE A 39 -3.430 -0.799 7.895 1.00 0.00 C ATOM 620 CE1 PHE A 39 -1.212 -2.169 8.962 1.00 0.00 C ATOM 621 CE2 PHE A 39 -2.324 -0.057 8.380 1.00 0.00 C ATOM 622 CZ PHE A 39 -1.305 -0.745 9.046 1.00 0.00 C ATOM 0 H PHE A 39 -2.731 -3.682 4.684 1.00 0.00 H new ATOM 0 HA PHE A 39 -3.657 -4.936 7.171 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -4.576 -2.310 5.988 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -5.202 -3.081 7.432 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -2.023 -3.915 8.036 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -4.372 -0.310 7.694 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -0.422 -2.699 9.474 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -2.270 1.012 8.239 1.00 0.00 H new ATOM 0 HZ PHE A 39 -0.581 -0.195 9.629 1.00 0.00 H new ATOM 632 N PRO A 40 -6.016 -5.481 6.192 1.00 0.00 N ATOM 633 CA PRO A 40 -7.219 -6.086 5.598 1.00 0.00 C ATOM 634 C PRO A 40 -8.446 -5.210 5.323 1.00 0.00 C ATOM 635 O PRO A 40 -9.576 -5.429 5.735 1.00 0.00 O ATOM 636 CB PRO A 40 -7.542 -7.245 6.577 1.00 0.00 C ATOM 637 CG PRO A 40 -7.294 -6.539 7.933 1.00 0.00 C ATOM 638 CD PRO A 40 -6.056 -5.646 7.661 1.00 0.00 C ATOM 0 HA PRO A 40 -6.989 -6.369 4.571 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.567 -7.601 6.475 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -6.890 -8.106 6.431 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -8.156 -5.946 8.239 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -7.102 -7.258 8.730 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -6.146 -4.683 8.164 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -5.143 -6.114 8.030 1.00 0.00 H new ATOM 646 N GLU A 41 -8.200 -4.206 4.466 1.00 0.00 N ATOM 647 CA GLU A 41 -8.976 -3.077 4.155 1.00 0.00 C ATOM 648 C GLU A 41 -9.676 -2.274 5.215 1.00 0.00 C ATOM 649 O GLU A 41 -9.883 -1.010 5.023 1.00 0.00 O ATOM 650 CB GLU A 41 -9.798 -3.210 2.865 1.00 0.00 C ATOM 651 CG GLU A 41 -11.276 -3.536 3.111 1.00 0.00 C ATOM 652 CD GLU A 41 -12.240 -2.746 2.167 1.00 0.00 C ATOM 653 OE1 GLU A 41 -11.741 -2.160 1.186 1.00 0.00 O ATOM 654 OE2 GLU A 41 -13.464 -2.802 2.484 1.00 0.00 O ATOM 0 H GLU A 41 -7.334 -4.203 3.927 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.132 -2.407 3.992 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -9.728 -2.279 2.302 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -9.360 -3.992 2.244 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -11.435 -4.605 2.971 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -11.525 -3.309 4.148 1.00 0.00 H new ATOM 661 N THR A 42 -10.187 -2.856 6.285 1.00 0.00 N ATOM 662 CA THR A 42 -10.934 -2.262 7.446 1.00 0.00 C ATOM 663 C THR A 42 -9.993 -1.494 8.355 1.00 0.00 C ATOM 664 O THR A 42 -10.317 -1.028 9.448 1.00 0.00 O ATOM 665 CB THR A 42 -11.556 -3.429 8.302 1.00 0.00 C ATOM 666 OG1 THR A 42 -10.457 -4.214 8.859 1.00 0.00 O ATOM 667 CG2 THR A 42 -12.386 -4.318 7.303 1.00 0.00 C ATOM 0 H THR A 42 -10.094 -3.865 6.402 1.00 0.00 H new ATOM 0 HA THR A 42 -11.700 -1.594 7.053 1.00 0.00 H new ATOM 0 HB THR A 42 -12.186 -3.062 9.112 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.819 -4.947 9.399 1.00 0.00 H new ATOM 0 HG21 THR A 42 -12.842 -5.146 7.845 1.00 0.00 H new ATOM 0 HG22 THR A 42 -13.167 -3.714 6.841 1.00 0.00 H new ATOM 0 HG23 THR A 42 -11.725 -4.710 6.530 1.00 0.00 H new ATOM 675 N LEU A 43 -8.691 -1.385 7.882 1.00 0.00 N ATOM 676 CA LEU A 43 -7.758 -0.297 8.294 1.00 0.00 C ATOM 677 C LEU A 43 -7.290 0.470 7.055 1.00 0.00 C ATOM 678 O LEU A 43 -6.185 1.010 7.015 1.00 0.00 O ATOM 679 CB LEU A 43 -6.544 -1.106 8.922 1.00 0.00 C ATOM 680 CG LEU A 43 -6.746 -1.557 10.420 1.00 0.00 C ATOM 681 CD1 LEU A 43 -5.636 -2.454 10.959 1.00 0.00 C ATOM 682 CD2 LEU A 43 -7.039 -0.336 11.305 1.00 0.00 C ATOM 0 H LEU A 43 -8.283 -2.044 7.219 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.197 0.431 8.976 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.364 -1.992 8.313 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -5.647 -0.490 8.862 1.00 0.00 H new ATOM 0 HG LEU A 43 -7.621 -2.206 10.447 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -5.852 -2.718 11.994 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.577 -3.361 10.358 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.685 -1.924 10.911 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -7.177 -0.659 12.337 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -6.203 0.361 11.252 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.946 0.158 10.955 1.00 0.00 H new ATOM 694 N ALA A 44 -8.138 0.518 6.003 1.00 0.00 N ATOM 695 CA ALA A 44 -8.065 1.519 4.936 1.00 0.00 C ATOM 696 C ALA A 44 -8.787 2.843 5.344 1.00 0.00 C ATOM 697 O ALA A 44 -8.314 3.934 5.121 1.00 0.00 O ATOM 698 CB ALA A 44 -8.611 1.018 3.611 1.00 0.00 C ATOM 0 H ALA A 44 -8.899 -0.150 5.878 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.003 1.721 4.794 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -8.529 1.806 2.862 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -8.039 0.148 3.287 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -9.658 0.739 3.731 1.00 0.00 H new ATOM 704 N GLY A 45 -9.995 2.635 5.933 1.00 0.00 N ATOM 705 CA GLY A 45 -10.684 3.622 6.794 1.00 0.00 C ATOM 706 C GLY A 45 -9.690 4.532 7.555 1.00 0.00 C ATOM 707 O GLY A 45 -9.621 5.737 7.334 1.00 0.00 O ATOM 0 H GLY A 45 -10.519 1.767 5.819 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -11.342 4.239 6.182 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.315 3.097 7.511 1.00 0.00 H new ATOM 711 N GLU A 46 -8.930 3.887 8.462 1.00 0.00 N ATOM 712 CA GLU A 46 -8.022 4.556 9.437 1.00 0.00 C ATOM 713 C GLU A 46 -6.674 4.903 8.770 1.00 0.00 C ATOM 714 O GLU A 46 -6.236 6.080 8.838 1.00 0.00 O ATOM 715 CB GLU A 46 -7.833 3.672 10.671 1.00 0.00 C ATOM 716 CG GLU A 46 -6.823 4.325 11.663 1.00 0.00 C ATOM 717 CD GLU A 46 -7.370 5.598 12.294 1.00 0.00 C ATOM 718 OE1 GLU A 46 -8.513 5.971 11.928 1.00 0.00 O ATOM 719 OE2 GLU A 46 -6.657 6.233 13.121 1.00 0.00 O ATOM 0 H GLU A 46 -8.924 2.870 8.546 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.475 5.492 9.763 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.792 3.520 11.167 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.471 2.689 10.369 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -6.576 3.611 12.448 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.896 4.553 11.136 1.00 0.00 H new ATOM 726 N LYS A 47 -5.992 3.881 8.238 1.00 0.00 N ATOM 727 CA LYS A 47 -4.563 4.055 7.716 1.00 0.00 C ATOM 728 C LYS A 47 -4.598 4.582 6.302 1.00 0.00 C ATOM 729 O LYS A 47 -3.803 5.453 5.892 1.00 0.00 O ATOM 730 CB LYS A 47 -3.867 2.701 7.828 1.00 0.00 C ATOM 731 CG LYS A 47 -4.049 2.194 9.320 1.00 0.00 C ATOM 732 CD LYS A 47 -2.908 2.602 10.233 1.00 0.00 C ATOM 733 CE LYS A 47 -3.000 1.945 11.591 1.00 0.00 C ATOM 734 NZ LYS A 47 -3.109 2.978 12.683 1.00 0.00 N ATOM 0 H LYS A 47 -6.363 2.936 8.143 1.00 0.00 H new ATOM 0 HA LYS A 47 -4.003 4.784 8.301 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.299 1.988 7.125 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.809 2.792 7.580 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.984 2.588 9.719 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.135 1.107 9.320 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.959 2.337 9.767 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -2.912 3.685 10.354 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -3.867 1.285 11.622 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.120 1.324 11.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -3.171 2.502 13.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -2.270 3.592 12.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -3.962 3.554 12.532 1.00 0.00 H new ATOM 748 N GLY A 48 -5.524 4.028 5.487 1.00 0.00 N ATOM 749 CA GLY A 48 -5.928 4.553 4.191 1.00 0.00 C ATOM 750 C GLY A 48 -6.578 5.922 4.204 1.00 0.00 C ATOM 751 O GLY A 48 -6.632 6.638 3.197 1.00 0.00 O ATOM 0 H GLY A 48 -6.020 3.172 5.736 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -5.049 4.596 3.548 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -6.622 3.847 3.735 1.00 0.00 H new ATOM 755 N GLN A 49 -7.078 6.352 5.413 1.00 0.00 N ATOM 756 CA GLN A 49 -7.256 7.742 5.798 1.00 0.00 C ATOM 757 C GLN A 49 -5.939 8.510 5.947 1.00 0.00 C ATOM 758 O GLN A 49 -5.764 9.598 5.352 1.00 0.00 O ATOM 759 CB GLN A 49 -8.040 7.789 7.112 1.00 0.00 C ATOM 760 CG GLN A 49 -8.341 9.190 7.654 1.00 0.00 C ATOM 761 CD GLN A 49 -8.347 9.313 9.164 1.00 0.00 C ATOM 762 OE1 GLN A 49 -7.993 10.368 9.778 1.00 0.00 O ATOM 763 NE2 GLN A 49 -8.755 8.274 9.902 1.00 0.00 N ATOM 0 H GLN A 49 -7.366 5.701 6.143 1.00 0.00 H new ATOM 0 HA GLN A 49 -7.803 8.236 4.995 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -8.984 7.263 6.970 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -7.480 7.239 7.868 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -7.602 9.883 7.252 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -9.313 9.506 7.276 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -9.047 7.409 9.447 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -8.774 8.347 10.919 1.00 0.00 H new ATOM 772 N ASN A 50 -5.013 8.007 6.803 1.00 0.00 N ATOM 773 CA ASN A 50 -3.852 8.725 7.344 1.00 0.00 C ATOM 774 C ASN A 50 -2.593 8.545 6.469 1.00 0.00 C ATOM 775 O ASN A 50 -1.473 8.777 6.894 1.00 0.00 O ATOM 776 CB ASN A 50 -3.618 8.257 8.808 1.00 0.00 C ATOM 777 CG ASN A 50 -4.501 9.007 9.834 1.00 0.00 C ATOM 778 OD1 ASN A 50 -5.627 8.607 10.190 1.00 0.00 O ATOM 779 ND2 ASN A 50 -4.018 10.163 10.315 1.00 0.00 N ATOM 0 H ASN A 50 -5.066 7.047 7.144 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.059 9.795 7.336 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -3.819 7.188 8.878 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -2.569 8.402 9.066 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -4.572 10.713 10.971 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -3.097 10.491 10.024 1.00 0.00 H new ATOM 786 N ALA A 51 -2.820 7.994 5.251 1.00 0.00 N ATOM 787 CA ALA A 51 -1.813 7.731 4.237 1.00 0.00 C ATOM 788 C ALA A 51 -1.332 8.985 3.501 1.00 0.00 C ATOM 789 O ALA A 51 -1.835 10.101 3.683 1.00 0.00 O ATOM 790 CB ALA A 51 -2.349 6.734 3.172 1.00 0.00 C ATOM 0 H ALA A 51 -3.755 7.715 4.953 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.968 7.313 4.783 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.578 6.552 2.423 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.615 5.794 3.655 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -3.231 7.156 2.690 1.00 0.00 H new ATOM 796 N ASP A 52 -0.287 8.798 2.676 1.00 0.00 N ATOM 797 CA ASP A 52 0.058 9.557 1.459 1.00 0.00 C ATOM 798 C ASP A 52 -0.384 8.719 0.208 1.00 0.00 C ATOM 799 O ASP A 52 -0.960 9.240 -0.725 1.00 0.00 O ATOM 800 CB ASP A 52 1.611 9.683 1.403 1.00 0.00 C ATOM 801 CG ASP A 52 2.096 10.244 0.069 1.00 0.00 C ATOM 802 OD1 ASP A 52 1.346 11.106 -0.527 1.00 0.00 O ATOM 803 OD2 ASP A 52 3.190 9.809 -0.387 1.00 0.00 O ATOM 0 H ASP A 52 0.390 8.057 2.855 1.00 0.00 H new ATOM 0 HA ASP A 52 -0.427 10.533 1.467 1.00 0.00 H new ATOM 0 HB2 ASP A 52 1.951 10.329 2.212 1.00 0.00 H new ATOM 0 HB3 ASP A 52 2.060 8.703 1.568 1.00 0.00 H new ATOM 808 N VAL A 53 0.095 7.435 0.247 1.00 0.00 N ATOM 809 CA VAL A 53 -0.208 6.411 -0.722 1.00 0.00 C ATOM 810 C VAL A 53 -0.695 5.098 0.006 1.00 0.00 C ATOM 811 O VAL A 53 -0.469 4.891 1.173 1.00 0.00 O ATOM 812 CB VAL A 53 0.919 6.129 -1.711 1.00 0.00 C ATOM 813 CG1 VAL A 53 0.539 5.366 -2.993 1.00 0.00 C ATOM 814 CG2 VAL A 53 1.813 7.356 -2.039 1.00 0.00 C ATOM 0 H VAL A 53 0.717 7.108 0.987 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.020 6.800 -1.337 1.00 0.00 H new ATOM 0 HB VAL A 53 1.519 5.427 -1.132 1.00 0.00 H new ATOM 0 HG11 VAL A 53 1.426 5.229 -3.611 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.127 4.392 -2.728 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.206 5.936 -3.548 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.586 7.063 -2.749 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.201 8.146 -2.474 1.00 0.00 H new ATOM 0 HG23 VAL A 53 2.280 7.721 -1.124 1.00 0.00 H new ATOM 824 N VAL A 54 -1.493 4.328 -0.764 1.00 0.00 N ATOM 825 CA VAL A 54 -2.308 3.192 -0.251 1.00 0.00 C ATOM 826 C VAL A 54 -2.551 2.219 -1.404 1.00 0.00 C ATOM 827 O VAL A 54 -2.676 2.593 -2.569 1.00 0.00 O ATOM 828 CB VAL A 54 -3.567 3.740 0.435 1.00 0.00 C ATOM 829 CG1 VAL A 54 -4.740 2.788 0.578 1.00 0.00 C ATOM 830 CG2 VAL A 54 -3.230 4.414 1.792 1.00 0.00 C ATOM 0 H VAL A 54 -1.595 4.474 -1.768 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.796 2.619 0.522 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.926 4.487 -0.273 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.563 3.298 1.078 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.063 2.458 -0.409 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.437 1.923 1.168 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.145 4.790 2.249 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -2.767 3.684 2.456 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.541 5.242 1.626 1.00 0.00 H new ATOM 840 N LEU A 55 -2.474 0.910 -1.068 1.00 0.00 N ATOM 841 CA LEU A 55 -2.681 -0.251 -1.934 1.00 0.00 C ATOM 842 C LEU A 55 -3.674 -1.235 -1.352 1.00 0.00 C ATOM 843 O LEU A 55 -3.742 -1.386 -0.106 1.00 0.00 O ATOM 844 CB LEU A 55 -1.244 -0.831 -2.070 1.00 0.00 C ATOM 845 CG LEU A 55 -0.133 0.151 -2.478 1.00 0.00 C ATOM 846 CD1 LEU A 55 -0.424 0.884 -3.828 1.00 0.00 C ATOM 847 CD2 LEU A 55 0.211 1.174 -1.352 1.00 0.00 C ATOM 0 H LEU A 55 -2.249 0.629 -0.114 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.125 -0.002 -2.898 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.967 -1.279 -1.116 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -1.271 -1.636 -2.804 1.00 0.00 H new ATOM 0 HG LEU A 55 0.748 -0.471 -2.636 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.398 1.562 -4.058 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -0.523 0.149 -4.627 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -1.350 1.453 -3.741 1.00 0.00 H new ATOM 0 HD21 LEU A 55 1.001 1.842 -1.696 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -0.676 1.758 -1.107 1.00 0.00 H new ATOM 0 HD23 LEU A 55 0.549 0.639 -0.465 1.00 0.00 H new ATOM 859 N LEU A 56 -4.495 -1.893 -2.168 1.00 0.00 N ATOM 860 CA LEU A 56 -5.505 -2.901 -1.867 1.00 0.00 C ATOM 861 C LEU A 56 -5.179 -4.206 -2.593 1.00 0.00 C ATOM 862 O LEU A 56 -4.979 -4.165 -3.809 1.00 0.00 O ATOM 863 CB LEU A 56 -6.845 -2.313 -2.366 1.00 0.00 C ATOM 864 CG LEU A 56 -8.138 -3.114 -2.116 1.00 0.00 C ATOM 865 CD1 LEU A 56 -8.202 -4.476 -2.820 1.00 0.00 C ATOM 866 CD2 LEU A 56 -8.447 -3.251 -0.603 1.00 0.00 C ATOM 0 H LEU A 56 -4.463 -1.710 -3.171 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.546 -3.132 -0.803 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.968 -1.332 -1.906 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.757 -2.153 -3.441 1.00 0.00 H new ATOM 0 HG LEU A 56 -8.922 -2.516 -2.581 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.148 -4.964 -2.584 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -8.127 -4.332 -3.898 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -7.377 -5.101 -2.479 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -9.366 -3.822 -0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -7.624 -3.767 -0.109 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -8.569 -2.260 -0.165 1.00 0.00 H new ATOM 878 N GLY A 57 -5.045 -5.333 -1.873 1.00 0.00 N ATOM 879 CA GLY A 57 -4.667 -6.652 -2.416 1.00 0.00 C ATOM 880 C GLY A 57 -5.244 -6.897 -3.803 1.00 0.00 C ATOM 881 O GLY A 57 -6.229 -6.279 -4.212 1.00 0.00 O ATOM 0 H GLY A 57 -5.201 -5.353 -0.865 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -3.580 -6.726 -2.460 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -5.013 -7.433 -1.739 1.00 0.00 H new ATOM 885 N PRO A 58 -4.562 -7.770 -4.584 1.00 0.00 N ATOM 886 CA PRO A 58 -4.948 -8.164 -5.957 1.00 0.00 C ATOM 887 C PRO A 58 -6.128 -9.167 -6.122 1.00 0.00 C ATOM 888 O PRO A 58 -6.684 -9.365 -7.188 1.00 0.00 O ATOM 889 CB PRO A 58 -3.693 -8.519 -6.664 1.00 0.00 C ATOM 890 CG PRO A 58 -2.786 -9.084 -5.555 1.00 0.00 C ATOM 891 CD PRO A 58 -3.205 -8.285 -4.309 1.00 0.00 C ATOM 0 HA PRO A 58 -5.431 -7.311 -6.434 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -3.871 -9.256 -7.447 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -3.244 -7.648 -7.141 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -2.940 -10.154 -5.416 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -1.731 -8.941 -5.788 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -3.202 -8.918 -3.422 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -2.510 -7.467 -4.119 1.00 0.00 H new ATOM 899 N GLN A 59 -6.565 -9.647 -4.928 1.00 0.00 N ATOM 900 CA GLN A 59 -7.622 -10.657 -4.756 1.00 0.00 C ATOM 901 C GLN A 59 -8.884 -10.037 -4.156 1.00 0.00 C ATOM 902 O GLN A 59 -10.024 -10.501 -4.393 1.00 0.00 O ATOM 903 CB GLN A 59 -7.075 -11.773 -3.867 1.00 0.00 C ATOM 904 CG GLN A 59 -5.538 -11.924 -3.942 1.00 0.00 C ATOM 905 CD GLN A 59 -4.886 -11.894 -2.555 1.00 0.00 C ATOM 906 OE1 GLN A 59 -4.275 -10.909 -2.086 1.00 0.00 O ATOM 907 NE2 GLN A 59 -5.031 -12.985 -1.767 1.00 0.00 N ATOM 0 H GLN A 59 -6.176 -9.328 -4.040 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.905 -11.066 -5.726 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -7.363 -11.578 -2.834 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -7.539 -12.716 -4.155 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -5.290 -12.863 -4.438 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -5.125 -11.122 -4.553 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -5.524 -13.806 -2.118 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -4.647 -12.986 -0.822 1.00 0.00 H new ATOM 916 N ILE A 60 -8.718 -9.020 -3.285 1.00 0.00 N ATOM 917 CA ILE A 60 -9.783 -8.176 -2.703 1.00 0.00 C ATOM 918 C ILE A 60 -10.234 -7.137 -3.772 1.00 0.00 C ATOM 919 O ILE A 60 -11.219 -6.434 -3.556 1.00 0.00 O ATOM 920 CB ILE A 60 -9.465 -7.624 -1.340 1.00 0.00 C ATOM 921 CG1 ILE A 60 -8.027 -7.858 -0.842 1.00 0.00 C ATOM 922 CG2 ILE A 60 -10.513 -7.900 -0.242 1.00 0.00 C ATOM 923 CD1 ILE A 60 -7.669 -7.181 0.485 1.00 0.00 C ATOM 0 H ILE A 60 -7.792 -8.752 -2.952 1.00 0.00 H new ATOM 0 HA ILE A 60 -10.646 -8.799 -2.469 1.00 0.00 H new ATOM 0 HB ILE A 60 -9.531 -6.554 -1.538 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.868 -8.931 -0.737 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -7.335 -7.507 -1.607 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -10.181 -7.457 0.697 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -11.468 -7.462 -0.532 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -10.631 -8.976 -0.114 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -6.635 -7.410 0.743 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -7.788 -6.102 0.387 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -8.329 -7.548 1.271 1.00 0.00 H new ATOM 935 N ALA A 61 -9.491 -7.088 -4.883 1.00 0.00 N ATOM 936 CA ALA A 61 -9.777 -6.284 -6.074 1.00 0.00 C ATOM 937 C ALA A 61 -11.006 -5.383 -5.920 1.00 0.00 C ATOM 938 O ALA A 61 -10.891 -4.135 -5.948 1.00 0.00 O ATOM 939 CB ALA A 61 -9.954 -7.168 -7.333 1.00 0.00 C ATOM 0 H ALA A 61 -8.635 -7.633 -4.980 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.905 -5.642 -6.195 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.165 -6.535 -8.195 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -9.039 -7.733 -7.512 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.783 -7.859 -7.179 1.00 0.00 H new ATOM 945 N TYR A 62 -12.199 -6.010 -5.810 1.00 0.00 N ATOM 946 CA TYR A 62 -13.517 -5.398 -5.906 1.00 0.00 C ATOM 947 C TYR A 62 -13.738 -4.314 -4.881 1.00 0.00 C ATOM 948 O TYR A 62 -14.718 -3.496 -4.990 1.00 0.00 O ATOM 949 CB TYR A 62 -14.641 -6.472 -5.892 1.00 0.00 C ATOM 950 CG TYR A 62 -14.745 -7.268 -4.579 1.00 0.00 C ATOM 951 CD1 TYR A 62 -13.748 -7.158 -3.590 1.00 0.00 C ATOM 952 CD2 TYR A 62 -15.845 -8.113 -4.445 1.00 0.00 C ATOM 953 CE1 TYR A 62 -13.941 -7.814 -2.362 1.00 0.00 C ATOM 954 CE2 TYR A 62 -16.005 -8.821 -3.231 1.00 0.00 C ATOM 955 CZ TYR A 62 -15.028 -8.672 -2.234 1.00 0.00 C ATOM 956 OH TYR A 62 -15.121 -9.452 -1.103 1.00 0.00 O ATOM 0 H TYR A 62 -12.256 -7.014 -5.642 1.00 0.00 H new ATOM 0 HA TYR A 62 -13.562 -4.896 -6.872 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -15.596 -5.983 -6.082 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -14.471 -7.169 -6.712 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -12.853 -6.581 -3.772 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -16.558 -8.225 -5.249 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -13.261 -7.656 -1.538 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -16.860 -9.462 -3.075 1.00 0.00 H new ATOM 0 HH TYR A 62 -15.932 -10.001 -1.150 1.00 0.00 H new ATOM 966 N MET A 63 -12.899 -4.252 -3.842 1.00 0.00 N ATOM 967 CA MET A 63 -12.940 -3.357 -2.693 1.00 0.00 C ATOM 968 C MET A 63 -12.552 -1.904 -3.027 1.00 0.00 C ATOM 969 O MET A 63 -12.580 -1.023 -2.173 1.00 0.00 O ATOM 970 CB MET A 63 -12.021 -3.935 -1.560 1.00 0.00 C ATOM 971 CG MET A 63 -12.889 -4.932 -0.710 1.00 0.00 C ATOM 972 SD MET A 63 -12.031 -5.585 0.755 1.00 0.00 S ATOM 973 CE MET A 63 -13.416 -5.756 1.896 1.00 0.00 C ATOM 0 H MET A 63 -12.103 -4.887 -3.784 1.00 0.00 H new ATOM 0 HA MET A 63 -13.975 -3.310 -2.354 1.00 0.00 H new ATOM 0 HB2 MET A 63 -11.159 -4.447 -1.989 1.00 0.00 H new ATOM 0 HB3 MET A 63 -11.635 -3.132 -0.932 1.00 0.00 H new ATOM 0 HG2 MET A 63 -13.800 -4.425 -0.391 1.00 0.00 H new ATOM 0 HG3 MET A 63 -13.193 -5.765 -1.343 1.00 0.00 H new ATOM 0 HE1 MET A 63 -13.053 -5.691 2.922 1.00 0.00 H new ATOM 0 HE2 MET A 63 -14.137 -4.959 1.715 1.00 0.00 H new ATOM 0 HE3 MET A 63 -13.897 -6.722 1.742 1.00 0.00 H new ATOM 983 N LEU A 64 -12.188 -1.686 -4.327 1.00 0.00 N ATOM 984 CA LEU A 64 -11.614 -0.469 -4.888 1.00 0.00 C ATOM 985 C LEU A 64 -12.606 0.681 -4.913 1.00 0.00 C ATOM 986 O LEU A 64 -12.226 1.841 -4.671 1.00 0.00 O ATOM 987 CB LEU A 64 -11.113 -0.813 -6.303 1.00 0.00 C ATOM 988 CG LEU A 64 -10.061 0.113 -6.947 1.00 0.00 C ATOM 989 CD1 LEU A 64 -9.011 0.651 -5.938 1.00 0.00 C ATOM 990 CD2 LEU A 64 -9.353 -0.573 -8.146 1.00 0.00 C ATOM 0 H LEU A 64 -12.303 -2.411 -5.035 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.792 -0.126 -4.260 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -10.697 -1.820 -6.274 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -11.979 -0.845 -6.965 1.00 0.00 H new ATOM 0 HG LEU A 64 -10.619 0.975 -7.313 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -8.302 1.295 -6.459 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.515 1.222 -5.158 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.477 -0.186 -5.487 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -8.619 0.110 -8.574 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.851 -1.477 -7.803 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -10.092 -0.834 -8.904 1.00 0.00 H new ATOM 1002 N PRO A 65 -13.882 0.424 -5.259 1.00 0.00 N ATOM 1003 CA PRO A 65 -14.989 1.410 -5.319 1.00 0.00 C ATOM 1004 C PRO A 65 -15.585 1.871 -3.926 1.00 0.00 C ATOM 1005 O PRO A 65 -15.917 3.001 -3.702 1.00 0.00 O ATOM 1006 CB PRO A 65 -15.999 0.908 -6.272 1.00 0.00 C ATOM 1007 CG PRO A 65 -15.489 -0.412 -6.800 1.00 0.00 C ATOM 1008 CD PRO A 65 -14.379 -0.866 -5.809 1.00 0.00 C ATOM 0 HA PRO A 65 -14.575 2.351 -5.681 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -16.963 0.780 -5.780 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -16.148 1.618 -7.086 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -16.291 -1.148 -6.852 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -15.091 -0.302 -7.809 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -14.775 -1.514 -5.027 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -13.589 -1.422 -6.313 1.00 0.00 H new ATOM 1016 N GLU A 66 -15.483 0.885 -3.025 1.00 0.00 N ATOM 1017 CA GLU A 66 -15.722 1.032 -1.575 1.00 0.00 C ATOM 1018 C GLU A 66 -14.677 1.894 -0.867 1.00 0.00 C ATOM 1019 O GLU A 66 -15.015 2.739 -0.041 1.00 0.00 O ATOM 1020 CB GLU A 66 -15.781 -0.370 -0.895 1.00 0.00 C ATOM 1021 CG GLU A 66 -16.285 -0.317 0.517 1.00 0.00 C ATOM 1022 CD GLU A 66 -17.745 -0.800 0.704 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -18.527 -0.576 -0.230 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -18.029 -1.406 1.786 1.00 0.00 O ATOM 0 H GLU A 66 -15.225 -0.066 -3.288 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.678 1.547 -1.477 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -16.426 -1.025 -1.481 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -14.785 -0.814 -0.903 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -15.633 -0.925 1.144 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -16.207 0.709 0.877 1.00 0.00 H new ATOM 1031 N ILE A 67 -13.393 1.622 -1.161 1.00 0.00 N ATOM 1032 CA ILE A 67 -12.245 2.512 -0.774 1.00 0.00 C ATOM 1033 C ILE A 67 -12.576 3.964 -1.114 1.00 0.00 C ATOM 1034 O ILE A 67 -12.508 4.852 -0.264 1.00 0.00 O ATOM 1035 CB ILE A 67 -10.914 1.978 -1.412 1.00 0.00 C ATOM 1036 CG1 ILE A 67 -10.710 0.501 -1.214 1.00 0.00 C ATOM 1037 CG2 ILE A 67 -9.731 2.908 -1.067 1.00 0.00 C ATOM 1038 CD1 ILE A 67 -9.617 -0.058 -0.332 1.00 0.00 C ATOM 0 H ILE A 67 -13.106 0.787 -1.671 1.00 0.00 H new ATOM 0 HA ILE A 67 -12.084 2.490 0.304 1.00 0.00 H new ATOM 0 HB ILE A 67 -10.991 2.034 -2.498 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -11.651 0.105 -0.833 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -10.561 0.071 -2.205 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -8.819 2.519 -1.519 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -9.930 3.908 -1.453 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -9.608 2.955 0.015 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -9.663 -1.147 -0.342 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -8.646 0.268 -0.705 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -9.753 0.302 0.688 1.00 0.00 H new ATOM 1050 N GLN A 68 -12.922 4.209 -2.404 1.00 0.00 N ATOM 1051 CA GLN A 68 -12.975 5.515 -3.063 1.00 0.00 C ATOM 1052 C GLN A 68 -14.190 6.341 -2.617 1.00 0.00 C ATOM 1053 O GLN A 68 -14.224 7.568 -2.750 1.00 0.00 O ATOM 1054 CB GLN A 68 -13.041 5.281 -4.584 1.00 0.00 C ATOM 1055 CG GLN A 68 -11.793 4.556 -5.154 1.00 0.00 C ATOM 1056 CD GLN A 68 -10.659 4.405 -4.169 1.00 0.00 C ATOM 1057 OE1 GLN A 68 -10.257 3.301 -3.715 1.00 0.00 O ATOM 1058 NE2 GLN A 68 -10.014 5.509 -3.724 1.00 0.00 N ATOM 0 H GLN A 68 -13.183 3.452 -3.036 1.00 0.00 H new ATOM 0 HA GLN A 68 -12.084 6.080 -2.788 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.930 4.693 -4.815 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -13.154 6.241 -5.087 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -12.090 3.567 -5.503 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -11.433 5.106 -6.023 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -10.294 6.432 -4.056 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.248 5.418 -3.057 1.00 0.00 H new ATOM 1067 N ARG A 69 -15.230 5.640 -2.086 1.00 0.00 N ATOM 1068 CA ARG A 69 -16.467 6.269 -1.530 1.00 0.00 C ATOM 1069 C ARG A 69 -16.203 6.829 -0.122 1.00 0.00 C ATOM 1070 O ARG A 69 -16.744 7.851 0.285 1.00 0.00 O ATOM 1071 CB ARG A 69 -17.592 5.226 -1.496 1.00 0.00 C ATOM 1072 CG ARG A 69 -17.841 4.514 -2.818 1.00 0.00 C ATOM 1073 CD ARG A 69 -19.344 4.464 -3.163 1.00 0.00 C ATOM 1074 NE ARG A 69 -20.070 3.762 -2.101 1.00 0.00 N ATOM 1075 CZ ARG A 69 -20.939 4.311 -1.222 1.00 0.00 C ATOM 1076 NH1 ARG A 69 -21.107 5.666 -1.117 1.00 0.00 N ATOM 1077 NH2 ARG A 69 -21.700 3.511 -0.458 1.00 0.00 N ATOM 0 H ARG A 69 -15.236 4.622 -2.030 1.00 0.00 H new ATOM 0 HA ARG A 69 -16.767 7.100 -2.168 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -17.355 4.481 -0.737 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -18.514 5.716 -1.184 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -17.301 5.026 -3.615 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -17.445 3.500 -2.766 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -19.735 5.475 -3.277 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -19.492 3.955 -4.116 1.00 0.00 H new ATOM 0 HE ARG A 69 -19.903 2.759 -2.016 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -20.568 6.294 -1.713 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -21.771 6.047 -0.443 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -21.620 2.498 -0.543 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -22.358 3.917 0.208 1.00 0.00 H new ATOM 1091 N LEU A 70 -15.355 6.071 0.647 1.00 0.00 N ATOM 1092 CA LEU A 70 -14.731 6.423 1.892 1.00 0.00 C ATOM 1093 C LEU A 70 -13.684 7.517 1.669 1.00 0.00 C ATOM 1094 O LEU A 70 -13.794 8.603 2.246 1.00 0.00 O ATOM 1095 CB LEU A 70 -14.024 5.103 2.369 1.00 0.00 C ATOM 1096 CG LEU A 70 -13.967 4.816 3.867 1.00 0.00 C ATOM 1097 CD1 LEU A 70 -15.301 5.143 4.632 1.00 0.00 C ATOM 1098 CD2 LEU A 70 -13.535 3.343 4.157 1.00 0.00 C ATOM 0 H LEU A 70 -15.094 5.129 0.356 1.00 0.00 H new ATOM 0 HA LEU A 70 -15.449 6.803 2.619 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -14.527 4.264 1.888 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -13.001 5.119 1.994 1.00 0.00 H new ATOM 0 HG LEU A 70 -13.208 5.497 4.252 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -15.180 4.912 5.690 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -15.537 6.201 4.516 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -16.113 4.543 4.221 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -13.506 3.178 5.234 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -14.251 2.658 3.704 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -12.546 3.164 3.736 1.00 0.00 H new ATOM 1110 N LEU A 71 -12.631 7.221 0.856 1.00 0.00 N ATOM 1111 CA LEU A 71 -11.353 7.930 0.774 1.00 0.00 C ATOM 1112 C LEU A 71 -11.065 8.318 -0.683 1.00 0.00 C ATOM 1113 O LEU A 71 -10.338 7.576 -1.370 1.00 0.00 O ATOM 1114 CB LEU A 71 -10.283 6.903 1.254 1.00 0.00 C ATOM 1115 CG LEU A 71 -10.425 6.242 2.616 1.00 0.00 C ATOM 1116 CD1 LEU A 71 -9.910 4.802 2.721 1.00 0.00 C ATOM 1117 CD2 LEU A 71 -9.913 7.143 3.778 1.00 0.00 C ATOM 0 H LEU A 71 -12.669 6.433 0.209 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.354 8.841 1.373 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.239 6.108 0.510 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.317 7.408 1.237 1.00 0.00 H new ATOM 0 HG LEU A 71 -11.504 6.137 2.731 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -10.063 4.434 3.736 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -10.454 4.169 2.020 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.847 4.778 2.483 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -10.039 6.620 4.726 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.858 7.369 3.625 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -10.484 8.072 3.797 1.00 0.00 H new ATOM 1129 N PRO A 72 -11.673 9.415 -1.179 1.00 0.00 N ATOM 1130 CA PRO A 72 -11.559 9.886 -2.578 1.00 0.00 C ATOM 1131 C PRO A 72 -10.463 10.942 -2.913 1.00 0.00 C ATOM 1132 O PRO A 72 -10.133 11.173 -4.070 1.00 0.00 O ATOM 1133 CB PRO A 72 -12.978 10.404 -2.905 1.00 0.00 C ATOM 1134 CG PRO A 72 -13.353 11.069 -1.579 1.00 0.00 C ATOM 1135 CD PRO A 72 -12.729 10.173 -0.494 1.00 0.00 C ATOM 0 HA PRO A 72 -11.211 9.058 -3.196 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -12.979 11.109 -3.736 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -13.661 9.597 -3.171 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -12.964 12.086 -1.523 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -14.435 11.135 -1.462 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -12.320 10.769 0.321 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.473 9.506 -0.059 1.00 0.00 H new ATOM 1143 N ASN A 73 -9.787 11.361 -1.812 1.00 0.00 N ATOM 1144 CA ASN A 73 -8.610 12.258 -1.833 1.00 0.00 C ATOM 1145 C ASN A 73 -7.303 11.462 -1.778 1.00 0.00 C ATOM 1146 O ASN A 73 -6.229 11.927 -2.272 1.00 0.00 O ATOM 1147 CB ASN A 73 -8.721 13.255 -0.670 1.00 0.00 C ATOM 1148 CG ASN A 73 -9.472 14.577 -1.002 1.00 0.00 C ATOM 1149 OD1 ASN A 73 -9.105 15.662 -0.610 1.00 0.00 O ATOM 1150 ND2 ASN A 73 -10.583 14.436 -1.767 1.00 0.00 N ATOM 0 H ASN A 73 -10.053 11.077 -0.869 1.00 0.00 H new ATOM 0 HA ASN A 73 -8.594 12.812 -2.771 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -9.230 12.765 0.160 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -7.716 13.502 -0.327 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -11.132 15.256 -2.025 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -10.870 13.510 -2.084 1.00 0.00 H new ATOM 1157 N LYS A 74 -7.332 10.312 -1.099 1.00 0.00 N ATOM 1158 CA LYS A 74 -6.154 9.384 -0.981 1.00 0.00 C ATOM 1159 C LYS A 74 -5.878 8.618 -2.265 1.00 0.00 C ATOM 1160 O LYS A 74 -6.822 8.155 -2.950 1.00 0.00 O ATOM 1161 CB LYS A 74 -6.348 8.429 0.216 1.00 0.00 C ATOM 1162 CG LYS A 74 -6.252 9.173 1.554 1.00 0.00 C ATOM 1163 CD LYS A 74 -7.359 10.204 1.817 1.00 0.00 C ATOM 1164 CE LYS A 74 -7.144 10.869 3.188 1.00 0.00 C ATOM 1165 NZ LYS A 74 -7.972 12.094 3.301 1.00 0.00 N ATOM 0 H LYS A 74 -8.162 9.979 -0.608 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.271 9.998 -0.802 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.320 7.941 0.139 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -5.593 7.643 0.181 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -6.264 8.439 2.360 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -5.288 9.681 1.599 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -7.357 10.961 1.032 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -8.334 9.718 1.788 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -7.405 10.171 3.983 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -6.091 11.120 3.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -7.817 12.533 4.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -7.704 12.765 2.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -8.976 11.845 3.199 1.00 0.00 H new ATOM 1179 N PRO A 75 -4.574 8.479 -2.600 1.00 0.00 N ATOM 1180 CA PRO A 75 -4.036 7.598 -3.676 1.00 0.00 C ATOM 1181 C PRO A 75 -3.844 6.100 -3.325 1.00 0.00 C ATOM 1182 O PRO A 75 -2.784 5.501 -3.535 1.00 0.00 O ATOM 1183 CB PRO A 75 -2.818 8.285 -4.195 1.00 0.00 C ATOM 1184 CG PRO A 75 -2.294 9.100 -3.023 1.00 0.00 C ATOM 1185 CD PRO A 75 -3.504 9.388 -2.136 1.00 0.00 C ATOM 0 HA PRO A 75 -4.789 7.487 -4.456 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -2.075 7.565 -4.538 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -3.058 8.925 -5.044 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.531 8.548 -2.474 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -1.833 10.026 -3.367 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -3.269 9.211 -1.086 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.812 10.430 -2.222 1.00 0.00 H new ATOM 1193 N VAL A 76 -5.030 5.506 -3.005 1.00 0.00 N ATOM 1194 CA VAL A 76 -5.264 4.093 -3.029 1.00 0.00 C ATOM 1195 C VAL A 76 -4.992 3.498 -4.419 1.00 0.00 C ATOM 1196 O VAL A 76 -5.393 4.048 -5.457 1.00 0.00 O ATOM 1197 CB VAL A 76 -6.660 3.736 -2.464 1.00 0.00 C ATOM 1198 CG1 VAL A 76 -6.796 2.236 -2.093 1.00 0.00 C ATOM 1199 CG2 VAL A 76 -7.016 4.638 -1.245 1.00 0.00 C ATOM 0 H VAL A 76 -5.850 6.041 -2.720 1.00 0.00 H new ATOM 0 HA VAL A 76 -4.545 3.621 -2.359 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.374 3.928 -3.265 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.796 2.047 -1.703 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.632 1.625 -2.981 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -6.056 1.980 -1.335 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -8.002 4.367 -0.867 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -6.274 4.497 -0.459 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.021 5.683 -1.555 1.00 0.00 H new ATOM 1209 N GLU A 77 -4.298 2.352 -4.452 1.00 0.00 N ATOM 1210 CA GLU A 77 -4.194 1.403 -5.544 1.00 0.00 C ATOM 1211 C GLU A 77 -4.690 -0.007 -5.126 1.00 0.00 C ATOM 1212 O GLU A 77 -5.017 -0.292 -4.011 1.00 0.00 O ATOM 1213 CB GLU A 77 -2.743 1.317 -6.070 1.00 0.00 C ATOM 1214 CG GLU A 77 -2.669 1.457 -7.595 1.00 0.00 C ATOM 1215 CD GLU A 77 -1.894 2.640 -8.105 1.00 0.00 C ATOM 1216 OE1 GLU A 77 -0.639 2.534 -8.234 1.00 0.00 O ATOM 1217 OE2 GLU A 77 -2.522 3.718 -8.420 1.00 0.00 O ATOM 0 H GLU A 77 -3.754 2.050 -3.644 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.837 1.767 -6.345 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -2.143 2.100 -5.606 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -2.307 0.363 -5.773 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -2.223 0.550 -8.003 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -3.685 1.516 -7.986 1.00 0.00 H new ATOM 1224 N VAL A 78 -4.790 -0.862 -6.201 1.00 0.00 N ATOM 1225 CA VAL A 78 -4.731 -2.330 -6.083 1.00 0.00 C ATOM 1226 C VAL A 78 -3.372 -2.816 -6.665 1.00 0.00 C ATOM 1227 O VAL A 78 -2.851 -2.261 -7.630 1.00 0.00 O ATOM 1228 CB VAL A 78 -5.960 -2.963 -6.781 1.00 0.00 C ATOM 1229 CG1 VAL A 78 -5.843 -3.021 -8.328 1.00 0.00 C ATOM 1230 CG2 VAL A 78 -6.330 -4.327 -6.197 1.00 0.00 C ATOM 0 H VAL A 78 -4.913 -0.536 -7.160 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.777 -2.647 -5.041 1.00 0.00 H new ATOM 0 HB VAL A 78 -6.782 -2.280 -6.566 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -6.741 -3.477 -8.744 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -5.733 -2.011 -8.723 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -4.973 -3.616 -8.605 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -7.198 -4.725 -6.723 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.490 -5.012 -6.312 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -6.566 -4.218 -5.139 1.00 0.00 H new ATOM 1240 N ILE A 79 -2.802 -3.840 -5.989 1.00 0.00 N ATOM 1241 CA ILE A 79 -1.486 -4.447 -6.321 1.00 0.00 C ATOM 1242 C ILE A 79 -1.655 -5.511 -7.428 1.00 0.00 C ATOM 1243 O ILE A 79 -2.732 -5.910 -7.810 1.00 0.00 O ATOM 1244 CB ILE A 79 -0.805 -5.012 -5.053 1.00 0.00 C ATOM 1245 CG1 ILE A 79 -1.025 -4.124 -3.803 1.00 0.00 C ATOM 1246 CG2 ILE A 79 0.659 -5.379 -5.283 1.00 0.00 C ATOM 1247 CD1 ILE A 79 -1.188 -4.854 -2.449 1.00 0.00 C ATOM 0 H ILE A 79 -3.249 -4.277 -5.183 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.823 -3.675 -6.712 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.312 -5.952 -4.833 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -0.181 -3.439 -3.720 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.914 -3.516 -3.970 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.086 -5.770 -4.359 1.00 0.00 H new ATOM 0 HG22 ILE A 79 0.726 -6.137 -6.063 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.212 -4.492 -5.591 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.335 -4.121 -1.656 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.052 -5.517 -2.495 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -0.292 -5.439 -2.241 1.00 0.00 H new ATOM 1259 N ASP A 80 -0.484 -5.980 -7.907 1.00 0.00 N ATOM 1260 CA ASP A 80 -0.207 -7.198 -8.647 1.00 0.00 C ATOM 1261 C ASP A 80 0.102 -8.356 -7.630 1.00 0.00 C ATOM 1262 O ASP A 80 0.163 -8.121 -6.446 1.00 0.00 O ATOM 1263 CB ASP A 80 1.156 -6.968 -9.422 1.00 0.00 C ATOM 1264 CG ASP A 80 1.070 -5.701 -10.315 1.00 0.00 C ATOM 1265 OD1 ASP A 80 0.101 -4.913 -10.094 1.00 0.00 O ATOM 1266 OD2 ASP A 80 1.971 -5.560 -11.194 1.00 0.00 O ATOM 0 H ASP A 80 0.373 -5.447 -7.761 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.049 -7.439 -9.296 1.00 0.00 H new ATOM 0 HB2 ASP A 80 1.973 -6.862 -8.708 1.00 0.00 H new ATOM 0 HB3 ASP A 80 1.382 -7.839 -10.038 1.00 0.00 H new ATOM 1271 N SER A 81 0.082 -9.565 -8.197 1.00 0.00 N ATOM 1272 CA SER A 81 -0.050 -10.840 -7.459 1.00 0.00 C ATOM 1273 C SER A 81 1.298 -11.575 -7.438 1.00 0.00 C ATOM 1274 O SER A 81 1.556 -12.468 -6.608 1.00 0.00 O ATOM 1275 CB SER A 81 -1.113 -11.679 -8.231 1.00 0.00 C ATOM 1276 OG SER A 81 -0.792 -13.089 -8.174 1.00 0.00 O ATOM 0 H SER A 81 0.158 -9.696 -9.206 1.00 0.00 H new ATOM 0 HA SER A 81 -0.351 -10.677 -6.424 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.100 -11.508 -7.802 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.156 -11.353 -9.270 1.00 0.00 H new ATOM 0 HG SER A 81 -1.471 -13.599 -8.663 1.00 0.00 H new ATOM 1282 N LEU A 82 2.206 -11.104 -8.350 1.00 0.00 N ATOM 1283 CA LEU A 82 3.633 -11.512 -8.440 1.00 0.00 C ATOM 1284 C LEU A 82 4.502 -10.559 -7.634 1.00 0.00 C ATOM 1285 O LEU A 82 5.296 -11.001 -6.815 1.00 0.00 O ATOM 1286 CB LEU A 82 3.981 -11.429 -9.959 1.00 0.00 C ATOM 1287 CG LEU A 82 3.732 -12.697 -10.803 1.00 0.00 C ATOM 1288 CD1 LEU A 82 5.010 -13.350 -11.299 1.00 0.00 C ATOM 1289 CD2 LEU A 82 2.809 -13.716 -10.013 1.00 0.00 C ATOM 0 H LEU A 82 1.952 -10.414 -9.057 1.00 0.00 H new ATOM 0 HA LEU A 82 3.806 -12.511 -8.039 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.405 -10.613 -10.395 1.00 0.00 H new ATOM 0 HB3 LEU A 82 5.033 -11.161 -10.052 1.00 0.00 H new ATOM 0 HG LEU A 82 3.204 -12.382 -11.703 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.763 -14.235 -11.885 1.00 0.00 H new ATOM 0 HD12 LEU A 82 5.561 -12.645 -11.922 1.00 0.00 H new ATOM 0 HD13 LEU A 82 5.625 -13.639 -10.447 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.643 -14.604 -10.622 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.297 -14.001 -9.081 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.852 -13.244 -9.792 1.00 0.00 H new ATOM 1301 N LEU A 83 4.368 -9.231 -7.926 1.00 0.00 N ATOM 1302 CA LEU A 83 5.100 -8.173 -7.145 1.00 0.00 C ATOM 1303 C LEU A 83 4.619 -8.275 -5.697 1.00 0.00 C ATOM 1304 O LEU A 83 5.401 -8.081 -4.771 1.00 0.00 O ATOM 1305 CB LEU A 83 4.831 -6.872 -7.815 1.00 0.00 C ATOM 1306 CG LEU A 83 4.123 -5.678 -7.281 1.00 0.00 C ATOM 1307 CD1 LEU A 83 3.382 -5.796 -5.944 1.00 0.00 C ATOM 1308 CD2 LEU A 83 4.938 -4.328 -7.367 1.00 0.00 C ATOM 0 H LEU A 83 3.778 -8.869 -8.675 1.00 0.00 H new ATOM 0 HA LEU A 83 6.184 -8.289 -7.120 1.00 0.00 H new ATOM 0 HB2 LEU A 83 5.812 -6.504 -8.117 1.00 0.00 H new ATOM 0 HB3 LEU A 83 4.293 -7.132 -8.727 1.00 0.00 H new ATOM 0 HG LEU A 83 3.314 -5.638 -8.010 1.00 0.00 H new ATOM 0 HD11 LEU A 83 2.921 -4.839 -5.698 1.00 0.00 H new ATOM 0 HD12 LEU A 83 2.610 -6.562 -6.022 1.00 0.00 H new ATOM 0 HD13 LEU A 83 4.088 -6.071 -5.160 1.00 0.00 H new ATOM 0 HD21 LEU A 83 4.340 -3.515 -6.954 1.00 0.00 H new ATOM 0 HD22 LEU A 83 5.862 -4.424 -6.798 1.00 0.00 H new ATOM 0 HD23 LEU A 83 5.174 -4.111 -8.409 1.00 0.00 H new ATOM 1320 N TYR A 84 3.287 -8.513 -5.469 1.00 0.00 N ATOM 1321 CA TYR A 84 2.702 -8.980 -4.201 1.00 0.00 C ATOM 1322 C TYR A 84 3.510 -10.126 -3.594 1.00 0.00 C ATOM 1323 O TYR A 84 4.424 -9.935 -2.747 1.00 0.00 O ATOM 1324 CB TYR A 84 1.210 -9.347 -4.405 1.00 0.00 C ATOM 1325 CG TYR A 84 0.365 -9.436 -3.115 1.00 0.00 C ATOM 1326 CD1 TYR A 84 0.592 -8.497 -2.082 1.00 0.00 C ATOM 1327 CD2 TYR A 84 -0.562 -10.469 -2.993 1.00 0.00 C ATOM 1328 CE1 TYR A 84 -0.146 -8.606 -0.895 1.00 0.00 C ATOM 1329 CE2 TYR A 84 -1.329 -10.531 -1.822 1.00 0.00 C ATOM 1330 CZ TYR A 84 -1.037 -9.669 -0.749 1.00 0.00 C ATOM 1331 OH TYR A 84 -1.654 -9.889 0.453 1.00 0.00 O ATOM 0 H TYR A 84 2.584 -8.376 -6.195 1.00 0.00 H new ATOM 0 HA TYR A 84 2.746 -8.166 -3.477 1.00 0.00 H new ATOM 0 HB2 TYR A 84 0.758 -8.606 -5.064 1.00 0.00 H new ATOM 0 HB3 TYR A 84 1.157 -10.306 -4.920 1.00 0.00 H new ATOM 0 HD1 TYR A 84 1.321 -7.710 -2.205 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.686 -11.200 -3.778 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -0.026 -7.878 -0.106 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -2.142 -11.238 -1.743 1.00 0.00 H new ATOM 0 HH TYR A 84 -0.991 -9.848 1.173 1.00 0.00 H new ATOM 1341 N GLY A 85 3.184 -11.371 -3.987 1.00 0.00 N ATOM 1342 CA GLY A 85 3.637 -12.623 -3.370 1.00 0.00 C ATOM 1343 C GLY A 85 5.112 -12.950 -3.669 1.00 0.00 C ATOM 1344 O GLY A 85 5.625 -13.987 -3.228 1.00 0.00 O ATOM 0 H GLY A 85 2.567 -11.535 -4.783 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.498 -12.559 -2.291 1.00 0.00 H new ATOM 0 HA3 GLY A 85 3.011 -13.442 -3.725 1.00 0.00 H new ATOM 1348 N LYS A 86 5.810 -12.072 -4.434 1.00 0.00 N ATOM 1349 CA LYS A 86 7.271 -11.940 -4.430 1.00 0.00 C ATOM 1350 C LYS A 86 7.783 -10.609 -3.879 1.00 0.00 C ATOM 1351 O LYS A 86 8.970 -10.278 -3.954 1.00 0.00 O ATOM 1352 CB LYS A 86 7.942 -12.345 -5.719 1.00 0.00 C ATOM 1353 CG LYS A 86 7.043 -13.262 -6.591 1.00 0.00 C ATOM 1354 CD LYS A 86 7.707 -14.600 -7.006 1.00 0.00 C ATOM 1355 CE LYS A 86 6.924 -15.752 -6.318 1.00 0.00 C ATOM 1356 NZ LYS A 86 7.855 -16.866 -6.037 1.00 0.00 N ATOM 0 H LYS A 86 5.354 -11.428 -5.080 1.00 0.00 H new ATOM 0 HA LYS A 86 7.587 -12.689 -3.704 1.00 0.00 H new ATOM 0 HB2 LYS A 86 8.203 -11.451 -6.286 1.00 0.00 H new ATOM 0 HB3 LYS A 86 8.874 -12.863 -5.493 1.00 0.00 H new ATOM 0 HG2 LYS A 86 6.126 -13.480 -6.043 1.00 0.00 H new ATOM 0 HG3 LYS A 86 6.755 -12.719 -7.491 1.00 0.00 H new ATOM 0 HD2 LYS A 86 7.685 -14.717 -8.089 1.00 0.00 H new ATOM 0 HD3 LYS A 86 8.754 -14.616 -6.704 1.00 0.00 H new ATOM 0 HE2 LYS A 86 6.470 -15.398 -5.392 1.00 0.00 H new ATOM 0 HE3 LYS A 86 6.113 -16.093 -6.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 7.339 -17.642 -5.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 8.268 -17.207 -6.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 8.614 -16.534 -5.408 1.00 0.00 H new ATOM 1370 N VAL A 87 6.866 -9.801 -3.267 1.00 0.00 N ATOM 1371 CA VAL A 87 7.115 -8.814 -2.243 1.00 0.00 C ATOM 1372 C VAL A 87 8.087 -7.729 -2.691 1.00 0.00 C ATOM 1373 O VAL A 87 8.965 -7.263 -1.905 1.00 0.00 O ATOM 1374 CB VAL A 87 7.587 -9.534 -0.939 1.00 0.00 C ATOM 1375 CG1 VAL A 87 6.795 -10.841 -0.657 1.00 0.00 C ATOM 1376 CG2 VAL A 87 9.109 -9.864 -1.023 1.00 0.00 C ATOM 0 H VAL A 87 5.877 -9.848 -3.513 1.00 0.00 H new ATOM 0 HA VAL A 87 6.182 -8.288 -2.038 1.00 0.00 H new ATOM 0 HB VAL A 87 7.396 -8.845 -0.116 1.00 0.00 H new ATOM 0 HG11 VAL A 87 7.164 -11.300 0.260 1.00 0.00 H new ATOM 0 HG12 VAL A 87 5.736 -10.608 -0.545 1.00 0.00 H new ATOM 0 HG13 VAL A 87 6.928 -11.534 -1.488 1.00 0.00 H new ATOM 0 HG21 VAL A 87 9.424 -10.365 -0.108 1.00 0.00 H new ATOM 0 HG22 VAL A 87 9.293 -10.517 -1.876 1.00 0.00 H new ATOM 0 HG23 VAL A 87 9.675 -8.941 -1.144 1.00 0.00 H new ATOM 1386 N ASP A 88 7.997 -7.307 -3.961 1.00 0.00 N ATOM 1387 CA ASP A 88 8.919 -6.478 -4.731 1.00 0.00 C ATOM 1388 C ASP A 88 8.861 -4.987 -4.346 1.00 0.00 C ATOM 1389 O ASP A 88 8.152 -4.182 -4.935 1.00 0.00 O ATOM 1390 CB ASP A 88 8.778 -6.700 -6.231 1.00 0.00 C ATOM 1391 CG ASP A 88 9.765 -5.916 -7.120 1.00 0.00 C ATOM 1392 OD1 ASP A 88 10.508 -5.060 -6.509 1.00 0.00 O ATOM 1393 OD2 ASP A 88 9.723 -6.108 -8.351 1.00 0.00 O ATOM 0 H ASP A 88 7.190 -7.569 -4.527 1.00 0.00 H new ATOM 0 HA ASP A 88 9.920 -6.811 -4.458 1.00 0.00 H new ATOM 0 HB2 ASP A 88 8.900 -7.764 -6.435 1.00 0.00 H new ATOM 0 HB3 ASP A 88 7.763 -6.434 -6.525 1.00 0.00 H new ATOM 1398 N GLY A 89 9.504 -4.677 -3.182 1.00 0.00 N ATOM 1399 CA GLY A 89 9.712 -3.363 -2.617 1.00 0.00 C ATOM 1400 C GLY A 89 10.092 -2.229 -3.549 1.00 0.00 C ATOM 1401 O GLY A 89 9.321 -1.279 -3.758 1.00 0.00 O ATOM 0 H GLY A 89 9.908 -5.407 -2.595 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.797 -3.075 -2.100 1.00 0.00 H new ATOM 0 HA3 GLY A 89 10.492 -3.447 -1.861 1.00 0.00 H new ATOM 1405 N LEU A 90 11.364 -2.271 -4.056 1.00 0.00 N ATOM 1406 CA LEU A 90 11.944 -1.223 -4.944 1.00 0.00 C ATOM 1407 C LEU A 90 10.866 -0.735 -5.920 1.00 0.00 C ATOM 1408 O LEU A 90 10.850 0.436 -6.353 1.00 0.00 O ATOM 1409 CB LEU A 90 13.113 -1.892 -5.652 1.00 0.00 C ATOM 1410 CG LEU A 90 14.549 -1.734 -5.039 1.00 0.00 C ATOM 1411 CD1 LEU A 90 15.561 -1.095 -5.993 1.00 0.00 C ATOM 1412 CD2 LEU A 90 14.436 -0.965 -3.695 1.00 0.00 C ATOM 0 H LEU A 90 12.011 -3.034 -3.858 1.00 0.00 H new ATOM 0 HA LEU A 90 12.290 -0.342 -4.403 1.00 0.00 H new ATOM 0 HB2 LEU A 90 12.895 -2.958 -5.716 1.00 0.00 H new ATOM 0 HB3 LEU A 90 13.144 -1.511 -6.673 1.00 0.00 H new ATOM 0 HG LEU A 90 14.950 -2.731 -4.857 1.00 0.00 H new ATOM 0 HD11 LEU A 90 16.529 -1.019 -5.499 1.00 0.00 H new ATOM 0 HD12 LEU A 90 15.657 -1.711 -6.887 1.00 0.00 H new ATOM 0 HD13 LEU A 90 15.218 -0.099 -6.274 1.00 0.00 H new ATOM 0 HD21 LEU A 90 15.428 -0.848 -3.258 1.00 0.00 H new ATOM 0 HD22 LEU A 90 14.000 0.018 -3.874 1.00 0.00 H new ATOM 0 HD23 LEU A 90 13.800 -1.524 -3.008 1.00 0.00 H new ATOM 1424 N GLY A 91 9.923 -1.630 -6.310 1.00 0.00 N ATOM 1425 CA GLY A 91 8.714 -1.326 -7.084 1.00 0.00 C ATOM 1426 C GLY A 91 7.554 -0.763 -6.284 1.00 0.00 C ATOM 1427 O GLY A 91 6.895 0.196 -6.725 1.00 0.00 O ATOM 0 H GLY A 91 9.997 -2.621 -6.079 1.00 0.00 H new ATOM 0 HA2 GLY A 91 8.974 -0.613 -7.867 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.382 -2.238 -7.581 1.00 0.00 H new ATOM 1431 N VAL A 92 7.240 -1.361 -5.113 1.00 0.00 N ATOM 1432 CA VAL A 92 6.152 -0.966 -4.199 1.00 0.00 C ATOM 1433 C VAL A 92 6.464 0.351 -3.481 1.00 0.00 C ATOM 1434 O VAL A 92 5.575 1.051 -2.974 1.00 0.00 O ATOM 1435 CB VAL A 92 5.722 -2.160 -3.328 1.00 0.00 C ATOM 1436 CG1 VAL A 92 4.265 -1.929 -2.730 1.00 0.00 C ATOM 1437 CG2 VAL A 92 5.672 -3.470 -4.187 1.00 0.00 C ATOM 0 H VAL A 92 7.762 -2.166 -4.767 1.00 0.00 H new ATOM 0 HA VAL A 92 5.253 -0.716 -4.762 1.00 0.00 H new ATOM 0 HB VAL A 92 6.451 -2.253 -2.523 1.00 0.00 H new ATOM 0 HG11 VAL A 92 3.983 -2.786 -2.118 1.00 0.00 H new ATOM 0 HG12 VAL A 92 4.262 -1.028 -2.116 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.551 -1.815 -3.546 1.00 0.00 H new ATOM 0 HG21 VAL A 92 5.366 -4.306 -3.558 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.955 -3.346 -4.999 1.00 0.00 H new ATOM 0 HG23 VAL A 92 6.660 -3.671 -4.603 1.00 0.00 H new ATOM 1447 N LEU A 93 7.784 0.653 -3.327 1.00 0.00 N ATOM 1448 CA LEU A 93 8.346 1.990 -3.100 1.00 0.00 C ATOM 1449 C LEU A 93 7.948 2.980 -4.190 1.00 0.00 C ATOM 1450 O LEU A 93 7.042 3.812 -3.988 1.00 0.00 O ATOM 1451 CB LEU A 93 9.880 1.815 -3.046 1.00 0.00 C ATOM 1452 CG LEU A 93 10.704 2.647 -2.068 1.00 0.00 C ATOM 1453 CD1 LEU A 93 10.703 4.167 -2.269 1.00 0.00 C ATOM 1454 CD2 LEU A 93 10.468 2.242 -0.596 1.00 0.00 C ATOM 0 H LEU A 93 8.505 -0.068 -3.361 1.00 0.00 H new ATOM 0 HA LEU A 93 7.957 2.407 -2.171 1.00 0.00 H new ATOM 0 HB2 LEU A 93 10.080 0.766 -2.829 1.00 0.00 H new ATOM 0 HB3 LEU A 93 10.265 2.013 -4.046 1.00 0.00 H new ATOM 0 HG LEU A 93 11.726 2.376 -2.334 1.00 0.00 H new ATOM 0 HD11 LEU A 93 11.327 4.635 -1.507 1.00 0.00 H new ATOM 0 HD12 LEU A 93 11.098 4.404 -3.257 1.00 0.00 H new ATOM 0 HD13 LEU A 93 9.684 4.544 -2.186 1.00 0.00 H new ATOM 0 HD21 LEU A 93 11.079 2.866 0.056 1.00 0.00 H new ATOM 0 HD22 LEU A 93 9.416 2.377 -0.346 1.00 0.00 H new ATOM 0 HD23 LEU A 93 10.742 1.196 -0.458 1.00 0.00 H new ATOM 1466 N LYS A 94 8.652 2.981 -5.353 1.00 0.00 N ATOM 1467 CA LYS A 94 8.438 4.045 -6.404 1.00 0.00 C ATOM 1468 C LYS A 94 6.927 4.093 -6.798 1.00 0.00 C ATOM 1469 O LYS A 94 6.447 5.117 -7.280 1.00 0.00 O ATOM 1470 CB LYS A 94 9.257 3.581 -7.686 1.00 0.00 C ATOM 1471 CG LYS A 94 8.593 2.209 -8.080 1.00 0.00 C ATOM 1472 CD LYS A 94 9.266 1.556 -9.282 1.00 0.00 C ATOM 1473 CE LYS A 94 9.176 2.553 -10.486 1.00 0.00 C ATOM 1474 NZ LYS A 94 9.440 1.839 -11.738 1.00 0.00 N ATOM 0 H LYS A 94 9.356 2.284 -5.595 1.00 0.00 H new ATOM 0 HA LYS A 94 8.752 5.022 -6.037 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.181 4.309 -8.494 1.00 0.00 H new ATOM 0 HB3 LYS A 94 10.317 3.463 -7.462 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.639 1.530 -7.229 1.00 0.00 H new ATOM 0 HG3 LYS A 94 7.538 2.371 -8.302 1.00 0.00 H new ATOM 0 HD2 LYS A 94 10.307 1.323 -9.057 1.00 0.00 H new ATOM 0 HD3 LYS A 94 8.775 0.615 -9.529 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.187 3.011 -10.519 1.00 0.00 H new ATOM 0 HE3 LYS A 94 9.897 3.360 -10.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 9.380 2.503 -12.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 10.392 1.422 -11.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 8.736 1.084 -11.862 1.00 0.00 H new ATOM 1488 N ALA A 95 6.276 2.940 -6.659 1.00 0.00 N ATOM 1489 CA ALA A 95 4.882 2.708 -7.126 1.00 0.00 C ATOM 1490 C ALA A 95 3.884 3.389 -6.200 1.00 0.00 C ATOM 1491 O ALA A 95 2.840 3.897 -6.628 1.00 0.00 O ATOM 1492 CB ALA A 95 4.575 1.224 -7.260 1.00 0.00 C ATOM 0 H ALA A 95 6.693 2.122 -6.216 1.00 0.00 H new ATOM 0 HA ALA A 95 4.788 3.151 -8.118 1.00 0.00 H new ATOM 0 HB1 ALA A 95 3.549 1.094 -7.603 1.00 0.00 H new ATOM 0 HB2 ALA A 95 5.258 0.775 -7.981 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.698 0.738 -6.292 1.00 0.00 H new ATOM 1498 N ALA A 96 4.196 3.350 -4.868 1.00 0.00 N ATOM 1499 CA ALA A 96 3.573 4.240 -3.869 1.00 0.00 C ATOM 1500 C ALA A 96 3.778 5.714 -4.241 1.00 0.00 C ATOM 1501 O ALA A 96 2.835 6.505 -4.326 1.00 0.00 O ATOM 1502 CB ALA A 96 4.083 3.953 -2.464 1.00 0.00 C ATOM 0 H ALA A 96 4.880 2.704 -4.473 1.00 0.00 H new ATOM 0 HA ALA A 96 2.502 4.036 -3.873 1.00 0.00 H new ATOM 0 HB1 ALA A 96 3.601 4.628 -1.757 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.852 2.922 -2.196 1.00 0.00 H new ATOM 0 HB3 ALA A 96 5.162 4.103 -2.431 1.00 0.00 H new ATOM 1508 N VAL A 97 5.061 6.087 -4.467 1.00 0.00 N ATOM 1509 CA VAL A 97 5.457 7.360 -5.111 1.00 0.00 C ATOM 1510 C VAL A 97 4.512 7.670 -6.293 1.00 0.00 C ATOM 1511 O VAL A 97 3.856 8.710 -6.371 1.00 0.00 O ATOM 1512 CB VAL A 97 6.951 7.287 -5.524 1.00 0.00 C ATOM 1513 CG1 VAL A 97 7.347 8.228 -6.679 1.00 0.00 C ATOM 1514 CG2 VAL A 97 7.880 7.593 -4.299 1.00 0.00 C ATOM 0 H VAL A 97 5.857 5.506 -4.204 1.00 0.00 H new ATOM 0 HA VAL A 97 5.359 8.189 -4.411 1.00 0.00 H new ATOM 0 HB VAL A 97 7.087 6.266 -5.881 1.00 0.00 H new ATOM 0 HG11 VAL A 97 8.408 8.108 -6.898 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.763 7.981 -7.566 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.150 9.261 -6.391 1.00 0.00 H new ATOM 0 HG21 VAL A 97 8.923 7.537 -4.610 1.00 0.00 H new ATOM 0 HG22 VAL A 97 7.667 8.593 -3.922 1.00 0.00 H new ATOM 0 HG23 VAL A 97 7.696 6.862 -3.512 1.00 0.00 H new ATOM 1524 N ALA A 98 4.517 6.752 -7.282 1.00 0.00 N ATOM 1525 CA ALA A 98 3.965 6.921 -8.631 1.00 0.00 C ATOM 1526 C ALA A 98 2.487 7.390 -8.564 1.00 0.00 C ATOM 1527 O ALA A 98 2.006 8.119 -9.421 1.00 0.00 O ATOM 1528 CB ALA A 98 4.051 5.606 -9.418 1.00 0.00 C ATOM 0 H ALA A 98 4.928 5.828 -7.149 1.00 0.00 H new ATOM 0 HA ALA A 98 4.556 7.682 -9.142 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.637 5.751 -10.416 1.00 0.00 H new ATOM 0 HB2 ALA A 98 5.093 5.298 -9.499 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.484 4.833 -8.899 1.00 0.00 H new ATOM 1534 N ALA A 99 1.775 6.867 -7.529 1.00 0.00 N ATOM 1535 CA ALA A 99 0.412 7.257 -7.187 1.00 0.00 C ATOM 1536 C ALA A 99 0.336 8.707 -6.692 1.00 0.00 C ATOM 1537 O ALA A 99 -0.516 9.495 -7.098 1.00 0.00 O ATOM 1538 CB ALA A 99 -0.171 6.323 -6.094 1.00 0.00 C ATOM 0 H ALA A 99 2.154 6.151 -6.909 1.00 0.00 H new ATOM 0 HA ALA A 99 -0.175 7.170 -8.101 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -1.188 6.633 -5.855 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -0.181 5.296 -6.460 1.00 0.00 H new ATOM 0 HB3 ALA A 99 0.446 6.382 -5.198 1.00 0.00 H new ATOM 1544 N ILE A 100 1.248 9.036 -5.740 1.00 0.00 N ATOM 1545 CA ILE A 100 1.223 10.256 -4.895 1.00 0.00 C ATOM 1546 C ILE A 100 1.221 11.500 -5.823 1.00 0.00 C ATOM 1547 O ILE A 100 0.851 12.582 -5.473 1.00 0.00 O ATOM 1548 CB ILE A 100 2.231 10.270 -3.774 1.00 0.00 C ATOM 1549 CG1 ILE A 100 2.965 11.650 -3.649 1.00 0.00 C ATOM 1550 CG2 ILE A 100 3.272 9.120 -3.771 1.00 0.00 C ATOM 1551 CD1 ILE A 100 3.948 11.786 -2.516 1.00 0.00 C ATOM 0 H ILE A 100 2.048 8.438 -5.534 1.00 0.00 H new ATOM 0 HA ILE A 100 0.296 10.271 -4.321 1.00 0.00 H new ATOM 0 HB ILE A 100 1.607 10.098 -2.897 1.00 0.00 H new ATOM 0 HG12 ILE A 100 3.492 11.842 -4.583 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.211 12.430 -3.542 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.942 9.238 -2.919 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.756 8.163 -3.698 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.851 9.151 -4.694 1.00 0.00 H new ATOM 0 HD11 ILE A 100 4.389 12.782 -2.535 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.433 11.635 -1.567 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.734 11.039 -2.625 1.00 0.00 H new ATOM 1563 N LYS A 101 1.743 11.223 -7.071 1.00 0.00 N ATOM 1564 CA LYS A 101 1.863 12.228 -8.118 1.00 0.00 C ATOM 1565 C LYS A 101 0.806 12.172 -9.215 1.00 0.00 C ATOM 1566 O LYS A 101 0.582 13.148 -9.956 1.00 0.00 O ATOM 1567 CB LYS A 101 3.287 12.308 -8.690 1.00 0.00 C ATOM 1568 CG LYS A 101 3.721 13.779 -8.886 1.00 0.00 C ATOM 1569 CD LYS A 101 4.240 14.100 -10.306 1.00 0.00 C ATOM 1570 CE LYS A 101 3.148 13.646 -11.319 1.00 0.00 C ATOM 1571 NZ LYS A 101 2.971 14.672 -12.348 1.00 0.00 N ATOM 0 H LYS A 101 2.079 10.300 -7.345 1.00 0.00 H new ATOM 0 HA LYS A 101 1.654 13.164 -7.601 1.00 0.00 H new ATOM 0 HB2 LYS A 101 3.982 11.806 -8.017 1.00 0.00 H new ATOM 0 HB3 LYS A 101 3.330 11.782 -9.644 1.00 0.00 H new ATOM 0 HG2 LYS A 101 2.874 14.429 -8.665 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.502 14.016 -8.163 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.439 15.167 -10.409 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.179 13.581 -10.497 1.00 0.00 H new ATOM 0 HE2 LYS A 101 3.436 12.701 -11.780 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.206 13.473 -10.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 2.241 14.365 -13.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 2.677 15.564 -11.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 3.869 14.817 -12.852 1.00 0.00 H new ATOM 1585 N LYS A 102 0.178 10.977 -9.387 1.00 0.00 N ATOM 1586 CA LYS A 102 -1.129 10.860 -10.095 1.00 0.00 C ATOM 1587 C LYS A 102 -2.339 11.163 -9.201 1.00 0.00 C ATOM 1588 O LYS A 102 -3.486 10.954 -9.609 1.00 0.00 O ATOM 1589 CB LYS A 102 -1.237 9.497 -10.770 1.00 0.00 C ATOM 1590 CG LYS A 102 -2.188 9.537 -11.983 1.00 0.00 C ATOM 1591 CD LYS A 102 -1.495 9.329 -13.339 1.00 0.00 C ATOM 1592 CE LYS A 102 -1.981 7.983 -13.934 1.00 0.00 C ATOM 1593 NZ LYS A 102 -1.964 8.072 -15.420 1.00 0.00 N ATOM 0 H LYS A 102 0.550 10.089 -9.049 1.00 0.00 H new ATOM 0 HA LYS A 102 -1.151 11.633 -10.864 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.248 9.171 -11.093 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.596 8.761 -10.050 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -2.951 8.769 -11.857 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -2.702 10.498 -11.995 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -1.731 10.150 -14.016 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -0.412 9.320 -13.214 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -1.337 7.170 -13.599 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -2.988 7.758 -13.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -2.289 7.171 -15.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -2.595 8.839 -15.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -0.996 8.268 -15.745 1.00 0.00 H new ATOM 1607 N ALA A 103 -2.051 11.561 -7.939 1.00 0.00 N ATOM 1608 CA ALA A 103 -3.056 11.880 -6.904 1.00 0.00 C ATOM 1609 C ALA A 103 -3.568 13.322 -7.038 1.00 0.00 C ATOM 1610 O ALA A 103 -4.741 13.599 -6.901 1.00 0.00 O ATOM 1611 CB ALA A 103 -2.444 11.682 -5.503 1.00 0.00 C ATOM 0 H ALA A 103 -1.093 11.671 -7.608 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.901 11.205 -7.041 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -3.189 11.919 -4.744 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.125 10.646 -5.388 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.584 12.341 -5.385 1.00 0.00 H new ATOM 1617 N ALA A 104 -2.610 14.248 -7.261 1.00 0.00 N ATOM 1618 CA ALA A 104 -2.774 15.698 -7.141 1.00 0.00 C ATOM 1619 C ALA A 104 -3.018 16.109 -5.675 1.00 0.00 C ATOM 1620 O ALA A 104 -2.680 15.395 -4.735 1.00 0.00 O ATOM 1621 CB ALA A 104 -3.929 16.183 -8.032 1.00 0.00 C ATOM 0 H ALA A 104 -1.665 13.986 -7.541 1.00 0.00 H new ATOM 0 HA ALA A 104 -1.851 16.171 -7.476 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -4.038 17.263 -7.931 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -3.715 15.935 -9.072 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.854 15.695 -7.726 1.00 0.00 H new ATOM 1627 N ALA A 105 -3.566 17.335 -5.499 1.00 0.00 N ATOM 1628 CA ALA A 105 -4.125 17.846 -4.231 1.00 0.00 C ATOM 1629 C ALA A 105 -4.642 19.286 -4.404 1.00 0.00 C ATOM 1630 O ALA A 105 -5.782 19.600 -4.039 1.00 0.00 O ATOM 1631 CB ALA A 105 -3.017 17.822 -3.138 1.00 0.00 C ATOM 0 H ALA A 105 -3.632 18.013 -6.259 1.00 0.00 H new ATOM 0 HA ALA A 105 -4.960 17.211 -3.934 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -3.424 18.198 -2.199 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -2.666 16.799 -2.998 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -2.184 18.451 -3.451 1.00 0.00 H new ATOM 1637 N ASN A 106 -3.750 20.165 -4.899 1.00 0.00 N ATOM 1638 CA ASN A 106 -4.052 21.560 -5.320 1.00 0.00 C ATOM 1639 C ASN A 106 -2.730 22.330 -5.591 1.00 0.00 C ATOM 1640 O ASN A 106 -1.662 21.890 -5.115 1.00 0.00 O ATOM 1641 CB ASN A 106 -4.931 22.283 -4.304 1.00 0.00 C ATOM 1642 CG ASN A 106 -5.981 23.218 -4.959 1.00 0.00 C ATOM 1643 OD1 ASN A 106 -5.833 23.704 -6.088 1.00 0.00 O ATOM 1644 ND2 ASN A 106 -7.078 23.502 -4.241 1.00 0.00 N ATOM 0 H ASN A 106 -2.767 19.923 -5.024 1.00 0.00 H new ATOM 0 HA ASN A 106 -4.624 21.522 -6.247 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -5.445 21.545 -3.688 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -4.298 22.869 -3.638 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -7.793 24.120 -4.625 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -7.197 23.100 -3.311 1.00 0.00 H new TER 1651 ASN A 106