USER MOD reduce.3.24.130724 H: found=0, std=0, add=681, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 679 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 43 GLN : amide:sc= -11.3! C(o=-12!,f=-16!) USER MOD Set 1.2: A 74 MET CE :methyl 166:sc= -0.451 (180deg=-0.217) USER MOD Set 2.1: A 69 ASN : amide:sc= -0.406 K(o=-0.44,f=-3.6!) USER MOD Set 2.2: A 70 THR OG1 : rot -170:sc= -0.0328 USER MOD Set 3.1: A 12 GLN : amide:sc= -0.04 X(o=-0.056,f=-0.035) USER MOD Set 3.2: A 14 TYR OH : rot 30:sc= -0.016 USER MOD Set 4.1: A 8 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.321) USER MOD Set 4.2: A 71 LYS NZ :NH3+ 166:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 149:sc= 0.39 (180deg=0.11) USER MOD Single : A 15 SER OG : rot 180:sc= 0.023 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.976 USER MOD Single : A 29 LYS NZ :NH3+ 141:sc= -3.31! (180deg=-5.86!) USER MOD Single : A 30 GLN : amide:sc= -0.902 K(o=-0.9,f=-3.1!) USER MOD Single : A 33 LYS NZ :NH3+ -158:sc= 0.144 (180deg=-0.413!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= -0.912 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -2.29! C(o=-2.3!,f=-5.4!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 163:sc= -0.489 (180deg=-1.41!) USER MOD Single : A 67 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0138) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot -58:sc= 0.192 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.794 0.132 -0.053 1.00 0.00 N ATOM 2 CA MET A 1 2.168 0.072 -1.461 1.00 0.00 C ATOM 3 C MET A 1 2.518 -1.355 -1.870 1.00 0.00 C ATOM 4 O MET A 1 2.803 -2.201 -1.023 1.00 0.00 O ATOM 5 CB MET A 1 3.353 0.999 -1.737 1.00 0.00 C ATOM 6 CG MET A 1 2.960 2.461 -1.880 1.00 0.00 C ATOM 7 SD MET A 1 2.896 3.321 -0.297 1.00 0.00 S ATOM 8 CE MET A 1 3.666 4.880 -0.727 1.00 0.00 C ATOM 0 H1 MET A 1 2.063 1.057 0.339 1.00 0.00 H new ATOM 0 H2 MET A 1 0.766 0.003 0.039 1.00 0.00 H new ATOM 0 H3 MET A 1 2.286 -0.621 0.469 1.00 0.00 H new ATOM 0 HA MET A 1 1.313 0.402 -2.052 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.075 0.903 -0.926 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.853 0.675 -2.650 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.674 2.963 -2.533 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.985 2.526 -2.364 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.700 5.524 0.152 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.680 4.699 -1.084 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.087 5.368 -1.511 1.00 0.00 H new ATOM 18 N ALA A 2 2.494 -1.615 -3.173 1.00 0.00 N ATOM 19 CA ALA A 2 2.811 -2.939 -3.694 1.00 0.00 C ATOM 20 C ALA A 2 4.272 -3.026 -4.121 1.00 0.00 C ATOM 21 O ALA A 2 4.816 -2.087 -4.703 1.00 0.00 O ATOM 22 CB ALA A 2 1.896 -3.280 -4.861 1.00 0.00 C ATOM 0 H ALA A 2 2.258 -0.926 -3.887 1.00 0.00 H new ATOM 0 HA ALA A 2 2.650 -3.664 -2.896 1.00 0.00 H new ATOM 0 HB1 ALA A 2 2.144 -4.271 -5.240 1.00 0.00 H new ATOM 0 HB2 ALA A 2 0.859 -3.269 -4.526 1.00 0.00 H new ATOM 0 HB3 ALA A 2 2.029 -2.544 -5.654 1.00 0.00 H new ATOM 28 N LEU A 3 4.903 -4.158 -3.829 1.00 0.00 N ATOM 29 CA LEU A 3 6.302 -4.367 -4.182 1.00 0.00 C ATOM 30 C LEU A 3 6.439 -5.452 -5.246 1.00 0.00 C ATOM 31 O LEU A 3 6.036 -6.599 -5.053 1.00 0.00 O ATOM 32 CB LEU A 3 7.111 -4.749 -2.941 1.00 0.00 C ATOM 33 CG LEU A 3 7.615 -3.587 -2.085 1.00 0.00 C ATOM 34 CD1 LEU A 3 8.780 -2.887 -2.768 1.00 0.00 C ATOM 35 CD2 LEU A 3 6.489 -2.603 -1.805 1.00 0.00 C ATOM 0 H LEU A 3 4.467 -4.945 -3.348 1.00 0.00 H new ATOM 0 HA LEU A 3 6.691 -3.434 -4.588 1.00 0.00 H new ATOM 0 HB2 LEU A 3 6.495 -5.395 -2.315 1.00 0.00 H new ATOM 0 HB3 LEU A 3 7.970 -5.339 -3.259 1.00 0.00 H new ATOM 0 HG LEU A 3 7.966 -3.987 -1.134 1.00 0.00 H new ATOM 0 HD11 LEU A 3 9.126 -2.063 -2.144 1.00 0.00 H new ATOM 0 HD12 LEU A 3 9.594 -3.596 -2.916 1.00 0.00 H new ATOM 0 HD13 LEU A 3 8.456 -2.500 -3.734 1.00 0.00 H new ATOM 0 HD21 LEU A 3 6.866 -1.783 -1.194 1.00 0.00 H new ATOM 0 HD22 LEU A 3 6.108 -2.209 -2.747 1.00 0.00 H new ATOM 0 HD23 LEU A 3 5.685 -3.112 -1.273 1.00 0.00 H new ATOM 47 N PRO A 4 7.023 -5.083 -6.396 1.00 0.00 N ATOM 48 CA PRO A 4 7.229 -6.011 -7.512 1.00 0.00 C ATOM 49 C PRO A 4 8.284 -7.067 -7.201 1.00 0.00 C ATOM 50 O PRO A 4 9.155 -6.857 -6.356 1.00 0.00 O ATOM 51 CB PRO A 4 7.702 -5.100 -8.648 1.00 0.00 C ATOM 52 CG PRO A 4 8.312 -3.926 -7.963 1.00 0.00 C ATOM 53 CD PRO A 4 7.527 -3.732 -6.695 1.00 0.00 C ATOM 0 HA PRO A 4 6.325 -6.573 -7.747 1.00 0.00 H new ATOM 0 HB2 PRO A 4 8.426 -5.606 -9.286 1.00 0.00 H new ATOM 0 HB3 PRO A 4 6.871 -4.799 -9.286 1.00 0.00 H new ATOM 0 HG2 PRO A 4 9.365 -4.105 -7.746 1.00 0.00 H new ATOM 0 HG3 PRO A 4 8.262 -3.038 -8.593 1.00 0.00 H new ATOM 0 HD2 PRO A 4 8.153 -3.349 -5.889 1.00 0.00 H new ATOM 0 HD3 PRO A 4 6.713 -3.020 -6.831 1.00 0.00 H new ATOM 61 N ILE A 5 8.201 -8.200 -7.890 1.00 0.00 N ATOM 62 CA ILE A 5 9.151 -9.287 -7.687 1.00 0.00 C ATOM 63 C ILE A 5 9.387 -10.059 -8.981 1.00 0.00 C ATOM 64 O ILE A 5 8.440 -10.471 -9.652 1.00 0.00 O ATOM 65 CB ILE A 5 8.664 -10.265 -6.602 1.00 0.00 C ATOM 66 CG1 ILE A 5 9.037 -9.745 -5.212 1.00 0.00 C ATOM 67 CG2 ILE A 5 9.255 -11.648 -6.831 1.00 0.00 C ATOM 68 CD1 ILE A 5 9.872 -10.716 -4.407 1.00 0.00 C ATOM 0 H ILE A 5 7.487 -8.389 -8.593 1.00 0.00 H new ATOM 0 HA ILE A 5 10.086 -8.832 -7.361 1.00 0.00 H new ATOM 0 HB ILE A 5 7.578 -10.340 -6.663 1.00 0.00 H new ATOM 0 HG12 ILE A 5 9.585 -8.809 -5.318 1.00 0.00 H new ATOM 0 HG13 ILE A 5 8.124 -9.519 -4.660 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.901 -12.328 -6.056 1.00 0.00 H new ATOM 0 HG22 ILE A 5 8.945 -12.019 -7.808 1.00 0.00 H new ATOM 0 HG23 ILE A 5 10.343 -11.590 -6.794 1.00 0.00 H new ATOM 0 HD11 ILE A 5 10.099 -10.281 -3.434 1.00 0.00 H new ATOM 0 HD12 ILE A 5 9.318 -11.645 -4.269 1.00 0.00 H new ATOM 0 HD13 ILE A 5 10.802 -10.923 -4.937 1.00 0.00 H new ATOM 80 N ILE A 6 10.656 -10.251 -9.325 1.00 0.00 N ATOM 81 CA ILE A 6 11.017 -10.976 -10.538 1.00 0.00 C ATOM 82 C ILE A 6 11.284 -12.447 -10.239 1.00 0.00 C ATOM 83 O ILE A 6 12.009 -12.781 -9.302 1.00 0.00 O ATOM 84 CB ILE A 6 12.262 -10.366 -11.209 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.935 -8.984 -11.779 1.00 0.00 C ATOM 86 CG2 ILE A 6 12.779 -11.288 -12.303 1.00 0.00 C ATOM 87 CD1 ILE A 6 13.099 -8.019 -11.729 1.00 0.00 C ATOM 0 H ILE A 6 11.451 -9.915 -8.782 1.00 0.00 H new ATOM 0 HA ILE A 6 10.170 -10.893 -11.219 1.00 0.00 H new ATOM 0 HB ILE A 6 13.043 -10.253 -10.458 1.00 0.00 H new ATOM 0 HG12 ILE A 6 11.609 -9.094 -12.813 1.00 0.00 H new ATOM 0 HG13 ILE A 6 11.098 -8.560 -11.225 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.659 -10.843 -12.768 1.00 0.00 H new ATOM 0 HG22 ILE A 6 13.045 -12.252 -11.870 1.00 0.00 H new ATOM 0 HG23 ILE A 6 12.004 -11.430 -13.056 1.00 0.00 H new ATOM 0 HD11 ILE A 6 12.795 -7.060 -12.149 1.00 0.00 H new ATOM 0 HD12 ILE A 6 13.411 -7.879 -10.694 1.00 0.00 H new ATOM 0 HD13 ILE A 6 13.930 -8.422 -12.308 1.00 0.00 H new ATOM 99 N VAL A 7 10.693 -13.325 -11.044 1.00 0.00 N ATOM 100 CA VAL A 7 10.868 -14.762 -10.869 1.00 0.00 C ATOM 101 C VAL A 7 11.629 -15.370 -12.042 1.00 0.00 C ATOM 102 O VAL A 7 11.468 -14.947 -13.187 1.00 0.00 O ATOM 103 CB VAL A 7 9.513 -15.479 -10.723 1.00 0.00 C ATOM 104 CG1 VAL A 7 9.718 -16.933 -10.326 1.00 0.00 C ATOM 105 CG2 VAL A 7 8.636 -14.760 -9.709 1.00 0.00 C ATOM 0 H VAL A 7 10.089 -13.066 -11.824 1.00 0.00 H new ATOM 0 HA VAL A 7 11.444 -14.901 -9.954 1.00 0.00 H new ATOM 0 HB VAL A 7 9.006 -15.459 -11.687 1.00 0.00 H new ATOM 0 HG11 VAL A 7 8.749 -17.423 -10.228 1.00 0.00 H new ATOM 0 HG12 VAL A 7 10.305 -17.440 -11.092 1.00 0.00 H new ATOM 0 HG13 VAL A 7 10.246 -16.979 -9.374 1.00 0.00 H new ATOM 0 HG21 VAL A 7 7.683 -15.280 -9.619 1.00 0.00 H new ATOM 0 HG22 VAL A 7 9.136 -14.747 -8.740 1.00 0.00 H new ATOM 0 HG23 VAL A 7 8.461 -13.737 -10.040 1.00 0.00 H new ATOM 115 N LYS A 8 12.458 -16.366 -11.749 1.00 0.00 N ATOM 116 CA LYS A 8 13.244 -17.035 -12.779 1.00 0.00 C ATOM 117 C LYS A 8 13.011 -18.542 -12.748 1.00 0.00 C ATOM 118 O LYS A 8 13.350 -19.212 -11.772 1.00 0.00 O ATOM 119 CB LYS A 8 14.733 -16.735 -12.590 1.00 0.00 C ATOM 120 CG LYS A 8 15.493 -16.581 -13.895 1.00 0.00 C ATOM 121 CD LYS A 8 16.688 -15.657 -13.739 1.00 0.00 C ATOM 122 CE LYS A 8 16.263 -14.197 -13.700 1.00 0.00 C ATOM 123 NZ LYS A 8 17.376 -13.284 -14.080 1.00 0.00 N ATOM 0 H LYS A 8 12.603 -16.728 -10.806 1.00 0.00 H new ATOM 0 HA LYS A 8 12.923 -16.655 -13.749 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.839 -15.820 -12.007 1.00 0.00 H new ATOM 0 HB3 LYS A 8 15.186 -17.538 -12.008 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.831 -17.559 -14.238 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.825 -16.187 -14.662 1.00 0.00 H new ATOM 0 HD2 LYS A 8 17.224 -15.905 -12.823 1.00 0.00 H new ATOM 0 HD3 LYS A 8 17.381 -15.813 -14.566 1.00 0.00 H new ATOM 0 HE2 LYS A 8 15.422 -14.046 -14.377 1.00 0.00 H new ATOM 0 HE3 LYS A 8 15.915 -13.947 -12.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 16.992 -12.344 -14.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 18.046 -13.205 -13.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 17.869 -13.665 -14.913 1.00 0.00 H new ATOM 137 N TRP A 9 12.431 -19.069 -13.820 1.00 0.00 N ATOM 138 CA TRP A 9 12.154 -20.498 -13.915 1.00 0.00 C ATOM 139 C TRP A 9 12.386 -21.004 -15.334 1.00 0.00 C ATOM 140 O TRP A 9 11.777 -20.516 -16.285 1.00 0.00 O ATOM 141 CB TRP A 9 10.715 -20.789 -13.486 1.00 0.00 C ATOM 142 CG TRP A 9 10.236 -22.148 -13.898 1.00 0.00 C ATOM 143 CD1 TRP A 9 9.114 -22.437 -14.621 1.00 0.00 C ATOM 144 CD2 TRP A 9 10.863 -23.402 -13.608 1.00 0.00 C ATOM 145 NE1 TRP A 9 9.007 -23.795 -14.799 1.00 0.00 N ATOM 146 CE2 TRP A 9 10.067 -24.409 -14.188 1.00 0.00 C ATOM 147 CE3 TRP A 9 12.020 -23.772 -12.918 1.00 0.00 C ATOM 148 CZ2 TRP A 9 10.393 -25.760 -14.096 1.00 0.00 C ATOM 149 CZ3 TRP A 9 12.342 -25.113 -12.827 1.00 0.00 C ATOM 150 CH2 TRP A 9 11.531 -26.094 -13.414 1.00 0.00 C ATOM 0 H TRP A 9 12.143 -18.529 -14.636 1.00 0.00 H new ATOM 0 HA TRP A 9 12.838 -21.021 -13.246 1.00 0.00 H new ATOM 0 HB2 TRP A 9 10.641 -20.699 -12.402 1.00 0.00 H new ATOM 0 HB3 TRP A 9 10.056 -20.034 -13.914 1.00 0.00 H new ATOM 0 HD1 TRP A 9 8.414 -21.706 -14.997 1.00 0.00 H new ATOM 0 HE1 TRP A 9 8.259 -24.269 -15.305 1.00 0.00 H new ATOM 0 HE3 TRP A 9 12.652 -23.023 -12.464 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 9.769 -26.517 -14.547 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 13.234 -25.410 -12.295 1.00 0.00 H new ATOM 0 HH2 TRP A 9 11.810 -27.134 -13.326 1.00 0.00 H new ATOM 161 N GLY A 10 13.272 -21.987 -15.471 1.00 0.00 N ATOM 162 CA GLY A 10 13.568 -22.542 -16.778 1.00 0.00 C ATOM 163 C GLY A 10 14.013 -21.486 -17.770 1.00 0.00 C ATOM 164 O GLY A 10 13.736 -21.589 -18.964 1.00 0.00 O ATOM 0 H GLY A 10 13.790 -22.408 -14.700 1.00 0.00 H new ATOM 0 HA2 GLY A 10 14.349 -23.296 -16.680 1.00 0.00 H new ATOM 0 HA3 GLY A 10 12.683 -23.048 -17.163 1.00 0.00 H new ATOM 168 N GLY A 11 14.705 -20.464 -17.274 1.00 0.00 N ATOM 169 CA GLY A 11 15.176 -19.398 -18.138 1.00 0.00 C ATOM 170 C GLY A 11 14.109 -18.356 -18.408 1.00 0.00 C ATOM 171 O GLY A 11 14.372 -17.344 -19.057 1.00 0.00 O ATOM 0 H GLY A 11 14.947 -20.356 -16.289 1.00 0.00 H new ATOM 0 HA2 GLY A 11 16.040 -18.918 -17.679 1.00 0.00 H new ATOM 0 HA3 GLY A 11 15.512 -19.823 -19.084 1.00 0.00 H new ATOM 175 N GLN A 12 12.902 -18.605 -17.910 1.00 0.00 N ATOM 176 CA GLN A 12 11.791 -17.680 -18.104 1.00 0.00 C ATOM 177 C GLN A 12 11.775 -16.612 -17.015 1.00 0.00 C ATOM 178 O GLN A 12 12.165 -16.869 -15.876 1.00 0.00 O ATOM 179 CB GLN A 12 10.463 -18.440 -18.109 1.00 0.00 C ATOM 180 CG GLN A 12 10.430 -19.600 -19.091 1.00 0.00 C ATOM 181 CD GLN A 12 10.609 -19.153 -20.529 1.00 0.00 C ATOM 182 OE1 GLN A 12 9.638 -18.851 -21.223 1.00 0.00 O ATOM 183 NE2 GLN A 12 11.856 -19.108 -20.984 1.00 0.00 N ATOM 0 H GLN A 12 12.669 -19.438 -17.370 1.00 0.00 H new ATOM 0 HA GLN A 12 11.924 -17.188 -19.068 1.00 0.00 H new ATOM 0 HB2 GLN A 12 10.267 -18.818 -17.106 1.00 0.00 H new ATOM 0 HB3 GLN A 12 9.658 -17.746 -18.351 1.00 0.00 H new ATOM 0 HG2 GLN A 12 11.216 -20.310 -18.835 1.00 0.00 H new ATOM 0 HG3 GLN A 12 9.481 -20.126 -18.994 1.00 0.00 H new ATOM 0 HE21 GLN A 12 12.631 -19.367 -20.374 1.00 0.00 H new ATOM 0 HE22 GLN A 12 12.038 -18.814 -21.944 1.00 0.00 H new ATOM 192 N GLU A 13 11.323 -15.415 -17.374 1.00 0.00 N ATOM 193 CA GLU A 13 11.258 -14.308 -16.426 1.00 0.00 C ATOM 194 C GLU A 13 9.819 -13.840 -16.234 1.00 0.00 C ATOM 195 O GLU A 13 9.130 -13.505 -17.198 1.00 0.00 O ATOM 196 CB GLU A 13 12.125 -13.143 -16.909 1.00 0.00 C ATOM 197 CG GLU A 13 13.190 -12.723 -15.910 1.00 0.00 C ATOM 198 CD GLU A 13 13.924 -11.465 -16.335 1.00 0.00 C ATOM 199 OE1 GLU A 13 14.871 -11.575 -17.141 1.00 0.00 O ATOM 200 OE2 GLU A 13 13.551 -10.372 -15.860 1.00 0.00 O ATOM 0 H GLU A 13 10.997 -15.187 -18.313 1.00 0.00 H new ATOM 0 HA GLU A 13 11.638 -14.661 -15.467 1.00 0.00 H new ATOM 0 HB2 GLU A 13 12.607 -13.424 -17.845 1.00 0.00 H new ATOM 0 HB3 GLU A 13 11.484 -12.288 -17.125 1.00 0.00 H new ATOM 0 HG2 GLU A 13 12.726 -12.558 -14.938 1.00 0.00 H new ATOM 0 HG3 GLU A 13 13.908 -13.534 -15.787 1.00 0.00 H new ATOM 207 N TYR A 14 9.371 -13.821 -14.984 1.00 0.00 N ATOM 208 CA TYR A 14 8.013 -13.397 -14.664 1.00 0.00 C ATOM 209 C TYR A 14 8.005 -12.446 -13.471 1.00 0.00 C ATOM 210 O TYR A 14 8.359 -12.829 -12.356 1.00 0.00 O ATOM 211 CB TYR A 14 7.134 -14.613 -14.368 1.00 0.00 C ATOM 212 CG TYR A 14 7.173 -15.667 -15.451 1.00 0.00 C ATOM 213 CD1 TYR A 14 6.488 -15.489 -16.646 1.00 0.00 C ATOM 214 CD2 TYR A 14 7.896 -16.841 -15.279 1.00 0.00 C ATOM 215 CE1 TYR A 14 6.520 -16.450 -17.638 1.00 0.00 C ATOM 216 CE2 TYR A 14 7.935 -17.807 -16.266 1.00 0.00 C ATOM 217 CZ TYR A 14 7.245 -17.607 -17.443 1.00 0.00 C ATOM 218 OH TYR A 14 7.281 -18.566 -18.429 1.00 0.00 O ATOM 0 H TYR A 14 9.929 -14.094 -14.175 1.00 0.00 H new ATOM 0 HA TYR A 14 7.611 -12.868 -15.528 1.00 0.00 H new ATOM 0 HB2 TYR A 14 7.452 -15.060 -13.426 1.00 0.00 H new ATOM 0 HB3 TYR A 14 6.104 -14.282 -14.232 1.00 0.00 H new ATOM 0 HD1 TYR A 14 5.920 -14.584 -16.802 1.00 0.00 H new ATOM 0 HD2 TYR A 14 8.437 -17.001 -14.358 1.00 0.00 H new ATOM 0 HE1 TYR A 14 5.980 -16.296 -18.561 1.00 0.00 H new ATOM 0 HE2 TYR A 14 8.503 -18.714 -16.117 1.00 0.00 H new ATOM 0 HH TYR A 14 7.188 -18.138 -19.306 1.00 0.00 H new ATOM 228 N SER A 15 7.599 -11.205 -13.715 1.00 0.00 N ATOM 229 CA SER A 15 7.547 -10.197 -12.662 1.00 0.00 C ATOM 230 C SER A 15 6.160 -10.143 -12.029 1.00 0.00 C ATOM 231 O SER A 15 5.166 -10.520 -12.650 1.00 0.00 O ATOM 232 CB SER A 15 7.917 -8.823 -13.224 1.00 0.00 C ATOM 233 OG SER A 15 7.277 -8.591 -14.467 1.00 0.00 O ATOM 0 H SER A 15 7.301 -10.873 -14.632 1.00 0.00 H new ATOM 0 HA SER A 15 8.268 -10.474 -11.893 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.631 -8.047 -12.514 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.998 -8.757 -13.350 1.00 0.00 H new ATOM 0 HG SER A 15 7.528 -7.706 -14.804 1.00 0.00 H new ATOM 239 N VAL A 16 6.102 -9.673 -10.787 1.00 0.00 N ATOM 240 CA VAL A 16 4.838 -9.569 -10.068 1.00 0.00 C ATOM 241 C VAL A 16 4.464 -8.111 -9.821 1.00 0.00 C ATOM 242 O VAL A 16 5.333 -7.244 -9.724 1.00 0.00 O ATOM 243 CB VAL A 16 4.897 -10.307 -8.717 1.00 0.00 C ATOM 244 CG1 VAL A 16 4.953 -9.314 -7.567 1.00 0.00 C ATOM 245 CG2 VAL A 16 3.706 -11.242 -8.569 1.00 0.00 C ATOM 0 H VAL A 16 6.915 -9.358 -10.258 1.00 0.00 H new ATOM 0 HA VAL A 16 4.079 -10.035 -10.696 1.00 0.00 H new ATOM 0 HB VAL A 16 5.806 -10.907 -8.690 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.994 -9.854 -6.621 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.841 -8.690 -7.668 1.00 0.00 H new ATOM 0 HG13 VAL A 16 4.064 -8.684 -7.586 1.00 0.00 H new ATOM 0 HG21 VAL A 16 3.763 -11.755 -7.609 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.782 -10.665 -8.617 1.00 0.00 H new ATOM 0 HG23 VAL A 16 3.718 -11.976 -9.374 1.00 0.00 H new ATOM 255 N THR A 17 3.165 -7.848 -9.721 1.00 0.00 N ATOM 256 CA THR A 17 2.675 -6.495 -9.486 1.00 0.00 C ATOM 257 C THR A 17 1.270 -6.514 -8.896 1.00 0.00 C ATOM 258 O THR A 17 0.361 -5.860 -9.408 1.00 0.00 O ATOM 259 CB THR A 17 2.663 -5.669 -10.785 1.00 0.00 C ATOM 260 OG1 THR A 17 2.277 -6.496 -11.889 1.00 0.00 O ATOM 261 CG2 THR A 17 4.033 -5.064 -11.055 1.00 0.00 C ATOM 0 H THR A 17 2.433 -8.554 -9.799 1.00 0.00 H new ATOM 0 HA THR A 17 3.358 -6.030 -8.775 1.00 0.00 H new ATOM 0 HB THR A 17 1.942 -4.860 -10.667 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.270 -5.962 -12.711 1.00 0.00 H new ATOM 0 HG21 THR A 17 4.000 -4.485 -11.978 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.312 -4.412 -10.227 1.00 0.00 H new ATOM 0 HG23 THR A 17 4.770 -5.861 -11.153 1.00 0.00 H new ATOM 269 N THR A 18 1.097 -7.268 -7.815 1.00 0.00 N ATOM 270 CA THR A 18 -0.199 -7.372 -7.155 1.00 0.00 C ATOM 271 C THR A 18 -0.057 -7.244 -5.643 1.00 0.00 C ATOM 272 O THR A 18 -0.882 -6.610 -4.983 1.00 0.00 O ATOM 273 CB THR A 18 -0.891 -8.709 -7.483 1.00 0.00 C ATOM 274 OG1 THR A 18 -1.906 -8.986 -6.513 1.00 0.00 O ATOM 275 CG2 THR A 18 0.117 -9.848 -7.510 1.00 0.00 C ATOM 0 H THR A 18 1.838 -7.816 -7.378 1.00 0.00 H new ATOM 0 HA THR A 18 -0.812 -6.553 -7.531 1.00 0.00 H new ATOM 0 HB THR A 18 -1.346 -8.625 -8.470 1.00 0.00 H new ATOM 0 HG1 THR A 18 -2.342 -9.837 -6.729 1.00 0.00 H new ATOM 0 HG21 THR A 18 -0.395 -10.782 -7.744 1.00 0.00 H new ATOM 0 HG22 THR A 18 0.872 -9.648 -8.271 1.00 0.00 H new ATOM 0 HG23 THR A 18 0.598 -9.932 -6.535 1.00 0.00 H new ATOM 283 N LEU A 19 0.992 -7.849 -5.098 1.00 0.00 N ATOM 284 CA LEU A 19 1.243 -7.802 -3.662 1.00 0.00 C ATOM 285 C LEU A 19 2.638 -7.261 -3.369 1.00 0.00 C ATOM 286 O LEU A 19 3.316 -6.749 -4.261 1.00 0.00 O ATOM 287 CB LEU A 19 1.086 -9.196 -3.051 1.00 0.00 C ATOM 288 CG LEU A 19 2.147 -10.224 -3.445 1.00 0.00 C ATOM 289 CD1 LEU A 19 2.526 -11.084 -2.249 1.00 0.00 C ATOM 290 CD2 LEU A 19 1.649 -11.092 -4.591 1.00 0.00 C ATOM 0 H LEU A 19 1.683 -8.378 -5.629 1.00 0.00 H new ATOM 0 HA LEU A 19 0.512 -7.130 -3.213 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.089 -9.098 -1.965 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.108 -9.586 -3.333 1.00 0.00 H new ATOM 0 HG LEU A 19 3.036 -9.690 -3.780 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.282 -11.810 -2.548 1.00 0.00 H new ATOM 0 HD12 LEU A 19 2.925 -10.450 -1.457 1.00 0.00 H new ATOM 0 HD13 LEU A 19 1.643 -11.609 -1.884 1.00 0.00 H new ATOM 0 HD21 LEU A 19 2.417 -11.818 -4.858 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.745 -11.617 -4.283 1.00 0.00 H new ATOM 0 HD23 LEU A 19 1.428 -10.464 -5.454 1.00 0.00 H new ATOM 302 N SER A 20 3.062 -7.378 -2.115 1.00 0.00 N ATOM 303 CA SER A 20 4.377 -6.899 -1.705 1.00 0.00 C ATOM 304 C SER A 20 5.206 -8.032 -1.108 1.00 0.00 C ATOM 305 O SER A 20 4.662 -9.005 -0.587 1.00 0.00 O ATOM 306 CB SER A 20 4.235 -5.766 -0.687 1.00 0.00 C ATOM 307 OG SER A 20 2.872 -5.506 -0.400 1.00 0.00 O ATOM 0 H SER A 20 2.514 -7.800 -1.365 1.00 0.00 H new ATOM 0 HA SER A 20 4.891 -6.522 -2.589 1.00 0.00 H new ATOM 0 HB2 SER A 20 4.759 -6.030 0.231 1.00 0.00 H new ATOM 0 HB3 SER A 20 4.707 -4.863 -1.075 1.00 0.00 H new ATOM 0 HG SER A 20 2.808 -4.779 0.254 1.00 0.00 H new ATOM 313 N GLU A 21 6.526 -7.898 -1.190 1.00 0.00 N ATOM 314 CA GLU A 21 7.431 -8.911 -0.659 1.00 0.00 C ATOM 315 C GLU A 21 7.197 -9.121 0.834 1.00 0.00 C ATOM 316 O GLU A 21 7.520 -10.176 1.381 1.00 0.00 O ATOM 317 CB GLU A 21 8.886 -8.506 -0.906 1.00 0.00 C ATOM 318 CG GLU A 21 9.335 -7.314 -0.078 1.00 0.00 C ATOM 319 CD GLU A 21 10.844 -7.227 0.049 1.00 0.00 C ATOM 320 OE1 GLU A 21 11.540 -8.058 -0.571 1.00 0.00 O ATOM 321 OE2 GLU A 21 11.328 -6.328 0.767 1.00 0.00 O ATOM 0 H GLU A 21 6.992 -7.099 -1.619 1.00 0.00 H new ATOM 0 HA GLU A 21 7.229 -9.849 -1.176 1.00 0.00 H new ATOM 0 HB2 GLU A 21 9.533 -9.355 -0.686 1.00 0.00 H new ATOM 0 HB3 GLU A 21 9.015 -8.273 -1.963 1.00 0.00 H new ATOM 0 HG2 GLU A 21 8.959 -6.398 -0.533 1.00 0.00 H new ATOM 0 HG3 GLU A 21 8.894 -7.380 0.916 1.00 0.00 H new ATOM 328 N ASP A 22 6.633 -8.111 1.486 1.00 0.00 N ATOM 329 CA ASP A 22 6.354 -8.184 2.916 1.00 0.00 C ATOM 330 C ASP A 22 4.996 -8.829 3.172 1.00 0.00 C ATOM 331 O ASP A 22 4.521 -8.869 4.307 1.00 0.00 O ATOM 332 CB ASP A 22 6.395 -6.787 3.537 1.00 0.00 C ATOM 333 CG ASP A 22 6.814 -6.814 4.994 1.00 0.00 C ATOM 334 OD1 ASP A 22 7.881 -7.389 5.295 1.00 0.00 O ATOM 335 OD2 ASP A 22 6.075 -6.258 5.834 1.00 0.00 O ATOM 0 H ASP A 22 6.360 -7.232 1.047 1.00 0.00 H new ATOM 0 HA ASP A 22 7.123 -8.802 3.380 1.00 0.00 H new ATOM 0 HB2 ASP A 22 7.088 -6.162 2.974 1.00 0.00 H new ATOM 0 HB3 ASP A 22 5.411 -6.326 3.453 1.00 0.00 H new ATOM 340 N ASP A 23 4.376 -9.332 2.110 1.00 0.00 N ATOM 341 CA ASP A 23 3.072 -9.975 2.220 1.00 0.00 C ATOM 342 C ASP A 23 3.217 -11.426 2.668 1.00 0.00 C ATOM 343 O ASP A 23 2.941 -11.762 3.821 1.00 0.00 O ATOM 344 CB ASP A 23 2.335 -9.913 0.881 1.00 0.00 C ATOM 345 CG ASP A 23 0.832 -10.040 1.041 1.00 0.00 C ATOM 346 OD1 ASP A 23 0.390 -10.891 1.840 1.00 0.00 O ATOM 347 OD2 ASP A 23 0.099 -9.286 0.367 1.00 0.00 O ATOM 0 H ASP A 23 4.755 -9.307 1.164 1.00 0.00 H new ATOM 0 HA ASP A 23 2.492 -9.438 2.971 1.00 0.00 H new ATOM 0 HB2 ASP A 23 2.566 -8.970 0.386 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.697 -10.711 0.233 1.00 0.00 H new ATOM 352 N THR A 24 3.652 -12.283 1.750 1.00 0.00 N ATOM 353 CA THR A 24 3.832 -13.698 2.050 1.00 0.00 C ATOM 354 C THR A 24 4.244 -14.475 0.805 1.00 0.00 C ATOM 355 O THR A 24 3.871 -14.119 -0.313 1.00 0.00 O ATOM 356 CB THR A 24 2.546 -14.318 2.627 1.00 0.00 C ATOM 357 OG1 THR A 24 1.433 -13.450 2.387 1.00 0.00 O ATOM 358 CG2 THR A 24 2.688 -14.568 4.120 1.00 0.00 C ATOM 0 H THR A 24 3.886 -12.022 0.792 1.00 0.00 H new ATOM 0 HA THR A 24 4.624 -13.765 2.796 1.00 0.00 H new ATOM 0 HB THR A 24 2.375 -15.273 2.130 1.00 0.00 H new ATOM 0 HG1 THR A 24 0.619 -13.852 2.756 1.00 0.00 H new ATOM 0 HG21 THR A 24 1.767 -15.006 4.505 1.00 0.00 H new ATOM 0 HG22 THR A 24 3.517 -15.253 4.297 1.00 0.00 H new ATOM 0 HG23 THR A 24 2.882 -13.624 4.630 1.00 0.00 H new ATOM 366 N VAL A 25 5.014 -15.540 1.005 1.00 0.00 N ATOM 367 CA VAL A 25 5.475 -16.370 -0.101 1.00 0.00 C ATOM 368 C VAL A 25 4.300 -16.969 -0.865 1.00 0.00 C ATOM 369 O VAL A 25 4.197 -16.821 -2.084 1.00 0.00 O ATOM 370 CB VAL A 25 6.387 -17.508 0.393 1.00 0.00 C ATOM 371 CG1 VAL A 25 6.167 -18.766 -0.434 1.00 0.00 C ATOM 372 CG2 VAL A 25 7.846 -17.079 0.348 1.00 0.00 C ATOM 0 H VAL A 25 5.332 -15.848 1.924 1.00 0.00 H new ATOM 0 HA VAL A 25 6.045 -15.722 -0.767 1.00 0.00 H new ATOM 0 HB VAL A 25 6.130 -17.733 1.428 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.820 -19.559 -0.070 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.128 -19.082 -0.346 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.395 -18.559 -1.479 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.476 -17.895 0.701 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.119 -16.826 -0.676 1.00 0.00 H new ATOM 0 HG23 VAL A 25 7.989 -16.208 0.988 1.00 0.00 H new ATOM 382 N LEU A 26 3.416 -17.647 -0.142 1.00 0.00 N ATOM 383 CA LEU A 26 2.246 -18.270 -0.751 1.00 0.00 C ATOM 384 C LEU A 26 1.412 -17.241 -1.507 1.00 0.00 C ATOM 385 O LEU A 26 0.633 -17.589 -2.394 1.00 0.00 O ATOM 386 CB LEU A 26 1.390 -18.949 0.320 1.00 0.00 C ATOM 387 CG LEU A 26 0.028 -18.311 0.594 1.00 0.00 C ATOM 388 CD1 LEU A 26 -1.007 -18.813 -0.402 1.00 0.00 C ATOM 389 CD2 LEU A 26 -0.419 -18.600 2.020 1.00 0.00 C ATOM 0 H LEU A 26 3.487 -17.779 0.867 1.00 0.00 H new ATOM 0 HA LEU A 26 2.593 -19.021 -1.461 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.230 -19.986 0.025 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.955 -18.966 1.252 1.00 0.00 H new ATOM 0 HG LEU A 26 0.124 -17.232 0.475 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.970 -18.348 -0.191 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.693 -18.556 -1.414 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.100 -19.896 -0.315 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.390 -18.138 2.197 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.497 -19.677 2.165 1.00 0.00 H new ATOM 0 HD23 LEU A 26 0.310 -18.192 2.720 1.00 0.00 H new ATOM 401 N ASP A 27 1.584 -15.972 -1.152 1.00 0.00 N ATOM 402 CA ASP A 27 0.850 -14.891 -1.799 1.00 0.00 C ATOM 403 C ASP A 27 1.437 -14.581 -3.172 1.00 0.00 C ATOM 404 O ASP A 27 0.712 -14.493 -4.164 1.00 0.00 O ATOM 405 CB ASP A 27 0.873 -13.636 -0.925 1.00 0.00 C ATOM 406 CG ASP A 27 -0.136 -12.598 -1.377 1.00 0.00 C ATOM 407 OD1 ASP A 27 -0.138 -12.256 -2.578 1.00 0.00 O ATOM 408 OD2 ASP A 27 -0.922 -12.126 -0.528 1.00 0.00 O ATOM 0 H ASP A 27 2.225 -15.667 -0.420 1.00 0.00 H new ATOM 0 HA ASP A 27 -0.183 -15.214 -1.930 1.00 0.00 H new ATOM 0 HB2 ASP A 27 0.667 -13.913 0.109 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.872 -13.201 -0.945 1.00 0.00 H new ATOM 413 N LEU A 28 2.755 -14.416 -3.223 1.00 0.00 N ATOM 414 CA LEU A 28 3.440 -14.115 -4.475 1.00 0.00 C ATOM 415 C LEU A 28 3.685 -15.386 -5.281 1.00 0.00 C ATOM 416 O LEU A 28 3.341 -15.462 -6.461 1.00 0.00 O ATOM 417 CB LEU A 28 4.770 -13.412 -4.194 1.00 0.00 C ATOM 418 CG LEU A 28 5.187 -12.340 -5.202 1.00 0.00 C ATOM 419 CD1 LEU A 28 6.046 -11.280 -4.529 1.00 0.00 C ATOM 420 CD2 LEU A 28 5.932 -12.968 -6.371 1.00 0.00 C ATOM 0 H LEU A 28 3.370 -14.486 -2.412 1.00 0.00 H new ATOM 0 HA LEU A 28 2.802 -13.453 -5.060 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.714 -12.953 -3.207 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.555 -14.167 -4.150 1.00 0.00 H new ATOM 0 HG LEU A 28 4.287 -11.860 -5.586 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.333 -10.526 -5.261 1.00 0.00 H new ATOM 0 HD12 LEU A 28 5.480 -10.809 -3.726 1.00 0.00 H new ATOM 0 HD13 LEU A 28 6.941 -11.745 -4.117 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.221 -12.191 -7.078 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.825 -13.474 -6.004 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.285 -13.690 -6.870 1.00 0.00 H new ATOM 432 N LYS A 29 4.280 -16.385 -4.636 1.00 0.00 N ATOM 433 CA LYS A 29 4.568 -17.655 -5.291 1.00 0.00 C ATOM 434 C LYS A 29 3.340 -18.176 -6.031 1.00 0.00 C ATOM 435 O LYS A 29 3.431 -18.591 -7.187 1.00 0.00 O ATOM 436 CB LYS A 29 5.033 -18.688 -4.263 1.00 0.00 C ATOM 437 CG LYS A 29 6.536 -18.697 -4.046 1.00 0.00 C ATOM 438 CD LYS A 29 7.029 -17.366 -3.504 1.00 0.00 C ATOM 439 CE LYS A 29 7.496 -16.447 -4.623 1.00 0.00 C ATOM 440 NZ LYS A 29 8.795 -15.795 -4.299 1.00 0.00 N ATOM 0 H LYS A 29 4.572 -16.339 -3.660 1.00 0.00 H new ATOM 0 HA LYS A 29 5.364 -17.489 -6.016 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.538 -18.490 -3.312 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.715 -19.679 -4.587 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.799 -19.494 -3.351 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.039 -18.916 -4.988 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.229 -16.881 -2.944 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.849 -17.537 -2.806 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.597 -17.020 -5.545 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.741 -15.682 -4.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.385 -15.752 -5.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.622 -14.831 -3.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.287 -16.346 -3.567 1.00 0.00 H new ATOM 454 N GLN A 30 2.194 -18.151 -5.359 1.00 0.00 N ATOM 455 CA GLN A 30 0.949 -18.620 -5.955 1.00 0.00 C ATOM 456 C GLN A 30 0.637 -17.856 -7.237 1.00 0.00 C ATOM 457 O GLN A 30 0.104 -18.419 -8.194 1.00 0.00 O ATOM 458 CB GLN A 30 -0.205 -18.467 -4.962 1.00 0.00 C ATOM 459 CG GLN A 30 -0.694 -17.035 -4.813 1.00 0.00 C ATOM 460 CD GLN A 30 -1.833 -16.706 -5.758 1.00 0.00 C ATOM 461 OE1 GLN A 30 -2.284 -17.556 -6.526 1.00 0.00 O ATOM 462 NE2 GLN A 30 -2.304 -15.465 -5.707 1.00 0.00 N ATOM 0 H GLN A 30 2.102 -17.811 -4.402 1.00 0.00 H new ATOM 0 HA GLN A 30 1.069 -19.675 -6.203 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -1.036 -19.094 -5.284 1.00 0.00 H new ATOM 0 HB3 GLN A 30 0.114 -18.836 -3.987 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -1.020 -16.872 -3.786 1.00 0.00 H new ATOM 0 HG3 GLN A 30 0.135 -16.351 -4.997 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -1.900 -14.793 -5.055 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -3.070 -15.184 -6.320 1.00 0.00 H new ATOM 471 N PHE A 31 0.972 -16.570 -7.251 1.00 0.00 N ATOM 472 CA PHE A 31 0.727 -15.728 -8.416 1.00 0.00 C ATOM 473 C PHE A 31 1.629 -16.131 -9.578 1.00 0.00 C ATOM 474 O PHE A 31 1.152 -16.456 -10.666 1.00 0.00 O ATOM 475 CB PHE A 31 0.955 -14.256 -8.065 1.00 0.00 C ATOM 476 CG PHE A 31 0.431 -13.305 -9.102 1.00 0.00 C ATOM 477 CD1 PHE A 31 -0.909 -12.953 -9.125 1.00 0.00 C ATOM 478 CD2 PHE A 31 1.279 -12.761 -10.054 1.00 0.00 C ATOM 479 CE1 PHE A 31 -1.393 -12.078 -10.079 1.00 0.00 C ATOM 480 CE2 PHE A 31 0.800 -11.886 -11.010 1.00 0.00 C ATOM 481 CZ PHE A 31 -0.537 -11.543 -11.022 1.00 0.00 C ATOM 0 H PHE A 31 1.414 -16.088 -6.468 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.311 -15.865 -8.720 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.476 -14.040 -7.110 1.00 0.00 H new ATOM 0 HB3 PHE A 31 2.023 -14.084 -7.932 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.583 -13.367 -8.389 1.00 0.00 H new ATOM 0 HD2 PHE A 31 2.326 -13.024 -10.048 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -2.440 -11.813 -10.087 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.471 -11.471 -11.747 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.913 -10.858 -11.767 1.00 0.00 H new ATOM 491 N LEU A 32 2.936 -16.108 -9.340 1.00 0.00 N ATOM 492 CA LEU A 32 3.907 -16.470 -10.367 1.00 0.00 C ATOM 493 C LEU A 32 3.729 -17.923 -10.797 1.00 0.00 C ATOM 494 O LEU A 32 4.030 -18.287 -11.933 1.00 0.00 O ATOM 495 CB LEU A 32 5.330 -16.250 -9.851 1.00 0.00 C ATOM 496 CG LEU A 32 5.640 -16.829 -8.470 1.00 0.00 C ATOM 497 CD1 LEU A 32 6.294 -18.196 -8.599 1.00 0.00 C ATOM 498 CD2 LEU A 32 6.533 -15.881 -7.682 1.00 0.00 C ATOM 0 H LEU A 32 3.348 -15.843 -8.445 1.00 0.00 H new ATOM 0 HA LEU A 32 3.738 -15.831 -11.233 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.026 -16.683 -10.569 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.524 -15.178 -9.825 1.00 0.00 H new ATOM 0 HG LEU A 32 4.702 -16.947 -7.928 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.507 -18.592 -7.606 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.620 -18.874 -9.123 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.224 -18.103 -9.160 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.743 -16.309 -6.702 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.469 -15.731 -8.220 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.027 -14.923 -7.558 1.00 0.00 H new ATOM 510 N LYS A 33 3.234 -18.749 -9.881 1.00 0.00 N ATOM 511 CA LYS A 33 3.011 -20.161 -10.165 1.00 0.00 C ATOM 512 C LYS A 33 2.037 -20.336 -11.325 1.00 0.00 C ATOM 513 O LYS A 33 2.174 -21.255 -12.133 1.00 0.00 O ATOM 514 CB LYS A 33 2.473 -20.874 -8.922 1.00 0.00 C ATOM 515 CG LYS A 33 1.212 -21.680 -9.181 1.00 0.00 C ATOM 516 CD LYS A 33 1.514 -22.958 -9.944 1.00 0.00 C ATOM 517 CE LYS A 33 0.312 -23.421 -10.753 1.00 0.00 C ATOM 518 NZ LYS A 33 0.245 -24.906 -10.847 1.00 0.00 N ATOM 0 H LYS A 33 2.980 -18.464 -8.935 1.00 0.00 H new ATOM 0 HA LYS A 33 3.966 -20.604 -10.446 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.245 -21.538 -8.532 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.268 -20.134 -8.149 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.735 -21.926 -8.232 1.00 0.00 H new ATOM 0 HG3 LYS A 33 0.503 -21.076 -9.747 1.00 0.00 H new ATOM 0 HD2 LYS A 33 2.361 -22.794 -10.610 1.00 0.00 H new ATOM 0 HD3 LYS A 33 1.806 -23.741 -9.244 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.602 -23.045 -10.293 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.363 -22.996 -11.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -0.326 -25.176 -11.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.206 -25.291 -10.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -0.192 -25.289 -9.984 1.00 0.00 H new ATOM 532 N THR A 34 1.052 -19.447 -11.404 1.00 0.00 N ATOM 533 CA THR A 34 0.055 -19.502 -12.466 1.00 0.00 C ATOM 534 C THR A 34 0.682 -19.213 -13.825 1.00 0.00 C ATOM 535 O THR A 34 0.174 -19.646 -14.860 1.00 0.00 O ATOM 536 CB THR A 34 -1.088 -18.500 -12.217 1.00 0.00 C ATOM 537 OG1 THR A 34 -2.288 -18.957 -12.851 1.00 0.00 O ATOM 538 CG2 THR A 34 -0.723 -17.121 -12.745 1.00 0.00 C ATOM 0 H THR A 34 0.923 -18.680 -10.745 1.00 0.00 H new ATOM 0 HA THR A 34 -0.352 -20.513 -12.464 1.00 0.00 H new ATOM 0 HB THR A 34 -1.251 -18.429 -11.142 1.00 0.00 H new ATOM 0 HG1 THR A 34 -3.010 -18.315 -12.686 1.00 0.00 H new ATOM 0 HG21 THR A 34 -1.545 -16.430 -12.558 1.00 0.00 H new ATOM 0 HG22 THR A 34 0.174 -16.763 -12.239 1.00 0.00 H new ATOM 0 HG23 THR A 34 -0.535 -17.180 -13.817 1.00 0.00 H new ATOM 546 N LEU A 35 1.790 -18.479 -13.816 1.00 0.00 N ATOM 547 CA LEU A 35 2.488 -18.133 -15.049 1.00 0.00 C ATOM 548 C LEU A 35 3.613 -19.121 -15.334 1.00 0.00 C ATOM 549 O LEU A 35 4.078 -19.241 -16.468 1.00 0.00 O ATOM 550 CB LEU A 35 3.051 -16.713 -14.957 1.00 0.00 C ATOM 551 CG LEU A 35 2.081 -15.636 -14.470 1.00 0.00 C ATOM 552 CD1 LEU A 35 2.744 -14.268 -14.501 1.00 0.00 C ATOM 553 CD2 LEU A 35 0.815 -15.637 -15.315 1.00 0.00 C ATOM 0 H LEU A 35 2.224 -18.112 -12.969 1.00 0.00 H new ATOM 0 HA LEU A 35 1.772 -18.181 -15.869 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.912 -16.728 -14.288 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.418 -16.425 -15.942 1.00 0.00 H new ATOM 0 HG LEU A 35 1.806 -15.860 -13.439 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.039 -13.514 -14.151 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.620 -14.274 -13.853 1.00 0.00 H new ATOM 0 HD13 LEU A 35 3.049 -14.034 -15.521 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.136 -14.864 -14.954 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.072 -15.437 -16.355 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.329 -16.610 -15.241 1.00 0.00 H new ATOM 565 N THR A 36 4.047 -19.832 -14.297 1.00 0.00 N ATOM 566 CA THR A 36 5.117 -20.811 -14.435 1.00 0.00 C ATOM 567 C THR A 36 4.558 -22.226 -14.530 1.00 0.00 C ATOM 568 O THR A 36 5.214 -23.130 -15.047 1.00 0.00 O ATOM 569 CB THR A 36 6.102 -20.738 -13.253 1.00 0.00 C ATOM 570 OG1 THR A 36 5.462 -21.188 -12.054 1.00 0.00 O ATOM 571 CG2 THR A 36 6.611 -19.318 -13.060 1.00 0.00 C ATOM 0 H THR A 36 3.673 -19.747 -13.352 1.00 0.00 H new ATOM 0 HA THR A 36 5.649 -20.571 -15.356 1.00 0.00 H new ATOM 0 HB THR A 36 6.951 -21.384 -13.476 1.00 0.00 H new ATOM 0 HG1 THR A 36 6.095 -21.140 -11.307 1.00 0.00 H new ATOM 0 HG21 THR A 36 7.305 -19.291 -12.220 1.00 0.00 H new ATOM 0 HG22 THR A 36 7.123 -18.989 -13.964 1.00 0.00 H new ATOM 0 HG23 THR A 36 5.770 -18.655 -12.857 1.00 0.00 H new ATOM 579 N GLY A 37 3.342 -22.412 -14.026 1.00 0.00 N ATOM 580 CA GLY A 37 2.715 -23.721 -14.065 1.00 0.00 C ATOM 581 C GLY A 37 3.060 -24.564 -12.853 1.00 0.00 C ATOM 582 O GLY A 37 2.369 -25.537 -12.548 1.00 0.00 O ATOM 0 H GLY A 37 2.780 -21.680 -13.591 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.633 -23.601 -14.125 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.028 -24.244 -14.969 1.00 0.00 H new ATOM 586 N VAL A 38 4.132 -24.193 -12.161 1.00 0.00 N ATOM 587 CA VAL A 38 4.567 -24.922 -10.976 1.00 0.00 C ATOM 588 C VAL A 38 4.286 -24.126 -9.706 1.00 0.00 C ATOM 589 O VAL A 38 4.432 -22.904 -9.681 1.00 0.00 O ATOM 590 CB VAL A 38 6.070 -25.251 -11.040 1.00 0.00 C ATOM 591 CG1 VAL A 38 6.901 -23.987 -10.878 1.00 0.00 C ATOM 592 CG2 VAL A 38 6.436 -26.279 -9.980 1.00 0.00 C ATOM 0 H VAL A 38 4.716 -23.391 -12.401 1.00 0.00 H new ATOM 0 HA VAL A 38 3.999 -25.852 -10.951 1.00 0.00 H new ATOM 0 HB VAL A 38 6.289 -25.678 -12.019 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.960 -24.239 -10.926 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.658 -23.287 -11.677 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.681 -23.528 -9.914 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.502 -26.500 -10.040 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.202 -25.882 -8.992 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.866 -27.193 -10.148 1.00 0.00 H new ATOM 602 N LEU A 39 3.881 -24.827 -8.653 1.00 0.00 N ATOM 603 CA LEU A 39 3.580 -24.187 -7.377 1.00 0.00 C ATOM 604 C LEU A 39 4.809 -24.166 -6.474 1.00 0.00 C ATOM 605 O LEU A 39 5.790 -24.872 -6.704 1.00 0.00 O ATOM 606 CB LEU A 39 2.431 -24.915 -6.678 1.00 0.00 C ATOM 607 CG LEU A 39 2.280 -26.401 -7.005 1.00 0.00 C ATOM 608 CD1 LEU A 39 1.726 -26.584 -8.410 1.00 0.00 C ATOM 609 CD2 LEU A 39 3.614 -27.118 -6.857 1.00 0.00 C ATOM 0 H LEU A 39 3.753 -25.839 -8.657 1.00 0.00 H new ATOM 0 HA LEU A 39 3.282 -23.158 -7.576 1.00 0.00 H new ATOM 0 HB2 LEU A 39 2.564 -24.812 -5.601 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.499 -24.411 -6.934 1.00 0.00 H new ATOM 0 HG LEU A 39 1.575 -26.840 -6.299 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.625 -27.648 -8.626 1.00 0.00 H new ATOM 0 HD12 LEU A 39 0.749 -26.105 -8.481 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.406 -26.130 -9.131 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.487 -28.174 -7.094 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.341 -26.678 -7.539 1.00 0.00 H new ATOM 0 HD23 LEU A 39 3.970 -27.016 -5.832 1.00 0.00 H new ATOM 621 N PRO A 40 4.755 -23.338 -5.420 1.00 0.00 N ATOM 622 CA PRO A 40 5.854 -23.207 -4.460 1.00 0.00 C ATOM 623 C PRO A 40 6.022 -24.453 -3.597 1.00 0.00 C ATOM 624 O PRO A 40 7.115 -24.739 -3.110 1.00 0.00 O ATOM 625 CB PRO A 40 5.433 -22.013 -3.599 1.00 0.00 C ATOM 626 CG PRO A 40 3.948 -21.977 -3.702 1.00 0.00 C ATOM 627 CD PRO A 40 3.617 -22.466 -5.085 1.00 0.00 C ATOM 0 HA PRO A 40 6.815 -23.074 -4.957 1.00 0.00 H new ATOM 0 HB2 PRO A 40 5.755 -22.137 -2.565 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.878 -21.087 -3.962 1.00 0.00 H new ATOM 0 HG2 PRO A 40 3.489 -22.611 -2.944 1.00 0.00 H new ATOM 0 HG3 PRO A 40 3.570 -20.967 -3.544 1.00 0.00 H new ATOM 0 HD2 PRO A 40 2.674 -23.012 -5.103 1.00 0.00 H new ATOM 0 HD3 PRO A 40 3.522 -21.641 -5.791 1.00 0.00 H new ATOM 635 N GLU A 41 4.931 -25.190 -3.412 1.00 0.00 N ATOM 636 CA GLU A 41 4.958 -26.406 -2.607 1.00 0.00 C ATOM 637 C GLU A 41 5.914 -27.434 -3.206 1.00 0.00 C ATOM 638 O GLU A 41 6.376 -28.343 -2.517 1.00 0.00 O ATOM 639 CB GLU A 41 3.554 -27.003 -2.497 1.00 0.00 C ATOM 640 CG GLU A 41 3.017 -27.543 -3.811 1.00 0.00 C ATOM 641 CD GLU A 41 1.799 -28.427 -3.625 1.00 0.00 C ATOM 642 OE1 GLU A 41 1.185 -28.371 -2.539 1.00 0.00 O ATOM 643 OE2 GLU A 41 1.460 -29.174 -4.566 1.00 0.00 O ATOM 0 H GLU A 41 4.018 -24.966 -3.808 1.00 0.00 H new ATOM 0 HA GLU A 41 5.312 -26.143 -1.610 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.567 -27.808 -1.762 1.00 0.00 H new ATOM 0 HB3 GLU A 41 2.872 -26.240 -2.122 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.760 -26.709 -4.464 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.800 -28.111 -4.313 1.00 0.00 H new ATOM 650 N ARG A 42 6.206 -27.282 -4.494 1.00 0.00 N ATOM 651 CA ARG A 42 7.104 -28.197 -5.187 1.00 0.00 C ATOM 652 C ARG A 42 8.493 -27.583 -5.341 1.00 0.00 C ATOM 653 O ARG A 42 9.504 -28.275 -5.225 1.00 0.00 O ATOM 654 CB ARG A 42 6.539 -28.558 -6.562 1.00 0.00 C ATOM 655 CG ARG A 42 5.487 -29.654 -6.519 1.00 0.00 C ATOM 656 CD ARG A 42 6.121 -31.036 -6.533 1.00 0.00 C ATOM 657 NE ARG A 42 6.458 -31.497 -5.188 1.00 0.00 N ATOM 658 CZ ARG A 42 7.211 -32.564 -4.944 1.00 0.00 C ATOM 659 NH1 ARG A 42 7.704 -33.275 -5.948 1.00 0.00 N ATOM 660 NH2 ARG A 42 7.473 -32.920 -3.693 1.00 0.00 N ATOM 0 H ARG A 42 5.833 -26.534 -5.078 1.00 0.00 H new ATOM 0 HA ARG A 42 7.190 -29.104 -4.588 1.00 0.00 H new ATOM 0 HB2 ARG A 42 6.104 -27.666 -7.012 1.00 0.00 H new ATOM 0 HB3 ARG A 42 7.356 -28.876 -7.209 1.00 0.00 H new ATOM 0 HG2 ARG A 42 4.879 -29.541 -5.622 1.00 0.00 H new ATOM 0 HG3 ARG A 42 4.818 -29.551 -7.373 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.436 -31.745 -6.998 1.00 0.00 H new ATOM 0 HD3 ARG A 42 7.022 -31.015 -7.146 1.00 0.00 H new ATOM 0 HE ARG A 42 6.095 -30.971 -4.393 1.00 0.00 H new ATOM 0 HH11 ARG A 42 7.506 -33.003 -6.911 1.00 0.00 H new ATOM 0 HH12 ARG A 42 8.282 -34.094 -5.758 1.00 0.00 H new ATOM 0 HH21 ARG A 42 7.096 -32.374 -2.918 1.00 0.00 H new ATOM 0 HH22 ARG A 42 8.051 -33.739 -3.506 1.00 0.00 H new ATOM 674 N GLN A 43 8.532 -26.281 -5.603 1.00 0.00 N ATOM 675 CA GLN A 43 9.796 -25.575 -5.775 1.00 0.00 C ATOM 676 C GLN A 43 9.960 -24.487 -4.718 1.00 0.00 C ATOM 677 O GLN A 43 8.997 -23.813 -4.352 1.00 0.00 O ATOM 678 CB GLN A 43 9.876 -24.960 -7.173 1.00 0.00 C ATOM 679 CG GLN A 43 9.081 -25.724 -8.220 1.00 0.00 C ATOM 680 CD GLN A 43 9.463 -25.343 -9.636 1.00 0.00 C ATOM 681 OE1 GLN A 43 9.536 -26.195 -10.523 1.00 0.00 O ATOM 682 NE2 GLN A 43 9.710 -24.057 -9.857 1.00 0.00 N ATOM 0 H GLN A 43 7.704 -25.694 -5.701 1.00 0.00 H new ATOM 0 HA GLN A 43 10.605 -26.296 -5.657 1.00 0.00 H new ATOM 0 HB2 GLN A 43 9.513 -23.933 -7.131 1.00 0.00 H new ATOM 0 HB3 GLN A 43 10.920 -24.916 -7.482 1.00 0.00 H new ATOM 0 HG2 GLN A 43 9.238 -26.794 -8.081 1.00 0.00 H new ATOM 0 HG3 GLN A 43 8.018 -25.536 -8.072 1.00 0.00 H new ATOM 0 HE21 GLN A 43 9.638 -23.385 -9.093 1.00 0.00 H new ATOM 0 HE22 GLN A 43 9.972 -23.741 -10.791 1.00 0.00 H new ATOM 691 N LYS A 44 11.185 -24.321 -4.232 1.00 0.00 N ATOM 692 CA LYS A 44 11.476 -23.315 -3.218 1.00 0.00 C ATOM 693 C LYS A 44 12.375 -22.219 -3.781 1.00 0.00 C ATOM 694 O LYS A 44 13.459 -22.495 -4.298 1.00 0.00 O ATOM 695 CB LYS A 44 12.145 -23.963 -2.003 1.00 0.00 C ATOM 696 CG LYS A 44 13.568 -24.424 -2.266 1.00 0.00 C ATOM 697 CD LYS A 44 13.865 -25.742 -1.571 1.00 0.00 C ATOM 698 CE LYS A 44 15.273 -26.229 -1.876 1.00 0.00 C ATOM 699 NZ LYS A 44 15.354 -26.896 -3.205 1.00 0.00 N ATOM 0 H LYS A 44 11.993 -24.871 -4.524 1.00 0.00 H new ATOM 0 HA LYS A 44 10.533 -22.865 -2.909 1.00 0.00 H new ATOM 0 HB2 LYS A 44 12.149 -23.250 -1.178 1.00 0.00 H new ATOM 0 HB3 LYS A 44 11.549 -24.817 -1.683 1.00 0.00 H new ATOM 0 HG2 LYS A 44 13.723 -24.535 -3.339 1.00 0.00 H new ATOM 0 HG3 LYS A 44 14.268 -23.663 -1.920 1.00 0.00 H new ATOM 0 HD2 LYS A 44 13.746 -25.621 -0.494 1.00 0.00 H new ATOM 0 HD3 LYS A 44 13.142 -26.493 -1.889 1.00 0.00 H new ATOM 0 HE2 LYS A 44 15.962 -25.385 -1.851 1.00 0.00 H new ATOM 0 HE3 LYS A 44 15.592 -26.925 -1.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 16.330 -27.213 -3.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 14.715 -27.717 -3.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 15.074 -26.224 -3.948 1.00 0.00 H new ATOM 713 N LEU A 45 11.920 -20.975 -3.677 1.00 0.00 N ATOM 714 CA LEU A 45 12.684 -19.837 -4.175 1.00 0.00 C ATOM 715 C LEU A 45 13.969 -19.650 -3.373 1.00 0.00 C ATOM 716 O LEU A 45 13.952 -19.663 -2.142 1.00 0.00 O ATOM 717 CB LEU A 45 11.840 -18.563 -4.110 1.00 0.00 C ATOM 718 CG LEU A 45 10.925 -18.303 -5.308 1.00 0.00 C ATOM 719 CD1 LEU A 45 11.707 -18.400 -6.608 1.00 0.00 C ATOM 720 CD2 LEU A 45 9.759 -19.281 -5.310 1.00 0.00 C ATOM 0 H LEU A 45 11.026 -20.729 -3.252 1.00 0.00 H new ATOM 0 HA LEU A 45 12.951 -20.037 -5.213 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.225 -18.604 -3.211 1.00 0.00 H new ATOM 0 HB3 LEU A 45 12.511 -17.711 -3.999 1.00 0.00 H new ATOM 0 HG LEU A 45 10.526 -17.292 -5.223 1.00 0.00 H new ATOM 0 HD11 LEU A 45 11.040 -18.212 -7.449 1.00 0.00 H new ATOM 0 HD12 LEU A 45 12.507 -17.660 -6.607 1.00 0.00 H new ATOM 0 HD13 LEU A 45 12.136 -19.398 -6.701 1.00 0.00 H new ATOM 0 HD21 LEU A 45 9.118 -19.082 -6.169 1.00 0.00 H new ATOM 0 HD22 LEU A 45 10.139 -20.301 -5.370 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.183 -19.162 -4.392 1.00 0.00 H new ATOM 732 N LEU A 46 15.080 -19.475 -4.079 1.00 0.00 N ATOM 733 CA LEU A 46 16.374 -19.283 -3.434 1.00 0.00 C ATOM 734 C LEU A 46 16.305 -18.167 -2.396 1.00 0.00 C ATOM 735 O LEU A 46 15.514 -17.234 -2.525 1.00 0.00 O ATOM 736 CB LEU A 46 17.444 -18.959 -4.478 1.00 0.00 C ATOM 737 CG LEU A 46 18.598 -19.956 -4.589 1.00 0.00 C ATOM 738 CD1 LEU A 46 19.477 -19.624 -5.785 1.00 0.00 C ATOM 739 CD2 LEU A 46 19.419 -19.966 -3.308 1.00 0.00 C ATOM 0 H LEU A 46 15.111 -19.462 -5.098 1.00 0.00 H new ATOM 0 HA LEU A 46 16.640 -20.210 -2.926 1.00 0.00 H new ATOM 0 HB2 LEU A 46 16.961 -18.883 -5.452 1.00 0.00 H new ATOM 0 HB3 LEU A 46 17.859 -17.977 -4.251 1.00 0.00 H new ATOM 0 HG LEU A 46 18.180 -20.952 -4.737 1.00 0.00 H new ATOM 0 HD11 LEU A 46 20.293 -20.344 -5.848 1.00 0.00 H new ATOM 0 HD12 LEU A 46 18.882 -19.669 -6.697 1.00 0.00 H new ATOM 0 HD13 LEU A 46 19.887 -18.621 -5.668 1.00 0.00 H new ATOM 0 HD21 LEU A 46 20.236 -20.681 -3.405 1.00 0.00 H new ATOM 0 HD22 LEU A 46 19.827 -18.971 -3.130 1.00 0.00 H new ATOM 0 HD23 LEU A 46 18.783 -20.253 -2.471 1.00 0.00 H new ATOM 751 N GLY A 47 17.141 -18.270 -1.367 1.00 0.00 N ATOM 752 CA GLY A 47 17.160 -17.262 -0.324 1.00 0.00 C ATOM 753 C GLY A 47 17.680 -17.801 0.994 1.00 0.00 C ATOM 754 O GLY A 47 18.890 -17.917 1.192 1.00 0.00 O ATOM 0 H GLY A 47 17.805 -19.033 -1.238 1.00 0.00 H new ATOM 0 HA2 GLY A 47 17.783 -16.426 -0.642 1.00 0.00 H new ATOM 0 HA3 GLY A 47 16.152 -16.872 -0.181 1.00 0.00 H new ATOM 758 N LEU A 48 16.765 -18.131 1.899 1.00 0.00 N ATOM 759 CA LEU A 48 17.138 -18.660 3.206 1.00 0.00 C ATOM 760 C LEU A 48 16.006 -19.494 3.799 1.00 0.00 C ATOM 761 O LEU A 48 14.832 -19.261 3.511 1.00 0.00 O ATOM 762 CB LEU A 48 17.496 -17.517 4.157 1.00 0.00 C ATOM 763 CG LEU A 48 18.989 -17.237 4.338 1.00 0.00 C ATOM 764 CD1 LEU A 48 19.200 -15.933 5.091 1.00 0.00 C ATOM 765 CD2 LEU A 48 19.664 -18.390 5.065 1.00 0.00 C ATOM 0 H LEU A 48 15.760 -18.042 1.752 1.00 0.00 H new ATOM 0 HA LEU A 48 18.009 -19.303 3.076 1.00 0.00 H new ATOM 0 HB2 LEU A 48 17.017 -16.607 3.796 1.00 0.00 H new ATOM 0 HB3 LEU A 48 17.067 -17.736 5.135 1.00 0.00 H new ATOM 0 HG LEU A 48 19.443 -17.141 3.352 1.00 0.00 H new ATOM 0 HD11 LEU A 48 20.268 -15.750 5.210 1.00 0.00 H new ATOM 0 HD12 LEU A 48 18.752 -15.113 4.530 1.00 0.00 H new ATOM 0 HD13 LEU A 48 18.731 -16.000 6.073 1.00 0.00 H new ATOM 0 HD21 LEU A 48 20.725 -18.173 5.185 1.00 0.00 H new ATOM 0 HD22 LEU A 48 19.207 -18.519 6.046 1.00 0.00 H new ATOM 0 HD23 LEU A 48 19.544 -19.306 4.486 1.00 0.00 H new ATOM 777 N LYS A 49 16.367 -20.465 4.631 1.00 0.00 N ATOM 778 CA LYS A 49 15.383 -21.332 5.268 1.00 0.00 C ATOM 779 C LYS A 49 15.148 -20.915 6.716 1.00 0.00 C ATOM 780 O LYS A 49 16.094 -20.682 7.468 1.00 0.00 O ATOM 781 CB LYS A 49 15.847 -22.789 5.215 1.00 0.00 C ATOM 782 CG LYS A 49 16.432 -23.193 3.873 1.00 0.00 C ATOM 783 CD LYS A 49 16.074 -24.626 3.517 1.00 0.00 C ATOM 784 CE LYS A 49 16.588 -25.003 2.136 1.00 0.00 C ATOM 785 NZ LYS A 49 16.871 -26.461 2.028 1.00 0.00 N ATOM 0 H LYS A 49 17.334 -20.671 4.880 1.00 0.00 H new ATOM 0 HA LYS A 49 14.444 -21.236 4.723 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.594 -22.952 5.991 1.00 0.00 H new ATOM 0 HB3 LYS A 49 15.003 -23.439 5.444 1.00 0.00 H new ATOM 0 HG2 LYS A 49 16.063 -22.522 3.097 1.00 0.00 H new ATOM 0 HG3 LYS A 49 17.516 -23.084 3.900 1.00 0.00 H new ATOM 0 HD2 LYS A 49 16.495 -25.303 4.260 1.00 0.00 H new ATOM 0 HD3 LYS A 49 14.992 -24.751 3.550 1.00 0.00 H new ATOM 0 HE2 LYS A 49 15.851 -24.720 1.384 1.00 0.00 H new ATOM 0 HE3 LYS A 49 17.496 -24.440 1.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 17.219 -26.677 1.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 17.593 -26.727 2.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 15.999 -26.998 2.208 1.00 0.00 H new ATOM 799 N VAL A 50 13.879 -20.824 7.102 1.00 0.00 N ATOM 800 CA VAL A 50 13.519 -20.438 8.461 1.00 0.00 C ATOM 801 C VAL A 50 12.965 -21.625 9.242 1.00 0.00 C ATOM 802 O VAL A 50 12.146 -22.390 8.732 1.00 0.00 O ATOM 803 CB VAL A 50 12.476 -19.304 8.465 1.00 0.00 C ATOM 804 CG1 VAL A 50 11.181 -19.767 7.817 1.00 0.00 C ATOM 805 CG2 VAL A 50 12.227 -18.815 9.884 1.00 0.00 C ATOM 0 H VAL A 50 13.083 -21.012 6.492 1.00 0.00 H new ATOM 0 HA VAL A 50 14.432 -20.085 8.941 1.00 0.00 H new ATOM 0 HB VAL A 50 12.868 -18.471 7.881 1.00 0.00 H new ATOM 0 HG11 VAL A 50 10.457 -18.953 7.829 1.00 0.00 H new ATOM 0 HG12 VAL A 50 11.376 -20.064 6.787 1.00 0.00 H new ATOM 0 HG13 VAL A 50 10.781 -20.617 8.370 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.488 -18.014 9.868 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.856 -19.639 10.493 1.00 0.00 H new ATOM 0 HG23 VAL A 50 13.159 -18.441 10.309 1.00 0.00 H new ATOM 815 N LYS A 51 13.418 -21.773 10.482 1.00 0.00 N ATOM 816 CA LYS A 51 12.967 -22.866 11.336 1.00 0.00 C ATOM 817 C LYS A 51 13.276 -24.217 10.699 1.00 0.00 C ATOM 818 O LYS A 51 12.604 -25.211 10.971 1.00 0.00 O ATOM 819 CB LYS A 51 11.465 -22.747 11.602 1.00 0.00 C ATOM 820 CG LYS A 51 11.053 -21.402 12.174 1.00 0.00 C ATOM 821 CD LYS A 51 11.407 -21.290 13.647 1.00 0.00 C ATOM 822 CE LYS A 51 12.692 -20.502 13.853 1.00 0.00 C ATOM 823 NZ LYS A 51 12.442 -19.035 13.895 1.00 0.00 N ATOM 0 H LYS A 51 14.097 -21.150 10.918 1.00 0.00 H new ATOM 0 HA LYS A 51 13.503 -22.799 12.283 1.00 0.00 H new ATOM 0 HB2 LYS A 51 10.925 -22.917 10.670 1.00 0.00 H new ATOM 0 HB3 LYS A 51 11.164 -23.534 12.293 1.00 0.00 H new ATOM 0 HG2 LYS A 51 11.545 -20.603 11.619 1.00 0.00 H new ATOM 0 HG3 LYS A 51 9.979 -21.265 12.046 1.00 0.00 H new ATOM 0 HD2 LYS A 51 10.591 -20.804 14.182 1.00 0.00 H new ATOM 0 HD3 LYS A 51 11.518 -22.287 14.072 1.00 0.00 H new ATOM 0 HE2 LYS A 51 13.166 -20.816 14.783 1.00 0.00 H new ATOM 0 HE3 LYS A 51 13.390 -20.729 13.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 13.342 -18.533 14.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 12.013 -18.730 12.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 11.796 -18.815 14.680 1.00 0.00 H new ATOM 837 N GLY A 52 14.299 -24.246 9.849 1.00 0.00 N ATOM 838 CA GLY A 52 14.679 -25.480 9.188 1.00 0.00 C ATOM 839 C GLY A 52 13.756 -25.830 8.037 1.00 0.00 C ATOM 840 O GLY A 52 13.846 -26.918 7.468 1.00 0.00 O ATOM 0 H GLY A 52 14.871 -23.437 9.607 1.00 0.00 H new ATOM 0 HA2 GLY A 52 15.700 -25.390 8.817 1.00 0.00 H new ATOM 0 HA3 GLY A 52 14.674 -26.293 9.914 1.00 0.00 H new ATOM 844 N LYS A 53 12.865 -24.906 7.695 1.00 0.00 N ATOM 845 CA LYS A 53 11.920 -25.121 6.605 1.00 0.00 C ATOM 846 C LYS A 53 12.254 -24.232 5.412 1.00 0.00 C ATOM 847 O LYS A 53 12.710 -23.098 5.560 1.00 0.00 O ATOM 848 CB LYS A 53 10.492 -24.842 7.078 1.00 0.00 C ATOM 849 CG LYS A 53 9.909 -25.949 7.939 1.00 0.00 C ATOM 850 CD LYS A 53 8.897 -26.781 7.169 1.00 0.00 C ATOM 851 CE LYS A 53 8.627 -28.109 7.858 1.00 0.00 C ATOM 852 NZ LYS A 53 7.653 -27.966 8.976 1.00 0.00 N ATOM 0 H LYS A 53 12.777 -24.001 8.157 1.00 0.00 H new ATOM 0 HA LYS A 53 11.996 -26.162 6.292 1.00 0.00 H new ATOM 0 HB2 LYS A 53 10.481 -23.910 7.643 1.00 0.00 H new ATOM 0 HB3 LYS A 53 9.852 -24.695 6.208 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.712 -26.592 8.299 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.431 -25.515 8.817 1.00 0.00 H new ATOM 0 HD2 LYS A 53 7.965 -26.224 7.072 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.266 -26.962 6.160 1.00 0.00 H new ATOM 0 HE2 LYS A 53 8.243 -28.824 7.131 1.00 0.00 H new ATOM 0 HE3 LYS A 53 9.563 -28.516 8.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 7.496 -28.893 9.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 8.031 -27.303 9.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 6.752 -27.602 8.607 1.00 0.00 H new ATOM 866 N PRO A 54 12.023 -24.756 4.199 1.00 0.00 N ATOM 867 CA PRO A 54 12.290 -24.026 2.956 1.00 0.00 C ATOM 868 C PRO A 54 11.325 -22.864 2.747 1.00 0.00 C ATOM 869 O PRO A 54 10.529 -22.868 1.809 1.00 0.00 O ATOM 870 CB PRO A 54 12.094 -25.087 1.871 1.00 0.00 C ATOM 871 CG PRO A 54 11.163 -26.080 2.477 1.00 0.00 C ATOM 872 CD PRO A 54 11.481 -26.102 3.947 1.00 0.00 C ATOM 0 HA PRO A 54 13.282 -23.574 2.954 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.674 -24.653 0.964 1.00 0.00 H new ATOM 0 HB3 PRO A 54 13.041 -25.550 1.594 1.00 0.00 H new ATOM 0 HG2 PRO A 54 10.125 -25.796 2.307 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.301 -27.066 2.033 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.592 -26.296 4.548 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.206 -26.879 4.190 1.00 0.00 H new ATOM 880 N ALA A 55 11.400 -21.872 3.628 1.00 0.00 N ATOM 881 CA ALA A 55 10.534 -20.703 3.537 1.00 0.00 C ATOM 882 C ALA A 55 9.072 -21.112 3.399 1.00 0.00 C ATOM 883 O ALA A 55 8.549 -21.211 2.289 1.00 0.00 O ATOM 884 CB ALA A 55 10.952 -19.826 2.366 1.00 0.00 C ATOM 0 H ALA A 55 12.051 -21.855 4.413 1.00 0.00 H new ATOM 0 HA ALA A 55 10.638 -20.132 4.460 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.297 -18.957 2.310 1.00 0.00 H new ATOM 0 HB2 ALA A 55 11.981 -19.496 2.508 1.00 0.00 H new ATOM 0 HB3 ALA A 55 10.878 -20.396 1.440 1.00 0.00 H new ATOM 890 N GLU A 56 8.419 -21.350 4.532 1.00 0.00 N ATOM 891 CA GLU A 56 7.017 -21.750 4.535 1.00 0.00 C ATOM 892 C GLU A 56 6.179 -20.806 3.677 1.00 0.00 C ATOM 893 O GLU A 56 6.640 -19.735 3.284 1.00 0.00 O ATOM 894 CB GLU A 56 6.473 -21.775 5.965 1.00 0.00 C ATOM 895 CG GLU A 56 5.453 -22.874 6.210 1.00 0.00 C ATOM 896 CD GLU A 56 5.929 -23.897 7.222 1.00 0.00 C ATOM 897 OE1 GLU A 56 6.583 -23.498 8.208 1.00 0.00 O ATOM 898 OE2 GLU A 56 5.647 -25.099 7.029 1.00 0.00 O ATOM 0 H GLU A 56 8.838 -21.273 5.459 1.00 0.00 H new ATOM 0 HA GLU A 56 6.952 -22.752 4.112 1.00 0.00 H new ATOM 0 HB2 GLU A 56 7.304 -21.901 6.659 1.00 0.00 H new ATOM 0 HB3 GLU A 56 6.016 -20.811 6.188 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.522 -22.429 6.560 1.00 0.00 H new ATOM 0 HG3 GLU A 56 5.232 -23.376 5.268 1.00 0.00 H new ATOM 905 N ASN A 57 4.947 -21.212 3.391 1.00 0.00 N ATOM 906 CA ASN A 57 4.044 -20.404 2.579 1.00 0.00 C ATOM 907 C ASN A 57 3.682 -19.107 3.297 1.00 0.00 C ATOM 908 O ASN A 57 3.452 -18.077 2.662 1.00 0.00 O ATOM 909 CB ASN A 57 2.774 -21.191 2.253 1.00 0.00 C ATOM 910 CG ASN A 57 2.773 -21.724 0.833 1.00 0.00 C ATOM 911 OD1 ASN A 57 3.375 -21.134 -0.064 1.00 0.00 O ATOM 912 ND2 ASN A 57 2.094 -22.846 0.623 1.00 0.00 N ATOM 0 H ASN A 57 4.550 -22.096 3.709 1.00 0.00 H new ATOM 0 HA ASN A 57 4.556 -20.154 1.650 1.00 0.00 H new ATOM 0 HB2 ASN A 57 2.676 -22.023 2.951 1.00 0.00 H new ATOM 0 HB3 ASN A 57 1.905 -20.549 2.398 1.00 0.00 H new ATOM 0 HD21 ASN A 57 2.057 -23.252 -0.312 1.00 0.00 H new ATOM 0 HD22 ASN A 57 1.610 -23.301 1.397 1.00 0.00 H new ATOM 919 N ASP A 58 3.634 -19.164 4.623 1.00 0.00 N ATOM 920 CA ASP A 58 3.301 -17.994 5.428 1.00 0.00 C ATOM 921 C ASP A 58 4.510 -17.076 5.576 1.00 0.00 C ATOM 922 O ASP A 58 4.387 -15.939 6.033 1.00 0.00 O ATOM 923 CB ASP A 58 2.799 -18.424 6.807 1.00 0.00 C ATOM 924 CG ASP A 58 1.871 -17.399 7.430 1.00 0.00 C ATOM 925 OD1 ASP A 58 1.492 -16.438 6.728 1.00 0.00 O ATOM 926 OD2 ASP A 58 1.525 -17.558 8.619 1.00 0.00 O ATOM 0 H ASP A 58 3.822 -20.008 5.164 1.00 0.00 H new ATOM 0 HA ASP A 58 2.510 -17.444 4.918 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.277 -19.377 6.720 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.651 -18.587 7.467 1.00 0.00 H new ATOM 931 N VAL A 59 5.679 -17.576 5.189 1.00 0.00 N ATOM 932 CA VAL A 59 6.910 -16.801 5.279 1.00 0.00 C ATOM 933 C VAL A 59 6.937 -15.688 4.237 1.00 0.00 C ATOM 934 O VAL A 59 6.651 -15.916 3.062 1.00 0.00 O ATOM 935 CB VAL A 59 8.151 -17.694 5.092 1.00 0.00 C ATOM 936 CG1 VAL A 59 9.419 -16.854 5.086 1.00 0.00 C ATOM 937 CG2 VAL A 59 8.211 -18.757 6.178 1.00 0.00 C ATOM 0 H VAL A 59 5.799 -18.515 4.810 1.00 0.00 H new ATOM 0 HA VAL A 59 6.934 -16.362 6.276 1.00 0.00 H new ATOM 0 HB VAL A 59 8.073 -18.196 4.128 1.00 0.00 H new ATOM 0 HG11 VAL A 59 10.285 -17.503 4.953 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.375 -16.135 4.268 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.507 -16.321 6.033 1.00 0.00 H new ATOM 0 HG21 VAL A 59 9.094 -19.379 6.030 1.00 0.00 H new ATOM 0 HG22 VAL A 59 8.265 -18.276 7.155 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.317 -19.379 6.128 1.00 0.00 H new ATOM 947 N LYS A 60 7.281 -14.482 4.676 1.00 0.00 N ATOM 948 CA LYS A 60 7.347 -13.332 3.783 1.00 0.00 C ATOM 949 C LYS A 60 8.527 -13.455 2.823 1.00 0.00 C ATOM 950 O LYS A 60 9.485 -14.181 3.092 1.00 0.00 O ATOM 951 CB LYS A 60 7.467 -12.038 4.591 1.00 0.00 C ATOM 952 CG LYS A 60 6.773 -12.098 5.941 1.00 0.00 C ATOM 953 CD LYS A 60 6.142 -10.764 6.303 1.00 0.00 C ATOM 954 CE LYS A 60 4.649 -10.904 6.558 1.00 0.00 C ATOM 955 NZ LYS A 60 4.356 -11.211 7.985 1.00 0.00 N ATOM 0 H LYS A 60 7.519 -14.276 5.646 1.00 0.00 H new ATOM 0 HA LYS A 60 6.427 -13.305 3.199 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.522 -11.811 4.744 1.00 0.00 H new ATOM 0 HB3 LYS A 60 7.045 -11.217 4.011 1.00 0.00 H new ATOM 0 HG2 LYS A 60 6.005 -12.872 5.922 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.493 -12.381 6.709 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.627 -10.360 7.191 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.309 -10.051 5.496 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.144 -9.981 6.274 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.245 -11.695 5.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.328 -11.299 8.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.817 -12.105 8.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.718 -10.444 8.587 1.00 0.00 H new ATOM 969 N LEU A 61 8.451 -12.741 1.706 1.00 0.00 N ATOM 970 CA LEU A 61 9.514 -12.770 0.707 1.00 0.00 C ATOM 971 C LEU A 61 10.772 -12.083 1.230 1.00 0.00 C ATOM 972 O LEU A 61 11.805 -12.722 1.424 1.00 0.00 O ATOM 973 CB LEU A 61 9.048 -12.091 -0.582 1.00 0.00 C ATOM 974 CG LEU A 61 7.924 -12.795 -1.343 1.00 0.00 C ATOM 975 CD1 LEU A 61 8.204 -14.286 -1.449 1.00 0.00 C ATOM 976 CD2 LEU A 61 6.584 -12.550 -0.664 1.00 0.00 C ATOM 0 H LEU A 61 7.665 -12.135 1.469 1.00 0.00 H new ATOM 0 HA LEU A 61 9.752 -13.813 0.496 1.00 0.00 H new ATOM 0 HB2 LEU A 61 8.718 -11.081 -0.338 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.905 -11.994 -1.248 1.00 0.00 H new ATOM 0 HG LEU A 61 7.879 -12.381 -2.350 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.394 -14.771 -1.994 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.143 -14.443 -1.980 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.277 -14.715 -0.449 1.00 0.00 H new ATOM 0 HD21 LEU A 61 5.796 -13.059 -1.220 1.00 0.00 H new ATOM 0 HD22 LEU A 61 6.616 -12.936 0.355 1.00 0.00 H new ATOM 0 HD23 LEU A 61 6.378 -11.480 -0.640 1.00 0.00 H new ATOM 988 N GLY A 62 10.675 -10.777 1.460 1.00 0.00 N ATOM 989 CA GLY A 62 11.811 -10.026 1.960 1.00 0.00 C ATOM 990 C GLY A 62 12.381 -10.617 3.235 1.00 0.00 C ATOM 991 O GLY A 62 13.479 -10.256 3.657 1.00 0.00 O ATOM 0 H GLY A 62 9.830 -10.226 1.309 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.589 -9.998 1.197 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.508 -8.995 2.145 1.00 0.00 H new ATOM 995 N ALA A 63 11.632 -11.526 3.850 1.00 0.00 N ATOM 996 CA ALA A 63 12.069 -12.168 5.083 1.00 0.00 C ATOM 997 C ALA A 63 13.376 -12.926 4.874 1.00 0.00 C ATOM 998 O ALA A 63 14.390 -12.620 5.502 1.00 0.00 O ATOM 999 CB ALA A 63 10.989 -13.107 5.601 1.00 0.00 C ATOM 0 H ALA A 63 10.720 -11.834 3.514 1.00 0.00 H new ATOM 0 HA ALA A 63 12.245 -11.390 5.826 1.00 0.00 H new ATOM 0 HB1 ALA A 63 11.329 -13.580 6.522 1.00 0.00 H new ATOM 0 HB2 ALA A 63 10.079 -12.541 5.798 1.00 0.00 H new ATOM 0 HB3 ALA A 63 10.785 -13.874 4.854 1.00 0.00 H new ATOM 1005 N LEU A 64 13.345 -13.917 3.990 1.00 0.00 N ATOM 1006 CA LEU A 64 14.527 -14.720 3.699 1.00 0.00 C ATOM 1007 C LEU A 64 14.842 -14.704 2.206 1.00 0.00 C ATOM 1008 O LEU A 64 16.007 -14.716 1.806 1.00 0.00 O ATOM 1009 CB LEU A 64 14.320 -16.160 4.172 1.00 0.00 C ATOM 1010 CG LEU A 64 12.870 -16.589 4.399 1.00 0.00 C ATOM 1011 CD1 LEU A 64 12.128 -16.687 3.075 1.00 0.00 C ATOM 1012 CD2 LEU A 64 12.817 -17.916 5.142 1.00 0.00 C ATOM 0 H LEU A 64 12.514 -14.184 3.462 1.00 0.00 H new ATOM 0 HA LEU A 64 15.371 -14.286 4.235 1.00 0.00 H new ATOM 0 HB2 LEU A 64 14.766 -16.830 3.437 1.00 0.00 H new ATOM 0 HB3 LEU A 64 14.869 -16.298 5.104 1.00 0.00 H new ATOM 0 HG LEU A 64 12.379 -15.832 5.011 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.098 -16.994 3.257 1.00 0.00 H new ATOM 0 HD12 LEU A 64 12.136 -15.715 2.581 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.618 -17.422 2.437 1.00 0.00 H new ATOM 0 HD21 LEU A 64 11.778 -18.206 5.295 1.00 0.00 H new ATOM 0 HD22 LEU A 64 13.325 -18.682 4.556 1.00 0.00 H new ATOM 0 HD23 LEU A 64 13.311 -17.812 6.108 1.00 0.00 H new ATOM 1024 N LYS A 65 13.797 -14.674 1.386 1.00 0.00 N ATOM 1025 CA LYS A 65 13.961 -14.653 -0.062 1.00 0.00 C ATOM 1026 C LYS A 65 14.963 -13.582 -0.481 1.00 0.00 C ATOM 1027 O LYS A 65 16.150 -13.862 -0.654 1.00 0.00 O ATOM 1028 CB LYS A 65 12.614 -14.400 -0.745 1.00 0.00 C ATOM 1029 CG LYS A 65 11.554 -15.432 -0.399 1.00 0.00 C ATOM 1030 CD LYS A 65 11.857 -16.777 -1.036 1.00 0.00 C ATOM 1031 CE LYS A 65 11.948 -17.880 0.008 1.00 0.00 C ATOM 1032 NZ LYS A 65 11.688 -19.223 -0.580 1.00 0.00 N ATOM 0 H LYS A 65 12.827 -14.664 1.700 1.00 0.00 H new ATOM 0 HA LYS A 65 14.343 -15.625 -0.373 1.00 0.00 H new ATOM 0 HB2 LYS A 65 12.253 -13.411 -0.462 1.00 0.00 H new ATOM 0 HB3 LYS A 65 12.760 -14.389 -1.825 1.00 0.00 H new ATOM 0 HG2 LYS A 65 11.495 -15.546 0.683 1.00 0.00 H new ATOM 0 HG3 LYS A 65 10.579 -15.080 -0.736 1.00 0.00 H new ATOM 0 HD2 LYS A 65 11.079 -17.022 -1.759 1.00 0.00 H new ATOM 0 HD3 LYS A 65 12.796 -16.717 -1.586 1.00 0.00 H new ATOM 0 HE2 LYS A 65 12.938 -17.868 0.463 1.00 0.00 H new ATOM 0 HE3 LYS A 65 11.229 -17.687 0.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 12.033 -19.959 0.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.666 -19.345 -0.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 12.183 -19.305 -1.491 1.00 0.00 H new ATOM 1046 N LEU A 66 14.480 -12.355 -0.641 1.00 0.00 N ATOM 1047 CA LEU A 66 15.334 -11.242 -1.037 1.00 0.00 C ATOM 1048 C LEU A 66 14.511 -9.978 -1.265 1.00 0.00 C ATOM 1049 O LEU A 66 13.314 -9.943 -0.978 1.00 0.00 O ATOM 1050 CB LEU A 66 16.109 -11.595 -2.308 1.00 0.00 C ATOM 1051 CG LEU A 66 15.344 -12.400 -3.359 1.00 0.00 C ATOM 1052 CD1 LEU A 66 14.194 -11.581 -3.926 1.00 0.00 C ATOM 1053 CD2 LEU A 66 16.279 -12.850 -4.472 1.00 0.00 C ATOM 0 H LEU A 66 13.501 -12.106 -0.502 1.00 0.00 H new ATOM 0 HA LEU A 66 16.040 -11.053 -0.228 1.00 0.00 H new ATOM 0 HB2 LEU A 66 16.453 -10.669 -2.768 1.00 0.00 H new ATOM 0 HB3 LEU A 66 16.997 -12.159 -2.023 1.00 0.00 H new ATOM 0 HG LEU A 66 14.930 -13.287 -2.879 1.00 0.00 H new ATOM 0 HD11 LEU A 66 13.661 -12.170 -4.672 1.00 0.00 H new ATOM 0 HD12 LEU A 66 13.510 -11.309 -3.122 1.00 0.00 H new ATOM 0 HD13 LEU A 66 14.586 -10.676 -4.390 1.00 0.00 H new ATOM 0 HD21 LEU A 66 15.717 -13.421 -5.211 1.00 0.00 H new ATOM 0 HD22 LEU A 66 16.723 -11.977 -4.950 1.00 0.00 H new ATOM 0 HD23 LEU A 66 17.068 -13.475 -4.054 1.00 0.00 H new ATOM 1065 N LYS A 67 15.159 -8.942 -1.786 1.00 0.00 N ATOM 1066 CA LYS A 67 14.488 -7.676 -2.057 1.00 0.00 C ATOM 1067 C LYS A 67 13.404 -7.851 -3.116 1.00 0.00 C ATOM 1068 O LYS A 67 13.341 -8.863 -3.813 1.00 0.00 O ATOM 1069 CB LYS A 67 15.501 -6.626 -2.518 1.00 0.00 C ATOM 1070 CG LYS A 67 15.896 -5.642 -1.430 1.00 0.00 C ATOM 1071 CD LYS A 67 16.874 -6.262 -0.446 1.00 0.00 C ATOM 1072 CE LYS A 67 17.192 -5.311 0.698 1.00 0.00 C ATOM 1073 NZ LYS A 67 16.060 -5.203 1.659 1.00 0.00 N ATOM 0 H LYS A 67 16.149 -8.954 -2.029 1.00 0.00 H new ATOM 0 HA LYS A 67 14.018 -7.338 -1.133 1.00 0.00 H new ATOM 0 HB2 LYS A 67 16.396 -7.132 -2.881 1.00 0.00 H new ATOM 0 HB3 LYS A 67 15.082 -6.075 -3.360 1.00 0.00 H new ATOM 0 HG2 LYS A 67 16.345 -4.758 -1.883 1.00 0.00 H new ATOM 0 HG3 LYS A 67 15.005 -5.309 -0.898 1.00 0.00 H new ATOM 0 HD2 LYS A 67 16.454 -7.185 -0.047 1.00 0.00 H new ATOM 0 HD3 LYS A 67 17.794 -6.529 -0.965 1.00 0.00 H new ATOM 0 HE2 LYS A 67 18.082 -5.658 1.223 1.00 0.00 H new ATOM 0 HE3 LYS A 67 17.423 -4.324 0.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 16.351 -4.628 2.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 15.248 -4.753 1.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 15.789 -6.153 1.984 1.00 0.00 H new ATOM 1087 N PRO A 68 12.530 -6.841 -3.241 1.00 0.00 N ATOM 1088 CA PRO A 68 11.433 -6.860 -4.215 1.00 0.00 C ATOM 1089 C PRO A 68 11.931 -6.737 -5.651 1.00 0.00 C ATOM 1090 O PRO A 68 11.709 -7.625 -6.473 1.00 0.00 O ATOM 1091 CB PRO A 68 10.599 -5.635 -3.832 1.00 0.00 C ATOM 1092 CG PRO A 68 11.558 -4.719 -3.155 1.00 0.00 C ATOM 1093 CD PRO A 68 12.544 -5.604 -2.443 1.00 0.00 C ATOM 0 HA PRO A 68 10.878 -7.798 -4.186 1.00 0.00 H new ATOM 0 HB2 PRO A 68 10.158 -5.166 -4.712 1.00 0.00 H new ATOM 0 HB3 PRO A 68 9.777 -5.907 -3.170 1.00 0.00 H new ATOM 0 HG2 PRO A 68 12.061 -4.077 -3.878 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.043 -4.065 -2.452 1.00 0.00 H new ATOM 0 HD2 PRO A 68 13.537 -5.156 -2.413 1.00 0.00 H new ATOM 0 HD3 PRO A 68 12.246 -5.788 -1.411 1.00 0.00 H new ATOM 1101 N ASN A 69 12.606 -5.630 -5.946 1.00 0.00 N ATOM 1102 CA ASN A 69 13.136 -5.392 -7.284 1.00 0.00 C ATOM 1103 C ASN A 69 14.076 -6.517 -7.705 1.00 0.00 C ATOM 1104 O ASN A 69 14.311 -6.733 -8.895 1.00 0.00 O ATOM 1105 CB ASN A 69 13.872 -4.052 -7.332 1.00 0.00 C ATOM 1106 CG ASN A 69 14.819 -3.870 -6.161 1.00 0.00 C ATOM 1107 OD1 ASN A 69 15.653 -4.732 -5.883 1.00 0.00 O ATOM 1108 ND2 ASN A 69 14.693 -2.745 -5.468 1.00 0.00 N ATOM 0 H ASN A 69 12.799 -4.884 -5.277 1.00 0.00 H new ATOM 0 HA ASN A 69 12.298 -5.364 -7.980 1.00 0.00 H new ATOM 0 HB2 ASN A 69 14.433 -3.982 -8.264 1.00 0.00 H new ATOM 0 HB3 ASN A 69 13.144 -3.241 -7.337 1.00 0.00 H new ATOM 0 HD21 ASN A 69 15.302 -2.567 -4.669 1.00 0.00 H new ATOM 0 HD22 ASN A 69 13.988 -2.058 -5.734 1.00 0.00 H new ATOM 1115 N THR A 70 14.611 -7.234 -6.722 1.00 0.00 N ATOM 1116 CA THR A 70 15.526 -8.336 -6.989 1.00 0.00 C ATOM 1117 C THR A 70 14.782 -9.544 -7.547 1.00 0.00 C ATOM 1118 O THR A 70 13.622 -9.784 -7.208 1.00 0.00 O ATOM 1119 CB THR A 70 16.285 -8.758 -5.718 1.00 0.00 C ATOM 1120 OG1 THR A 70 17.078 -7.667 -5.236 1.00 0.00 O ATOM 1121 CG2 THR A 70 17.179 -9.958 -5.994 1.00 0.00 C ATOM 0 H THR A 70 14.426 -7.071 -5.732 1.00 0.00 H new ATOM 0 HA THR A 70 16.243 -7.979 -7.729 1.00 0.00 H new ATOM 0 HB THR A 70 15.553 -9.037 -4.960 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.675 -7.985 -4.527 1.00 0.00 H new ATOM 0 HG21 THR A 70 17.705 -10.238 -5.081 1.00 0.00 H new ATOM 0 HG22 THR A 70 16.569 -10.796 -6.333 1.00 0.00 H new ATOM 0 HG23 THR A 70 17.904 -9.702 -6.766 1.00 0.00 H new ATOM 1129 N LYS A 71 15.455 -10.305 -8.404 1.00 0.00 N ATOM 1130 CA LYS A 71 14.859 -11.490 -9.008 1.00 0.00 C ATOM 1131 C LYS A 71 15.223 -12.744 -8.219 1.00 0.00 C ATOM 1132 O LYS A 71 16.307 -12.832 -7.641 1.00 0.00 O ATOM 1133 CB LYS A 71 15.322 -11.636 -10.459 1.00 0.00 C ATOM 1134 CG LYS A 71 16.823 -11.812 -10.605 1.00 0.00 C ATOM 1135 CD LYS A 71 17.519 -10.484 -10.852 1.00 0.00 C ATOM 1136 CE LYS A 71 17.774 -10.255 -12.334 1.00 0.00 C ATOM 1137 NZ LYS A 71 19.068 -10.848 -12.772 1.00 0.00 N ATOM 0 H LYS A 71 16.415 -10.121 -8.696 1.00 0.00 H new ATOM 0 HA LYS A 71 13.776 -11.371 -8.989 1.00 0.00 H new ATOM 0 HB2 LYS A 71 14.819 -12.493 -10.907 1.00 0.00 H new ATOM 0 HB3 LYS A 71 15.012 -10.755 -11.021 1.00 0.00 H new ATOM 0 HG2 LYS A 71 17.226 -12.273 -9.703 1.00 0.00 H new ATOM 0 HG3 LYS A 71 17.032 -12.492 -11.431 1.00 0.00 H new ATOM 0 HD2 LYS A 71 16.907 -9.673 -10.457 1.00 0.00 H new ATOM 0 HD3 LYS A 71 18.465 -10.462 -10.311 1.00 0.00 H new ATOM 0 HE2 LYS A 71 16.960 -10.690 -12.914 1.00 0.00 H new ATOM 0 HE3 LYS A 71 17.776 -9.185 -12.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 19.100 -10.884 -13.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 19.854 -10.264 -12.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 19.156 -11.811 -12.390 1.00 0.00 H new ATOM 1151 N ILE A 72 14.312 -13.711 -8.201 1.00 0.00 N ATOM 1152 CA ILE A 72 14.540 -14.961 -7.486 1.00 0.00 C ATOM 1153 C ILE A 72 14.579 -16.145 -8.446 1.00 0.00 C ATOM 1154 O ILE A 72 14.021 -16.087 -9.541 1.00 0.00 O ATOM 1155 CB ILE A 72 13.450 -15.209 -6.426 1.00 0.00 C ATOM 1156 CG1 ILE A 72 12.454 -14.048 -6.406 1.00 0.00 C ATOM 1157 CG2 ILE A 72 14.079 -15.398 -5.054 1.00 0.00 C ATOM 1158 CD1 ILE A 72 11.402 -14.173 -5.326 1.00 0.00 C ATOM 0 H ILE A 72 13.410 -13.653 -8.673 1.00 0.00 H new ATOM 0 HA ILE A 72 15.505 -14.869 -6.989 1.00 0.00 H new ATOM 0 HB ILE A 72 12.912 -16.120 -6.686 1.00 0.00 H new ATOM 0 HG12 ILE A 72 12.999 -13.115 -6.265 1.00 0.00 H new ATOM 0 HG13 ILE A 72 11.961 -13.986 -7.376 1.00 0.00 H new ATOM 0 HG21 ILE A 72 13.296 -15.572 -4.316 1.00 0.00 H new ATOM 0 HG22 ILE A 72 14.753 -16.254 -5.077 1.00 0.00 H new ATOM 0 HG23 ILE A 72 14.639 -14.503 -4.784 1.00 0.00 H new ATOM 0 HD11 ILE A 72 10.731 -13.316 -5.371 1.00 0.00 H new ATOM 0 HD12 ILE A 72 10.831 -15.089 -5.478 1.00 0.00 H new ATOM 0 HD13 ILE A 72 11.885 -14.205 -4.349 1.00 0.00 H new ATOM 1170 N MET A 73 15.240 -17.219 -8.026 1.00 0.00 N ATOM 1171 CA MET A 73 15.348 -18.418 -8.848 1.00 0.00 C ATOM 1172 C MET A 73 14.414 -19.512 -8.340 1.00 0.00 C ATOM 1173 O MET A 73 14.251 -19.691 -7.134 1.00 0.00 O ATOM 1174 CB MET A 73 16.791 -18.927 -8.857 1.00 0.00 C ATOM 1175 CG MET A 73 17.591 -18.465 -10.063 1.00 0.00 C ATOM 1176 SD MET A 73 19.051 -19.481 -10.359 1.00 0.00 S ATOM 1177 CE MET A 73 19.536 -18.910 -11.987 1.00 0.00 C ATOM 0 H MET A 73 15.708 -17.283 -7.122 1.00 0.00 H new ATOM 0 HA MET A 73 15.055 -18.159 -9.865 1.00 0.00 H new ATOM 0 HB2 MET A 73 17.292 -18.591 -7.949 1.00 0.00 H new ATOM 0 HB3 MET A 73 16.783 -20.017 -8.832 1.00 0.00 H new ATOM 0 HG2 MET A 73 16.953 -18.486 -10.947 1.00 0.00 H new ATOM 0 HG3 MET A 73 17.898 -17.429 -9.916 1.00 0.00 H new ATOM 0 HE1 MET A 73 20.428 -19.447 -12.310 1.00 0.00 H new ATOM 0 HE2 MET A 73 18.726 -19.094 -12.693 1.00 0.00 H new ATOM 0 HE3 MET A 73 19.749 -17.842 -11.949 1.00 0.00 H new ATOM 1187 N MET A 74 13.803 -20.240 -9.269 1.00 0.00 N ATOM 1188 CA MET A 74 12.885 -21.317 -8.914 1.00 0.00 C ATOM 1189 C MET A 74 13.508 -22.679 -9.202 1.00 0.00 C ATOM 1190 O MET A 74 13.811 -23.003 -10.350 1.00 0.00 O ATOM 1191 CB MET A 74 11.571 -21.171 -9.684 1.00 0.00 C ATOM 1192 CG MET A 74 10.547 -20.296 -8.978 1.00 0.00 C ATOM 1193 SD MET A 74 8.979 -20.210 -9.864 1.00 0.00 S ATOM 1194 CE MET A 74 7.893 -21.045 -8.710 1.00 0.00 C ATOM 0 H MET A 74 13.927 -20.104 -10.272 1.00 0.00 H new ATOM 0 HA MET A 74 12.681 -21.249 -7.845 1.00 0.00 H new ATOM 0 HB2 MET A 74 11.780 -20.750 -10.667 1.00 0.00 H new ATOM 0 HB3 MET A 74 11.142 -22.160 -9.846 1.00 0.00 H new ATOM 0 HG2 MET A 74 10.372 -20.685 -7.975 1.00 0.00 H new ATOM 0 HG3 MET A 74 10.951 -19.290 -8.864 1.00 0.00 H new ATOM 0 HE1 MET A 74 6.855 -20.860 -8.988 1.00 0.00 H new ATOM 0 HE2 MET A 74 8.090 -22.117 -8.736 1.00 0.00 H new ATOM 0 HE3 MET A 74 8.072 -20.667 -7.703 1.00 0.00 H new ATOM 1204 N MET A 75 13.697 -23.472 -8.152 1.00 0.00 N ATOM 1205 CA MET A 75 14.283 -24.800 -8.294 1.00 0.00 C ATOM 1206 C MET A 75 13.249 -25.884 -8.007 1.00 0.00 C ATOM 1207 O MET A 75 12.796 -26.039 -6.874 1.00 0.00 O ATOM 1208 CB MET A 75 15.478 -24.956 -7.352 1.00 0.00 C ATOM 1209 CG MET A 75 16.408 -23.754 -7.345 1.00 0.00 C ATOM 1210 SD MET A 75 18.147 -24.222 -7.252 1.00 0.00 S ATOM 1211 CE MET A 75 18.587 -24.237 -8.988 1.00 0.00 C ATOM 0 H MET A 75 13.453 -23.218 -7.195 1.00 0.00 H new ATOM 0 HA MET A 75 14.624 -24.912 -9.323 1.00 0.00 H new ATOM 0 HB2 MET A 75 15.112 -25.128 -6.340 1.00 0.00 H new ATOM 0 HB3 MET A 75 16.044 -25.841 -7.641 1.00 0.00 H new ATOM 0 HG2 MET A 75 16.242 -23.166 -8.247 1.00 0.00 H new ATOM 0 HG3 MET A 75 16.162 -23.114 -6.498 1.00 0.00 H new ATOM 0 HE1 MET A 75 19.637 -24.510 -9.095 1.00 0.00 H new ATOM 0 HE2 MET A 75 17.968 -24.964 -9.514 1.00 0.00 H new ATOM 0 HE3 MET A 75 18.425 -23.247 -9.413 1.00 0.00 H new ATOM 1221 N GLY A 76 12.880 -26.633 -9.042 1.00 0.00 N ATOM 1222 CA GLY A 76 11.902 -27.692 -8.880 1.00 0.00 C ATOM 1223 C GLY A 76 11.361 -28.190 -10.206 1.00 0.00 C ATOM 1224 O GLY A 76 12.012 -28.052 -11.242 1.00 0.00 O ATOM 0 H GLY A 76 13.241 -26.525 -9.990 1.00 0.00 H new ATOM 0 HA2 GLY A 76 12.357 -28.523 -8.342 1.00 0.00 H new ATOM 0 HA3 GLY A 76 11.076 -27.329 -8.268 1.00 0.00 H new ATOM 1228 N THR A 77 10.166 -28.772 -10.175 1.00 0.00 N ATOM 1229 CA THR A 77 9.539 -29.295 -11.382 1.00 0.00 C ATOM 1230 C THR A 77 8.058 -28.939 -11.430 1.00 0.00 C ATOM 1231 O THR A 77 7.377 -28.933 -10.405 1.00 0.00 O ATOM 1232 CB THR A 77 9.691 -30.825 -11.477 1.00 0.00 C ATOM 1233 OG1 THR A 77 9.248 -31.283 -12.759 1.00 0.00 O ATOM 1234 CG2 THR A 77 8.893 -31.517 -10.382 1.00 0.00 C ATOM 0 H THR A 77 9.613 -28.893 -9.326 1.00 0.00 H new ATOM 0 HA THR A 77 10.049 -28.834 -12.228 1.00 0.00 H new ATOM 0 HB THR A 77 10.745 -31.072 -11.348 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.350 -32.256 -12.812 1.00 0.00 H new ATOM 0 HG21 THR A 77 9.016 -32.597 -10.469 1.00 0.00 H new ATOM 0 HG22 THR A 77 9.253 -31.189 -9.407 1.00 0.00 H new ATOM 0 HG23 THR A 77 7.838 -31.262 -10.484 1.00 0.00 H new ATOM 1242 N ARG A 78 7.564 -28.643 -12.628 1.00 0.00 N ATOM 1243 CA ARG A 78 6.163 -28.285 -12.810 1.00 0.00 C ATOM 1244 C ARG A 78 5.313 -29.526 -13.067 1.00 0.00 C ATOM 1245 O ARG A 78 5.832 -30.577 -13.443 1.00 0.00 O ATOM 1246 CB ARG A 78 6.012 -27.300 -13.971 1.00 0.00 C ATOM 1247 CG ARG A 78 6.391 -27.887 -15.320 1.00 0.00 C ATOM 1248 CD ARG A 78 7.666 -27.260 -15.862 1.00 0.00 C ATOM 1249 NE ARG A 78 7.674 -27.209 -17.321 1.00 0.00 N ATOM 1250 CZ ARG A 78 7.990 -28.244 -18.091 1.00 0.00 C ATOM 1251 NH1 ARG A 78 8.321 -29.405 -17.544 1.00 0.00 N ATOM 1252 NH2 ARG A 78 7.974 -28.120 -19.412 1.00 0.00 N ATOM 0 H ARG A 78 8.114 -28.644 -13.487 1.00 0.00 H new ATOM 0 HA ARG A 78 5.814 -27.811 -11.893 1.00 0.00 H new ATOM 0 HB2 ARG A 78 4.979 -26.955 -14.012 1.00 0.00 H new ATOM 0 HB3 ARG A 78 6.633 -26.425 -13.777 1.00 0.00 H new ATOM 0 HG2 ARG A 78 6.526 -28.964 -15.224 1.00 0.00 H new ATOM 0 HG3 ARG A 78 5.577 -27.730 -16.028 1.00 0.00 H new ATOM 0 HD2 ARG A 78 7.771 -26.251 -15.464 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.527 -27.831 -15.515 1.00 0.00 H new ATOM 0 HE ARG A 78 7.423 -26.330 -17.774 1.00 0.00 H new ATOM 0 HH11 ARG A 78 8.334 -29.505 -16.529 1.00 0.00 H new ATOM 0 HH12 ARG A 78 8.563 -30.198 -18.138 1.00 0.00 H new ATOM 0 HH21 ARG A 78 7.719 -27.229 -19.838 1.00 0.00 H new ATOM 0 HH22 ARG A 78 8.217 -28.916 -20.002 1.00 0.00 H new ATOM 1266 N GLU A 79 4.006 -29.396 -12.863 1.00 0.00 N ATOM 1267 CA GLU A 79 3.086 -30.507 -13.072 1.00 0.00 C ATOM 1268 C GLU A 79 2.284 -30.316 -14.356 1.00 0.00 C ATOM 1269 O GLU A 79 2.323 -29.250 -14.970 1.00 0.00 O ATOM 1270 CB GLU A 79 2.137 -30.644 -11.880 1.00 0.00 C ATOM 1271 CG GLU A 79 2.850 -30.819 -10.550 1.00 0.00 C ATOM 1272 CD GLU A 79 3.918 -31.894 -10.598 1.00 0.00 C ATOM 1273 OE1 GLU A 79 3.578 -33.078 -10.388 1.00 0.00 O ATOM 1274 OE2 GLU A 79 5.093 -31.552 -10.845 1.00 0.00 O ATOM 0 H GLU A 79 3.561 -28.532 -12.553 1.00 0.00 H new ATOM 0 HA GLU A 79 3.675 -31.420 -13.165 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.502 -29.759 -11.828 1.00 0.00 H new ATOM 0 HB3 GLU A 79 1.480 -31.498 -12.046 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.305 -29.872 -10.259 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.120 -31.071 -9.781 1.00 0.00 H new ATOM 1281 N GLU A 80 1.559 -31.356 -14.755 1.00 0.00 N ATOM 1282 CA GLU A 80 0.750 -31.303 -15.966 1.00 0.00 C ATOM 1283 C GLU A 80 -0.736 -31.404 -15.632 1.00 0.00 C ATOM 1284 O GLU A 80 -1.214 -32.447 -15.188 1.00 0.00 O ATOM 1285 CB GLU A 80 1.146 -32.430 -16.922 1.00 0.00 C ATOM 1286 CG GLU A 80 0.594 -32.259 -18.327 1.00 0.00 C ATOM 1287 CD GLU A 80 -0.868 -32.647 -18.430 1.00 0.00 C ATOM 1288 OE1 GLU A 80 -1.265 -33.640 -17.786 1.00 0.00 O ATOM 1289 OE2 GLU A 80 -1.615 -31.957 -19.155 1.00 0.00 O ATOM 0 H GLU A 80 1.516 -32.245 -14.257 1.00 0.00 H new ATOM 0 HA GLU A 80 0.932 -30.344 -16.452 1.00 0.00 H new ATOM 0 HB2 GLU A 80 2.233 -32.487 -16.972 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.796 -33.379 -16.516 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.713 -31.221 -18.636 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.177 -32.867 -19.019 1.00 0.00 H new ATOM 1296 N SER A 81 -1.461 -30.311 -15.849 1.00 0.00 N ATOM 1297 CA SER A 81 -2.891 -30.274 -15.568 1.00 0.00 C ATOM 1298 C SER A 81 -3.164 -30.592 -14.101 1.00 0.00 C ATOM 1299 O SER A 81 -4.177 -31.205 -13.767 1.00 0.00 O ATOM 1300 CB SER A 81 -3.635 -31.265 -16.464 1.00 0.00 C ATOM 1301 OG SER A 81 -5.028 -31.007 -16.464 1.00 0.00 O ATOM 0 H SER A 81 -1.081 -29.439 -16.219 1.00 0.00 H new ATOM 0 HA SER A 81 -3.251 -29.267 -15.777 1.00 0.00 H new ATOM 0 HB2 SER A 81 -3.250 -31.200 -17.482 1.00 0.00 H new ATOM 0 HB3 SER A 81 -3.450 -32.282 -16.118 1.00 0.00 H new ATOM 0 HG SER A 81 -5.370 -31.057 -15.547 1.00 0.00 H new TER 1307 SER A 81