USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 905 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 CYS SG : rot -87:sc= -5.38! USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot -19:sc= -3.74 USER MOD Single : A 35 ASN : amide:sc= -3.76! C(o=-3.8!,f=-2.7!) USER MOD Single : A 37 ASN : amide:sc= -0.771 K(o=-0.77,f=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ -119:sc= -4.41! (180deg=-8.05!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -170:sc= 0 USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -8.5! C(o=-8.5!,f=-16!) USER MOD Single : A 70 LYS NZ :NH3+ -176:sc= -0.69 (180deg=-0.716) USER MOD Single : A 71 GLN : amide:sc= -0.886 K(o=-0.89,f=-0.25) USER MOD Single : A 73 HIS : no HE2:sc= -2.59! C(o=-2.6!,f=-3.9!) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 MET CE :methyl -116:sc= -3.94 (180deg=-12.6!) USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.318 USER MOD Single : A 84 HIS : no HD1:sc= -3.22! K(o=-3.2!,f=-1.8) USER MOD Single : A 85 SER OG : rot 95:sc= 0.585 USER MOD Single : A 92 SER OG : rot -30:sc= 1.28 USER MOD Single : A 94 TYR OH : rot 13:sc= -0.941 USER MOD Single : A 95 GLN : amide:sc= -1.87 K(o=-1.9,f=-4.7!) USER MOD Single : A 96 GLN : amide:sc= -3.54 K(o=-3.5,f=-5.3!) USER MOD Single : A 101 TYR OH : rot 15:sc= -2.06 USER MOD Single : A 104 LYS NZ :NH3+ -159:sc= 0.142 (180deg=0.0565) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 HIS : no HD1:sc= -0.124 K(o=-0.12,f=-0.79) USER MOD ----------------------------------------------------------------- ATOM 61 N GLY A 4 9.938 -10.203 -4.684 1.00 0.00 N ATOM 62 CA GLY A 4 9.754 -8.979 -3.921 1.00 0.00 C ATOM 63 C GLY A 4 9.185 -7.851 -4.756 1.00 0.00 C ATOM 64 O GLY A 4 9.928 -7.097 -5.385 1.00 0.00 O ATOM 0 HA2 GLY A 4 9.088 -9.176 -3.081 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.712 -8.669 -3.503 1.00 0.00 H new ATOM 68 N ILE A 5 7.862 -7.734 -4.762 1.00 0.00 N ATOM 69 CA ILE A 5 7.189 -6.690 -5.524 1.00 0.00 C ATOM 70 C ILE A 5 6.431 -5.736 -4.610 1.00 0.00 C ATOM 71 O ILE A 5 5.437 -6.117 -3.993 1.00 0.00 O ATOM 72 CB ILE A 5 6.195 -7.285 -6.540 1.00 0.00 C ATOM 73 CG1 ILE A 5 6.788 -8.520 -7.223 1.00 0.00 C ATOM 74 CG2 ILE A 5 5.800 -6.239 -7.572 1.00 0.00 C ATOM 75 CD1 ILE A 5 8.229 -8.347 -7.642 1.00 0.00 C ATOM 0 H ILE A 5 7.234 -8.351 -4.247 1.00 0.00 H new ATOM 0 HA ILE A 5 7.969 -6.144 -6.055 1.00 0.00 H new ATOM 0 HB ILE A 5 5.299 -7.594 -6.001 1.00 0.00 H new ATOM 0 HG12 ILE A 5 6.715 -9.370 -6.544 1.00 0.00 H new ATOM 0 HG13 ILE A 5 6.190 -8.761 -8.101 1.00 0.00 H new ATOM 0 HG21 ILE A 5 5.098 -6.676 -8.282 1.00 0.00 H new ATOM 0 HG22 ILE A 5 5.330 -5.393 -7.071 1.00 0.00 H new ATOM 0 HG23 ILE A 5 6.689 -5.898 -8.103 1.00 0.00 H new ATOM 0 HD11 ILE A 5 8.582 -9.262 -8.119 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.306 -7.518 -8.346 1.00 0.00 H new ATOM 0 HD13 ILE A 5 8.840 -8.136 -6.764 1.00 0.00 H new ATOM 87 N VAL A 6 6.896 -4.494 -4.541 1.00 0.00 N ATOM 88 CA VAL A 6 6.249 -3.482 -3.714 1.00 0.00 C ATOM 89 C VAL A 6 5.510 -2.471 -4.588 1.00 0.00 C ATOM 90 O VAL A 6 6.122 -1.768 -5.385 1.00 0.00 O ATOM 91 CB VAL A 6 7.271 -2.730 -2.838 1.00 0.00 C ATOM 92 CG1 VAL A 6 8.388 -2.159 -3.695 1.00 0.00 C ATOM 93 CG2 VAL A 6 6.577 -1.635 -2.041 1.00 0.00 C ATOM 0 H VAL A 6 7.718 -4.164 -5.047 1.00 0.00 H new ATOM 0 HA VAL A 6 5.542 -3.999 -3.065 1.00 0.00 H new ATOM 0 HB VAL A 6 7.715 -3.433 -2.134 1.00 0.00 H new ATOM 0 HG11 VAL A 6 9.100 -1.632 -3.060 1.00 0.00 H new ATOM 0 HG12 VAL A 6 8.897 -2.970 -4.216 1.00 0.00 H new ATOM 0 HG13 VAL A 6 7.969 -1.466 -4.424 1.00 0.00 H new ATOM 0 HG21 VAL A 6 7.310 -1.112 -1.427 1.00 0.00 H new ATOM 0 HG22 VAL A 6 6.107 -0.929 -2.726 1.00 0.00 H new ATOM 0 HG23 VAL A 6 5.816 -2.079 -1.399 1.00 0.00 H new ATOM 103 N TRP A 7 4.192 -2.396 -4.442 1.00 0.00 N ATOM 104 CA TRP A 7 3.402 -1.458 -5.234 1.00 0.00 C ATOM 105 C TRP A 7 2.897 -0.301 -4.374 1.00 0.00 C ATOM 106 O TRP A 7 2.492 -0.497 -3.229 1.00 0.00 O ATOM 107 CB TRP A 7 2.255 -2.191 -5.928 1.00 0.00 C ATOM 108 CG TRP A 7 2.718 -2.934 -7.145 1.00 0.00 C ATOM 109 CD1 TRP A 7 4.012 -3.096 -7.552 1.00 0.00 C ATOM 110 CD2 TRP A 7 1.905 -3.612 -8.107 1.00 0.00 C ATOM 111 NE1 TRP A 7 4.054 -3.820 -8.714 1.00 0.00 N ATOM 112 CE2 TRP A 7 2.775 -4.156 -9.073 1.00 0.00 C ATOM 113 CE3 TRP A 7 0.527 -3.812 -8.250 1.00 0.00 C ATOM 114 CZ2 TRP A 7 2.313 -4.888 -10.163 1.00 0.00 C ATOM 115 CZ3 TRP A 7 0.071 -4.541 -9.334 1.00 0.00 C ATOM 116 CH2 TRP A 7 0.962 -5.072 -10.278 1.00 0.00 C ATOM 0 H TRP A 7 3.652 -2.966 -3.791 1.00 0.00 H new ATOM 0 HA TRP A 7 4.041 -1.026 -6.004 1.00 0.00 H new ATOM 0 HB2 TRP A 7 1.796 -2.890 -5.229 1.00 0.00 H new ATOM 0 HB3 TRP A 7 1.485 -1.473 -6.212 1.00 0.00 H new ATOM 0 HD1 TRP A 7 4.876 -2.709 -7.033 1.00 0.00 H new ATOM 0 HE1 TRP A 7 4.899 -4.068 -9.228 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -0.166 -3.405 -7.529 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 2.997 -5.296 -10.892 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -0.990 -4.704 -9.455 1.00 0.00 H new ATOM 0 HH2 TRP A 7 0.574 -5.637 -11.112 1.00 0.00 H new ATOM 127 N VAL A 8 2.964 0.913 -4.922 1.00 0.00 N ATOM 128 CA VAL A 8 2.556 2.111 -4.190 1.00 0.00 C ATOM 129 C VAL A 8 1.491 2.917 -4.925 1.00 0.00 C ATOM 130 O VAL A 8 1.540 3.073 -6.140 1.00 0.00 O ATOM 131 CB VAL A 8 3.756 3.052 -3.946 1.00 0.00 C ATOM 132 CG1 VAL A 8 3.543 3.883 -2.689 1.00 0.00 C ATOM 133 CG2 VAL A 8 5.066 2.274 -3.872 1.00 0.00 C ATOM 0 H VAL A 8 3.297 1.092 -5.869 1.00 0.00 H new ATOM 0 HA VAL A 8 2.147 1.747 -3.247 1.00 0.00 H new ATOM 0 HB VAL A 8 3.825 3.732 -4.795 1.00 0.00 H new ATOM 0 HG11 VAL A 8 4.400 4.539 -2.537 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.641 4.485 -2.799 1.00 0.00 H new ATOM 0 HG13 VAL A 8 3.435 3.221 -1.829 1.00 0.00 H new ATOM 0 HG21 VAL A 8 5.891 2.966 -3.700 1.00 0.00 H new ATOM 0 HG22 VAL A 8 5.017 1.556 -3.053 1.00 0.00 H new ATOM 0 HG23 VAL A 8 5.228 1.743 -4.810 1.00 0.00 H new ATOM 143 N VAL A 9 0.550 3.464 -4.168 1.00 0.00 N ATOM 144 CA VAL A 9 -0.500 4.295 -4.738 1.00 0.00 C ATOM 145 C VAL A 9 -0.569 5.628 -3.988 1.00 0.00 C ATOM 146 O VAL A 9 -0.885 5.665 -2.800 1.00 0.00 O ATOM 147 CB VAL A 9 -1.889 3.596 -4.734 1.00 0.00 C ATOM 148 CG1 VAL A 9 -2.482 3.610 -6.135 1.00 0.00 C ATOM 149 CG2 VAL A 9 -1.791 2.162 -4.236 1.00 0.00 C ATOM 0 H VAL A 9 0.493 3.347 -3.156 1.00 0.00 H new ATOM 0 HA VAL A 9 -0.244 4.472 -5.783 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.537 4.148 -4.054 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.455 3.118 -6.123 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.600 4.641 -6.470 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -1.816 3.081 -6.817 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -2.780 1.705 -4.247 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -1.123 1.596 -4.885 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -1.400 2.156 -3.219 1.00 0.00 H new ATOM 159 N ASP A 10 -0.240 6.716 -4.694 1.00 0.00 N ATOM 160 CA ASP A 10 -0.234 8.066 -4.113 1.00 0.00 C ATOM 161 C ASP A 10 -0.021 9.120 -5.204 1.00 0.00 C ATOM 162 O ASP A 10 -0.389 8.912 -6.359 1.00 0.00 O ATOM 163 CB ASP A 10 0.847 8.179 -3.023 1.00 0.00 C ATOM 164 CG ASP A 10 0.521 9.249 -1.988 1.00 0.00 C ATOM 165 OD1 ASP A 10 -0.291 10.143 -2.303 1.00 0.00 O ATOM 166 OD2 ASP A 10 1.084 9.204 -0.869 1.00 0.00 O ATOM 0 H ASP A 10 0.028 6.688 -5.678 1.00 0.00 H new ATOM 0 HA ASP A 10 -1.204 8.248 -3.650 1.00 0.00 H new ATOM 0 HB2 ASP A 10 0.957 7.216 -2.524 1.00 0.00 H new ATOM 0 HB3 ASP A 10 1.806 8.408 -3.489 1.00 0.00 H new ATOM 171 N ASP A 11 0.562 10.253 -4.833 1.00 0.00 N ATOM 172 CA ASP A 11 0.800 11.345 -5.774 1.00 0.00 C ATOM 173 C ASP A 11 1.818 10.970 -6.853 1.00 0.00 C ATOM 174 O ASP A 11 2.084 11.759 -7.760 1.00 0.00 O ATOM 175 CB ASP A 11 1.298 12.580 -5.022 1.00 0.00 C ATOM 176 CG ASP A 11 1.391 13.797 -5.919 1.00 0.00 C ATOM 177 OD1 ASP A 11 0.627 13.866 -6.903 1.00 0.00 O ATOM 178 OD2 ASP A 11 2.231 14.677 -5.640 1.00 0.00 O ATOM 0 H ASP A 11 0.881 10.442 -3.883 1.00 0.00 H new ATOM 0 HA ASP A 11 -0.149 11.557 -6.267 1.00 0.00 H new ATOM 0 HB2 ASP A 11 0.625 12.793 -4.191 1.00 0.00 H new ATOM 0 HB3 ASP A 11 2.278 12.371 -4.593 1.00 0.00 H new ATOM 183 N ASP A 12 2.374 9.764 -6.771 1.00 0.00 N ATOM 184 CA ASP A 12 3.341 9.309 -7.763 1.00 0.00 C ATOM 185 C ASP A 12 4.558 10.242 -7.824 1.00 0.00 C ATOM 186 O ASP A 12 4.938 10.831 -6.815 1.00 0.00 O ATOM 187 CB ASP A 12 2.655 9.220 -9.128 1.00 0.00 C ATOM 188 CG ASP A 12 3.092 8.005 -9.919 1.00 0.00 C ATOM 189 OD1 ASP A 12 4.143 8.080 -10.590 1.00 0.00 O ATOM 190 OD2 ASP A 12 2.384 6.979 -9.866 1.00 0.00 O ATOM 0 H ASP A 12 2.173 9.089 -6.033 1.00 0.00 H new ATOM 0 HA ASP A 12 3.705 8.323 -7.475 1.00 0.00 H new ATOM 0 HB2 ASP A 12 1.575 9.188 -8.987 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.875 10.121 -9.701 1.00 0.00 H new ATOM 195 N SER A 13 5.152 10.374 -9.017 1.00 0.00 N ATOM 196 CA SER A 13 6.313 11.232 -9.241 1.00 0.00 C ATOM 197 C SER A 13 7.261 11.280 -8.040 1.00 0.00 C ATOM 198 O SER A 13 8.196 10.483 -7.950 1.00 0.00 O ATOM 199 CB SER A 13 5.836 12.627 -9.634 1.00 0.00 C ATOM 200 OG SER A 13 6.850 13.347 -10.315 1.00 0.00 O ATOM 0 H SER A 13 4.836 9.885 -9.855 1.00 0.00 H new ATOM 0 HA SER A 13 6.897 10.803 -10.055 1.00 0.00 H new ATOM 0 HB2 SER A 13 4.955 12.546 -10.271 1.00 0.00 H new ATOM 0 HB3 SER A 13 5.535 13.175 -8.741 1.00 0.00 H new ATOM 0 HG SER A 13 6.515 14.236 -10.556 1.00 0.00 H new ATOM 206 N SER A 14 7.024 12.214 -7.132 1.00 0.00 N ATOM 207 CA SER A 14 7.865 12.362 -5.949 1.00 0.00 C ATOM 208 C SER A 14 7.940 11.056 -5.166 1.00 0.00 C ATOM 209 O SER A 14 9.025 10.539 -4.903 1.00 0.00 O ATOM 210 CB SER A 14 7.329 13.480 -5.053 1.00 0.00 C ATOM 211 OG SER A 14 7.330 14.725 -5.731 1.00 0.00 O ATOM 0 H SER A 14 6.256 12.883 -7.190 1.00 0.00 H new ATOM 0 HA SER A 14 8.871 12.622 -6.280 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.316 13.238 -4.732 1.00 0.00 H new ATOM 0 HB3 SER A 14 7.939 13.553 -4.153 1.00 0.00 H new ATOM 0 HG SER A 14 6.981 15.422 -5.136 1.00 0.00 H new ATOM 217 N ILE A 15 6.781 10.525 -4.800 1.00 0.00 N ATOM 218 CA ILE A 15 6.716 9.277 -4.049 1.00 0.00 C ATOM 219 C ILE A 15 7.278 8.119 -4.862 1.00 0.00 C ATOM 220 O ILE A 15 7.884 7.196 -4.319 1.00 0.00 O ATOM 221 CB ILE A 15 5.272 8.934 -3.640 1.00 0.00 C ATOM 222 CG1 ILE A 15 4.571 10.154 -3.041 1.00 0.00 C ATOM 223 CG2 ILE A 15 5.267 7.775 -2.654 1.00 0.00 C ATOM 224 CD1 ILE A 15 5.195 10.631 -1.752 1.00 0.00 C ATOM 0 H ILE A 15 5.873 10.939 -5.011 1.00 0.00 H new ATOM 0 HA ILE A 15 7.317 9.423 -3.151 1.00 0.00 H new ATOM 0 HB ILE A 15 4.723 8.635 -4.533 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.589 10.967 -3.767 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.524 9.910 -2.861 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.240 7.542 -2.372 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.724 6.901 -3.118 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.834 8.051 -1.765 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.648 11.499 -1.382 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.153 9.833 -1.011 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.234 10.906 -1.931 1.00 0.00 H new ATOM 236 N ARG A 16 7.057 8.175 -6.165 1.00 0.00 N ATOM 237 CA ARG A 16 7.517 7.134 -7.077 1.00 0.00 C ATOM 238 C ARG A 16 9.041 7.128 -7.216 1.00 0.00 C ATOM 239 O ARG A 16 9.682 6.096 -7.040 1.00 0.00 O ATOM 240 CB ARG A 16 6.876 7.335 -8.451 1.00 0.00 C ATOM 241 CG ARG A 16 7.259 6.269 -9.464 1.00 0.00 C ATOM 242 CD ARG A 16 7.270 6.820 -10.882 1.00 0.00 C ATOM 243 NE ARG A 16 6.472 6.000 -11.788 1.00 0.00 N ATOM 244 CZ ARG A 16 5.983 6.433 -12.946 1.00 0.00 C ATOM 245 NH1 ARG A 16 6.224 7.673 -13.357 1.00 0.00 N ATOM 246 NH2 ARG A 16 5.253 5.624 -13.700 1.00 0.00 N ATOM 0 H ARG A 16 6.557 8.938 -6.621 1.00 0.00 H new ATOM 0 HA ARG A 16 7.218 6.172 -6.661 1.00 0.00 H new ATOM 0 HB2 ARG A 16 5.792 7.345 -8.339 1.00 0.00 H new ATOM 0 HB3 ARG A 16 7.165 8.312 -8.838 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.244 5.872 -9.220 1.00 0.00 H new ATOM 0 HG3 ARG A 16 6.556 5.438 -9.402 1.00 0.00 H new ATOM 0 HD2 ARG A 16 6.884 7.839 -10.879 1.00 0.00 H new ATOM 0 HD3 ARG A 16 8.297 6.869 -11.245 1.00 0.00 H new ATOM 0 HE ARG A 16 6.278 5.036 -11.516 1.00 0.00 H new ATOM 0 HH11 ARG A 16 6.788 8.300 -12.783 1.00 0.00 H new ATOM 0 HH12 ARG A 16 5.845 7.998 -14.247 1.00 0.00 H new ATOM 0 HH21 ARG A 16 5.067 4.670 -13.392 1.00 0.00 H new ATOM 0 HH22 ARG A 16 4.878 5.956 -14.589 1.00 0.00 H new ATOM 260 N TRP A 17 9.614 8.278 -7.556 1.00 0.00 N ATOM 261 CA TRP A 17 11.060 8.390 -7.746 1.00 0.00 C ATOM 262 C TRP A 17 11.845 7.862 -6.552 1.00 0.00 C ATOM 263 O TRP A 17 12.835 7.145 -6.717 1.00 0.00 O ATOM 264 CB TRP A 17 11.453 9.841 -8.004 1.00 0.00 C ATOM 265 CG TRP A 17 12.901 10.000 -8.359 1.00 0.00 C ATOM 266 CD1 TRP A 17 13.454 9.897 -9.603 1.00 0.00 C ATOM 267 CD2 TRP A 17 13.982 10.282 -7.459 1.00 0.00 C ATOM 268 NE1 TRP A 17 14.812 10.100 -9.534 1.00 0.00 N ATOM 269 CE2 TRP A 17 15.160 10.337 -8.229 1.00 0.00 C ATOM 270 CE3 TRP A 17 14.070 10.494 -6.078 1.00 0.00 C ATOM 271 CZ2 TRP A 17 16.407 10.595 -7.666 1.00 0.00 C ATOM 272 CZ3 TRP A 17 15.310 10.750 -5.520 1.00 0.00 C ATOM 273 CH2 TRP A 17 16.463 10.799 -6.314 1.00 0.00 C ATOM 0 H TRP A 17 9.101 9.147 -7.706 1.00 0.00 H new ATOM 0 HA TRP A 17 11.311 7.776 -8.611 1.00 0.00 H new ATOM 0 HB2 TRP A 17 10.840 10.240 -8.813 1.00 0.00 H new ATOM 0 HB3 TRP A 17 11.235 10.434 -7.116 1.00 0.00 H new ATOM 0 HD1 TRP A 17 12.905 9.687 -10.509 1.00 0.00 H new ATOM 0 HE1 TRP A 17 15.456 10.078 -10.325 1.00 0.00 H new ATOM 0 HE3 TRP A 17 13.186 10.458 -5.459 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 17.298 10.633 -8.275 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 15.390 10.915 -4.456 1.00 0.00 H new ATOM 0 HH2 TRP A 17 17.416 11.002 -5.849 1.00 0.00 H new ATOM 284 N VAL A 18 11.422 8.231 -5.352 1.00 0.00 N ATOM 285 CA VAL A 18 12.119 7.796 -4.150 1.00 0.00 C ATOM 286 C VAL A 18 11.970 6.301 -3.933 1.00 0.00 C ATOM 287 O VAL A 18 12.954 5.571 -3.828 1.00 0.00 O ATOM 288 CB VAL A 18 11.638 8.521 -2.873 1.00 0.00 C ATOM 289 CG1 VAL A 18 12.767 8.590 -1.857 1.00 0.00 C ATOM 290 CG2 VAL A 18 11.109 9.917 -3.174 1.00 0.00 C ATOM 0 H VAL A 18 10.609 8.824 -5.185 1.00 0.00 H new ATOM 0 HA VAL A 18 13.165 8.051 -4.319 1.00 0.00 H new ATOM 0 HB VAL A 18 10.812 7.945 -2.457 1.00 0.00 H new ATOM 0 HG11 VAL A 18 12.419 9.103 -0.960 1.00 0.00 H new ATOM 0 HG12 VAL A 18 13.085 7.580 -1.597 1.00 0.00 H new ATOM 0 HG13 VAL A 18 13.608 9.137 -2.284 1.00 0.00 H new ATOM 0 HG21 VAL A 18 10.782 10.390 -2.248 1.00 0.00 H new ATOM 0 HG22 VAL A 18 11.899 10.516 -3.628 1.00 0.00 H new ATOM 0 HG23 VAL A 18 10.267 9.846 -3.862 1.00 0.00 H new ATOM 300 N LEU A 19 10.729 5.865 -3.834 1.00 0.00 N ATOM 301 CA LEU A 19 10.414 4.462 -3.588 1.00 0.00 C ATOM 302 C LEU A 19 10.794 3.544 -4.753 1.00 0.00 C ATOM 303 O LEU A 19 11.062 2.363 -4.547 1.00 0.00 O ATOM 304 CB LEU A 19 8.927 4.324 -3.262 1.00 0.00 C ATOM 305 CG LEU A 19 8.554 4.482 -1.783 1.00 0.00 C ATOM 306 CD1 LEU A 19 9.371 3.535 -0.907 1.00 0.00 C ATOM 307 CD2 LEU A 19 8.734 5.927 -1.334 1.00 0.00 C ATOM 0 H LEU A 19 9.910 6.467 -3.921 1.00 0.00 H new ATOM 0 HA LEU A 19 11.017 4.140 -2.739 1.00 0.00 H new ATOM 0 HB2 LEU A 19 8.377 5.068 -3.838 1.00 0.00 H new ATOM 0 HB3 LEU A 19 8.589 3.345 -3.601 1.00 0.00 H new ATOM 0 HG LEU A 19 7.502 4.218 -1.670 1.00 0.00 H new ATOM 0 HD11 LEU A 19 9.086 3.668 0.137 1.00 0.00 H new ATOM 0 HD12 LEU A 19 9.179 2.505 -1.207 1.00 0.00 H new ATOM 0 HD13 LEU A 19 10.432 3.755 -1.024 1.00 0.00 H new ATOM 0 HD21 LEU A 19 8.464 6.017 -0.282 1.00 0.00 H new ATOM 0 HD22 LEU A 19 9.774 6.223 -1.468 1.00 0.00 H new ATOM 0 HD23 LEU A 19 8.092 6.576 -1.930 1.00 0.00 H new ATOM 319 N GLU A 20 10.806 4.071 -5.969 1.00 0.00 N ATOM 320 CA GLU A 20 11.140 3.258 -7.144 1.00 0.00 C ATOM 321 C GLU A 20 12.603 2.805 -7.158 1.00 0.00 C ATOM 322 O GLU A 20 12.890 1.607 -7.191 1.00 0.00 O ATOM 323 CB GLU A 20 10.799 3.999 -8.447 1.00 0.00 C ATOM 324 CG GLU A 20 11.730 5.140 -8.812 1.00 0.00 C ATOM 325 CD GLU A 20 11.339 5.812 -10.113 1.00 0.00 C ATOM 326 OE1 GLU A 20 10.129 6.021 -10.334 1.00 0.00 O ATOM 327 OE2 GLU A 20 12.245 6.126 -10.913 1.00 0.00 O ATOM 0 H GLU A 20 10.592 5.047 -6.174 1.00 0.00 H new ATOM 0 HA GLU A 20 10.526 2.360 -7.076 1.00 0.00 H new ATOM 0 HB2 GLU A 20 10.798 3.278 -9.265 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.785 4.392 -8.367 1.00 0.00 H new ATOM 0 HG2 GLU A 20 11.727 5.878 -8.010 1.00 0.00 H new ATOM 0 HG3 GLU A 20 12.749 4.762 -8.894 1.00 0.00 H new ATOM 334 N ARG A 21 13.520 3.758 -7.163 1.00 0.00 N ATOM 335 CA ARG A 21 14.946 3.443 -7.210 1.00 0.00 C ATOM 336 C ARG A 21 15.470 2.948 -5.867 1.00 0.00 C ATOM 337 O ARG A 21 16.107 1.899 -5.790 1.00 0.00 O ATOM 338 CB ARG A 21 15.749 4.664 -7.662 1.00 0.00 C ATOM 339 CG ARG A 21 15.328 5.207 -9.019 1.00 0.00 C ATOM 340 CD ARG A 21 16.452 5.119 -10.040 1.00 0.00 C ATOM 341 NE ARG A 21 15.961 5.309 -11.405 1.00 0.00 N ATOM 342 CZ ARG A 21 16.710 5.157 -12.495 1.00 0.00 C ATOM 343 NH1 ARG A 21 17.989 4.823 -12.390 1.00 0.00 N ATOM 344 NH2 ARG A 21 16.178 5.345 -13.695 1.00 0.00 N ATOM 0 H ARG A 21 13.308 4.755 -7.135 1.00 0.00 H new ATOM 0 HA ARG A 21 15.071 2.637 -7.933 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.644 5.453 -6.917 1.00 0.00 H new ATOM 0 HB3 ARG A 21 16.806 4.399 -7.699 1.00 0.00 H new ATOM 0 HG2 ARG A 21 14.464 4.649 -9.381 1.00 0.00 H new ATOM 0 HG3 ARG A 21 15.015 6.246 -8.913 1.00 0.00 H new ATOM 0 HD2 ARG A 21 17.206 5.874 -9.817 1.00 0.00 H new ATOM 0 HD3 ARG A 21 16.940 4.147 -9.961 1.00 0.00 H new ATOM 0 HE ARG A 21 14.984 5.574 -11.529 1.00 0.00 H new ATOM 0 HH11 ARG A 21 18.405 4.681 -11.470 1.00 0.00 H new ATOM 0 HH12 ARG A 21 18.557 4.708 -13.230 1.00 0.00 H new ATOM 0 HH21 ARG A 21 15.196 5.606 -13.782 1.00 0.00 H new ATOM 0 HH22 ARG A 21 16.751 5.229 -14.531 1.00 0.00 H new ATOM 358 N ALA A 22 15.216 3.711 -4.813 1.00 0.00 N ATOM 359 CA ALA A 22 15.680 3.343 -3.481 1.00 0.00 C ATOM 360 C ALA A 22 15.233 1.944 -3.093 1.00 0.00 C ATOM 361 O ALA A 22 16.050 1.101 -2.723 1.00 0.00 O ATOM 362 CB ALA A 22 15.201 4.353 -2.459 1.00 0.00 C ATOM 0 H ALA A 22 14.693 4.586 -4.853 1.00 0.00 H new ATOM 0 HA ALA A 22 16.770 3.345 -3.500 1.00 0.00 H new ATOM 0 HB1 ALA A 22 15.555 4.065 -1.469 1.00 0.00 H new ATOM 0 HB2 ALA A 22 15.591 5.339 -2.711 1.00 0.00 H new ATOM 0 HB3 ALA A 22 14.111 4.383 -2.460 1.00 0.00 H new ATOM 368 N LEU A 23 13.938 1.701 -3.178 1.00 0.00 N ATOM 369 CA LEU A 23 13.397 0.395 -2.833 1.00 0.00 C ATOM 370 C LEU A 23 13.925 -0.664 -3.794 1.00 0.00 C ATOM 371 O LEU A 23 14.028 -1.845 -3.444 1.00 0.00 O ATOM 372 CB LEU A 23 11.864 0.415 -2.827 1.00 0.00 C ATOM 373 CG LEU A 23 11.198 -0.732 -2.058 1.00 0.00 C ATOM 374 CD1 LEU A 23 11.972 -1.062 -0.787 1.00 0.00 C ATOM 375 CD2 LEU A 23 9.754 -0.393 -1.728 1.00 0.00 C ATOM 0 H LEU A 23 13.244 2.384 -3.481 1.00 0.00 H new ATOM 0 HA LEU A 23 13.726 0.143 -1.825 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.531 1.360 -2.398 1.00 0.00 H new ATOM 0 HB3 LEU A 23 11.512 0.392 -3.858 1.00 0.00 H new ATOM 0 HG LEU A 23 11.207 -1.613 -2.699 1.00 0.00 H new ATOM 0 HD11 LEU A 23 11.477 -1.879 -0.261 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.988 -1.360 -1.047 1.00 0.00 H new ATOM 0 HD13 LEU A 23 12.005 -0.183 -0.143 1.00 0.00 H new ATOM 0 HD21 LEU A 23 9.301 -1.221 -1.182 1.00 0.00 H new ATOM 0 HD22 LEU A 23 9.723 0.507 -1.113 1.00 0.00 H new ATOM 0 HD23 LEU A 23 9.201 -0.221 -2.651 1.00 0.00 H new ATOM 387 N ALA A 24 14.284 -0.236 -5.000 1.00 0.00 N ATOM 388 CA ALA A 24 14.829 -1.150 -5.987 1.00 0.00 C ATOM 389 C ALA A 24 16.201 -1.628 -5.540 1.00 0.00 C ATOM 390 O ALA A 24 16.582 -2.773 -5.784 1.00 0.00 O ATOM 391 CB ALA A 24 14.905 -0.488 -7.354 1.00 0.00 C ATOM 0 H ALA A 24 14.207 0.732 -5.312 1.00 0.00 H new ATOM 0 HA ALA A 24 14.167 -2.011 -6.073 1.00 0.00 H new ATOM 0 HB1 ALA A 24 15.317 -1.192 -8.077 1.00 0.00 H new ATOM 0 HB2 ALA A 24 13.906 -0.187 -7.669 1.00 0.00 H new ATOM 0 HB3 ALA A 24 15.547 0.391 -7.297 1.00 0.00 H new ATOM 397 N GLY A 25 16.928 -0.749 -4.856 1.00 0.00 N ATOM 398 CA GLY A 25 18.237 -1.110 -4.355 1.00 0.00 C ATOM 399 C GLY A 25 18.141 -2.149 -3.258 1.00 0.00 C ATOM 400 O GLY A 25 19.094 -2.882 -2.999 1.00 0.00 O ATOM 0 H GLY A 25 16.633 0.203 -4.642 1.00 0.00 H new ATOM 0 HA2 GLY A 25 18.847 -1.496 -5.172 1.00 0.00 H new ATOM 0 HA3 GLY A 25 18.740 -0.221 -3.974 1.00 0.00 H new ATOM 404 N ALA A 26 16.976 -2.215 -2.614 1.00 0.00 N ATOM 405 CA ALA A 26 16.747 -3.175 -1.548 1.00 0.00 C ATOM 406 C ALA A 26 16.498 -4.569 -2.117 1.00 0.00 C ATOM 407 O ALA A 26 16.582 -5.565 -1.399 1.00 0.00 O ATOM 408 CB ALA A 26 15.574 -2.734 -0.683 1.00 0.00 C ATOM 0 H ALA A 26 16.179 -1.612 -2.816 1.00 0.00 H new ATOM 0 HA ALA A 26 17.642 -3.218 -0.927 1.00 0.00 H new ATOM 0 HB1 ALA A 26 15.414 -3.463 0.112 1.00 0.00 H new ATOM 0 HB2 ALA A 26 15.791 -1.760 -0.244 1.00 0.00 H new ATOM 0 HB3 ALA A 26 14.676 -2.663 -1.297 1.00 0.00 H new ATOM 414 N GLY A 27 16.209 -4.639 -3.416 1.00 0.00 N ATOM 415 CA GLY A 27 15.975 -5.921 -4.053 1.00 0.00 C ATOM 416 C GLY A 27 14.515 -6.188 -4.364 1.00 0.00 C ATOM 417 O GLY A 27 14.120 -7.341 -4.525 1.00 0.00 O ATOM 0 H GLY A 27 16.133 -3.832 -4.035 1.00 0.00 H new ATOM 0 HA2 GLY A 27 16.549 -5.967 -4.978 1.00 0.00 H new ATOM 0 HA3 GLY A 27 16.350 -6.713 -3.405 1.00 0.00 H new ATOM 421 N LEU A 28 13.706 -5.134 -4.460 1.00 0.00 N ATOM 422 CA LEU A 28 12.294 -5.301 -4.765 1.00 0.00 C ATOM 423 C LEU A 28 11.878 -4.444 -5.957 1.00 0.00 C ATOM 424 O LEU A 28 12.634 -3.593 -6.423 1.00 0.00 O ATOM 425 CB LEU A 28 11.424 -4.948 -3.556 1.00 0.00 C ATOM 426 CG LEU A 28 12.116 -5.041 -2.196 1.00 0.00 C ATOM 427 CD1 LEU A 28 12.748 -3.720 -1.838 1.00 0.00 C ATOM 428 CD2 LEU A 28 11.135 -5.485 -1.121 1.00 0.00 C ATOM 0 H LEU A 28 14.004 -4.167 -4.332 1.00 0.00 H new ATOM 0 HA LEU A 28 12.144 -6.351 -5.018 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.049 -3.933 -3.684 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.557 -5.609 -3.549 1.00 0.00 H new ATOM 0 HG LEU A 28 12.904 -5.791 -2.259 1.00 0.00 H new ATOM 0 HD11 LEU A 28 13.237 -3.802 -0.867 1.00 0.00 H new ATOM 0 HD12 LEU A 28 13.486 -3.453 -2.594 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.979 -2.949 -1.793 1.00 0.00 H new ATOM 0 HD21 LEU A 28 11.649 -5.544 -0.162 1.00 0.00 H new ATOM 0 HD22 LEU A 28 10.320 -4.764 -1.052 1.00 0.00 H new ATOM 0 HD23 LEU A 28 10.732 -6.465 -1.378 1.00 0.00 H new ATOM 440 N THR A 29 10.656 -4.669 -6.431 1.00 0.00 N ATOM 441 CA THR A 29 10.114 -3.915 -7.554 1.00 0.00 C ATOM 442 C THR A 29 9.090 -2.903 -7.054 1.00 0.00 C ATOM 443 O THR A 29 7.981 -3.270 -6.665 1.00 0.00 O ATOM 444 CB THR A 29 9.466 -4.859 -8.567 1.00 0.00 C ATOM 445 OG1 THR A 29 10.437 -5.699 -9.169 1.00 0.00 O ATOM 446 CG2 THR A 29 8.733 -4.135 -9.674 1.00 0.00 C ATOM 0 H THR A 29 10.021 -5.371 -6.052 1.00 0.00 H new ATOM 0 HA THR A 29 10.930 -3.384 -8.045 1.00 0.00 H new ATOM 0 HB THR A 29 8.744 -5.442 -7.995 1.00 0.00 H new ATOM 0 HG1 THR A 29 10.000 -6.296 -9.812 1.00 0.00 H new ATOM 0 HG21 THR A 29 8.297 -4.863 -10.358 1.00 0.00 H new ATOM 0 HG22 THR A 29 7.942 -3.520 -9.245 1.00 0.00 H new ATOM 0 HG23 THR A 29 9.432 -3.499 -10.218 1.00 0.00 H new ATOM 454 N CYS A 30 9.467 -1.631 -7.055 1.00 0.00 N ATOM 455 CA CYS A 30 8.574 -0.584 -6.584 1.00 0.00 C ATOM 456 C CYS A 30 8.000 0.236 -7.725 1.00 0.00 C ATOM 457 O CYS A 30 8.716 0.961 -8.418 1.00 0.00 O ATOM 458 CB CYS A 30 9.286 0.330 -5.596 1.00 0.00 C ATOM 459 SG CYS A 30 8.148 1.317 -4.604 1.00 0.00 S ATOM 0 H CYS A 30 10.378 -1.302 -7.374 1.00 0.00 H new ATOM 0 HA CYS A 30 7.744 -1.080 -6.081 1.00 0.00 H new ATOM 0 HB2 CYS A 30 9.907 -0.273 -4.934 1.00 0.00 H new ATOM 0 HB3 CYS A 30 9.955 0.996 -6.142 1.00 0.00 H new ATOM 0 HG CYS A 30 7.859 2.414 -5.238 1.00 0.00 H new ATOM 465 N THR A 31 6.690 0.125 -7.888 1.00 0.00 N ATOM 466 CA THR A 31 5.969 0.857 -8.914 1.00 0.00 C ATOM 467 C THR A 31 4.884 1.695 -8.242 1.00 0.00 C ATOM 468 O THR A 31 4.462 1.384 -7.129 1.00 0.00 O ATOM 469 CB THR A 31 5.346 -0.105 -9.927 1.00 0.00 C ATOM 470 OG1 THR A 31 5.076 0.569 -11.149 1.00 0.00 O ATOM 471 CG2 THR A 31 4.049 -0.713 -9.441 1.00 0.00 C ATOM 0 H THR A 31 6.099 -0.475 -7.312 1.00 0.00 H new ATOM 0 HA THR A 31 6.660 1.506 -9.452 1.00 0.00 H new ATOM 0 HB THR A 31 6.075 -0.903 -10.068 1.00 0.00 H new ATOM 0 HG1 THR A 31 4.679 -0.059 -11.788 1.00 0.00 H new ATOM 0 HG21 THR A 31 3.655 -1.386 -10.202 1.00 0.00 H new ATOM 0 HG22 THR A 31 4.230 -1.271 -8.522 1.00 0.00 H new ATOM 0 HG23 THR A 31 3.326 0.079 -9.248 1.00 0.00 H new ATOM 479 N THR A 32 4.440 2.757 -8.895 1.00 0.00 N ATOM 480 CA THR A 32 3.421 3.609 -8.309 1.00 0.00 C ATOM 481 C THR A 32 2.243 3.831 -9.251 1.00 0.00 C ATOM 482 O THR A 32 2.360 3.695 -10.469 1.00 0.00 O ATOM 483 CB THR A 32 4.038 4.940 -7.889 1.00 0.00 C ATOM 484 OG1 THR A 32 4.422 5.707 -9.020 1.00 0.00 O ATOM 485 CG2 THR A 32 5.259 4.759 -7.007 1.00 0.00 C ATOM 0 H THR A 32 4.764 3.046 -9.818 1.00 0.00 H new ATOM 0 HA THR A 32 3.028 3.101 -7.429 1.00 0.00 H new ATOM 0 HB THR A 32 3.265 5.460 -7.324 1.00 0.00 H new ATOM 0 HG1 THR A 32 4.497 5.121 -9.802 1.00 0.00 H new ATOM 0 HG21 THR A 32 5.660 5.736 -6.736 1.00 0.00 H new ATOM 0 HG22 THR A 32 4.978 4.219 -6.103 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.017 4.193 -7.547 1.00 0.00 H new ATOM 493 N PHE A 33 1.104 4.163 -8.653 1.00 0.00 N ATOM 494 CA PHE A 33 -0.131 4.402 -9.387 1.00 0.00 C ATOM 495 C PHE A 33 -0.738 5.752 -8.980 1.00 0.00 C ATOM 496 O PHE A 33 -0.213 6.435 -8.100 1.00 0.00 O ATOM 497 CB PHE A 33 -1.134 3.265 -9.171 1.00 0.00 C ATOM 498 CG PHE A 33 -0.579 1.878 -9.390 1.00 0.00 C ATOM 499 CD1 PHE A 33 0.515 1.422 -8.672 1.00 0.00 C ATOM 500 CD2 PHE A 33 -1.168 1.024 -10.312 1.00 0.00 C ATOM 501 CE1 PHE A 33 1.010 0.145 -8.871 1.00 0.00 C ATOM 502 CE2 PHE A 33 -0.679 -0.251 -10.513 1.00 0.00 C ATOM 503 CZ PHE A 33 0.411 -0.693 -9.795 1.00 0.00 C ATOM 0 H PHE A 33 1.012 4.274 -7.643 1.00 0.00 H new ATOM 0 HA PHE A 33 0.105 4.434 -10.451 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -1.521 3.329 -8.154 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -1.979 3.413 -9.843 1.00 0.00 H new ATOM 0 HD1 PHE A 33 0.987 2.071 -7.949 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -2.022 1.362 -10.881 1.00 0.00 H new ATOM 0 HE1 PHE A 33 1.864 -0.197 -8.305 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -1.151 -0.903 -11.233 1.00 0.00 H new ATOM 0 HZ PHE A 33 0.796 -1.690 -9.953 1.00 0.00 H new ATOM 513 N GLU A 34 -1.809 6.152 -9.665 1.00 0.00 N ATOM 514 CA GLU A 34 -2.453 7.449 -9.427 1.00 0.00 C ATOM 515 C GLU A 34 -2.924 7.652 -7.983 1.00 0.00 C ATOM 516 O GLU A 34 -2.601 8.675 -7.379 1.00 0.00 O ATOM 517 CB GLU A 34 -3.648 7.610 -10.365 1.00 0.00 C ATOM 518 CG GLU A 34 -4.670 6.492 -10.233 1.00 0.00 C ATOM 519 CD GLU A 34 -5.835 6.853 -9.334 1.00 0.00 C ATOM 520 OE1 GLU A 34 -6.100 8.060 -9.154 1.00 0.00 O ATOM 521 OE2 GLU A 34 -6.484 5.922 -8.809 1.00 0.00 O ATOM 0 H GLU A 34 -2.253 5.594 -10.394 1.00 0.00 H new ATOM 0 HA GLU A 34 -1.692 8.205 -9.621 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -4.135 8.564 -10.162 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -3.291 7.647 -11.394 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -5.049 6.236 -11.222 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.178 5.603 -9.840 1.00 0.00 H new ATOM 528 N ASN A 35 -3.695 6.721 -7.426 1.00 0.00 N ATOM 529 CA ASN A 35 -4.176 6.899 -6.060 1.00 0.00 C ATOM 530 C ASN A 35 -4.618 5.595 -5.408 1.00 0.00 C ATOM 531 O ASN A 35 -4.396 5.386 -4.215 1.00 0.00 O ATOM 532 CB ASN A 35 -5.323 7.905 -6.036 1.00 0.00 C ATOM 533 CG ASN A 35 -5.179 8.915 -4.915 1.00 0.00 C ATOM 534 OD1 ASN A 35 -4.780 10.056 -5.139 1.00 0.00 O ATOM 535 ND2 ASN A 35 -5.505 8.497 -3.699 1.00 0.00 N ATOM 0 H ASN A 35 -3.993 5.860 -7.884 1.00 0.00 H new ATOM 0 HA ASN A 35 -3.335 7.275 -5.478 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -5.364 8.429 -6.991 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -6.268 7.373 -5.924 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -5.429 9.132 -2.904 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -5.832 7.541 -3.559 1.00 0.00 H new ATOM 542 N GLY A 36 -5.246 4.727 -6.181 1.00 0.00 N ATOM 543 CA GLY A 36 -5.707 3.465 -5.633 1.00 0.00 C ATOM 544 C GLY A 36 -6.438 2.603 -6.637 1.00 0.00 C ATOM 545 O GLY A 36 -6.067 1.449 -6.857 1.00 0.00 O ATOM 0 H GLY A 36 -5.446 4.868 -7.171 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.851 2.912 -5.246 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.367 3.664 -4.788 1.00 0.00 H new ATOM 549 N ASN A 37 -7.485 3.150 -7.245 1.00 0.00 N ATOM 550 CA ASN A 37 -8.262 2.397 -8.219 1.00 0.00 C ATOM 551 C ASN A 37 -7.372 1.900 -9.348 1.00 0.00 C ATOM 552 O ASN A 37 -7.656 0.878 -9.975 1.00 0.00 O ATOM 553 CB ASN A 37 -9.410 3.243 -8.773 1.00 0.00 C ATOM 554 CG ASN A 37 -10.571 3.341 -7.801 1.00 0.00 C ATOM 555 OD1 ASN A 37 -10.748 4.360 -7.132 1.00 0.00 O ATOM 556 ND2 ASN A 37 -11.372 2.282 -7.723 1.00 0.00 N ATOM 0 H ASN A 37 -7.812 4.102 -7.082 1.00 0.00 H new ATOM 0 HA ASN A 37 -8.691 1.532 -7.713 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -9.044 4.244 -9.001 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -9.759 2.810 -9.710 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -12.172 2.293 -7.090 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -11.187 1.459 -8.297 1.00 0.00 H new ATOM 563 N GLU A 38 -6.284 2.619 -9.595 1.00 0.00 N ATOM 564 CA GLU A 38 -5.354 2.235 -10.639 1.00 0.00 C ATOM 565 C GLU A 38 -4.710 0.888 -10.314 1.00 0.00 C ATOM 566 O GLU A 38 -4.671 -0.001 -11.164 1.00 0.00 O ATOM 567 CB GLU A 38 -4.293 3.318 -10.834 1.00 0.00 C ATOM 568 CG GLU A 38 -3.328 3.039 -11.977 1.00 0.00 C ATOM 569 CD GLU A 38 -3.394 4.089 -13.069 1.00 0.00 C ATOM 570 OE1 GLU A 38 -2.891 5.210 -12.847 1.00 0.00 O ATOM 571 OE2 GLU A 38 -3.945 3.788 -14.149 1.00 0.00 O ATOM 0 H GLU A 38 -6.028 3.466 -9.087 1.00 0.00 H new ATOM 0 HA GLU A 38 -5.904 2.128 -11.574 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -4.790 4.271 -11.016 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -3.725 3.426 -9.910 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.312 2.991 -11.586 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -3.551 2.062 -12.405 1.00 0.00 H new ATOM 578 N VAL A 39 -4.207 0.721 -9.085 1.00 0.00 N ATOM 579 CA VAL A 39 -3.585 -0.550 -8.710 1.00 0.00 C ATOM 580 C VAL A 39 -4.560 -1.709 -8.850 1.00 0.00 C ATOM 581 O VAL A 39 -4.160 -2.828 -9.168 1.00 0.00 O ATOM 582 CB VAL A 39 -3.056 -0.546 -7.274 1.00 0.00 C ATOM 583 CG1 VAL A 39 -2.189 -1.774 -7.031 1.00 0.00 C ATOM 584 CG2 VAL A 39 -2.290 0.729 -6.987 1.00 0.00 C ATOM 0 H VAL A 39 -4.218 1.430 -8.352 1.00 0.00 H new ATOM 0 HA VAL A 39 -2.748 -0.677 -9.396 1.00 0.00 H new ATOM 0 HB VAL A 39 -3.903 -0.584 -6.589 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.818 -1.761 -6.006 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.781 -2.675 -7.191 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -1.346 -1.767 -7.722 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -1.923 0.710 -5.961 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.446 0.809 -7.672 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -2.949 1.587 -7.121 1.00 0.00 H new ATOM 594 N LEU A 40 -5.837 -1.440 -8.607 1.00 0.00 N ATOM 595 CA LEU A 40 -6.860 -2.474 -8.713 1.00 0.00 C ATOM 596 C LEU A 40 -6.835 -3.101 -10.095 1.00 0.00 C ATOM 597 O LEU A 40 -6.839 -4.323 -10.228 1.00 0.00 O ATOM 598 CB LEU A 40 -8.246 -1.901 -8.435 1.00 0.00 C ATOM 599 CG LEU A 40 -8.348 -1.052 -7.178 1.00 0.00 C ATOM 600 CD1 LEU A 40 -9.765 -0.543 -7.011 1.00 0.00 C ATOM 601 CD2 LEU A 40 -7.913 -1.844 -5.952 1.00 0.00 C ATOM 0 H LEU A 40 -6.188 -0.521 -8.337 1.00 0.00 H new ATOM 0 HA LEU A 40 -6.643 -3.238 -7.967 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.551 -1.297 -9.289 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -8.955 -2.725 -8.358 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.678 -0.198 -7.280 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -9.829 0.064 -6.108 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -10.039 0.062 -7.875 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -10.448 -1.388 -6.929 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.995 -1.216 -5.065 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -8.554 -2.718 -5.837 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.879 -2.166 -6.075 1.00 0.00 H new ATOM 613 N ALA A 41 -6.796 -2.259 -11.127 1.00 0.00 N ATOM 614 CA ALA A 41 -6.756 -2.750 -12.497 1.00 0.00 C ATOM 615 C ALA A 41 -5.574 -3.687 -12.686 1.00 0.00 C ATOM 616 O ALA A 41 -5.708 -4.786 -13.223 1.00 0.00 O ATOM 617 CB ALA A 41 -6.676 -1.589 -13.476 1.00 0.00 C ATOM 0 H ALA A 41 -6.791 -1.243 -11.039 1.00 0.00 H new ATOM 0 HA ALA A 41 -7.674 -3.304 -12.695 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -6.647 -1.974 -14.495 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -7.550 -0.950 -13.354 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -5.773 -1.010 -13.281 1.00 0.00 H new ATOM 623 N ALA A 42 -4.420 -3.240 -12.222 1.00 0.00 N ATOM 624 CA ALA A 42 -3.199 -4.024 -12.313 1.00 0.00 C ATOM 625 C ALA A 42 -3.267 -5.235 -11.392 1.00 0.00 C ATOM 626 O ALA A 42 -2.710 -6.291 -11.692 1.00 0.00 O ATOM 627 CB ALA A 42 -1.984 -3.171 -11.974 1.00 0.00 C ATOM 0 H ALA A 42 -4.302 -2.331 -11.775 1.00 0.00 H new ATOM 0 HA ALA A 42 -3.099 -4.375 -13.340 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.081 -3.778 -12.048 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -1.919 -2.337 -12.672 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -2.081 -2.787 -10.958 1.00 0.00 H new ATOM 633 N LEU A 43 -3.956 -5.069 -10.264 1.00 0.00 N ATOM 634 CA LEU A 43 -4.105 -6.140 -9.286 1.00 0.00 C ATOM 635 C LEU A 43 -4.955 -7.274 -9.842 1.00 0.00 C ATOM 636 O LEU A 43 -4.805 -8.430 -9.444 1.00 0.00 O ATOM 637 CB LEU A 43 -4.739 -5.607 -7.999 1.00 0.00 C ATOM 638 CG LEU A 43 -3.765 -5.020 -6.989 1.00 0.00 C ATOM 639 CD1 LEU A 43 -4.524 -4.309 -5.882 1.00 0.00 C ATOM 640 CD2 LEU A 43 -2.907 -6.128 -6.418 1.00 0.00 C ATOM 0 H LEU A 43 -4.421 -4.198 -10.006 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.110 -6.526 -9.063 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.468 -4.841 -8.263 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -5.288 -6.418 -7.521 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.123 -4.292 -7.484 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.816 -3.893 -5.165 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.123 -3.505 -6.310 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.179 -5.019 -5.376 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.208 -5.710 -5.694 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.543 -6.864 -5.926 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.351 -6.609 -7.223 1.00 0.00 H new ATOM 652 N ALA A 44 -5.846 -6.937 -10.763 1.00 0.00 N ATOM 653 CA ALA A 44 -6.724 -7.927 -11.377 1.00 0.00 C ATOM 654 C ALA A 44 -5.928 -8.993 -12.125 1.00 0.00 C ATOM 655 O ALA A 44 -6.458 -10.053 -12.462 1.00 0.00 O ATOM 656 CB ALA A 44 -7.709 -7.243 -12.314 1.00 0.00 C ATOM 0 H ALA A 44 -5.981 -5.985 -11.103 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.277 -8.426 -10.581 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -8.360 -7.991 -12.767 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -8.312 -6.531 -11.751 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -7.162 -6.717 -13.096 1.00 0.00 H new ATOM 662 N SER A 45 -4.655 -8.707 -12.390 1.00 0.00 N ATOM 663 CA SER A 45 -3.797 -9.639 -13.100 1.00 0.00 C ATOM 664 C SER A 45 -2.546 -9.990 -12.296 1.00 0.00 C ATOM 665 O SER A 45 -1.761 -10.843 -12.710 1.00 0.00 O ATOM 666 CB SER A 45 -3.395 -9.058 -14.455 1.00 0.00 C ATOM 667 OG SER A 45 -4.424 -9.237 -15.410 1.00 0.00 O ATOM 0 H SER A 45 -4.199 -7.835 -12.121 1.00 0.00 H new ATOM 0 HA SER A 45 -4.366 -10.557 -13.249 1.00 0.00 H new ATOM 0 HB2 SER A 45 -3.174 -7.996 -14.348 1.00 0.00 H new ATOM 0 HB3 SER A 45 -2.482 -9.540 -14.805 1.00 0.00 H new ATOM 0 HG SER A 45 -4.144 -8.856 -16.268 1.00 0.00 H new ATOM 673 N LYS A 46 -2.355 -9.335 -11.151 1.00 0.00 N ATOM 674 CA LYS A 46 -1.191 -9.597 -10.317 1.00 0.00 C ATOM 675 C LYS A 46 -1.450 -9.231 -8.861 1.00 0.00 C ATOM 676 O LYS A 46 -2.417 -8.542 -8.537 1.00 0.00 O ATOM 677 CB LYS A 46 0.029 -8.839 -10.863 1.00 0.00 C ATOM 678 CG LYS A 46 0.999 -8.299 -9.813 1.00 0.00 C ATOM 679 CD LYS A 46 2.432 -8.485 -10.255 1.00 0.00 C ATOM 680 CE LYS A 46 3.409 -7.801 -9.312 1.00 0.00 C ATOM 681 NZ LYS A 46 4.626 -7.322 -10.024 1.00 0.00 N ATOM 0 H LYS A 46 -2.989 -8.625 -10.785 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.985 -10.667 -10.349 1.00 0.00 H new ATOM 0 HB2 LYS A 46 0.578 -9.504 -11.530 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.326 -8.004 -11.467 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.802 -7.241 -9.640 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.837 -8.812 -8.865 1.00 0.00 H new ATOM 0 HD2 LYS A 46 2.661 -9.549 -10.306 1.00 0.00 H new ATOM 0 HD3 LYS A 46 2.557 -8.084 -11.261 1.00 0.00 H new ATOM 0 HE2 LYS A 46 2.916 -6.958 -8.828 1.00 0.00 H new ATOM 0 HE3 LYS A 46 3.699 -8.496 -8.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 5.466 -7.794 -9.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 4.545 -7.544 -11.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 4.718 -6.293 -9.901 1.00 0.00 H new ATOM 695 N THR A 47 -0.558 -9.689 -7.992 1.00 0.00 N ATOM 696 CA THR A 47 -0.658 -9.405 -6.573 1.00 0.00 C ATOM 697 C THR A 47 0.716 -9.075 -5.987 1.00 0.00 C ATOM 698 O THR A 47 1.587 -9.941 -5.911 1.00 0.00 O ATOM 699 CB THR A 47 -1.276 -10.590 -5.828 1.00 0.00 C ATOM 700 OG1 THR A 47 -2.584 -10.860 -6.311 1.00 0.00 O ATOM 701 CG2 THR A 47 -1.361 -10.372 -4.331 1.00 0.00 C ATOM 0 H THR A 47 0.246 -10.261 -8.251 1.00 0.00 H new ATOM 0 HA THR A 47 -1.306 -8.537 -6.448 1.00 0.00 H new ATOM 0 HB THR A 47 -0.612 -11.434 -6.015 1.00 0.00 H new ATOM 0 HG1 THR A 47 -2.962 -11.622 -5.824 1.00 0.00 H new ATOM 0 HG21 THR A 47 -1.808 -11.248 -3.861 1.00 0.00 H new ATOM 0 HG22 THR A 47 -0.360 -10.215 -3.929 1.00 0.00 H new ATOM 0 HG23 THR A 47 -1.976 -9.496 -4.125 1.00 0.00 H new ATOM 709 N PRO A 48 0.929 -7.819 -5.556 1.00 0.00 N ATOM 710 CA PRO A 48 2.201 -7.395 -4.968 1.00 0.00 C ATOM 711 C PRO A 48 2.405 -7.990 -3.580 1.00 0.00 C ATOM 712 O PRO A 48 1.446 -8.385 -2.919 1.00 0.00 O ATOM 713 CB PRO A 48 2.068 -5.873 -4.888 1.00 0.00 C ATOM 714 CG PRO A 48 0.601 -5.623 -4.810 1.00 0.00 C ATOM 715 CD PRO A 48 -0.053 -6.721 -5.603 1.00 0.00 C ATOM 0 HA PRO A 48 3.059 -7.724 -5.554 1.00 0.00 H new ATOM 0 HB2 PRO A 48 2.584 -5.476 -4.014 1.00 0.00 H new ATOM 0 HB3 PRO A 48 2.506 -5.391 -5.762 1.00 0.00 H new ATOM 0 HG2 PRO A 48 0.259 -5.633 -3.775 1.00 0.00 H new ATOM 0 HG3 PRO A 48 0.350 -4.644 -5.219 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -1.006 -7.018 -5.166 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -0.256 -6.409 -6.627 1.00 0.00 H new ATOM 723 N ASP A 49 3.656 -8.060 -3.140 1.00 0.00 N ATOM 724 CA ASP A 49 3.967 -8.615 -1.828 1.00 0.00 C ATOM 725 C ASP A 49 3.666 -7.607 -0.721 1.00 0.00 C ATOM 726 O ASP A 49 3.310 -7.985 0.396 1.00 0.00 O ATOM 727 CB ASP A 49 5.433 -9.048 -1.766 1.00 0.00 C ATOM 728 CG ASP A 49 5.738 -10.183 -2.724 1.00 0.00 C ATOM 729 OD1 ASP A 49 6.073 -9.900 -3.893 1.00 0.00 O ATOM 730 OD2 ASP A 49 5.640 -11.355 -2.305 1.00 0.00 O ATOM 0 H ASP A 49 4.468 -7.741 -3.669 1.00 0.00 H new ATOM 0 HA ASP A 49 3.335 -9.489 -1.673 1.00 0.00 H new ATOM 0 HB2 ASP A 49 6.071 -8.196 -2.000 1.00 0.00 H new ATOM 0 HB3 ASP A 49 5.675 -9.358 -0.750 1.00 0.00 H new ATOM 735 N VAL A 50 3.804 -6.326 -1.044 1.00 0.00 N ATOM 736 CA VAL A 50 3.541 -5.258 -0.087 1.00 0.00 C ATOM 737 C VAL A 50 2.943 -4.047 -0.792 1.00 0.00 C ATOM 738 O VAL A 50 3.666 -3.207 -1.330 1.00 0.00 O ATOM 739 CB VAL A 50 4.824 -4.837 0.658 1.00 0.00 C ATOM 740 CG1 VAL A 50 5.913 -4.455 -0.331 1.00 0.00 C ATOM 741 CG2 VAL A 50 4.540 -3.693 1.625 1.00 0.00 C ATOM 0 H VAL A 50 4.098 -6.001 -1.965 1.00 0.00 H new ATOM 0 HA VAL A 50 2.829 -5.643 0.643 1.00 0.00 H new ATOM 0 HB VAL A 50 5.176 -5.688 1.241 1.00 0.00 H new ATOM 0 HG11 VAL A 50 6.811 -4.161 0.212 1.00 0.00 H new ATOM 0 HG12 VAL A 50 6.139 -5.308 -0.971 1.00 0.00 H new ATOM 0 HG13 VAL A 50 5.571 -3.622 -0.945 1.00 0.00 H new ATOM 0 HG21 VAL A 50 5.460 -3.414 2.139 1.00 0.00 H new ATOM 0 HG22 VAL A 50 4.159 -2.835 1.072 1.00 0.00 H new ATOM 0 HG23 VAL A 50 3.798 -4.011 2.357 1.00 0.00 H new ATOM 751 N LEU A 51 1.617 -3.974 -0.794 1.00 0.00 N ATOM 752 CA LEU A 51 0.911 -2.879 -1.445 1.00 0.00 C ATOM 753 C LEU A 51 0.816 -1.643 -0.554 1.00 0.00 C ATOM 754 O LEU A 51 0.608 -1.738 0.655 1.00 0.00 O ATOM 755 CB LEU A 51 -0.492 -3.331 -1.861 1.00 0.00 C ATOM 756 CG LEU A 51 -1.290 -2.311 -2.674 1.00 0.00 C ATOM 757 CD1 LEU A 51 -0.531 -1.919 -3.930 1.00 0.00 C ATOM 758 CD2 LEU A 51 -2.662 -2.865 -3.029 1.00 0.00 C ATOM 0 H LEU A 51 1.009 -4.662 -0.351 1.00 0.00 H new ATOM 0 HA LEU A 51 1.486 -2.603 -2.329 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.403 -4.247 -2.445 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -1.058 -3.579 -0.963 1.00 0.00 H new ATOM 0 HG LEU A 51 -1.428 -1.418 -2.064 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.114 -1.193 -4.496 1.00 0.00 H new ATOM 0 HD12 LEU A 51 0.427 -1.479 -3.654 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -0.360 -2.804 -4.543 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -3.215 -2.125 -3.607 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -2.546 -3.774 -3.619 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -3.210 -3.094 -2.115 1.00 0.00 H new ATOM 770 N LEU A 52 0.964 -0.481 -1.179 1.00 0.00 N ATOM 771 CA LEU A 52 0.892 0.797 -0.485 1.00 0.00 C ATOM 772 C LEU A 52 -0.166 1.672 -1.137 1.00 0.00 C ATOM 773 O LEU A 52 -0.061 1.962 -2.319 1.00 0.00 O ATOM 774 CB LEU A 52 2.245 1.494 -0.552 1.00 0.00 C ATOM 775 CG LEU A 52 3.008 1.529 0.760 1.00 0.00 C ATOM 776 CD1 LEU A 52 4.508 1.532 0.514 1.00 0.00 C ATOM 777 CD2 LEU A 52 2.586 2.737 1.570 1.00 0.00 C ATOM 0 H LEU A 52 1.137 -0.399 -2.181 1.00 0.00 H new ATOM 0 HA LEU A 52 0.627 0.626 0.558 1.00 0.00 H new ATOM 0 HB2 LEU A 52 2.859 0.993 -1.300 1.00 0.00 H new ATOM 0 HB3 LEU A 52 2.094 2.517 -0.896 1.00 0.00 H new ATOM 0 HG LEU A 52 2.770 0.630 1.329 1.00 0.00 H new ATOM 0 HD11 LEU A 52 5.033 1.557 1.469 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.789 0.631 -0.031 1.00 0.00 H new ATOM 0 HD13 LEU A 52 4.779 2.410 -0.072 1.00 0.00 H new ATOM 0 HD21 LEU A 52 3.138 2.756 2.510 1.00 0.00 H new ATOM 0 HD22 LEU A 52 2.799 3.645 1.006 1.00 0.00 H new ATOM 0 HD23 LEU A 52 1.517 2.681 1.777 1.00 0.00 H new ATOM 789 N SER A 53 -1.193 2.068 -0.382 1.00 0.00 N ATOM 790 CA SER A 53 -2.275 2.882 -0.943 1.00 0.00 C ATOM 791 C SER A 53 -2.374 4.281 -0.344 1.00 0.00 C ATOM 792 O SER A 53 -2.096 4.499 0.835 1.00 0.00 O ATOM 793 CB SER A 53 -3.615 2.163 -0.774 1.00 0.00 C ATOM 794 OG SER A 53 -3.913 1.371 -1.910 1.00 0.00 O ATOM 0 H SER A 53 -1.299 1.842 0.607 1.00 0.00 H new ATOM 0 HA SER A 53 -2.034 3.011 -1.998 1.00 0.00 H new ATOM 0 HB2 SER A 53 -3.584 1.533 0.115 1.00 0.00 H new ATOM 0 HB3 SER A 53 -4.407 2.895 -0.619 1.00 0.00 H new ATOM 0 HG SER A 53 -4.837 1.049 -1.851 1.00 0.00 H new ATOM 800 N ASP A 54 -2.811 5.220 -1.180 1.00 0.00 N ATOM 801 CA ASP A 54 -3.000 6.601 -0.767 1.00 0.00 C ATOM 802 C ASP A 54 -4.351 6.743 -0.090 1.00 0.00 C ATOM 803 O ASP A 54 -5.075 5.760 0.075 1.00 0.00 O ATOM 804 CB ASP A 54 -2.929 7.539 -1.973 1.00 0.00 C ATOM 805 CG ASP A 54 -2.623 8.973 -1.583 1.00 0.00 C ATOM 806 OD1 ASP A 54 -2.093 9.186 -0.472 1.00 0.00 O ATOM 807 OD2 ASP A 54 -2.917 9.883 -2.387 1.00 0.00 O ATOM 0 H ASP A 54 -3.042 5.042 -2.157 1.00 0.00 H new ATOM 0 HA ASP A 54 -2.206 6.871 -0.070 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -2.162 7.182 -2.661 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -3.878 7.507 -2.509 1.00 0.00 H new ATOM 812 N ILE A 55 -4.689 7.956 0.308 1.00 0.00 N ATOM 813 CA ILE A 55 -5.949 8.195 0.967 1.00 0.00 C ATOM 814 C ILE A 55 -6.360 9.662 0.904 1.00 0.00 C ATOM 815 O ILE A 55 -6.282 10.388 1.895 1.00 0.00 O ATOM 816 CB ILE A 55 -5.873 7.715 2.422 1.00 0.00 C ATOM 817 CG1 ILE A 55 -7.132 8.104 3.196 1.00 0.00 C ATOM 818 CG2 ILE A 55 -4.627 8.264 3.093 1.00 0.00 C ATOM 819 CD1 ILE A 55 -7.674 6.990 4.062 1.00 0.00 C ATOM 0 H ILE A 55 -4.107 8.785 0.185 1.00 0.00 H new ATOM 0 HA ILE A 55 -6.716 7.628 0.439 1.00 0.00 H new ATOM 0 HB ILE A 55 -5.811 6.627 2.422 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -6.911 8.967 3.824 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -7.903 8.413 2.490 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -4.586 7.915 4.125 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -3.743 7.918 2.558 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -4.656 9.354 3.079 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -8.567 7.335 4.582 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -7.926 6.133 3.437 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.920 6.697 4.792 1.00 0.00 H new ATOM 831 N ARG A 56 -6.813 10.080 -0.273 1.00 0.00 N ATOM 832 CA ARG A 56 -7.255 11.451 -0.489 1.00 0.00 C ATOM 833 C ARG A 56 -7.653 11.665 -1.948 1.00 0.00 C ATOM 834 O ARG A 56 -7.087 12.515 -2.636 1.00 0.00 O ATOM 835 CB ARG A 56 -6.148 12.433 -0.104 1.00 0.00 C ATOM 836 CG ARG A 56 -6.657 13.827 0.231 1.00 0.00 C ATOM 837 CD ARG A 56 -6.052 14.874 -0.688 1.00 0.00 C ATOM 838 NE ARG A 56 -6.937 15.197 -1.804 1.00 0.00 N ATOM 839 CZ ARG A 56 -7.957 16.046 -1.720 1.00 0.00 C ATOM 840 NH1 ARG A 56 -8.223 16.669 -0.578 1.00 0.00 N ATOM 841 NH2 ARG A 56 -8.716 16.274 -2.783 1.00 0.00 N ATOM 0 H ARG A 56 -6.884 9.483 -1.097 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.126 11.631 0.141 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.606 12.037 0.755 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.435 12.504 -0.926 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -7.743 13.850 0.145 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.414 14.066 1.266 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -5.842 15.779 -0.118 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -5.099 14.511 -1.074 1.00 0.00 H new ATOM 0 HE ARG A 56 -6.762 14.744 -2.701 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -7.643 16.498 0.243 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -9.007 17.319 -0.522 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -8.517 15.798 -3.663 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -9.499 16.925 -2.721 1.00 0.00 H new ATOM 855 N MET A 57 -8.625 10.885 -2.417 1.00 0.00 N ATOM 856 CA MET A 57 -9.088 10.998 -3.800 1.00 0.00 C ATOM 857 C MET A 57 -10.448 10.321 -4.005 1.00 0.00 C ATOM 858 O MET A 57 -11.426 10.979 -4.357 1.00 0.00 O ATOM 859 CB MET A 57 -8.054 10.403 -4.762 1.00 0.00 C ATOM 860 CG MET A 57 -7.837 11.234 -6.017 1.00 0.00 C ATOM 861 SD MET A 57 -7.723 10.221 -7.505 1.00 0.00 S ATOM 862 CE MET A 57 -8.023 11.442 -8.779 1.00 0.00 C ATOM 0 H MET A 57 -9.104 10.173 -1.866 1.00 0.00 H new ATOM 0 HA MET A 57 -9.210 12.060 -4.015 1.00 0.00 H new ATOM 0 HB2 MET A 57 -7.104 10.296 -4.239 1.00 0.00 H new ATOM 0 HB3 MET A 57 -8.373 9.402 -5.051 1.00 0.00 H new ATOM 0 HG2 MET A 57 -8.658 11.943 -6.126 1.00 0.00 H new ATOM 0 HG3 MET A 57 -6.923 11.819 -5.908 1.00 0.00 H new ATOM 0 HE1 MET A 57 -7.984 10.964 -9.758 1.00 0.00 H new ATOM 0 HE2 MET A 57 -9.007 11.887 -8.632 1.00 0.00 H new ATOM 0 HE3 MET A 57 -7.261 12.220 -8.724 1.00 0.00 H new ATOM 872 N PRO A 58 -10.528 8.992 -3.807 1.00 0.00 N ATOM 873 CA PRO A 58 -11.777 8.235 -3.991 1.00 0.00 C ATOM 874 C PRO A 58 -12.906 8.701 -3.079 1.00 0.00 C ATOM 875 O PRO A 58 -12.841 9.775 -2.481 1.00 0.00 O ATOM 876 CB PRO A 58 -11.384 6.795 -3.645 1.00 0.00 C ATOM 877 CG PRO A 58 -10.136 6.923 -2.844 1.00 0.00 C ATOM 878 CD PRO A 58 -9.419 8.112 -3.405 1.00 0.00 C ATOM 0 HA PRO A 58 -12.165 8.363 -5.002 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -12.169 6.296 -3.077 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -11.217 6.203 -4.545 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -10.361 7.064 -1.787 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -9.525 6.024 -2.923 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.774 8.584 -2.664 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -8.787 7.843 -4.251 1.00 0.00 H new ATOM 886 N GLY A 59 -13.947 7.875 -2.986 1.00 0.00 N ATOM 887 CA GLY A 59 -15.091 8.197 -2.154 1.00 0.00 C ATOM 888 C GLY A 59 -14.735 8.299 -0.685 1.00 0.00 C ATOM 889 O GLY A 59 -14.831 9.374 -0.091 1.00 0.00 O ATOM 0 H GLY A 59 -14.016 6.983 -3.476 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -15.522 9.142 -2.486 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -15.857 7.433 -2.286 1.00 0.00 H new ATOM 893 N MET A 60 -14.323 7.179 -0.093 1.00 0.00 N ATOM 894 CA MET A 60 -13.953 7.154 1.319 1.00 0.00 C ATOM 895 C MET A 60 -12.497 7.572 1.509 1.00 0.00 C ATOM 896 O MET A 60 -11.711 6.865 2.144 1.00 0.00 O ATOM 897 CB MET A 60 -14.199 5.764 1.918 1.00 0.00 C ATOM 898 CG MET A 60 -15.176 5.776 3.082 1.00 0.00 C ATOM 899 SD MET A 60 -16.212 4.301 3.130 1.00 0.00 S ATOM 900 CE MET A 60 -17.833 5.010 2.850 1.00 0.00 C ATOM 0 H MET A 60 -14.238 6.281 -0.568 1.00 0.00 H new ATOM 0 HA MET A 60 -14.582 7.871 1.846 1.00 0.00 H new ATOM 0 HB2 MET A 60 -14.580 5.103 1.140 1.00 0.00 H new ATOM 0 HB3 MET A 60 -13.249 5.347 2.254 1.00 0.00 H new ATOM 0 HG2 MET A 60 -14.621 5.857 4.017 1.00 0.00 H new ATOM 0 HG3 MET A 60 -15.810 6.659 3.010 1.00 0.00 H new ATOM 0 HE1 MET A 60 -18.582 4.218 2.852 1.00 0.00 H new ATOM 0 HE2 MET A 60 -18.059 5.725 3.641 1.00 0.00 H new ATOM 0 HE3 MET A 60 -17.846 5.519 1.886 1.00 0.00 H new ATOM 910 N ASP A 61 -12.158 8.737 0.956 1.00 0.00 N ATOM 911 CA ASP A 61 -10.810 9.289 1.049 1.00 0.00 C ATOM 912 C ASP A 61 -9.762 8.311 0.521 1.00 0.00 C ATOM 913 O ASP A 61 -9.149 8.552 -0.517 1.00 0.00 O ATOM 914 CB ASP A 61 -10.499 9.678 2.493 1.00 0.00 C ATOM 915 CG ASP A 61 -10.437 11.183 2.685 1.00 0.00 C ATOM 916 OD1 ASP A 61 -10.314 11.907 1.674 1.00 0.00 O ATOM 917 OD2 ASP A 61 -10.510 11.637 3.846 1.00 0.00 O ATOM 0 H ASP A 61 -12.810 9.322 0.433 1.00 0.00 H new ATOM 0 HA ASP A 61 -10.770 10.181 0.423 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -11.261 9.261 3.151 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -9.547 9.237 2.789 1.00 0.00 H new ATOM 922 N GLY A 62 -9.561 7.210 1.236 1.00 0.00 N ATOM 923 CA GLY A 62 -8.589 6.216 0.816 1.00 0.00 C ATOM 924 C GLY A 62 -8.944 4.832 1.295 1.00 0.00 C ATOM 925 O GLY A 62 -8.714 3.845 0.594 1.00 0.00 O ATOM 0 H GLY A 62 -10.054 6.987 2.101 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -8.520 6.215 -0.272 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -7.605 6.489 1.197 1.00 0.00 H new ATOM 929 N LEU A 63 -9.513 4.758 2.491 1.00 0.00 N ATOM 930 CA LEU A 63 -9.907 3.480 3.052 1.00 0.00 C ATOM 931 C LEU A 63 -10.799 2.746 2.062 1.00 0.00 C ATOM 932 O LEU A 63 -10.815 1.517 2.020 1.00 0.00 O ATOM 933 CB LEU A 63 -10.619 3.650 4.397 1.00 0.00 C ATOM 934 CG LEU A 63 -10.025 4.710 5.325 1.00 0.00 C ATOM 935 CD1 LEU A 63 -10.694 6.057 5.111 1.00 0.00 C ATOM 936 CD2 LEU A 63 -10.147 4.280 6.772 1.00 0.00 C ATOM 0 H LEU A 63 -9.709 5.564 3.085 1.00 0.00 H new ATOM 0 HA LEU A 63 -9.008 2.892 3.236 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -11.662 3.902 4.207 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -10.612 2.692 4.916 1.00 0.00 H new ATOM 0 HG LEU A 63 -8.967 4.815 5.084 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -10.253 6.793 5.783 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -10.549 6.375 4.079 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -11.761 5.970 5.317 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -9.719 5.047 7.417 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -11.199 4.141 7.023 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -9.612 3.342 6.919 1.00 0.00 H new ATOM 948 N ALA A 64 -11.513 3.515 1.238 1.00 0.00 N ATOM 949 CA ALA A 64 -12.371 2.933 0.222 1.00 0.00 C ATOM 950 C ALA A 64 -11.527 2.112 -0.740 1.00 0.00 C ATOM 951 O ALA A 64 -11.958 1.070 -1.234 1.00 0.00 O ATOM 952 CB ALA A 64 -13.138 4.017 -0.524 1.00 0.00 C ATOM 0 H ALA A 64 -11.510 4.535 1.259 1.00 0.00 H new ATOM 0 HA ALA A 64 -13.101 2.282 0.702 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -13.774 3.557 -1.280 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -13.756 4.575 0.179 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -12.434 4.695 -1.006 1.00 0.00 H new ATOM 958 N LEU A 65 -10.305 2.584 -0.978 1.00 0.00 N ATOM 959 CA LEU A 65 -9.375 1.891 -1.858 1.00 0.00 C ATOM 960 C LEU A 65 -9.103 0.502 -1.320 1.00 0.00 C ATOM 961 O LEU A 65 -8.960 -0.457 -2.080 1.00 0.00 O ATOM 962 CB LEU A 65 -8.065 2.667 -1.987 1.00 0.00 C ATOM 963 CG LEU A 65 -8.215 4.079 -2.541 1.00 0.00 C ATOM 964 CD1 LEU A 65 -6.901 4.841 -2.442 1.00 0.00 C ATOM 965 CD2 LEU A 65 -8.712 4.028 -3.980 1.00 0.00 C ATOM 0 H LEU A 65 -9.938 3.445 -0.572 1.00 0.00 H new ATOM 0 HA LEU A 65 -9.825 1.816 -2.848 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -7.594 2.724 -1.006 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -7.389 2.107 -2.633 1.00 0.00 H new ATOM 0 HG LEU A 65 -8.953 4.612 -1.942 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -7.032 5.846 -2.843 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -6.595 4.904 -1.398 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.134 4.319 -3.014 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -8.815 5.042 -4.365 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.997 3.478 -4.592 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.679 3.527 -4.013 1.00 0.00 H new ATOM 977 N LEU A 66 -9.055 0.402 0.001 1.00 0.00 N ATOM 978 CA LEU A 66 -8.828 -0.871 0.659 1.00 0.00 C ATOM 979 C LEU A 66 -9.959 -1.827 0.315 1.00 0.00 C ATOM 980 O LEU A 66 -9.729 -2.955 -0.121 1.00 0.00 O ATOM 981 CB LEU A 66 -8.744 -0.675 2.172 1.00 0.00 C ATOM 982 CG LEU A 66 -7.535 -1.323 2.838 1.00 0.00 C ATOM 983 CD1 LEU A 66 -7.515 -2.818 2.560 1.00 0.00 C ATOM 984 CD2 LEU A 66 -6.250 -0.674 2.359 1.00 0.00 C ATOM 0 H LEU A 66 -9.171 1.191 0.637 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.884 -1.292 0.312 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -8.728 0.394 2.385 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -9.650 -1.077 2.626 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.612 -1.173 3.915 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.646 -3.266 3.042 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -8.424 -3.273 2.954 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -7.461 -2.987 1.485 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.399 -1.150 2.846 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -6.163 -0.792 1.279 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -6.263 0.387 2.608 1.00 0.00 H new ATOM 996 N LYS A 67 -11.187 -1.351 0.507 1.00 0.00 N ATOM 997 CA LYS A 67 -12.377 -2.139 0.212 1.00 0.00 C ATOM 998 C LYS A 67 -12.275 -2.795 -1.167 1.00 0.00 C ATOM 999 O LYS A 67 -12.585 -3.971 -1.326 1.00 0.00 O ATOM 1000 CB LYS A 67 -13.626 -1.261 0.284 1.00 0.00 C ATOM 1001 CG LYS A 67 -14.909 -2.046 0.505 1.00 0.00 C ATOM 1002 CD LYS A 67 -15.879 -1.288 1.398 1.00 0.00 C ATOM 1003 CE LYS A 67 -17.140 -2.095 1.663 1.00 0.00 C ATOM 1004 NZ LYS A 67 -17.012 -2.945 2.881 1.00 0.00 N ATOM 0 H LYS A 67 -11.383 -0.417 0.868 1.00 0.00 H new ATOM 0 HA LYS A 67 -12.453 -2.928 0.961 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -13.507 -0.540 1.093 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -13.713 -0.691 -0.641 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -15.381 -2.251 -0.456 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -14.674 -3.010 0.957 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -15.393 -1.049 2.344 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -16.144 -0.341 0.928 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -17.986 -1.418 1.780 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -17.354 -2.726 0.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -17.893 -3.479 3.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -16.221 -3.609 2.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -16.833 -2.341 3.709 1.00 0.00 H new ATOM 1018 N GLN A 68 -11.838 -2.034 -2.167 1.00 0.00 N ATOM 1019 CA GLN A 68 -11.697 -2.575 -3.514 1.00 0.00 C ATOM 1020 C GLN A 68 -10.698 -3.728 -3.516 1.00 0.00 C ATOM 1021 O GLN A 68 -10.914 -4.758 -4.155 1.00 0.00 O ATOM 1022 CB GLN A 68 -11.208 -1.499 -4.489 1.00 0.00 C ATOM 1023 CG GLN A 68 -12.161 -0.325 -4.685 1.00 0.00 C ATOM 1024 CD GLN A 68 -11.513 1.018 -4.410 1.00 0.00 C ATOM 1025 OE1 GLN A 68 -10.407 1.297 -4.872 1.00 0.00 O ATOM 1026 NE2 GLN A 68 -12.205 1.864 -3.661 1.00 0.00 N ATOM 0 H GLN A 68 -11.578 -1.052 -2.072 1.00 0.00 H new ATOM 0 HA GLN A 68 -12.677 -2.930 -3.833 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -10.252 -1.116 -4.133 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -11.025 -1.964 -5.458 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -12.538 -0.337 -5.708 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -13.021 -0.449 -4.027 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -13.119 1.593 -3.297 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.824 2.786 -3.448 1.00 0.00 H new ATOM 1035 N ILE A 69 -9.593 -3.529 -2.805 1.00 0.00 N ATOM 1036 CA ILE A 69 -8.537 -4.528 -2.722 1.00 0.00 C ATOM 1037 C ILE A 69 -9.003 -5.795 -2.021 1.00 0.00 C ATOM 1038 O ILE A 69 -8.617 -6.900 -2.399 1.00 0.00 O ATOM 1039 CB ILE A 69 -7.301 -3.967 -1.993 1.00 0.00 C ATOM 1040 CG1 ILE A 69 -6.840 -2.671 -2.658 1.00 0.00 C ATOM 1041 CG2 ILE A 69 -6.177 -4.991 -1.980 1.00 0.00 C ATOM 1042 CD1 ILE A 69 -6.219 -1.686 -1.696 1.00 0.00 C ATOM 0 H ILE A 69 -9.406 -2.678 -2.275 1.00 0.00 H new ATOM 0 HA ILE A 69 -8.269 -4.782 -3.747 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.575 -3.750 -0.961 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.117 -2.910 -3.438 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -7.693 -2.200 -3.147 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -5.313 -4.576 -1.461 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -6.511 -5.892 -1.466 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -5.900 -5.240 -3.004 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.915 -0.790 -2.238 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -6.946 -1.418 -0.930 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.346 -2.138 -1.225 1.00 0.00 H new ATOM 1054 N LYS A 70 -9.819 -5.634 -0.993 1.00 0.00 N ATOM 1055 CA LYS A 70 -10.319 -6.775 -0.238 1.00 0.00 C ATOM 1056 C LYS A 70 -11.437 -7.493 -0.984 1.00 0.00 C ATOM 1057 O LYS A 70 -11.693 -8.673 -0.747 1.00 0.00 O ATOM 1058 CB LYS A 70 -10.802 -6.335 1.143 1.00 0.00 C ATOM 1059 CG LYS A 70 -12.047 -5.471 1.112 1.00 0.00 C ATOM 1060 CD LYS A 70 -13.266 -6.218 1.629 1.00 0.00 C ATOM 1061 CE LYS A 70 -14.541 -5.732 0.957 1.00 0.00 C ATOM 1062 NZ LYS A 70 -15.403 -6.863 0.520 1.00 0.00 N ATOM 0 H LYS A 70 -10.150 -4.728 -0.661 1.00 0.00 H new ATOM 0 HA LYS A 70 -9.493 -7.476 -0.117 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -11.001 -7.221 1.747 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -10.002 -5.785 1.639 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -11.885 -4.578 1.716 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -12.232 -5.136 0.091 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -13.143 -7.286 1.450 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.347 -6.083 2.708 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -15.097 -5.098 1.648 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -14.285 -5.116 0.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -16.228 -6.492 0.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -14.860 -7.492 -0.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -15.724 -7.397 1.353 1.00 0.00 H new ATOM 1076 N GLN A 71 -12.102 -6.779 -1.879 1.00 0.00 N ATOM 1077 CA GLN A 71 -13.192 -7.360 -2.648 1.00 0.00 C ATOM 1078 C GLN A 71 -12.683 -8.429 -3.605 1.00 0.00 C ATOM 1079 O GLN A 71 -13.282 -9.497 -3.744 1.00 0.00 O ATOM 1080 CB GLN A 71 -13.934 -6.270 -3.421 1.00 0.00 C ATOM 1081 CG GLN A 71 -15.249 -5.865 -2.778 1.00 0.00 C ATOM 1082 CD GLN A 71 -15.713 -4.496 -3.225 1.00 0.00 C ATOM 1083 OE1 GLN A 71 -16.814 -4.340 -3.753 1.00 0.00 O ATOM 1084 NE2 GLN A 71 -14.870 -3.495 -3.015 1.00 0.00 N ATOM 0 H GLN A 71 -11.907 -5.800 -2.090 1.00 0.00 H new ATOM 0 HA GLN A 71 -13.882 -7.833 -1.949 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -13.293 -5.392 -3.503 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -14.126 -6.621 -4.435 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -16.013 -6.603 -3.024 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -15.137 -5.871 -1.694 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -13.968 -3.672 -2.574 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -15.124 -2.547 -3.295 1.00 0.00 H new ATOM 1093 N ARG A 72 -11.579 -8.129 -4.265 1.00 0.00 N ATOM 1094 CA ARG A 72 -10.978 -9.053 -5.219 1.00 0.00 C ATOM 1095 C ARG A 72 -9.765 -9.748 -4.621 1.00 0.00 C ATOM 1096 O ARG A 72 -9.409 -10.857 -5.020 1.00 0.00 O ATOM 1097 CB ARG A 72 -10.578 -8.309 -6.491 1.00 0.00 C ATOM 1098 CG ARG A 72 -11.583 -8.455 -7.619 1.00 0.00 C ATOM 1099 CD ARG A 72 -12.441 -7.209 -7.768 1.00 0.00 C ATOM 1100 NE ARG A 72 -12.031 -6.399 -8.914 1.00 0.00 N ATOM 1101 CZ ARG A 72 -11.449 -5.203 -8.819 1.00 0.00 C ATOM 1102 NH1 ARG A 72 -11.192 -4.665 -7.632 1.00 0.00 N ATOM 1103 NH2 ARG A 72 -11.119 -4.544 -9.920 1.00 0.00 N ATOM 0 H ARG A 72 -11.075 -7.248 -4.159 1.00 0.00 H new ATOM 0 HA ARG A 72 -11.719 -9.813 -5.465 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -10.454 -7.251 -6.260 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -9.609 -8.677 -6.828 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -11.056 -8.649 -8.553 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -12.222 -9.317 -7.428 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -13.485 -7.499 -7.883 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -12.375 -6.612 -6.859 1.00 0.00 H new ATOM 0 HE ARG A 72 -12.201 -6.773 -9.847 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -11.440 -5.167 -6.780 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -10.746 -3.749 -7.573 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -11.310 -4.952 -10.835 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -10.674 -3.629 -9.852 1.00 0.00 H new ATOM 1117 N HIS A 73 -9.133 -9.086 -3.665 1.00 0.00 N ATOM 1118 CA HIS A 73 -7.956 -9.635 -3.009 1.00 0.00 C ATOM 1119 C HIS A 73 -8.096 -9.556 -1.496 1.00 0.00 C ATOM 1120 O HIS A 73 -7.488 -8.705 -0.847 1.00 0.00 O ATOM 1121 CB HIS A 73 -6.703 -8.888 -3.467 1.00 0.00 C ATOM 1122 CG HIS A 73 -6.646 -8.708 -4.947 1.00 0.00 C ATOM 1123 ND1 HIS A 73 -6.334 -9.729 -5.819 1.00 0.00 N ATOM 1124 CD2 HIS A 73 -6.887 -7.619 -5.713 1.00 0.00 C ATOM 1125 CE1 HIS A 73 -6.385 -9.277 -7.058 1.00 0.00 C ATOM 1126 NE2 HIS A 73 -6.719 -8.000 -7.021 1.00 0.00 N ATOM 0 H HIS A 73 -9.415 -8.167 -3.325 1.00 0.00 H new ATOM 0 HA HIS A 73 -7.863 -10.685 -3.288 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -6.672 -7.911 -2.985 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -5.819 -9.434 -3.138 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -6.100 -10.684 -5.549 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -7.160 -6.635 -5.361 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -6.187 -9.853 -7.950 1.00 0.00 H new ATOM 1135 N PRO A 74 -8.904 -10.455 -0.909 1.00 0.00 N ATOM 1136 CA PRO A 74 -9.124 -10.492 0.538 1.00 0.00 C ATOM 1137 C PRO A 74 -7.934 -11.083 1.288 1.00 0.00 C ATOM 1138 O PRO A 74 -8.105 -11.844 2.239 1.00 0.00 O ATOM 1139 CB PRO A 74 -10.346 -11.398 0.679 1.00 0.00 C ATOM 1140 CG PRO A 74 -10.266 -12.313 -0.491 1.00 0.00 C ATOM 1141 CD PRO A 74 -9.665 -11.506 -1.610 1.00 0.00 C ATOM 0 HA PRO A 74 -9.260 -9.496 0.960 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -10.324 -11.951 1.618 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -11.271 -10.822 0.670 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -9.651 -13.184 -0.264 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -11.254 -12.684 -0.764 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -9.019 -12.115 -2.242 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -10.434 -11.081 -2.256 1.00 0.00 H new ATOM 1149 N MET A 75 -6.728 -10.727 0.852 1.00 0.00 N ATOM 1150 CA MET A 75 -5.507 -11.220 1.479 1.00 0.00 C ATOM 1151 C MET A 75 -4.355 -10.244 1.268 1.00 0.00 C ATOM 1152 O MET A 75 -3.544 -10.016 2.167 1.00 0.00 O ATOM 1153 CB MET A 75 -5.138 -12.597 0.923 1.00 0.00 C ATOM 1154 CG MET A 75 -6.201 -13.661 1.157 1.00 0.00 C ATOM 1155 SD MET A 75 -5.808 -15.219 0.338 1.00 0.00 S ATOM 1156 CE MET A 75 -7.373 -16.084 0.463 1.00 0.00 C ATOM 0 H MET A 75 -6.571 -10.097 0.065 1.00 0.00 H new ATOM 0 HA MET A 75 -5.690 -11.310 2.550 1.00 0.00 H new ATOM 0 HB2 MET A 75 -4.956 -12.509 -0.148 1.00 0.00 H new ATOM 0 HB3 MET A 75 -4.204 -12.924 1.379 1.00 0.00 H new ATOM 0 HG2 MET A 75 -6.308 -13.834 2.228 1.00 0.00 H new ATOM 0 HG3 MET A 75 -7.162 -13.296 0.795 1.00 0.00 H new ATOM 0 HE1 MET A 75 -7.284 -17.066 -0.002 1.00 0.00 H new ATOM 0 HE2 MET A 75 -7.641 -16.202 1.513 1.00 0.00 H new ATOM 0 HE3 MET A 75 -8.147 -15.510 -0.046 1.00 0.00 H new ATOM 1166 N LEU A 76 -4.293 -9.667 0.075 1.00 0.00 N ATOM 1167 CA LEU A 76 -3.242 -8.710 -0.261 1.00 0.00 C ATOM 1168 C LEU A 76 -3.203 -7.568 0.748 1.00 0.00 C ATOM 1169 O LEU A 76 -4.126 -6.756 0.810 1.00 0.00 O ATOM 1170 CB LEU A 76 -3.448 -8.133 -1.664 1.00 0.00 C ATOM 1171 CG LEU A 76 -2.451 -7.045 -2.055 1.00 0.00 C ATOM 1172 CD1 LEU A 76 -1.120 -7.665 -2.435 1.00 0.00 C ATOM 1173 CD2 LEU A 76 -3.007 -6.212 -3.193 1.00 0.00 C ATOM 0 H LEU A 76 -4.958 -9.844 -0.678 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.295 -9.248 -0.233 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -3.384 -8.944 -2.389 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -4.456 -7.725 -1.730 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.288 -6.389 -1.200 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -0.418 -6.878 -2.712 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -0.723 -8.223 -1.587 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -1.261 -8.339 -3.280 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -2.288 -5.439 -3.464 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -3.193 -6.852 -4.055 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -3.941 -5.745 -2.880 1.00 0.00 H new ATOM 1185 N PRO A 77 -2.132 -7.479 1.551 1.00 0.00 N ATOM 1186 CA PRO A 77 -1.997 -6.417 2.543 1.00 0.00 C ATOM 1187 C PRO A 77 -1.677 -5.071 1.899 1.00 0.00 C ATOM 1188 O PRO A 77 -0.921 -5.002 0.930 1.00 0.00 O ATOM 1189 CB PRO A 77 -0.837 -6.888 3.411 1.00 0.00 C ATOM 1190 CG PRO A 77 -0.015 -7.752 2.516 1.00 0.00 C ATOM 1191 CD PRO A 77 -0.976 -8.394 1.552 1.00 0.00 C ATOM 0 HA PRO A 77 -2.919 -6.255 3.101 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -0.258 -6.045 3.788 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -1.193 -7.443 4.279 1.00 0.00 H new ATOM 0 HG2 PRO A 77 0.733 -7.162 1.985 1.00 0.00 H new ATOM 0 HG3 PRO A 77 0.523 -8.507 3.090 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -0.541 -8.491 0.557 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -1.258 -9.396 1.875 1.00 0.00 H new ATOM 1199 N VAL A 78 -2.269 -4.007 2.432 1.00 0.00 N ATOM 1200 CA VAL A 78 -2.060 -2.667 1.900 1.00 0.00 C ATOM 1201 C VAL A 78 -1.668 -1.688 3.001 1.00 0.00 C ATOM 1202 O VAL A 78 -2.051 -1.858 4.159 1.00 0.00 O ATOM 1203 CB VAL A 78 -3.330 -2.134 1.212 1.00 0.00 C ATOM 1204 CG1 VAL A 78 -2.977 -1.039 0.225 1.00 0.00 C ATOM 1205 CG2 VAL A 78 -4.103 -3.254 0.521 1.00 0.00 C ATOM 0 H VAL A 78 -2.898 -4.048 3.234 1.00 0.00 H new ATOM 0 HA VAL A 78 -1.252 -2.745 1.172 1.00 0.00 H new ATOM 0 HB VAL A 78 -3.977 -1.714 1.983 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -3.886 -0.673 -0.253 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.488 -0.219 0.751 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.303 -1.437 -0.534 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -4.993 -2.842 0.046 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.471 -3.720 -0.235 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -4.398 -4.001 1.258 1.00 0.00 H new ATOM 1215 N ILE A 79 -0.912 -0.656 2.633 1.00 0.00 N ATOM 1216 CA ILE A 79 -0.480 0.352 3.595 1.00 0.00 C ATOM 1217 C ILE A 79 -0.966 1.737 3.194 1.00 0.00 C ATOM 1218 O ILE A 79 -0.616 2.248 2.131 1.00 0.00 O ATOM 1219 CB ILE A 79 1.050 0.385 3.747 1.00 0.00 C ATOM 1220 CG1 ILE A 79 1.623 -1.031 3.766 1.00 0.00 C ATOM 1221 CG2 ILE A 79 1.430 1.123 5.023 1.00 0.00 C ATOM 1222 CD1 ILE A 79 2.789 -1.232 2.823 1.00 0.00 C ATOM 0 H ILE A 79 -0.588 -0.497 1.679 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.921 0.072 4.552 1.00 0.00 H new ATOM 0 HB ILE A 79 1.471 0.913 2.891 1.00 0.00 H new ATOM 0 HG12 ILE A 79 1.943 -1.270 4.780 1.00 0.00 H new ATOM 0 HG13 ILE A 79 0.833 -1.736 3.507 1.00 0.00 H new ATOM 0 HG21 ILE A 79 2.515 1.142 5.123 1.00 0.00 H new ATOM 0 HG22 ILE A 79 1.052 2.144 4.979 1.00 0.00 H new ATOM 0 HG23 ILE A 79 0.995 0.612 5.882 1.00 0.00 H new ATOM 0 HD11 ILE A 79 3.141 -2.261 2.893 1.00 0.00 H new ATOM 0 HD12 ILE A 79 2.470 -1.027 1.801 1.00 0.00 H new ATOM 0 HD13 ILE A 79 3.597 -0.553 3.094 1.00 0.00 H new ATOM 1234 N ILE A 80 -1.780 2.335 4.057 1.00 0.00 N ATOM 1235 CA ILE A 80 -2.327 3.662 3.798 1.00 0.00 C ATOM 1236 C ILE A 80 -1.482 4.754 4.453 1.00 0.00 C ATOM 1237 O ILE A 80 -0.957 4.573 5.550 1.00 0.00 O ATOM 1238 CB ILE A 80 -3.781 3.770 4.289 1.00 0.00 C ATOM 1239 CG1 ILE A 80 -4.568 2.533 3.861 1.00 0.00 C ATOM 1240 CG2 ILE A 80 -4.431 5.036 3.748 1.00 0.00 C ATOM 1241 CD1 ILE A 80 -4.713 2.403 2.361 1.00 0.00 C ATOM 0 H ILE A 80 -2.076 1.922 4.942 1.00 0.00 H new ATOM 0 HA ILE A 80 -2.307 3.808 2.718 1.00 0.00 H new ATOM 0 HB ILE A 80 -3.784 3.825 5.378 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -4.072 1.643 4.249 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -5.559 2.568 4.313 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -5.459 5.098 4.104 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -3.874 5.907 4.093 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -4.426 5.011 2.658 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -5.282 1.503 2.127 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -5.236 3.275 1.969 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -3.725 2.337 1.904 1.00 0.00 H new ATOM 1253 N MET A 81 -1.347 5.885 3.758 1.00 0.00 N ATOM 1254 CA MET A 81 -0.543 7.011 4.264 1.00 0.00 C ATOM 1255 C MET A 81 -1.310 7.880 5.249 1.00 0.00 C ATOM 1256 O MET A 81 -0.704 8.664 5.974 1.00 0.00 O ATOM 1257 CB MET A 81 -0.006 7.898 3.129 1.00 0.00 C ATOM 1258 CG MET A 81 -0.667 7.677 1.781 1.00 0.00 C ATOM 1259 SD MET A 81 0.107 6.340 0.854 1.00 0.00 S ATOM 1260 CE MET A 81 1.741 7.019 0.599 1.00 0.00 C ATOM 0 H MET A 81 -1.779 6.050 2.849 1.00 0.00 H new ATOM 0 HA MET A 81 0.297 6.551 4.784 1.00 0.00 H new ATOM 0 HB2 MET A 81 -0.132 8.943 3.413 1.00 0.00 H new ATOM 0 HB3 MET A 81 1.065 7.723 3.026 1.00 0.00 H new ATOM 0 HG2 MET A 81 -1.723 7.450 1.929 1.00 0.00 H new ATOM 0 HG3 MET A 81 -0.617 8.597 1.199 1.00 0.00 H new ATOM 0 HE1 MET A 81 1.910 7.169 -0.467 1.00 0.00 H new ATOM 0 HE2 MET A 81 1.823 7.974 1.118 1.00 0.00 H new ATOM 0 HE3 MET A 81 2.487 6.328 0.991 1.00 0.00 H new ATOM 1270 N THR A 82 -2.627 7.767 5.280 1.00 0.00 N ATOM 1271 CA THR A 82 -3.405 8.584 6.203 1.00 0.00 C ATOM 1272 C THR A 82 -4.667 7.864 6.681 1.00 0.00 C ATOM 1273 O THR A 82 -5.301 7.124 5.930 1.00 0.00 O ATOM 1274 CB THR A 82 -3.754 9.919 5.548 1.00 0.00 C ATOM 1275 OG1 THR A 82 -2.657 10.391 4.783 1.00 0.00 O ATOM 1276 CG2 THR A 82 -4.098 11.001 6.550 1.00 0.00 C ATOM 0 H THR A 82 -3.172 7.135 4.693 1.00 0.00 H new ATOM 0 HA THR A 82 -2.793 8.769 7.086 1.00 0.00 H new ATOM 0 HB THR A 82 -4.628 9.724 4.926 1.00 0.00 H new ATOM 0 HG1 THR A 82 -2.892 11.246 4.367 1.00 0.00 H new ATOM 0 HG21 THR A 82 -4.336 11.924 6.021 1.00 0.00 H new ATOM 0 HG22 THR A 82 -4.959 10.689 7.141 1.00 0.00 H new ATOM 0 HG23 THR A 82 -3.247 11.170 7.210 1.00 0.00 H new ATOM 1284 N ALA A 83 -5.030 8.097 7.938 1.00 0.00 N ATOM 1285 CA ALA A 83 -6.217 7.482 8.519 1.00 0.00 C ATOM 1286 C ALA A 83 -7.100 8.533 9.192 1.00 0.00 C ATOM 1287 O ALA A 83 -7.642 8.300 10.273 1.00 0.00 O ATOM 1288 CB ALA A 83 -5.818 6.405 9.513 1.00 0.00 C ATOM 0 H ALA A 83 -4.518 8.708 8.574 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.793 7.021 7.717 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -6.714 5.954 9.940 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -5.233 5.639 9.004 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -5.221 6.848 10.310 1.00 0.00 H new ATOM 1294 N HIS A 84 -7.234 9.698 8.554 1.00 0.00 N ATOM 1295 CA HIS A 84 -8.043 10.781 9.110 1.00 0.00 C ATOM 1296 C HIS A 84 -9.501 10.697 8.660 1.00 0.00 C ATOM 1297 O HIS A 84 -10.362 11.392 9.201 1.00 0.00 O ATOM 1298 CB HIS A 84 -7.459 12.143 8.724 1.00 0.00 C ATOM 1299 CG HIS A 84 -7.321 12.355 7.247 1.00 0.00 C ATOM 1300 ND1 HIS A 84 -6.398 13.219 6.698 1.00 0.00 N ATOM 1301 CD2 HIS A 84 -7.996 11.819 6.199 1.00 0.00 C ATOM 1302 CE1 HIS A 84 -6.512 13.208 5.383 1.00 0.00 C ATOM 1303 NE2 HIS A 84 -7.473 12.366 5.055 1.00 0.00 N ATOM 0 H HIS A 84 -6.796 9.913 7.659 1.00 0.00 H new ATOM 0 HA HIS A 84 -8.020 10.672 10.194 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -8.094 12.928 9.135 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -6.479 12.250 9.188 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -8.796 11.096 6.255 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -5.919 13.790 4.693 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -7.778 12.156 4.105 1.00 0.00 H new ATOM 1312 N SER A 85 -9.781 9.853 7.672 1.00 0.00 N ATOM 1313 CA SER A 85 -11.141 9.705 7.172 1.00 0.00 C ATOM 1314 C SER A 85 -11.856 8.565 7.890 1.00 0.00 C ATOM 1315 O SER A 85 -11.410 8.109 8.943 1.00 0.00 O ATOM 1316 CB SER A 85 -11.138 9.463 5.662 1.00 0.00 C ATOM 1317 OG SER A 85 -12.222 10.133 5.038 1.00 0.00 O ATOM 0 H SER A 85 -9.090 9.266 7.206 1.00 0.00 H new ATOM 0 HA SER A 85 -11.679 10.632 7.372 1.00 0.00 H new ATOM 0 HB2 SER A 85 -10.197 9.811 5.236 1.00 0.00 H new ATOM 0 HB3 SER A 85 -11.203 8.394 5.461 1.00 0.00 H new ATOM 0 HG SER A 85 -11.921 11.006 4.709 1.00 0.00 H new ATOM 1323 N ASP A 86 -12.968 8.110 7.322 1.00 0.00 N ATOM 1324 CA ASP A 86 -13.741 7.027 7.922 1.00 0.00 C ATOM 1325 C ASP A 86 -12.868 5.804 8.190 1.00 0.00 C ATOM 1326 O ASP A 86 -12.683 4.959 7.315 1.00 0.00 O ATOM 1327 CB ASP A 86 -14.906 6.638 7.013 1.00 0.00 C ATOM 1328 CG ASP A 86 -16.237 7.156 7.521 1.00 0.00 C ATOM 1329 OD1 ASP A 86 -16.434 8.389 7.522 1.00 0.00 O ATOM 1330 OD2 ASP A 86 -17.085 6.327 7.914 1.00 0.00 O ATOM 0 H ASP A 86 -13.354 8.472 6.450 1.00 0.00 H new ATOM 0 HA ASP A 86 -14.130 7.387 8.874 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -14.727 7.028 6.011 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -14.950 5.552 6.929 1.00 0.00 H new ATOM 1335 N LEU A 87 -12.343 5.716 9.409 1.00 0.00 N ATOM 1336 CA LEU A 87 -11.495 4.593 9.799 1.00 0.00 C ATOM 1337 C LEU A 87 -12.252 3.271 9.666 1.00 0.00 C ATOM 1338 O LEU A 87 -11.648 2.204 9.557 1.00 0.00 O ATOM 1339 CB LEU A 87 -10.994 4.781 11.238 1.00 0.00 C ATOM 1340 CG LEU A 87 -9.482 4.984 11.378 1.00 0.00 C ATOM 1341 CD1 LEU A 87 -9.102 5.162 12.839 1.00 0.00 C ATOM 1342 CD2 LEU A 87 -8.724 3.814 10.766 1.00 0.00 C ATOM 0 H LEU A 87 -12.490 6.408 10.144 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.635 4.562 9.130 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -11.502 5.641 11.674 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.284 3.909 11.824 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.206 5.889 10.838 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -8.024 5.305 12.920 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -9.615 6.034 13.245 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -9.394 4.275 13.401 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.652 3.978 10.876 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.004 2.892 11.276 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.972 3.733 9.708 1.00 0.00 H new ATOM 1354 N ASP A 88 -13.580 3.358 9.683 1.00 0.00 N ATOM 1355 CA ASP A 88 -14.443 2.185 9.575 1.00 0.00 C ATOM 1356 C ASP A 88 -14.030 1.264 8.428 1.00 0.00 C ATOM 1357 O ASP A 88 -14.009 0.042 8.580 1.00 0.00 O ATOM 1358 CB ASP A 88 -15.899 2.624 9.386 1.00 0.00 C ATOM 1359 CG ASP A 88 -16.459 3.303 10.620 1.00 0.00 C ATOM 1360 OD1 ASP A 88 -16.903 2.587 11.541 1.00 0.00 O ATOM 1361 OD2 ASP A 88 -16.454 4.552 10.667 1.00 0.00 O ATOM 0 H ASP A 88 -14.086 4.239 9.772 1.00 0.00 H new ATOM 0 HA ASP A 88 -14.340 1.621 10.502 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -15.964 3.306 8.538 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -16.510 1.755 9.143 1.00 0.00 H new ATOM 1366 N ALA A 89 -13.717 1.853 7.280 1.00 0.00 N ATOM 1367 CA ALA A 89 -13.326 1.078 6.112 1.00 0.00 C ATOM 1368 C ALA A 89 -11.967 0.415 6.305 1.00 0.00 C ATOM 1369 O ALA A 89 -11.666 -0.594 5.666 1.00 0.00 O ATOM 1370 CB ALA A 89 -13.336 1.955 4.871 1.00 0.00 C ATOM 0 H ALA A 89 -13.727 2.863 7.134 1.00 0.00 H new ATOM 0 HA ALA A 89 -14.056 0.279 5.979 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -13.042 1.363 4.005 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -14.339 2.353 4.715 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -12.635 2.779 5.002 1.00 0.00 H new ATOM 1376 N ALA A 90 -11.155 0.972 7.201 1.00 0.00 N ATOM 1377 CA ALA A 90 -9.837 0.408 7.487 1.00 0.00 C ATOM 1378 C ALA A 90 -9.979 -0.939 8.178 1.00 0.00 C ATOM 1379 O ALA A 90 -9.072 -1.768 8.132 1.00 0.00 O ATOM 1380 CB ALA A 90 -9.005 1.349 8.350 1.00 0.00 C ATOM 0 H ALA A 90 -11.384 1.808 7.739 1.00 0.00 H new ATOM 0 HA ALA A 90 -9.320 0.273 6.537 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -8.031 0.899 8.544 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.870 2.297 7.829 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -9.518 1.525 9.295 1.00 0.00 H new ATOM 1386 N VAL A 91 -11.129 -1.155 8.817 1.00 0.00 N ATOM 1387 CA VAL A 91 -11.382 -2.410 9.506 1.00 0.00 C ATOM 1388 C VAL A 91 -11.538 -3.544 8.505 1.00 0.00 C ATOM 1389 O VAL A 91 -10.993 -4.632 8.699 1.00 0.00 O ATOM 1390 CB VAL A 91 -12.625 -2.349 10.410 1.00 0.00 C ATOM 1391 CG1 VAL A 91 -12.593 -3.507 11.395 1.00 0.00 C ATOM 1392 CG2 VAL A 91 -12.701 -1.020 11.149 1.00 0.00 C ATOM 0 H VAL A 91 -11.892 -0.480 8.869 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.518 -2.594 10.145 1.00 0.00 H new ATOM 0 HB VAL A 91 -13.515 -2.431 9.787 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -13.474 -3.464 12.036 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -12.588 -4.450 10.848 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -11.694 -3.438 12.008 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -13.589 -1.005 11.780 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -11.813 -0.897 11.769 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -12.755 -0.205 10.427 1.00 0.00 H new ATOM 1402 N SER A 92 -12.252 -3.281 7.411 1.00 0.00 N ATOM 1403 CA SER A 92 -12.425 -4.289 6.372 1.00 0.00 C ATOM 1404 C SER A 92 -11.058 -4.679 5.815 1.00 0.00 C ATOM 1405 O SER A 92 -10.896 -5.725 5.185 1.00 0.00 O ATOM 1406 CB SER A 92 -13.326 -3.771 5.250 1.00 0.00 C ATOM 1407 OG SER A 92 -12.714 -2.698 4.557 1.00 0.00 O ATOM 0 H SER A 92 -12.713 -2.391 7.225 1.00 0.00 H new ATOM 0 HA SER A 92 -12.905 -5.165 6.808 1.00 0.00 H new ATOM 0 HB2 SER A 92 -13.545 -4.580 4.553 1.00 0.00 H new ATOM 0 HB3 SER A 92 -14.278 -3.443 5.667 1.00 0.00 H new ATOM 0 HG SER A 92 -12.132 -2.202 5.170 1.00 0.00 H new ATOM 1413 N ALA A 93 -10.075 -3.820 6.065 1.00 0.00 N ATOM 1414 CA ALA A 93 -8.712 -4.044 5.627 1.00 0.00 C ATOM 1415 C ALA A 93 -8.014 -5.086 6.491 1.00 0.00 C ATOM 1416 O ALA A 93 -7.461 -6.065 5.995 1.00 0.00 O ATOM 1417 CB ALA A 93 -7.954 -2.733 5.658 1.00 0.00 C ATOM 0 H ALA A 93 -10.207 -2.949 6.579 1.00 0.00 H new ATOM 0 HA ALA A 93 -8.733 -4.429 4.607 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.928 -2.898 5.329 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -8.438 -2.017 4.993 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.950 -2.339 6.674 1.00 0.00 H new ATOM 1423 N TYR A 94 -8.032 -4.851 7.791 1.00 0.00 N ATOM 1424 CA TYR A 94 -7.390 -5.755 8.745 1.00 0.00 C ATOM 1425 C TYR A 94 -7.972 -7.158 8.646 1.00 0.00 C ATOM 1426 O TYR A 94 -7.279 -8.147 8.882 1.00 0.00 O ATOM 1427 CB TYR A 94 -7.530 -5.229 10.176 1.00 0.00 C ATOM 1428 CG TYR A 94 -7.429 -3.725 10.284 1.00 0.00 C ATOM 1429 CD1 TYR A 94 -6.352 -3.044 9.735 1.00 0.00 C ATOM 1430 CD2 TYR A 94 -8.416 -2.989 10.921 1.00 0.00 C ATOM 1431 CE1 TYR A 94 -6.258 -1.667 9.819 1.00 0.00 C ATOM 1432 CE2 TYR A 94 -8.334 -1.609 11.011 1.00 0.00 C ATOM 1433 CZ TYR A 94 -7.251 -0.950 10.457 1.00 0.00 C ATOM 1434 OH TYR A 94 -7.164 0.427 10.538 1.00 0.00 O ATOM 0 H TYR A 94 -8.484 -4.042 8.217 1.00 0.00 H new ATOM 0 HA TYR A 94 -6.331 -5.801 8.493 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -8.491 -5.549 10.579 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -6.757 -5.682 10.797 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -5.573 -3.599 9.233 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -9.263 -3.500 11.354 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -5.411 -1.154 9.387 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -9.111 -1.051 11.511 1.00 0.00 H new ATOM 0 HH TYR A 94 -6.466 0.747 9.929 1.00 0.00 H new ATOM 1444 N GLN A 95 -9.248 -7.233 8.299 1.00 0.00 N ATOM 1445 CA GLN A 95 -9.926 -8.516 8.172 1.00 0.00 C ATOM 1446 C GLN A 95 -9.518 -9.220 6.879 1.00 0.00 C ATOM 1447 O GLN A 95 -9.403 -10.446 6.844 1.00 0.00 O ATOM 1448 CB GLN A 95 -11.442 -8.328 8.232 1.00 0.00 C ATOM 1449 CG GLN A 95 -12.008 -7.520 7.080 1.00 0.00 C ATOM 1450 CD GLN A 95 -12.334 -8.367 5.867 1.00 0.00 C ATOM 1451 OE1 GLN A 95 -12.130 -9.580 5.870 1.00 0.00 O ATOM 1452 NE2 GLN A 95 -12.846 -7.728 4.819 1.00 0.00 N ATOM 0 H GLN A 95 -9.835 -6.423 8.100 1.00 0.00 H new ATOM 0 HA GLN A 95 -9.625 -9.147 9.008 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -11.919 -9.308 8.245 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -11.700 -7.836 9.170 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -12.911 -7.008 7.412 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -11.291 -6.750 6.796 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -12.998 -6.720 4.861 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -13.086 -8.246 3.974 1.00 0.00 H new ATOM 1461 N GLN A 96 -9.281 -8.444 5.823 1.00 0.00 N ATOM 1462 CA GLN A 96 -8.868 -9.011 4.548 1.00 0.00 C ATOM 1463 C GLN A 96 -7.373 -9.319 4.550 1.00 0.00 C ATOM 1464 O GLN A 96 -6.893 -10.095 3.727 1.00 0.00 O ATOM 1465 CB GLN A 96 -9.205 -8.066 3.391 1.00 0.00 C ATOM 1466 CG GLN A 96 -8.380 -6.788 3.379 1.00 0.00 C ATOM 1467 CD GLN A 96 -7.026 -6.969 2.719 1.00 0.00 C ATOM 1468 OE1 GLN A 96 -6.770 -7.984 2.070 1.00 0.00 O ATOM 1469 NE2 GLN A 96 -6.151 -5.982 2.880 1.00 0.00 N ATOM 0 H GLN A 96 -9.368 -7.428 5.828 1.00 0.00 H new ATOM 0 HA GLN A 96 -9.418 -9.942 4.407 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -9.054 -8.593 2.449 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -10.262 -7.804 3.445 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -8.933 -6.009 2.855 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -8.237 -6.444 4.403 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -6.405 -5.159 3.426 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -5.225 -6.048 2.458 1.00 0.00 H new ATOM 1478 N GLY A 97 -6.642 -8.710 5.484 1.00 0.00 N ATOM 1479 CA GLY A 97 -5.214 -8.944 5.573 1.00 0.00 C ATOM 1480 C GLY A 97 -4.384 -7.724 5.213 1.00 0.00 C ATOM 1481 O GLY A 97 -3.290 -7.861 4.670 1.00 0.00 O ATOM 0 H GLY A 97 -7.015 -8.061 6.177 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -4.966 -9.258 6.587 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -4.945 -9.767 4.910 1.00 0.00 H new ATOM 1485 N ALA A 98 -4.894 -6.531 5.510 1.00 0.00 N ATOM 1486 CA ALA A 98 -4.169 -5.302 5.202 1.00 0.00 C ATOM 1487 C ALA A 98 -2.879 -5.211 6.011 1.00 0.00 C ATOM 1488 O ALA A 98 -2.655 -6.007 6.923 1.00 0.00 O ATOM 1489 CB ALA A 98 -5.047 -4.086 5.450 1.00 0.00 C ATOM 0 H ALA A 98 -5.799 -6.390 5.960 1.00 0.00 H new ATOM 0 HA ALA A 98 -3.902 -5.323 4.145 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -4.489 -3.180 5.215 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -5.932 -4.141 4.817 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -5.350 -4.064 6.497 1.00 0.00 H new ATOM 1495 N PHE A 99 -2.027 -4.245 5.671 1.00 0.00 N ATOM 1496 CA PHE A 99 -0.760 -4.070 6.369 1.00 0.00 C ATOM 1497 C PHE A 99 -0.939 -3.212 7.616 1.00 0.00 C ATOM 1498 O PHE A 99 -0.581 -3.624 8.720 1.00 0.00 O ATOM 1499 CB PHE A 99 0.261 -3.396 5.444 1.00 0.00 C ATOM 1500 CG PHE A 99 1.602 -4.075 5.370 1.00 0.00 C ATOM 1501 CD1 PHE A 99 1.702 -5.418 5.053 1.00 0.00 C ATOM 1502 CD2 PHE A 99 2.766 -3.354 5.579 1.00 0.00 C ATOM 1503 CE1 PHE A 99 2.935 -6.030 4.945 1.00 0.00 C ATOM 1504 CE2 PHE A 99 4.002 -3.962 5.480 1.00 0.00 C ATOM 1505 CZ PHE A 99 4.085 -5.302 5.158 1.00 0.00 C ATOM 0 H PHE A 99 -2.192 -3.576 4.919 1.00 0.00 H new ATOM 0 HA PHE A 99 -0.401 -5.056 6.664 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -0.159 -3.346 4.440 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.409 -2.369 5.779 1.00 0.00 H new ATOM 0 HD1 PHE A 99 0.804 -5.995 4.888 1.00 0.00 H new ATOM 0 HD2 PHE A 99 2.706 -2.303 5.822 1.00 0.00 H new ATOM 0 HE1 PHE A 99 2.998 -7.078 4.694 1.00 0.00 H new ATOM 0 HE2 PHE A 99 4.902 -3.391 5.654 1.00 0.00 H new ATOM 0 HZ PHE A 99 5.050 -5.779 5.073 1.00 0.00 H new ATOM 1515 N ASP A 100 -1.495 -2.012 7.426 1.00 0.00 N ATOM 1516 CA ASP A 100 -1.723 -1.077 8.531 1.00 0.00 C ATOM 1517 C ASP A 100 -2.010 0.328 8.005 1.00 0.00 C ATOM 1518 O ASP A 100 -2.332 0.513 6.831 1.00 0.00 O ATOM 1519 CB ASP A 100 -0.507 -1.055 9.470 1.00 0.00 C ATOM 1520 CG ASP A 100 -0.839 -1.580 10.851 1.00 0.00 C ATOM 1521 OD1 ASP A 100 -1.464 -2.658 10.943 1.00 0.00 O ATOM 1522 OD2 ASP A 100 -0.475 -0.914 11.842 1.00 0.00 O ATOM 0 H ASP A 100 -1.796 -1.665 6.515 1.00 0.00 H new ATOM 0 HA ASP A 100 -2.595 -1.417 9.090 1.00 0.00 H new ATOM 0 HB2 ASP A 100 0.294 -1.655 9.038 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -0.132 -0.035 9.552 1.00 0.00 H new ATOM 1527 N TYR A 101 -1.880 1.317 8.885 1.00 0.00 N ATOM 1528 CA TYR A 101 -2.112 2.708 8.519 1.00 0.00 C ATOM 1529 C TYR A 101 -0.972 3.586 9.038 1.00 0.00 C ATOM 1530 O TYR A 101 -0.811 3.758 10.246 1.00 0.00 O ATOM 1531 CB TYR A 101 -3.452 3.193 9.086 1.00 0.00 C ATOM 1532 CG TYR A 101 -4.600 3.132 8.103 1.00 0.00 C ATOM 1533 CD1 TYR A 101 -5.279 1.943 7.846 1.00 0.00 C ATOM 1534 CD2 TYR A 101 -5.006 4.277 7.432 1.00 0.00 C ATOM 1535 CE1 TYR A 101 -6.332 1.905 6.949 1.00 0.00 C ATOM 1536 CE2 TYR A 101 -6.057 4.247 6.535 1.00 0.00 C ATOM 1537 CZ TYR A 101 -6.717 3.058 6.297 1.00 0.00 C ATOM 1538 OH TYR A 101 -7.769 3.022 5.404 1.00 0.00 O ATOM 0 H TYR A 101 -1.614 1.178 9.860 1.00 0.00 H new ATOM 0 HA TYR A 101 -2.147 2.781 7.432 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -3.704 2.591 9.959 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -3.337 4.221 9.430 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -4.979 1.038 8.354 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -4.491 5.209 7.614 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -6.850 0.976 6.760 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -6.360 5.148 6.023 1.00 0.00 H new ATOM 0 HH TYR A 101 -8.272 2.190 5.525 1.00 0.00 H new ATOM 1548 N LEU A 102 -0.184 4.137 8.116 1.00 0.00 N ATOM 1549 CA LEU A 102 0.942 4.997 8.475 1.00 0.00 C ATOM 1550 C LEU A 102 0.583 6.460 8.246 1.00 0.00 C ATOM 1551 O LEU A 102 -0.106 6.783 7.285 1.00 0.00 O ATOM 1552 CB LEU A 102 2.178 4.617 7.647 1.00 0.00 C ATOM 1553 CG LEU A 102 3.395 5.539 7.805 1.00 0.00 C ATOM 1554 CD1 LEU A 102 4.304 5.033 8.913 1.00 0.00 C ATOM 1555 CD2 LEU A 102 4.171 5.633 6.507 1.00 0.00 C ATOM 0 H LEU A 102 -0.305 4.002 7.112 1.00 0.00 H new ATOM 0 HA LEU A 102 1.169 4.857 9.532 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.476 3.604 7.917 1.00 0.00 H new ATOM 0 HB3 LEU A 102 1.895 4.597 6.595 1.00 0.00 H new ATOM 0 HG LEU A 102 3.033 6.533 8.068 1.00 0.00 H new ATOM 0 HD11 LEU A 102 5.162 5.698 9.012 1.00 0.00 H new ATOM 0 HD12 LEU A 102 3.753 5.009 9.853 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.650 4.028 8.670 1.00 0.00 H new ATOM 0 HD21 LEU A 102 5.029 6.292 6.643 1.00 0.00 H new ATOM 0 HD22 LEU A 102 4.517 4.641 6.218 1.00 0.00 H new ATOM 0 HD23 LEU A 102 3.526 6.034 5.726 1.00 0.00 H new ATOM 1567 N PRO A 103 1.047 7.369 9.120 1.00 0.00 N ATOM 1568 CA PRO A 103 0.766 8.802 8.985 1.00 0.00 C ATOM 1569 C PRO A 103 1.228 9.330 7.628 1.00 0.00 C ATOM 1570 O PRO A 103 1.887 8.612 6.877 1.00 0.00 O ATOM 1571 CB PRO A 103 1.558 9.440 10.137 1.00 0.00 C ATOM 1572 CG PRO A 103 2.546 8.404 10.555 1.00 0.00 C ATOM 1573 CD PRO A 103 1.885 7.082 10.293 1.00 0.00 C ATOM 0 HA PRO A 103 -0.299 9.030 9.034 1.00 0.00 H new ATOM 0 HB2 PRO A 103 2.058 10.353 9.813 1.00 0.00 H new ATOM 0 HB3 PRO A 103 0.901 9.713 10.963 1.00 0.00 H new ATOM 0 HG2 PRO A 103 3.473 8.497 9.990 1.00 0.00 H new ATOM 0 HG3 PRO A 103 2.803 8.511 11.609 1.00 0.00 H new ATOM 0 HD2 PRO A 103 2.614 6.298 10.088 1.00 0.00 H new ATOM 0 HD3 PRO A 103 1.291 6.750 11.144 1.00 0.00 H new ATOM 1581 N LYS A 104 0.861 10.570 7.298 1.00 0.00 N ATOM 1582 CA LYS A 104 1.231 11.152 6.005 1.00 0.00 C ATOM 1583 C LYS A 104 2.691 10.879 5.652 1.00 0.00 C ATOM 1584 O LYS A 104 2.987 10.449 4.539 1.00 0.00 O ATOM 1585 CB LYS A 104 0.950 12.653 5.963 1.00 0.00 C ATOM 1586 CG LYS A 104 1.150 13.257 4.580 1.00 0.00 C ATOM 1587 CD LYS A 104 0.360 12.507 3.510 1.00 0.00 C ATOM 1588 CE LYS A 104 1.273 11.729 2.569 1.00 0.00 C ATOM 1589 NZ LYS A 104 0.591 11.378 1.288 1.00 0.00 N ATOM 0 H LYS A 104 0.314 11.185 7.900 1.00 0.00 H new ATOM 0 HA LYS A 104 0.607 10.664 5.256 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -0.074 12.835 6.288 1.00 0.00 H new ATOM 0 HB3 LYS A 104 1.604 13.160 6.673 1.00 0.00 H new ATOM 0 HG2 LYS A 104 0.842 14.302 4.593 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.210 13.240 4.327 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -0.338 11.820 3.989 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -0.235 13.216 2.934 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.162 12.322 2.355 1.00 0.00 H new ATOM 0 HE3 LYS A 104 1.609 10.817 3.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 1.083 10.578 0.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -0.396 11.114 1.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 0.611 12.198 0.648 1.00 0.00 H new ATOM 1603 N PRO A 105 3.636 11.096 6.587 1.00 0.00 N ATOM 1604 CA PRO A 105 5.047 10.831 6.318 1.00 0.00 C ATOM 1605 C PRO A 105 5.215 9.455 5.688 1.00 0.00 C ATOM 1606 O PRO A 105 4.306 8.629 5.752 1.00 0.00 O ATOM 1607 CB PRO A 105 5.690 10.889 7.704 1.00 0.00 C ATOM 1608 CG PRO A 105 4.804 11.796 8.489 1.00 0.00 C ATOM 1609 CD PRO A 105 3.410 11.582 7.959 1.00 0.00 C ATOM 0 HA PRO A 105 5.496 11.537 5.620 1.00 0.00 H new ATOM 0 HB2 PRO A 105 5.746 9.899 8.157 1.00 0.00 H new ATOM 0 HB3 PRO A 105 6.708 11.275 7.653 1.00 0.00 H new ATOM 0 HG2 PRO A 105 4.856 11.566 9.553 1.00 0.00 H new ATOM 0 HG3 PRO A 105 5.110 12.836 8.373 1.00 0.00 H new ATOM 0 HD2 PRO A 105 2.860 10.855 8.557 1.00 0.00 H new ATOM 0 HD3 PRO A 105 2.831 12.505 7.968 1.00 0.00 H new ATOM 1617 N PHE A 106 6.353 9.208 5.057 1.00 0.00 N ATOM 1618 CA PHE A 106 6.572 7.928 4.405 1.00 0.00 C ATOM 1619 C PHE A 106 7.977 7.839 3.817 1.00 0.00 C ATOM 1620 O PHE A 106 8.881 7.284 4.442 1.00 0.00 O ATOM 1621 CB PHE A 106 5.516 7.714 3.308 1.00 0.00 C ATOM 1622 CG PHE A 106 4.615 6.536 3.544 1.00 0.00 C ATOM 1623 CD1 PHE A 106 5.144 5.288 3.801 1.00 0.00 C ATOM 1624 CD2 PHE A 106 3.238 6.674 3.484 1.00 0.00 C ATOM 1625 CE1 PHE A 106 4.321 4.198 4.002 1.00 0.00 C ATOM 1626 CE2 PHE A 106 2.411 5.590 3.679 1.00 0.00 C ATOM 1627 CZ PHE A 106 2.951 4.352 3.941 1.00 0.00 C ATOM 0 H PHE A 106 7.128 9.867 4.983 1.00 0.00 H new ATOM 0 HA PHE A 106 6.476 7.141 5.153 1.00 0.00 H new ATOM 0 HB2 PHE A 106 4.906 8.613 3.226 1.00 0.00 H new ATOM 0 HB3 PHE A 106 6.023 7.584 2.352 1.00 0.00 H new ATOM 0 HD1 PHE A 106 6.216 5.162 3.846 1.00 0.00 H new ATOM 0 HD2 PHE A 106 2.808 7.644 3.282 1.00 0.00 H new ATOM 0 HE1 PHE A 106 4.748 3.227 4.206 1.00 0.00 H new ATOM 0 HE2 PHE A 106 1.339 5.712 3.626 1.00 0.00 H new ATOM 0 HZ PHE A 106 2.304 3.502 4.099 1.00 0.00 H new ATOM 1637 N ASP A 107 8.159 8.370 2.607 1.00 0.00 N ATOM 1638 CA ASP A 107 9.457 8.319 1.943 1.00 0.00 C ATOM 1639 C ASP A 107 10.089 6.947 2.140 1.00 0.00 C ATOM 1640 O ASP A 107 9.430 6.009 2.589 1.00 0.00 O ATOM 1641 CB ASP A 107 10.380 9.418 2.479 1.00 0.00 C ATOM 1642 CG ASP A 107 10.703 9.248 3.950 1.00 0.00 C ATOM 1643 OD1 ASP A 107 11.693 8.556 4.267 1.00 0.00 O ATOM 1644 OD2 ASP A 107 9.967 9.813 4.786 1.00 0.00 O ATOM 0 H ASP A 107 7.427 8.837 2.072 1.00 0.00 H new ATOM 0 HA ASP A 107 9.311 8.488 0.876 1.00 0.00 H new ATOM 0 HB2 ASP A 107 11.307 9.419 1.906 1.00 0.00 H new ATOM 0 HB3 ASP A 107 9.909 10.389 2.325 1.00 0.00 H new ATOM 1649 N ILE A 108 11.351 6.819 1.802 1.00 0.00 N ATOM 1650 CA ILE A 108 12.029 5.551 1.963 1.00 0.00 C ATOM 1651 C ILE A 108 12.196 5.195 3.425 1.00 0.00 C ATOM 1652 O ILE A 108 11.862 4.093 3.855 1.00 0.00 O ATOM 1653 CB ILE A 108 13.397 5.559 1.249 1.00 0.00 C ATOM 1654 CG1 ILE A 108 13.251 5.109 -0.198 1.00 0.00 C ATOM 1655 CG2 ILE A 108 14.422 4.681 1.956 1.00 0.00 C ATOM 1656 CD1 ILE A 108 11.978 5.571 -0.867 1.00 0.00 C ATOM 0 H ILE A 108 11.926 7.569 1.417 1.00 0.00 H new ATOM 0 HA ILE A 108 11.405 4.787 1.500 1.00 0.00 H new ATOM 0 HB ILE A 108 13.760 6.586 1.277 1.00 0.00 H new ATOM 0 HG12 ILE A 108 14.103 5.479 -0.769 1.00 0.00 H new ATOM 0 HG13 ILE A 108 13.292 4.020 -0.234 1.00 0.00 H new ATOM 0 HG21 ILE A 108 15.368 4.719 1.416 1.00 0.00 H new ATOM 0 HG22 ILE A 108 14.570 5.042 2.974 1.00 0.00 H new ATOM 0 HG23 ILE A 108 14.062 3.653 1.985 1.00 0.00 H new ATOM 0 HD11 ILE A 108 11.954 5.207 -1.894 1.00 0.00 H new ATOM 0 HD12 ILE A 108 11.118 5.179 -0.323 1.00 0.00 H new ATOM 0 HD13 ILE A 108 11.942 6.660 -0.867 1.00 0.00 H new ATOM 1668 N ASP A 109 12.736 6.128 4.174 1.00 0.00 N ATOM 1669 CA ASP A 109 12.985 5.920 5.590 1.00 0.00 C ATOM 1670 C ASP A 109 11.766 5.360 6.320 1.00 0.00 C ATOM 1671 O ASP A 109 11.856 4.319 6.965 1.00 0.00 O ATOM 1672 CB ASP A 109 13.416 7.227 6.248 1.00 0.00 C ATOM 1673 CG ASP A 109 14.294 6.997 7.460 1.00 0.00 C ATOM 1674 OD1 ASP A 109 13.744 6.774 8.558 1.00 0.00 O ATOM 1675 OD2 ASP A 109 15.533 7.039 7.310 1.00 0.00 O ATOM 0 H ASP A 109 13.015 7.046 3.828 1.00 0.00 H new ATOM 0 HA ASP A 109 13.784 5.183 5.666 1.00 0.00 H new ATOM 0 HB2 ASP A 109 13.954 7.836 5.522 1.00 0.00 H new ATOM 0 HB3 ASP A 109 12.532 7.791 6.544 1.00 0.00 H new ATOM 1680 N GLU A 110 10.644 6.071 6.252 1.00 0.00 N ATOM 1681 CA GLU A 110 9.434 5.654 6.947 1.00 0.00 C ATOM 1682 C GLU A 110 8.695 4.513 6.248 1.00 0.00 C ATOM 1683 O GLU A 110 8.055 3.693 6.914 1.00 0.00 O ATOM 1684 CB GLU A 110 8.492 6.850 7.147 1.00 0.00 C ATOM 1685 CG GLU A 110 9.159 8.053 7.794 1.00 0.00 C ATOM 1686 CD GLU A 110 9.176 7.969 9.307 1.00 0.00 C ATOM 1687 OE1 GLU A 110 9.585 6.917 9.839 1.00 0.00 O ATOM 1688 OE2 GLU A 110 8.781 8.958 9.960 1.00 0.00 O ATOM 0 H GLU A 110 10.549 6.938 5.723 1.00 0.00 H new ATOM 0 HA GLU A 110 9.754 5.270 7.916 1.00 0.00 H new ATOM 0 HB2 GLU A 110 8.087 7.147 6.180 1.00 0.00 H new ATOM 0 HB3 GLU A 110 7.649 6.538 7.764 1.00 0.00 H new ATOM 0 HG2 GLU A 110 10.182 8.137 7.427 1.00 0.00 H new ATOM 0 HG3 GLU A 110 8.636 8.960 7.490 1.00 0.00 H new ATOM 1695 N ALA A 111 8.769 4.440 4.924 1.00 0.00 N ATOM 1696 CA ALA A 111 8.074 3.380 4.216 1.00 0.00 C ATOM 1697 C ALA A 111 8.903 2.111 4.179 1.00 0.00 C ATOM 1698 O ALA A 111 8.434 1.046 4.586 1.00 0.00 O ATOM 1699 CB ALA A 111 7.685 3.814 2.817 1.00 0.00 C ATOM 0 H ALA A 111 9.291 5.087 4.333 1.00 0.00 H new ATOM 0 HA ALA A 111 7.157 3.166 4.765 1.00 0.00 H new ATOM 0 HB1 ALA A 111 7.167 2.998 2.314 1.00 0.00 H new ATOM 0 HB2 ALA A 111 7.027 4.681 2.875 1.00 0.00 H new ATOM 0 HB3 ALA A 111 8.581 4.076 2.255 1.00 0.00 H new ATOM 1705 N VAL A 112 10.141 2.215 3.705 1.00 0.00 N ATOM 1706 CA VAL A 112 11.007 1.051 3.650 1.00 0.00 C ATOM 1707 C VAL A 112 11.144 0.434 5.033 1.00 0.00 C ATOM 1708 O VAL A 112 11.269 -0.780 5.184 1.00 0.00 O ATOM 1709 CB VAL A 112 12.401 1.381 3.111 1.00 0.00 C ATOM 1710 CG1 VAL A 112 13.218 0.106 2.978 1.00 0.00 C ATOM 1711 CG2 VAL A 112 12.299 2.107 1.781 1.00 0.00 C ATOM 0 H VAL A 112 10.558 3.079 3.360 1.00 0.00 H new ATOM 0 HA VAL A 112 10.540 0.345 2.963 1.00 0.00 H new ATOM 0 HB VAL A 112 12.907 2.043 3.813 1.00 0.00 H new ATOM 0 HG11 VAL A 112 14.209 0.347 2.594 1.00 0.00 H new ATOM 0 HG12 VAL A 112 13.313 -0.369 3.955 1.00 0.00 H new ATOM 0 HG13 VAL A 112 12.719 -0.576 2.290 1.00 0.00 H new ATOM 0 HG21 VAL A 112 13.299 2.334 1.413 1.00 0.00 H new ATOM 0 HG22 VAL A 112 11.782 1.474 1.060 1.00 0.00 H new ATOM 0 HG23 VAL A 112 11.743 3.035 1.915 1.00 0.00 H new ATOM 1721 N ALA A 113 11.095 1.290 6.039 1.00 0.00 N ATOM 1722 CA ALA A 113 11.179 0.855 7.420 1.00 0.00 C ATOM 1723 C ALA A 113 10.055 -0.119 7.722 1.00 0.00 C ATOM 1724 O ALA A 113 10.270 -1.215 8.238 1.00 0.00 O ATOM 1725 CB ALA A 113 11.057 2.055 8.336 1.00 0.00 C ATOM 0 H ALA A 113 10.997 2.298 5.922 1.00 0.00 H new ATOM 0 HA ALA A 113 12.138 0.363 7.582 1.00 0.00 H new ATOM 0 HB1 ALA A 113 11.120 1.728 9.374 1.00 0.00 H new ATOM 0 HB2 ALA A 113 11.865 2.756 8.127 1.00 0.00 H new ATOM 0 HB3 ALA A 113 10.098 2.545 8.168 1.00 0.00 H new ATOM 1731 N LEU A 114 8.846 0.323 7.409 1.00 0.00 N ATOM 1732 CA LEU A 114 7.647 -0.460 7.650 1.00 0.00 C ATOM 1733 C LEU A 114 7.517 -1.652 6.702 1.00 0.00 C ATOM 1734 O LEU A 114 6.855 -2.633 7.032 1.00 0.00 O ATOM 1735 CB LEU A 114 6.417 0.445 7.524 1.00 0.00 C ATOM 1736 CG LEU A 114 5.063 -0.256 7.672 1.00 0.00 C ATOM 1737 CD1 LEU A 114 4.620 -0.264 9.127 1.00 0.00 C ATOM 1738 CD2 LEU A 114 4.015 0.423 6.801 1.00 0.00 C ATOM 0 H LEU A 114 8.670 1.233 6.982 1.00 0.00 H new ATOM 0 HA LEU A 114 7.719 -0.867 8.659 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.485 1.228 8.279 1.00 0.00 H new ATOM 0 HB3 LEU A 114 6.447 0.936 6.552 1.00 0.00 H new ATOM 0 HG LEU A 114 5.173 -1.289 7.341 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.656 -0.766 9.211 1.00 0.00 H new ATOM 0 HD12 LEU A 114 5.359 -0.793 9.729 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.527 0.761 9.485 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.059 -0.087 6.918 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.910 1.465 7.104 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.325 0.378 5.757 1.00 0.00 H new ATOM 1750 N VAL A 115 8.119 -1.569 5.523 1.00 0.00 N ATOM 1751 CA VAL A 115 8.011 -2.665 4.561 1.00 0.00 C ATOM 1752 C VAL A 115 8.950 -3.831 4.874 1.00 0.00 C ATOM 1753 O VAL A 115 8.512 -4.978 4.967 1.00 0.00 O ATOM 1754 CB VAL A 115 8.211 -2.213 3.098 1.00 0.00 C ATOM 1755 CG1 VAL A 115 9.659 -1.856 2.814 1.00 0.00 C ATOM 1756 CG2 VAL A 115 7.739 -3.304 2.151 1.00 0.00 C ATOM 0 H VAL A 115 8.676 -0.774 5.211 1.00 0.00 H new ATOM 0 HA VAL A 115 6.985 -3.016 4.668 1.00 0.00 H new ATOM 0 HB VAL A 115 7.615 -1.314 2.939 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.759 -1.543 1.775 1.00 0.00 H new ATOM 0 HG12 VAL A 115 9.968 -1.042 3.470 1.00 0.00 H new ATOM 0 HG13 VAL A 115 10.290 -2.726 2.993 1.00 0.00 H new ATOM 0 HG21 VAL A 115 7.883 -2.979 1.121 1.00 0.00 H new ATOM 0 HG22 VAL A 115 8.314 -4.213 2.328 1.00 0.00 H new ATOM 0 HG23 VAL A 115 6.682 -3.504 2.324 1.00 0.00 H new ATOM 1766 N GLU A 116 10.242 -3.542 5.014 1.00 0.00 N ATOM 1767 CA GLU A 116 11.229 -4.582 5.290 1.00 0.00 C ATOM 1768 C GLU A 116 10.893 -5.348 6.567 1.00 0.00 C ATOM 1769 O GLU A 116 10.653 -6.556 6.532 1.00 0.00 O ATOM 1770 CB GLU A 116 12.627 -3.970 5.395 1.00 0.00 C ATOM 1771 CG GLU A 116 13.179 -3.478 4.065 1.00 0.00 C ATOM 1772 CD GLU A 116 14.512 -4.108 3.717 1.00 0.00 C ATOM 1773 OE1 GLU A 116 15.502 -3.837 4.430 1.00 0.00 O ATOM 1774 OE2 GLU A 116 14.568 -4.873 2.731 1.00 0.00 O ATOM 0 H GLU A 116 10.628 -2.601 4.941 1.00 0.00 H new ATOM 0 HA GLU A 116 11.208 -5.289 4.461 1.00 0.00 H new ATOM 0 HB2 GLU A 116 12.598 -3.137 6.097 1.00 0.00 H new ATOM 0 HB3 GLU A 116 13.309 -4.712 5.810 1.00 0.00 H new ATOM 0 HG2 GLU A 116 12.461 -3.697 3.275 1.00 0.00 H new ATOM 0 HG3 GLU A 116 13.292 -2.395 4.102 1.00 0.00 H new ATOM 1781 N ARG A 117 10.884 -4.642 7.694 1.00 0.00 N ATOM 1782 CA ARG A 117 10.585 -5.265 8.981 1.00 0.00 C ATOM 1783 C ARG A 117 9.268 -6.025 8.934 1.00 0.00 C ATOM 1784 O ARG A 117 9.073 -6.995 9.666 1.00 0.00 O ATOM 1785 CB ARG A 117 10.533 -4.209 10.089 1.00 0.00 C ATOM 1786 CG ARG A 117 9.396 -3.211 9.930 1.00 0.00 C ATOM 1787 CD ARG A 117 8.144 -3.664 10.665 1.00 0.00 C ATOM 1788 NE ARG A 117 8.184 -3.315 12.084 1.00 0.00 N ATOM 1789 CZ ARG A 117 7.378 -2.423 12.660 1.00 0.00 C ATOM 1790 NH1 ARG A 117 6.477 -1.760 11.945 1.00 0.00 N ATOM 1791 NH2 ARG A 117 7.478 -2.190 13.961 1.00 0.00 N ATOM 0 H ARG A 117 11.079 -3.642 7.743 1.00 0.00 H new ATOM 0 HA ARG A 117 11.384 -5.974 9.198 1.00 0.00 H new ATOM 0 HB2 ARG A 117 10.433 -4.710 11.052 1.00 0.00 H new ATOM 0 HB3 ARG A 117 11.479 -3.668 10.108 1.00 0.00 H new ATOM 0 HG2 ARG A 117 9.709 -2.239 10.310 1.00 0.00 H new ATOM 0 HG3 ARG A 117 9.170 -3.082 8.871 1.00 0.00 H new ATOM 0 HD2 ARG A 117 7.268 -3.207 10.204 1.00 0.00 H new ATOM 0 HD3 ARG A 117 8.033 -4.743 10.560 1.00 0.00 H new ATOM 0 HE ARG A 117 8.873 -3.784 12.671 1.00 0.00 H new ATOM 0 HH11 ARG A 117 6.395 -1.931 10.943 1.00 0.00 H new ATOM 0 HH12 ARG A 117 5.866 -1.080 12.398 1.00 0.00 H new ATOM 0 HH21 ARG A 117 8.170 -2.692 14.517 1.00 0.00 H new ATOM 0 HH22 ARG A 117 6.863 -1.508 14.406 1.00 0.00 H new ATOM 1805 N ALA A 118 8.365 -5.570 8.080 1.00 0.00 N ATOM 1806 CA ALA A 118 7.060 -6.200 7.949 1.00 0.00 C ATOM 1807 C ALA A 118 7.140 -7.519 7.190 1.00 0.00 C ATOM 1808 O ALA A 118 6.613 -8.533 7.646 1.00 0.00 O ATOM 1809 CB ALA A 118 6.082 -5.257 7.279 1.00 0.00 C ATOM 0 H ALA A 118 8.511 -4.768 7.468 1.00 0.00 H new ATOM 0 HA ALA A 118 6.701 -6.424 8.953 1.00 0.00 H new ATOM 0 HB1 ALA A 118 5.111 -5.744 7.189 1.00 0.00 H new ATOM 0 HB2 ALA A 118 5.980 -4.352 7.878 1.00 0.00 H new ATOM 0 HB3 ALA A 118 6.450 -4.995 6.287 1.00 0.00 H new ATOM 1815 N ILE A 119 7.803 -7.509 6.036 1.00 0.00 N ATOM 1816 CA ILE A 119 7.946 -8.721 5.239 1.00 0.00 C ATOM 1817 C ILE A 119 8.768 -9.757 5.989 1.00 0.00 C ATOM 1818 O ILE A 119 8.564 -10.960 5.839 1.00 0.00 O ATOM 1819 CB ILE A 119 8.618 -8.436 3.885 1.00 0.00 C ATOM 1820 CG1 ILE A 119 7.914 -7.285 3.173 1.00 0.00 C ATOM 1821 CG2 ILE A 119 8.610 -9.682 3.012 1.00 0.00 C ATOM 1822 CD1 ILE A 119 8.864 -6.384 2.426 1.00 0.00 C ATOM 0 H ILE A 119 8.246 -6.682 5.636 1.00 0.00 H new ATOM 0 HA ILE A 119 6.942 -9.104 5.056 1.00 0.00 H new ATOM 0 HB ILE A 119 9.654 -8.150 4.069 1.00 0.00 H new ATOM 0 HG12 ILE A 119 7.182 -7.691 2.475 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.363 -6.695 3.905 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.089 -9.461 2.058 1.00 0.00 H new ATOM 0 HG22 ILE A 119 9.153 -10.482 3.515 1.00 0.00 H new ATOM 0 HG23 ILE A 119 7.581 -9.997 2.837 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.303 -5.585 1.941 1.00 0.00 H new ATOM 0 HD12 ILE A 119 9.580 -5.952 3.124 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.397 -6.963 1.671 1.00 0.00 H new ATOM 1834 N SER A 120 9.697 -9.274 6.800 1.00 0.00 N ATOM 1835 CA SER A 120 10.559 -10.145 7.587 1.00 0.00 C ATOM 1836 C SER A 120 9.746 -10.926 8.612 1.00 0.00 C ATOM 1837 O SER A 120 10.059 -12.075 8.925 1.00 0.00 O ATOM 1838 CB SER A 120 11.635 -9.320 8.291 1.00 0.00 C ATOM 1839 OG SER A 120 12.791 -10.097 8.549 1.00 0.00 O ATOM 0 H SER A 120 9.874 -8.278 6.931 1.00 0.00 H new ATOM 0 HA SER A 120 11.037 -10.856 6.913 1.00 0.00 H new ATOM 0 HB2 SER A 120 11.901 -8.462 7.673 1.00 0.00 H new ATOM 0 HB3 SER A 120 11.241 -8.928 9.229 1.00 0.00 H new ATOM 0 HG SER A 120 13.463 -9.544 8.999 1.00 0.00 H new ATOM 1845 N HIS A 121 8.696 -10.295 9.128 1.00 0.00 N ATOM 1846 CA HIS A 121 7.831 -10.932 10.114 1.00 0.00 C ATOM 1847 C HIS A 121 6.947 -11.985 9.457 1.00 0.00 C ATOM 1848 O HIS A 121 6.544 -12.958 10.093 1.00 0.00 O ATOM 1849 CB HIS A 121 6.963 -9.886 10.817 1.00 0.00 C ATOM 1850 CG HIS A 121 7.660 -9.183 11.938 1.00 0.00 C ATOM 1851 ND1 HIS A 121 8.979 -8.784 11.873 1.00 0.00 N ATOM 1852 CD2 HIS A 121 7.215 -8.804 13.159 1.00 0.00 C ATOM 1853 CE1 HIS A 121 9.314 -8.191 13.004 1.00 0.00 C ATOM 1854 NE2 HIS A 121 8.261 -8.190 13.801 1.00 0.00 N ATOM 0 H HIS A 121 8.424 -9.344 8.880 1.00 0.00 H new ATOM 0 HA HIS A 121 8.464 -11.422 10.854 1.00 0.00 H new ATOM 0 HB2 HIS A 121 6.634 -9.148 10.085 1.00 0.00 H new ATOM 0 HB3 HIS A 121 6.067 -10.371 11.205 1.00 0.00 H new ATOM 0 HD2 HIS A 121 6.222 -8.956 13.554 1.00 0.00 H new ATOM 0 HE1 HIS A 121 10.284 -7.777 13.238 1.00 0.00 H new ATOM 0 HE2 HIS A 121 8.230 -7.797 14.742 1.00 0.00 H new