USER MOD reduce.3.24.130724 H: found=0, std=0, add=679, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 677 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 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -139:sc= -0.367 (180deg=-3.69!) USER MOD Single : A 5 MET CE :methyl -119:sc= -6.55! (180deg=-17.2!) USER MOD Single : A 8 LYS NZ :NH3+ -101:sc= -0.464 (180deg=-2.38!) USER MOD Single : A 12 GLN : amide:sc= -1.32 K(o=-1.3,f=-2.8!) USER MOD Single : A 14 TYR OH : rot 180:sc= -0.647 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.295 USER MOD Single : A 18 THR OG1 : rot -35:sc= -0.688 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot -130:sc= -0.373 USER MOD Single : A 29 LYS NZ :NH3+ 152:sc= -0.14 (180deg=-0.682) USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 33 LYS NZ :NH3+ -154:sc= -0.156 (180deg=-0.771) USER MOD Single : A 34 THR OG1 : rot -91:sc= 0.809 USER MOD Single : A 36 THR OG1 : rot -68:sc= 0.363 USER MOD Single : A 43 GLN : amide:sc= -0.638 K(o=-0.64,f=-1.2) 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+ 166:sc= -0.0881 (180deg=-0.458) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN :FLIP amide:sc= -0.236 F(o=-0.75,f=-0.24) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 161:sc= -0.0524 (180deg=-0.379) USER MOD Single : A 69 ASN : amide:sc= -0.142 X(o=-0.14,f=-0.015) USER MOD Single : A 70 THR OG1 : rot -88:sc= 0.58 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 74 MET CE :methyl 163:sc= -6.27! (180deg=-6.54!) USER MOD Single : A 75 MET CE :methyl 157:sc= -2.43! (180deg=-2.71!) USER MOD Single : A 77 THR OG1 : rot 48:sc= -0.0573 USER MOD Single : A 81 SER OG : rot 24:sc= 0.778 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.988 1.607 -1.516 1.00 0.00 N ATOM 2 CA MET A 1 3.080 0.298 -0.881 1.00 0.00 C ATOM 3 C MET A 1 3.945 -0.648 -1.707 1.00 0.00 C ATOM 4 O MET A 1 3.872 -0.657 -2.936 1.00 0.00 O ATOM 5 CB MET A 1 1.684 -0.301 -0.694 1.00 0.00 C ATOM 6 CG MET A 1 0.746 0.585 0.110 1.00 0.00 C ATOM 7 SD MET A 1 -0.986 0.341 -0.330 1.00 0.00 S ATOM 8 CE MET A 1 -1.239 1.697 -1.473 1.00 0.00 C ATOM 0 H1 MET A 1 3.056 2.350 -0.791 1.00 0.00 H new ATOM 0 H2 MET A 1 3.765 1.717 -2.198 1.00 0.00 H new ATOM 0 H3 MET A 1 2.078 1.689 -2.012 1.00 0.00 H new ATOM 0 HA MET A 1 3.546 0.428 0.096 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.244 -0.488 -1.673 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.775 -1.266 -0.196 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.880 0.380 1.172 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.014 1.630 -0.049 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.267 1.681 -1.834 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.047 2.642 -0.965 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.556 1.594 -2.317 1.00 0.00 H new ATOM 18 N ALA A 2 4.764 -1.442 -1.025 1.00 0.00 N ATOM 19 CA ALA A 2 5.642 -2.392 -1.697 1.00 0.00 C ATOM 20 C ALA A 2 6.569 -1.684 -2.679 1.00 0.00 C ATOM 21 O ALA A 2 6.739 -2.124 -3.817 1.00 0.00 O ATOM 22 CB ALA A 2 4.821 -3.453 -2.415 1.00 0.00 C ATOM 0 H ALA A 2 4.838 -1.446 -0.008 1.00 0.00 H new ATOM 0 HA ALA A 2 6.259 -2.876 -0.940 1.00 0.00 H new ATOM 0 HB1 ALA A 2 5.490 -4.156 -2.912 1.00 0.00 H new ATOM 0 HB2 ALA A 2 4.205 -3.988 -1.692 1.00 0.00 H new ATOM 0 HB3 ALA A 2 4.179 -2.977 -3.156 1.00 0.00 H new ATOM 28 N LEU A 3 7.167 -0.585 -2.232 1.00 0.00 N ATOM 29 CA LEU A 3 8.078 0.185 -3.072 1.00 0.00 C ATOM 30 C LEU A 3 9.474 -0.430 -3.070 1.00 0.00 C ATOM 31 O LEU A 3 9.926 -1.000 -2.077 1.00 0.00 O ATOM 32 CB LEU A 3 8.147 1.635 -2.588 1.00 0.00 C ATOM 33 CG LEU A 3 6.807 2.355 -2.434 1.00 0.00 C ATOM 34 CD1 LEU A 3 6.233 2.123 -1.045 1.00 0.00 C ATOM 35 CD2 LEU A 3 6.968 3.844 -2.704 1.00 0.00 C ATOM 0 H LEU A 3 7.038 -0.207 -1.293 1.00 0.00 H new ATOM 0 HA LEU A 3 7.695 0.166 -4.092 1.00 0.00 H new ATOM 0 HB2 LEU A 3 8.659 1.652 -1.626 1.00 0.00 H new ATOM 0 HB3 LEU A 3 8.763 2.201 -3.287 1.00 0.00 H new ATOM 0 HG LEU A 3 6.110 1.946 -3.166 1.00 0.00 H new ATOM 0 HD11 LEU A 3 5.279 2.643 -0.954 1.00 0.00 H new ATOM 0 HD12 LEU A 3 6.081 1.055 -0.888 1.00 0.00 H new ATOM 0 HD13 LEU A 3 6.927 2.504 -0.296 1.00 0.00 H new ATOM 0 HD21 LEU A 3 6.004 4.341 -2.590 1.00 0.00 H new ATOM 0 HD22 LEU A 3 7.681 4.267 -1.996 1.00 0.00 H new ATOM 0 HD23 LEU A 3 7.334 3.992 -3.720 1.00 0.00 H new ATOM 47 N PRO A 4 10.175 -0.312 -4.207 1.00 0.00 N ATOM 48 CA PRO A 4 11.530 -0.849 -4.361 1.00 0.00 C ATOM 49 C PRO A 4 12.555 -0.080 -3.534 1.00 0.00 C ATOM 50 O PRO A 4 13.273 0.773 -4.056 1.00 0.00 O ATOM 51 CB PRO A 4 11.812 -0.678 -5.856 1.00 0.00 C ATOM 52 CG PRO A 4 10.935 0.450 -6.280 1.00 0.00 C ATOM 53 CD PRO A 4 9.698 0.354 -5.431 1.00 0.00 C ATOM 0 HA PRO A 4 11.602 -1.880 -4.015 1.00 0.00 H new ATOM 0 HB2 PRO A 4 12.863 -0.452 -6.037 1.00 0.00 H new ATOM 0 HB3 PRO A 4 11.581 -1.588 -6.409 1.00 0.00 H new ATOM 0 HG2 PRO A 4 11.434 1.408 -6.135 1.00 0.00 H new ATOM 0 HG3 PRO A 4 10.688 0.376 -7.339 1.00 0.00 H new ATOM 0 HD2 PRO A 4 9.281 1.338 -5.217 1.00 0.00 H new ATOM 0 HD3 PRO A 4 8.916 -0.224 -5.924 1.00 0.00 H new ATOM 61 N MET A 5 12.618 -0.387 -2.243 1.00 0.00 N ATOM 62 CA MET A 5 13.557 0.275 -1.345 1.00 0.00 C ATOM 63 C MET A 5 14.406 -0.748 -0.597 1.00 0.00 C ATOM 64 O MET A 5 14.079 -1.934 -0.563 1.00 0.00 O ATOM 65 CB MET A 5 12.805 1.158 -0.348 1.00 0.00 C ATOM 66 CG MET A 5 11.475 1.673 -0.874 1.00 0.00 C ATOM 67 SD MET A 5 10.599 2.690 0.330 1.00 0.00 S ATOM 68 CE MET A 5 9.722 3.816 -0.753 1.00 0.00 C ATOM 0 H MET A 5 12.030 -1.090 -1.795 1.00 0.00 H new ATOM 0 HA MET A 5 14.218 0.900 -1.946 1.00 0.00 H new ATOM 0 HB2 MET A 5 12.630 0.591 0.566 1.00 0.00 H new ATOM 0 HB3 MET A 5 13.434 2.007 -0.081 1.00 0.00 H new ATOM 0 HG2 MET A 5 11.648 2.256 -1.779 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.847 0.827 -1.154 1.00 0.00 H new ATOM 0 HE1 MET A 5 10.040 4.838 -0.550 1.00 0.00 H new ATOM 0 HE2 MET A 5 9.941 3.567 -1.791 1.00 0.00 H new ATOM 0 HE3 MET A 5 8.650 3.728 -0.578 1.00 0.00 H new ATOM 78 N ILE A 6 15.497 -0.280 0.001 1.00 0.00 N ATOM 79 CA ILE A 6 16.392 -1.155 0.748 1.00 0.00 C ATOM 80 C ILE A 6 16.329 -0.858 2.243 1.00 0.00 C ATOM 81 O ILE A 6 16.301 0.301 2.656 1.00 0.00 O ATOM 82 CB ILE A 6 17.849 -1.012 0.269 1.00 0.00 C ATOM 83 CG1 ILE A 6 18.014 -1.625 -1.123 1.00 0.00 C ATOM 84 CG2 ILE A 6 18.799 -1.669 1.259 1.00 0.00 C ATOM 85 CD1 ILE A 6 17.489 -0.745 -2.236 1.00 0.00 C ATOM 0 H ILE A 6 15.782 0.699 -0.017 1.00 0.00 H new ATOM 0 HA ILE A 6 16.058 -2.177 0.568 1.00 0.00 H new ATOM 0 HB ILE A 6 18.094 0.049 0.210 1.00 0.00 H new ATOM 0 HG12 ILE A 6 19.070 -1.828 -1.299 1.00 0.00 H new ATOM 0 HG13 ILE A 6 17.496 -2.583 -1.153 1.00 0.00 H new ATOM 0 HG21 ILE A 6 19.825 -1.560 0.907 1.00 0.00 H new ATOM 0 HG22 ILE A 6 18.697 -1.191 2.233 1.00 0.00 H new ATOM 0 HG23 ILE A 6 18.557 -2.728 1.348 1.00 0.00 H new ATOM 0 HD11 ILE A 6 17.639 -1.242 -3.194 1.00 0.00 H new ATOM 0 HD12 ILE A 6 16.425 -0.562 -2.084 1.00 0.00 H new ATOM 0 HD13 ILE A 6 18.024 0.204 -2.232 1.00 0.00 H new ATOM 97 N VAL A 7 16.308 -1.914 3.050 1.00 0.00 N ATOM 98 CA VAL A 7 16.251 -1.767 4.499 1.00 0.00 C ATOM 99 C VAL A 7 17.621 -1.992 5.129 1.00 0.00 C ATOM 100 O VAL A 7 18.319 -2.951 4.798 1.00 0.00 O ATOM 101 CB VAL A 7 15.243 -2.751 5.124 1.00 0.00 C ATOM 102 CG1 VAL A 7 15.482 -4.161 4.605 1.00 0.00 C ATOM 103 CG2 VAL A 7 15.331 -2.711 6.642 1.00 0.00 C ATOM 0 H VAL A 7 16.330 -2.880 2.725 1.00 0.00 H new ATOM 0 HA VAL A 7 15.925 -0.747 4.701 1.00 0.00 H new ATOM 0 HB VAL A 7 14.237 -2.448 4.833 1.00 0.00 H new ATOM 0 HG11 VAL A 7 14.761 -4.842 5.057 1.00 0.00 H new ATOM 0 HG12 VAL A 7 15.364 -4.175 3.521 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.492 -4.478 4.864 1.00 0.00 H new ATOM 0 HG21 VAL A 7 14.612 -3.412 7.067 1.00 0.00 H new ATOM 0 HG22 VAL A 7 16.337 -2.989 6.956 1.00 0.00 H new ATOM 0 HG23 VAL A 7 15.106 -1.704 6.993 1.00 0.00 H new ATOM 113 N LYS A 8 18.001 -1.102 6.039 1.00 0.00 N ATOM 114 CA LYS A 8 19.287 -1.203 6.718 1.00 0.00 C ATOM 115 C LYS A 8 19.149 -0.863 8.198 1.00 0.00 C ATOM 116 O LYS A 8 19.711 0.124 8.673 1.00 0.00 O ATOM 117 CB LYS A 8 20.307 -0.269 6.062 1.00 0.00 C ATOM 118 CG LYS A 8 20.294 -0.323 4.545 1.00 0.00 C ATOM 119 CD LYS A 8 21.365 0.573 3.945 1.00 0.00 C ATOM 120 CE LYS A 8 20.910 2.023 3.886 1.00 0.00 C ATOM 121 NZ LYS A 8 21.090 2.715 5.193 1.00 0.00 N ATOM 0 H LYS A 8 17.436 -0.302 6.324 1.00 0.00 H new ATOM 0 HA LYS A 8 19.636 -2.232 6.631 1.00 0.00 H new ATOM 0 HB2 LYS A 8 20.109 0.754 6.382 1.00 0.00 H new ATOM 0 HB3 LYS A 8 21.305 -0.527 6.418 1.00 0.00 H new ATOM 0 HG2 LYS A 8 20.451 -1.350 4.215 1.00 0.00 H new ATOM 0 HG3 LYS A 8 19.315 -0.017 4.178 1.00 0.00 H new ATOM 0 HD2 LYS A 8 22.276 0.500 4.539 1.00 0.00 H new ATOM 0 HD3 LYS A 8 21.610 0.226 2.941 1.00 0.00 H new ATOM 0 HE2 LYS A 8 21.474 2.549 3.116 1.00 0.00 H new ATOM 0 HE3 LYS A 8 19.860 2.063 3.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 20.176 2.766 5.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 21.770 2.186 5.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 21.450 3.677 5.030 1.00 0.00 H new ATOM 135 N TRP A 9 18.401 -1.688 8.922 1.00 0.00 N ATOM 136 CA TRP A 9 18.191 -1.475 10.350 1.00 0.00 C ATOM 137 C TRP A 9 19.364 -2.017 11.159 1.00 0.00 C ATOM 138 O TRP A 9 20.065 -2.928 10.721 1.00 0.00 O ATOM 139 CB TRP A 9 16.892 -2.144 10.801 1.00 0.00 C ATOM 140 CG TRP A 9 16.410 -1.666 12.137 1.00 0.00 C ATOM 141 CD1 TRP A 9 16.084 -2.439 13.215 1.00 0.00 C ATOM 142 CD2 TRP A 9 16.198 -0.307 12.536 1.00 0.00 C ATOM 143 NE1 TRP A 9 15.682 -1.642 14.260 1.00 0.00 N ATOM 144 CE2 TRP A 9 15.744 -0.331 13.869 1.00 0.00 C ATOM 145 CE3 TRP A 9 16.350 0.926 11.897 1.00 0.00 C ATOM 146 CZ2 TRP A 9 15.440 0.832 14.572 1.00 0.00 C ATOM 147 CZ3 TRP A 9 16.048 2.080 12.596 1.00 0.00 C ATOM 148 CH2 TRP A 9 15.598 2.026 13.922 1.00 0.00 C ATOM 0 H TRP A 9 17.930 -2.510 8.544 1.00 0.00 H new ATOM 0 HA TRP A 9 18.118 -0.402 10.525 1.00 0.00 H new ATOM 0 HB2 TRP A 9 16.118 -1.958 10.056 1.00 0.00 H new ATOM 0 HB3 TRP A 9 17.043 -3.223 10.842 1.00 0.00 H new ATOM 0 HD1 TRP A 9 16.135 -3.517 13.242 1.00 0.00 H new ATOM 0 HE1 TRP A 9 15.386 -1.973 15.178 1.00 0.00 H new ATOM 0 HE3 TRP A 9 16.697 0.977 10.876 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 15.092 0.793 15.594 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 16.161 3.039 12.112 1.00 0.00 H new ATOM 0 HH2 TRP A 9 15.371 2.945 14.442 1.00 0.00 H new ATOM 159 N GLY A 10 19.572 -1.450 12.344 1.00 0.00 N ATOM 160 CA GLY A 10 20.662 -1.890 13.195 1.00 0.00 C ATOM 161 C GLY A 10 20.576 -3.366 13.531 1.00 0.00 C ATOM 162 O GLY A 10 19.759 -3.775 14.355 1.00 0.00 O ATOM 0 H GLY A 10 19.005 -0.694 12.729 1.00 0.00 H new ATOM 0 HA2 GLY A 10 21.611 -1.688 12.698 1.00 0.00 H new ATOM 0 HA3 GLY A 10 20.656 -1.310 14.118 1.00 0.00 H new ATOM 166 N GLY A 11 21.420 -4.168 12.890 1.00 0.00 N ATOM 167 CA GLY A 11 21.419 -5.598 13.137 1.00 0.00 C ATOM 168 C GLY A 11 20.973 -6.395 11.927 1.00 0.00 C ATOM 169 O GLY A 11 21.414 -7.525 11.725 1.00 0.00 O ATOM 0 H GLY A 11 22.105 -3.853 12.203 1.00 0.00 H new ATOM 0 HA2 GLY A 11 22.421 -5.914 13.427 1.00 0.00 H new ATOM 0 HA3 GLY A 11 20.760 -5.818 13.976 1.00 0.00 H new ATOM 173 N GLN A 12 20.094 -5.805 11.123 1.00 0.00 N ATOM 174 CA GLN A 12 19.587 -6.469 9.928 1.00 0.00 C ATOM 175 C GLN A 12 19.551 -5.509 8.744 1.00 0.00 C ATOM 176 O GLN A 12 19.030 -4.399 8.850 1.00 0.00 O ATOM 177 CB GLN A 12 18.188 -7.031 10.187 1.00 0.00 C ATOM 178 CG GLN A 12 18.085 -7.841 11.469 1.00 0.00 C ATOM 179 CD GLN A 12 17.788 -6.980 12.681 1.00 0.00 C ATOM 180 OE1 GLN A 12 17.620 -5.765 12.567 1.00 0.00 O ATOM 181 NE2 GLN A 12 17.722 -7.606 13.850 1.00 0.00 N ATOM 0 H GLN A 12 19.719 -4.869 11.277 1.00 0.00 H new ATOM 0 HA GLN A 12 20.262 -7.290 9.685 1.00 0.00 H new ATOM 0 HB2 GLN A 12 17.477 -6.206 10.230 1.00 0.00 H new ATOM 0 HB3 GLN A 12 17.897 -7.660 9.346 1.00 0.00 H new ATOM 0 HG2 GLN A 12 17.301 -8.590 11.359 1.00 0.00 H new ATOM 0 HG3 GLN A 12 19.019 -8.379 11.630 1.00 0.00 H new ATOM 0 HE21 GLN A 12 17.868 -8.614 13.897 1.00 0.00 H new ATOM 0 HE22 GLN A 12 17.525 -7.079 14.701 1.00 0.00 H new ATOM 190 N GLU A 13 20.109 -5.943 7.619 1.00 0.00 N ATOM 191 CA GLU A 13 20.142 -5.119 6.416 1.00 0.00 C ATOM 192 C GLU A 13 19.708 -5.924 5.194 1.00 0.00 C ATOM 193 O GLU A 13 20.538 -6.498 4.488 1.00 0.00 O ATOM 194 CB GLU A 13 21.547 -4.555 6.195 1.00 0.00 C ATOM 195 CG GLU A 13 21.683 -3.743 4.918 1.00 0.00 C ATOM 196 CD GLU A 13 22.747 -2.667 5.021 1.00 0.00 C ATOM 197 OE1 GLU A 13 22.955 -2.145 6.137 1.00 0.00 O ATOM 198 OE2 GLU A 13 23.370 -2.347 3.988 1.00 0.00 O ATOM 0 H GLU A 13 20.544 -6.860 7.515 1.00 0.00 H new ATOM 0 HA GLU A 13 19.444 -4.293 6.553 1.00 0.00 H new ATOM 0 HB2 GLU A 13 21.815 -3.927 7.045 1.00 0.00 H new ATOM 0 HB3 GLU A 13 22.260 -5.379 6.169 1.00 0.00 H new ATOM 0 HG2 GLU A 13 21.926 -4.411 4.091 1.00 0.00 H new ATOM 0 HG3 GLU A 13 20.725 -3.280 4.683 1.00 0.00 H new ATOM 205 N TYR A 14 18.403 -5.961 4.951 1.00 0.00 N ATOM 206 CA TYR A 14 17.857 -6.697 3.817 1.00 0.00 C ATOM 207 C TYR A 14 17.527 -5.754 2.664 1.00 0.00 C ATOM 208 O TYR A 14 17.829 -4.562 2.716 1.00 0.00 O ATOM 209 CB TYR A 14 16.603 -7.466 4.237 1.00 0.00 C ATOM 210 CG TYR A 14 16.766 -8.231 5.531 1.00 0.00 C ATOM 211 CD1 TYR A 14 17.791 -9.155 5.690 1.00 0.00 C ATOM 212 CD2 TYR A 14 15.896 -8.028 6.595 1.00 0.00 C ATOM 213 CE1 TYR A 14 17.944 -9.856 6.870 1.00 0.00 C ATOM 214 CE2 TYR A 14 16.042 -8.724 7.779 1.00 0.00 C ATOM 215 CZ TYR A 14 17.067 -9.637 7.912 1.00 0.00 C ATOM 216 OH TYR A 14 17.216 -10.333 9.090 1.00 0.00 O ATOM 0 H TYR A 14 17.703 -5.490 5.524 1.00 0.00 H new ATOM 0 HA TYR A 14 18.613 -7.406 3.478 1.00 0.00 H new ATOM 0 HB2 TYR A 14 15.775 -6.765 4.341 1.00 0.00 H new ATOM 0 HB3 TYR A 14 16.332 -8.163 3.444 1.00 0.00 H new ATOM 0 HD1 TYR A 14 18.480 -9.328 4.877 1.00 0.00 H new ATOM 0 HD2 TYR A 14 15.092 -7.314 6.495 1.00 0.00 H new ATOM 0 HE1 TYR A 14 18.746 -10.572 6.976 1.00 0.00 H new ATOM 0 HE2 TYR A 14 15.357 -8.554 8.596 1.00 0.00 H new ATOM 0 HH TYR A 14 16.518 -10.061 9.721 1.00 0.00 H new ATOM 226 N SER A 15 16.904 -6.298 1.623 1.00 0.00 N ATOM 227 CA SER A 15 16.535 -5.508 0.454 1.00 0.00 C ATOM 228 C SER A 15 15.052 -5.672 0.134 1.00 0.00 C ATOM 229 O SER A 15 14.575 -6.783 -0.101 1.00 0.00 O ATOM 230 CB SER A 15 17.378 -5.920 -0.754 1.00 0.00 C ATOM 231 OG SER A 15 18.737 -6.096 -0.391 1.00 0.00 O ATOM 0 H SER A 15 16.644 -7.283 1.565 1.00 0.00 H new ATOM 0 HA SER A 15 16.727 -4.459 0.680 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.988 -6.847 -1.175 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.301 -5.160 -1.531 1.00 0.00 H new ATOM 0 HG SER A 15 19.255 -6.361 -1.180 1.00 0.00 H new ATOM 237 N VAL A 16 14.328 -4.558 0.126 1.00 0.00 N ATOM 238 CA VAL A 16 12.900 -4.577 -0.167 1.00 0.00 C ATOM 239 C VAL A 16 12.619 -4.053 -1.571 1.00 0.00 C ATOM 240 O VAL A 16 11.618 -3.375 -1.805 1.00 0.00 O ATOM 241 CB VAL A 16 12.107 -3.735 0.851 1.00 0.00 C ATOM 242 CG1 VAL A 16 10.621 -4.045 0.759 1.00 0.00 C ATOM 243 CG2 VAL A 16 12.625 -3.978 2.261 1.00 0.00 C ATOM 0 H VAL A 16 14.707 -3.631 0.319 1.00 0.00 H new ATOM 0 HA VAL A 16 12.577 -5.616 -0.099 1.00 0.00 H new ATOM 0 HB VAL A 16 12.248 -2.681 0.613 1.00 0.00 H new ATOM 0 HG11 VAL A 16 10.078 -3.441 1.485 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.263 -3.815 -0.244 1.00 0.00 H new ATOM 0 HG13 VAL A 16 10.456 -5.102 0.970 1.00 0.00 H new ATOM 0 HG21 VAL A 16 12.054 -3.376 2.967 1.00 0.00 H new ATOM 0 HG22 VAL A 16 12.515 -5.033 2.512 1.00 0.00 H new ATOM 0 HG23 VAL A 16 13.678 -3.700 2.315 1.00 0.00 H new ATOM 253 N THR A 17 13.511 -4.372 -2.504 1.00 0.00 N ATOM 254 CA THR A 17 13.360 -3.933 -3.886 1.00 0.00 C ATOM 255 C THR A 17 12.116 -4.541 -4.523 1.00 0.00 C ATOM 256 O THR A 17 11.472 -5.415 -3.943 1.00 0.00 O ATOM 257 CB THR A 17 14.592 -4.308 -4.731 1.00 0.00 C ATOM 258 OG1 THR A 17 14.441 -3.809 -6.065 1.00 0.00 O ATOM 259 CG2 THR A 17 14.784 -5.817 -4.768 1.00 0.00 C ATOM 0 H THR A 17 14.345 -4.932 -2.328 1.00 0.00 H new ATOM 0 HA THR A 17 13.260 -2.848 -3.865 1.00 0.00 H new ATOM 0 HB THR A 17 15.471 -3.857 -4.271 1.00 0.00 H new ATOM 0 HG1 THR A 17 15.229 -4.050 -6.596 1.00 0.00 H new ATOM 0 HG21 THR A 17 15.660 -6.058 -5.370 1.00 0.00 H new ATOM 0 HG22 THR A 17 14.927 -6.191 -3.754 1.00 0.00 H new ATOM 0 HG23 THR A 17 13.903 -6.285 -5.206 1.00 0.00 H new ATOM 267 N THR A 18 11.782 -4.073 -5.722 1.00 0.00 N ATOM 268 CA THR A 18 10.614 -4.570 -6.438 1.00 0.00 C ATOM 269 C THR A 18 10.990 -5.708 -7.380 1.00 0.00 C ATOM 270 O THR A 18 10.123 -6.339 -7.986 1.00 0.00 O ATOM 271 CB THR A 18 9.935 -3.451 -7.250 1.00 0.00 C ATOM 272 OG1 THR A 18 8.676 -3.908 -7.756 1.00 0.00 O ATOM 273 CG2 THR A 18 10.819 -3.006 -8.404 1.00 0.00 C ATOM 0 H THR A 18 12.304 -3.350 -6.217 1.00 0.00 H new ATOM 0 HA THR A 18 9.916 -4.939 -5.686 1.00 0.00 H new ATOM 0 HB THR A 18 9.773 -2.600 -6.588 1.00 0.00 H new ATOM 0 HG1 THR A 18 8.740 -4.859 -7.982 1.00 0.00 H new ATOM 0 HG21 THR A 18 10.318 -2.215 -8.962 1.00 0.00 H new ATOM 0 HG22 THR A 18 11.765 -2.631 -8.014 1.00 0.00 H new ATOM 0 HG23 THR A 18 11.009 -3.852 -9.064 1.00 0.00 H new ATOM 281 N LEU A 19 12.288 -5.967 -7.500 1.00 0.00 N ATOM 282 CA LEU A 19 12.779 -7.031 -8.368 1.00 0.00 C ATOM 283 C LEU A 19 12.562 -6.680 -9.836 1.00 0.00 C ATOM 284 O LEU A 19 12.084 -5.593 -10.161 1.00 0.00 O ATOM 285 CB LEU A 19 12.078 -8.350 -8.038 1.00 0.00 C ATOM 286 CG LEU A 19 11.838 -8.630 -6.554 1.00 0.00 C ATOM 287 CD1 LEU A 19 10.909 -9.821 -6.379 1.00 0.00 C ATOM 288 CD2 LEU A 19 13.158 -8.871 -5.837 1.00 0.00 C ATOM 0 H LEU A 19 13.019 -5.454 -7.007 1.00 0.00 H new ATOM 0 HA LEU A 19 13.849 -7.142 -8.195 1.00 0.00 H new ATOM 0 HB2 LEU A 19 11.116 -8.365 -8.550 1.00 0.00 H new ATOM 0 HB3 LEU A 19 12.671 -9.166 -8.450 1.00 0.00 H new ATOM 0 HG LEU A 19 11.361 -7.756 -6.111 1.00 0.00 H new ATOM 0 HD11 LEU A 19 10.750 -10.005 -5.317 1.00 0.00 H new ATOM 0 HD12 LEU A 19 9.953 -9.610 -6.858 1.00 0.00 H new ATOM 0 HD13 LEU A 19 11.357 -10.703 -6.837 1.00 0.00 H new ATOM 0 HD21 LEU A 19 12.968 -9.069 -4.782 1.00 0.00 H new ATOM 0 HD22 LEU A 19 13.662 -9.729 -6.282 1.00 0.00 H new ATOM 0 HD23 LEU A 19 13.790 -7.988 -5.933 1.00 0.00 H new ATOM 300 N SER A 20 12.913 -7.609 -10.720 1.00 0.00 N ATOM 301 CA SER A 20 12.758 -7.397 -12.154 1.00 0.00 C ATOM 302 C SER A 20 11.288 -7.460 -12.557 1.00 0.00 C ATOM 303 O SER A 20 10.463 -8.032 -11.845 1.00 0.00 O ATOM 304 CB SER A 20 13.558 -8.441 -12.935 1.00 0.00 C ATOM 305 OG SER A 20 14.932 -8.098 -12.986 1.00 0.00 O ATOM 0 H SER A 20 13.307 -8.516 -10.468 1.00 0.00 H new ATOM 0 HA SER A 20 13.140 -6.404 -12.393 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.441 -9.418 -12.466 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.163 -8.524 -13.947 1.00 0.00 H new ATOM 0 HG SER A 20 15.421 -8.782 -13.489 1.00 0.00 H new ATOM 311 N GLU A 21 10.968 -6.867 -13.703 1.00 0.00 N ATOM 312 CA GLU A 21 9.598 -6.856 -14.201 1.00 0.00 C ATOM 313 C GLU A 21 9.047 -8.275 -14.311 1.00 0.00 C ATOM 314 O GLU A 21 7.870 -8.517 -14.044 1.00 0.00 O ATOM 315 CB GLU A 21 9.532 -6.164 -15.564 1.00 0.00 C ATOM 316 CG GLU A 21 10.429 -6.799 -16.613 1.00 0.00 C ATOM 317 CD GLU A 21 10.410 -6.047 -17.929 1.00 0.00 C ATOM 318 OE1 GLU A 21 10.258 -4.808 -17.904 1.00 0.00 O ATOM 319 OE2 GLU A 21 10.548 -6.699 -18.986 1.00 0.00 O ATOM 0 H GLU A 21 11.639 -6.388 -14.304 1.00 0.00 H new ATOM 0 HA GLU A 21 8.985 -6.301 -13.490 1.00 0.00 H new ATOM 0 HB2 GLU A 21 8.502 -6.180 -15.921 1.00 0.00 H new ATOM 0 HB3 GLU A 21 9.812 -5.117 -15.445 1.00 0.00 H new ATOM 0 HG2 GLU A 21 11.451 -6.838 -16.236 1.00 0.00 H new ATOM 0 HG3 GLU A 21 10.112 -7.828 -16.782 1.00 0.00 H new ATOM 326 N ASP A 22 9.906 -9.207 -14.707 1.00 0.00 N ATOM 327 CA ASP A 22 9.507 -10.602 -14.853 1.00 0.00 C ATOM 328 C ASP A 22 8.943 -11.146 -13.544 1.00 0.00 C ATOM 329 O ASP A 22 7.990 -11.926 -13.544 1.00 0.00 O ATOM 330 CB ASP A 22 10.697 -11.451 -15.301 1.00 0.00 C ATOM 331 CG ASP A 22 11.047 -11.234 -16.761 1.00 0.00 C ATOM 332 OD1 ASP A 22 10.135 -11.328 -17.609 1.00 0.00 O ATOM 333 OD2 ASP A 22 12.232 -10.971 -17.055 1.00 0.00 O ATOM 0 H ASP A 22 10.883 -9.022 -14.933 1.00 0.00 H new ATOM 0 HA ASP A 22 8.727 -10.653 -15.613 1.00 0.00 H new ATOM 0 HB2 ASP A 22 11.563 -11.212 -14.684 1.00 0.00 H new ATOM 0 HB3 ASP A 22 10.470 -12.504 -15.138 1.00 0.00 H new ATOM 338 N ASP A 23 9.537 -10.730 -12.432 1.00 0.00 N ATOM 339 CA ASP A 23 9.094 -11.175 -11.116 1.00 0.00 C ATOM 340 C ASP A 23 7.962 -10.293 -10.597 1.00 0.00 C ATOM 341 O ASP A 23 7.423 -9.461 -11.327 1.00 0.00 O ATOM 342 CB ASP A 23 10.263 -11.160 -10.128 1.00 0.00 C ATOM 343 CG ASP A 23 11.444 -11.975 -10.617 1.00 0.00 C ATOM 344 OD1 ASP A 23 12.180 -11.484 -11.499 1.00 0.00 O ATOM 345 OD2 ASP A 23 11.633 -13.103 -10.117 1.00 0.00 O ATOM 0 H ASP A 23 10.327 -10.085 -12.415 1.00 0.00 H new ATOM 0 HA ASP A 23 8.722 -12.195 -11.211 1.00 0.00 H new ATOM 0 HB2 ASP A 23 10.580 -10.131 -9.960 1.00 0.00 H new ATOM 0 HB3 ASP A 23 9.928 -11.551 -9.167 1.00 0.00 H new ATOM 350 N THR A 24 7.605 -10.482 -9.330 1.00 0.00 N ATOM 351 CA THR A 24 6.536 -9.707 -8.714 1.00 0.00 C ATOM 352 C THR A 24 6.772 -9.537 -7.217 1.00 0.00 C ATOM 353 O THR A 24 7.670 -10.157 -6.646 1.00 0.00 O ATOM 354 CB THR A 24 5.163 -10.370 -8.933 1.00 0.00 C ATOM 355 OG1 THR A 24 5.319 -11.787 -9.064 1.00 0.00 O ATOM 356 CG2 THR A 24 4.485 -9.812 -10.175 1.00 0.00 C ATOM 0 H THR A 24 8.041 -11.165 -8.711 1.00 0.00 H new ATOM 0 HA THR A 24 6.539 -8.728 -9.193 1.00 0.00 H new ATOM 0 HB THR A 24 4.537 -10.153 -8.068 1.00 0.00 H new ATOM 0 HG1 THR A 24 4.843 -12.096 -9.863 1.00 0.00 H new ATOM 0 HG21 THR A 24 3.517 -10.295 -10.309 1.00 0.00 H new ATOM 0 HG22 THR A 24 4.341 -8.738 -10.060 1.00 0.00 H new ATOM 0 HG23 THR A 24 5.110 -10.003 -11.047 1.00 0.00 H new ATOM 364 N VAL A 25 5.961 -8.693 -6.587 1.00 0.00 N ATOM 365 CA VAL A 25 6.081 -8.443 -5.155 1.00 0.00 C ATOM 366 C VAL A 25 5.728 -9.688 -4.349 1.00 0.00 C ATOM 367 O VAL A 25 6.245 -9.897 -3.251 1.00 0.00 O ATOM 368 CB VAL A 25 5.172 -7.282 -4.711 1.00 0.00 C ATOM 369 CG1 VAL A 25 5.180 -7.148 -3.195 1.00 0.00 C ATOM 370 CG2 VAL A 25 5.608 -5.983 -5.371 1.00 0.00 C ATOM 0 H VAL A 25 5.214 -8.171 -7.045 1.00 0.00 H new ATOM 0 HA VAL A 25 7.120 -8.174 -4.966 1.00 0.00 H new ATOM 0 HB VAL A 25 4.152 -7.500 -5.028 1.00 0.00 H new ATOM 0 HG11 VAL A 25 4.532 -6.323 -2.899 1.00 0.00 H new ATOM 0 HG12 VAL A 25 4.817 -8.073 -2.746 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.196 -6.953 -2.852 1.00 0.00 H new ATOM 0 HG21 VAL A 25 4.955 -5.173 -5.046 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.636 -5.757 -5.086 1.00 0.00 H new ATOM 0 HG23 VAL A 25 5.546 -6.087 -6.454 1.00 0.00 H new ATOM 380 N LEU A 26 4.845 -10.513 -4.900 1.00 0.00 N ATOM 381 CA LEU A 26 4.422 -11.739 -4.232 1.00 0.00 C ATOM 382 C LEU A 26 5.624 -12.613 -3.887 1.00 0.00 C ATOM 383 O LEU A 26 5.664 -13.240 -2.828 1.00 0.00 O ATOM 384 CB LEU A 26 3.449 -12.517 -5.120 1.00 0.00 C ATOM 385 CG LEU A 26 3.986 -12.951 -6.484 1.00 0.00 C ATOM 386 CD1 LEU A 26 4.473 -14.391 -6.433 1.00 0.00 C ATOM 387 CD2 LEU A 26 2.918 -12.785 -7.556 1.00 0.00 C ATOM 0 H LEU A 26 4.408 -10.355 -5.808 1.00 0.00 H new ATOM 0 HA LEU A 26 3.918 -11.464 -3.305 1.00 0.00 H new ATOM 0 HB2 LEU A 26 3.127 -13.407 -4.579 1.00 0.00 H new ATOM 0 HB3 LEU A 26 2.563 -11.902 -5.279 1.00 0.00 H new ATOM 0 HG LEU A 26 4.831 -12.312 -6.740 1.00 0.00 H new ATOM 0 HD11 LEU A 26 4.852 -14.682 -7.413 1.00 0.00 H new ATOM 0 HD12 LEU A 26 5.270 -14.480 -5.695 1.00 0.00 H new ATOM 0 HD13 LEU A 26 3.647 -15.045 -6.154 1.00 0.00 H new ATOM 0 HD21 LEU A 26 3.318 -13.099 -8.520 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.053 -13.398 -7.305 1.00 0.00 H new ATOM 0 HD23 LEU A 26 2.617 -11.739 -7.611 1.00 0.00 H new ATOM 399 N ASP A 27 6.601 -12.647 -4.786 1.00 0.00 N ATOM 400 CA ASP A 27 7.806 -13.442 -4.575 1.00 0.00 C ATOM 401 C ASP A 27 8.571 -12.953 -3.349 1.00 0.00 C ATOM 402 O ASP A 27 8.555 -13.594 -2.298 1.00 0.00 O ATOM 403 CB ASP A 27 8.705 -13.381 -5.811 1.00 0.00 C ATOM 404 CG ASP A 27 8.436 -14.517 -6.778 1.00 0.00 C ATOM 405 OD1 ASP A 27 8.426 -15.685 -6.334 1.00 0.00 O ATOM 406 OD2 ASP A 27 8.236 -14.239 -7.979 1.00 0.00 O ATOM 0 H ASP A 27 6.583 -12.134 -5.667 1.00 0.00 H new ATOM 0 HA ASP A 27 7.505 -14.476 -4.405 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.553 -12.430 -6.321 1.00 0.00 H new ATOM 0 HB3 ASP A 27 9.749 -13.412 -5.499 1.00 0.00 H new ATOM 411 N LEU A 28 9.242 -11.815 -3.492 1.00 0.00 N ATOM 412 CA LEU A 28 10.015 -11.240 -2.397 1.00 0.00 C ATOM 413 C LEU A 28 9.190 -11.190 -1.115 1.00 0.00 C ATOM 414 O LEU A 28 9.718 -11.365 -0.017 1.00 0.00 O ATOM 415 CB LEU A 28 10.491 -9.833 -2.766 1.00 0.00 C ATOM 416 CG LEU A 28 9.447 -8.722 -2.654 1.00 0.00 C ATOM 417 CD1 LEU A 28 9.486 -8.089 -1.272 1.00 0.00 C ATOM 418 CD2 LEU A 28 9.671 -7.670 -3.731 1.00 0.00 C ATOM 0 H LEU A 28 9.266 -11.273 -4.355 1.00 0.00 H new ATOM 0 HA LEU A 28 10.883 -11.877 -2.224 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.335 -9.577 -2.126 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.862 -9.854 -3.791 1.00 0.00 H new ATOM 0 HG LEU A 28 8.460 -9.161 -2.802 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.736 -7.300 -1.212 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.276 -8.848 -0.518 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.474 -7.664 -1.094 1.00 0.00 H new ATOM 0 HD21 LEU A 28 8.919 -6.887 -3.636 1.00 0.00 H new ATOM 0 HD22 LEU A 28 10.664 -7.236 -3.614 1.00 0.00 H new ATOM 0 HD23 LEU A 28 9.591 -8.133 -4.714 1.00 0.00 H new ATOM 430 N LYS A 29 7.891 -10.953 -1.263 1.00 0.00 N ATOM 431 CA LYS A 29 6.990 -10.884 -0.118 1.00 0.00 C ATOM 432 C LYS A 29 7.153 -12.108 0.777 1.00 0.00 C ATOM 433 O LYS A 29 7.405 -11.982 1.975 1.00 0.00 O ATOM 434 CB LYS A 29 5.539 -10.775 -0.591 1.00 0.00 C ATOM 435 CG LYS A 29 4.524 -10.858 0.536 1.00 0.00 C ATOM 436 CD LYS A 29 3.126 -10.509 0.054 1.00 0.00 C ATOM 437 CE LYS A 29 2.393 -11.735 -0.468 1.00 0.00 C ATOM 438 NZ LYS A 29 2.182 -12.752 0.600 1.00 0.00 N ATOM 0 H LYS A 29 7.438 -10.805 -2.165 1.00 0.00 H new ATOM 0 HA LYS A 29 7.245 -9.996 0.460 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.408 -9.830 -1.118 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.339 -11.571 -1.308 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.525 -11.865 0.954 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.813 -10.179 1.338 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.558 -10.066 0.872 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.189 -9.759 -0.734 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.429 -11.434 -0.879 1.00 0.00 H new ATOM 0 HE3 LYS A 29 2.963 -12.179 -1.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 1.330 -13.308 0.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.006 -13.385 0.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.063 -12.274 1.516 1.00 0.00 H new ATOM 452 N GLN A 30 7.010 -13.291 0.187 1.00 0.00 N ATOM 453 CA GLN A 30 7.143 -14.537 0.933 1.00 0.00 C ATOM 454 C GLN A 30 8.572 -14.724 1.431 1.00 0.00 C ATOM 455 O GLN A 30 8.803 -15.347 2.467 1.00 0.00 O ATOM 456 CB GLN A 30 6.735 -15.724 0.059 1.00 0.00 C ATOM 457 CG GLN A 30 7.896 -16.351 -0.697 1.00 0.00 C ATOM 458 CD GLN A 30 7.465 -17.512 -1.570 1.00 0.00 C ATOM 459 OE1 GLN A 30 6.348 -18.016 -1.447 1.00 0.00 O ATOM 460 NE2 GLN A 30 8.351 -17.946 -2.459 1.00 0.00 N ATOM 0 H GLN A 30 6.802 -13.413 -0.804 1.00 0.00 H new ATOM 0 HA GLN A 30 6.481 -14.486 1.797 1.00 0.00 H new ATOM 0 HB2 GLN A 30 6.269 -16.483 0.687 1.00 0.00 H new ATOM 0 HB3 GLN A 30 5.981 -15.395 -0.657 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.373 -15.592 -1.318 1.00 0.00 H new ATOM 0 HG3 GLN A 30 8.645 -16.696 0.016 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.265 -17.499 -2.527 1.00 0.00 H new ATOM 0 HE22 GLN A 30 8.117 -18.726 -3.073 1.00 0.00 H new ATOM 469 N PHE A 31 9.529 -14.181 0.685 1.00 0.00 N ATOM 470 CA PHE A 31 10.937 -14.289 1.050 1.00 0.00 C ATOM 471 C PHE A 31 11.247 -13.437 2.278 1.00 0.00 C ATOM 472 O PHE A 31 12.168 -13.737 3.039 1.00 0.00 O ATOM 473 CB PHE A 31 11.823 -13.858 -0.120 1.00 0.00 C ATOM 474 CG PHE A 31 12.296 -15.005 -0.968 1.00 0.00 C ATOM 475 CD1 PHE A 31 13.362 -15.790 -0.562 1.00 0.00 C ATOM 476 CD2 PHE A 31 11.673 -15.297 -2.171 1.00 0.00 C ATOM 477 CE1 PHE A 31 13.799 -16.846 -1.339 1.00 0.00 C ATOM 478 CE2 PHE A 31 12.105 -16.352 -2.952 1.00 0.00 C ATOM 479 CZ PHE A 31 13.170 -17.127 -2.537 1.00 0.00 C ATOM 0 H PHE A 31 9.355 -13.662 -0.176 1.00 0.00 H new ATOM 0 HA PHE A 31 11.146 -15.331 1.290 1.00 0.00 H new ATOM 0 HB2 PHE A 31 11.270 -13.158 -0.746 1.00 0.00 H new ATOM 0 HB3 PHE A 31 12.689 -13.322 0.269 1.00 0.00 H new ATOM 0 HD1 PHE A 31 13.858 -15.574 0.373 1.00 0.00 H new ATOM 0 HD2 PHE A 31 10.841 -14.693 -2.502 1.00 0.00 H new ATOM 0 HE1 PHE A 31 14.631 -17.451 -1.010 1.00 0.00 H new ATOM 0 HE2 PHE A 31 11.610 -16.570 -3.887 1.00 0.00 H new ATOM 0 HZ PHE A 31 13.510 -17.951 -3.147 1.00 0.00 H new ATOM 489 N LEU A 32 10.473 -12.374 2.464 1.00 0.00 N ATOM 490 CA LEU A 32 10.664 -11.478 3.599 1.00 0.00 C ATOM 491 C LEU A 32 10.086 -12.083 4.875 1.00 0.00 C ATOM 492 O LEU A 32 10.690 -12.000 5.944 1.00 0.00 O ATOM 493 CB LEU A 32 10.008 -10.124 3.321 1.00 0.00 C ATOM 494 CG LEU A 32 10.688 -9.254 2.264 1.00 0.00 C ATOM 495 CD1 LEU A 32 10.029 -7.885 2.195 1.00 0.00 C ATOM 496 CD2 LEU A 32 12.175 -9.118 2.561 1.00 0.00 C ATOM 0 H LEU A 32 9.707 -12.111 1.844 1.00 0.00 H new ATOM 0 HA LEU A 32 11.735 -11.334 3.740 1.00 0.00 H new ATOM 0 HB2 LEU A 32 8.978 -10.299 3.011 1.00 0.00 H new ATOM 0 HB3 LEU A 32 9.969 -9.563 4.255 1.00 0.00 H new ATOM 0 HG LEU A 32 10.574 -9.739 1.294 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.526 -7.280 1.437 1.00 0.00 H new ATOM 0 HD12 LEU A 32 8.977 -8.000 1.934 1.00 0.00 H new ATOM 0 HD13 LEU A 32 10.111 -7.393 3.164 1.00 0.00 H new ATOM 0 HD21 LEU A 32 12.643 -8.495 1.798 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.310 -8.656 3.539 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.638 -10.105 2.558 1.00 0.00 H new ATOM 508 N LYS A 33 8.913 -12.695 4.754 1.00 0.00 N ATOM 509 CA LYS A 33 8.253 -13.318 5.895 1.00 0.00 C ATOM 510 C LYS A 33 8.989 -14.584 6.324 1.00 0.00 C ATOM 511 O LYS A 33 8.918 -14.994 7.484 1.00 0.00 O ATOM 512 CB LYS A 33 6.800 -13.653 5.551 1.00 0.00 C ATOM 513 CG LYS A 33 6.623 -15.026 4.928 1.00 0.00 C ATOM 514 CD LYS A 33 5.380 -15.087 4.056 1.00 0.00 C ATOM 515 CE LYS A 33 4.136 -15.381 4.879 1.00 0.00 C ATOM 516 NZ LYS A 33 4.224 -16.699 5.566 1.00 0.00 N ATOM 0 H LYS A 33 8.399 -12.773 3.876 1.00 0.00 H new ATOM 0 HA LYS A 33 8.270 -12.610 6.723 1.00 0.00 H new ATOM 0 HB2 LYS A 33 6.198 -13.595 6.458 1.00 0.00 H new ATOM 0 HB3 LYS A 33 6.415 -12.899 4.864 1.00 0.00 H new ATOM 0 HG2 LYS A 33 7.501 -15.271 4.330 1.00 0.00 H new ATOM 0 HG3 LYS A 33 6.554 -15.777 5.715 1.00 0.00 H new ATOM 0 HD2 LYS A 33 5.255 -14.140 3.532 1.00 0.00 H new ATOM 0 HD3 LYS A 33 5.505 -15.858 3.296 1.00 0.00 H new ATOM 0 HE2 LYS A 33 3.996 -14.594 5.620 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.260 -15.367 4.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 3.266 -17.066 5.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 4.750 -17.368 4.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 4.717 -16.585 6.474 1.00 0.00 H new ATOM 530 N THR A 34 9.698 -15.199 5.383 1.00 0.00 N ATOM 531 CA THR A 34 10.447 -16.417 5.664 1.00 0.00 C ATOM 532 C THR A 34 11.863 -16.097 6.128 1.00 0.00 C ATOM 533 O THR A 34 12.447 -16.833 6.925 1.00 0.00 O ATOM 534 CB THR A 34 10.519 -17.331 4.425 1.00 0.00 C ATOM 535 OG1 THR A 34 11.023 -16.597 3.304 1.00 0.00 O ATOM 536 CG2 THR A 34 9.148 -17.898 4.091 1.00 0.00 C ATOM 0 H THR A 34 9.769 -14.873 4.419 1.00 0.00 H new ATOM 0 HA THR A 34 9.916 -16.938 6.460 1.00 0.00 H new ATOM 0 HB THR A 34 11.192 -18.158 4.649 1.00 0.00 H new ATOM 0 HG1 THR A 34 10.275 -16.200 2.810 1.00 0.00 H new ATOM 0 HG21 THR A 34 9.224 -18.540 3.213 1.00 0.00 H new ATOM 0 HG22 THR A 34 8.779 -18.480 4.936 1.00 0.00 H new ATOM 0 HG23 THR A 34 8.457 -17.081 3.884 1.00 0.00 H new ATOM 544 N LEU A 35 12.410 -14.996 5.626 1.00 0.00 N ATOM 545 CA LEU A 35 13.759 -14.577 5.991 1.00 0.00 C ATOM 546 C LEU A 35 13.749 -13.779 7.291 1.00 0.00 C ATOM 547 O LEU A 35 14.553 -14.027 8.191 1.00 0.00 O ATOM 548 CB LEU A 35 14.375 -13.739 4.869 1.00 0.00 C ATOM 549 CG LEU A 35 15.785 -13.207 5.126 1.00 0.00 C ATOM 550 CD1 LEU A 35 15.732 -11.918 5.930 1.00 0.00 C ATOM 551 CD2 LEU A 35 16.627 -14.252 5.844 1.00 0.00 C ATOM 0 H LEU A 35 11.941 -14.377 4.965 1.00 0.00 H new ATOM 0 HA LEU A 35 14.363 -15.472 6.141 1.00 0.00 H new ATOM 0 HB2 LEU A 35 14.396 -14.342 3.961 1.00 0.00 H new ATOM 0 HB3 LEU A 35 13.718 -12.891 4.673 1.00 0.00 H new ATOM 0 HG LEU A 35 16.251 -12.992 4.165 1.00 0.00 H new ATOM 0 HD11 LEU A 35 16.745 -11.555 6.103 1.00 0.00 H new ATOM 0 HD12 LEU A 35 15.167 -11.167 5.377 1.00 0.00 H new ATOM 0 HD13 LEU A 35 15.246 -12.106 6.887 1.00 0.00 H new ATOM 0 HD21 LEU A 35 17.627 -13.856 6.019 1.00 0.00 H new ATOM 0 HD22 LEU A 35 16.163 -14.500 6.799 1.00 0.00 H new ATOM 0 HD23 LEU A 35 16.694 -15.150 5.230 1.00 0.00 H new ATOM 563 N THR A 36 12.832 -12.821 7.384 1.00 0.00 N ATOM 564 CA THR A 36 12.717 -11.987 8.574 1.00 0.00 C ATOM 565 C THR A 36 11.766 -12.609 9.591 1.00 0.00 C ATOM 566 O THR A 36 12.026 -12.586 10.793 1.00 0.00 O ATOM 567 CB THR A 36 12.220 -10.572 8.222 1.00 0.00 C ATOM 568 OG1 THR A 36 10.795 -10.575 8.078 1.00 0.00 O ATOM 569 CG2 THR A 36 12.864 -10.076 6.936 1.00 0.00 C ATOM 0 H THR A 36 12.158 -12.604 6.650 1.00 0.00 H new ATOM 0 HA THR A 36 13.714 -11.916 9.009 1.00 0.00 H new ATOM 0 HB THR A 36 12.501 -9.900 9.033 1.00 0.00 H new ATOM 0 HG1 THR A 36 10.548 -11.091 7.282 1.00 0.00 H new ATOM 0 HG21 THR A 36 12.498 -9.075 6.708 1.00 0.00 H new ATOM 0 HG22 THR A 36 13.947 -10.047 7.059 1.00 0.00 H new ATOM 0 HG23 THR A 36 12.610 -10.750 6.118 1.00 0.00 H new ATOM 577 N GLY A 37 10.663 -13.166 9.100 1.00 0.00 N ATOM 578 CA GLY A 37 9.691 -13.788 9.980 1.00 0.00 C ATOM 579 C GLY A 37 9.283 -12.881 11.124 1.00 0.00 C ATOM 580 O GLY A 37 8.888 -13.354 12.190 1.00 0.00 O ATOM 0 H GLY A 37 10.425 -13.198 8.109 1.00 0.00 H new ATOM 0 HA2 GLY A 37 8.807 -14.062 9.404 1.00 0.00 H new ATOM 0 HA3 GLY A 37 10.108 -14.711 10.383 1.00 0.00 H new ATOM 584 N VAL A 38 9.379 -11.574 10.905 1.00 0.00 N ATOM 585 CA VAL A 38 9.017 -10.599 11.927 1.00 0.00 C ATOM 586 C VAL A 38 7.893 -9.688 11.444 1.00 0.00 C ATOM 587 O VAL A 38 7.120 -9.160 12.245 1.00 0.00 O ATOM 588 CB VAL A 38 10.226 -9.734 12.330 1.00 0.00 C ATOM 589 CG1 VAL A 38 9.833 -8.738 13.411 1.00 0.00 C ATOM 590 CG2 VAL A 38 11.377 -10.612 12.796 1.00 0.00 C ATOM 0 H VAL A 38 9.704 -11.165 10.029 1.00 0.00 H new ATOM 0 HA VAL A 38 8.676 -11.162 12.796 1.00 0.00 H new ATOM 0 HB VAL A 38 10.557 -9.173 11.456 1.00 0.00 H new ATOM 0 HG11 VAL A 38 10.700 -8.136 13.683 1.00 0.00 H new ATOM 0 HG12 VAL A 38 9.042 -8.088 13.037 1.00 0.00 H new ATOM 0 HG13 VAL A 38 9.475 -9.276 14.289 1.00 0.00 H new ATOM 0 HG21 VAL A 38 12.223 -9.984 13.077 1.00 0.00 H new ATOM 0 HG22 VAL A 38 11.060 -11.201 13.657 1.00 0.00 H new ATOM 0 HG23 VAL A 38 11.674 -11.281 11.989 1.00 0.00 H new ATOM 600 N LEU A 39 7.807 -9.509 10.131 1.00 0.00 N ATOM 601 CA LEU A 39 6.777 -8.662 9.540 1.00 0.00 C ATOM 602 C LEU A 39 5.387 -9.098 9.994 1.00 0.00 C ATOM 603 O LEU A 39 4.577 -8.294 10.453 1.00 0.00 O ATOM 604 CB LEU A 39 6.865 -8.708 8.013 1.00 0.00 C ATOM 605 CG LEU A 39 8.275 -8.719 7.422 1.00 0.00 C ATOM 606 CD1 LEU A 39 8.220 -8.595 5.908 1.00 0.00 C ATOM 607 CD2 LEU A 39 9.113 -7.599 8.021 1.00 0.00 C ATOM 0 H LEU A 39 8.438 -9.939 9.455 1.00 0.00 H new ATOM 0 HA LEU A 39 6.945 -7.639 9.877 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.340 -9.598 7.665 1.00 0.00 H new ATOM 0 HB3 LEU A 39 6.331 -7.846 7.612 1.00 0.00 H new ATOM 0 HG LEU A 39 8.745 -9.670 7.671 1.00 0.00 H new ATOM 0 HD11 LEU A 39 9.233 -8.605 5.505 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.657 -9.432 5.495 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.731 -7.659 5.637 1.00 0.00 H new ATOM 0 HD21 LEU A 39 10.113 -7.622 7.589 1.00 0.00 H new ATOM 0 HD22 LEU A 39 8.646 -6.639 7.803 1.00 0.00 H new ATOM 0 HD23 LEU A 39 9.181 -7.733 9.101 1.00 0.00 H new ATOM 619 N PRO A 40 5.105 -10.403 9.865 1.00 0.00 N ATOM 620 CA PRO A 40 3.814 -10.976 10.259 1.00 0.00 C ATOM 621 C PRO A 40 3.621 -10.983 11.772 1.00 0.00 C ATOM 622 O PRO A 40 2.537 -11.291 12.266 1.00 0.00 O ATOM 623 CB PRO A 40 3.883 -12.408 9.723 1.00 0.00 C ATOM 624 CG PRO A 40 5.339 -12.718 9.655 1.00 0.00 C ATOM 625 CD PRO A 40 6.023 -11.420 9.326 1.00 0.00 C ATOM 0 HA PRO A 40 2.976 -10.400 9.868 1.00 0.00 H new ATOM 0 HB2 PRO A 40 3.361 -13.102 10.381 1.00 0.00 H new ATOM 0 HB3 PRO A 40 3.415 -12.486 8.741 1.00 0.00 H new ATOM 0 HG2 PRO A 40 5.697 -13.119 10.603 1.00 0.00 H new ATOM 0 HG3 PRO A 40 5.543 -13.471 8.893 1.00 0.00 H new ATOM 0 HD2 PRO A 40 7.008 -11.357 9.788 1.00 0.00 H new ATOM 0 HD3 PRO A 40 6.166 -11.303 8.252 1.00 0.00 H new ATOM 633 N GLU A 41 4.678 -10.640 12.501 1.00 0.00 N ATOM 634 CA GLU A 41 4.623 -10.608 13.958 1.00 0.00 C ATOM 635 C GLU A 41 4.551 -9.171 14.467 1.00 0.00 C ATOM 636 O GLU A 41 3.490 -8.699 14.878 1.00 0.00 O ATOM 637 CB GLU A 41 5.845 -11.310 14.553 1.00 0.00 C ATOM 638 CG GLU A 41 5.865 -12.809 14.305 1.00 0.00 C ATOM 639 CD GLU A 41 6.790 -13.545 15.255 1.00 0.00 C ATOM 640 OE1 GLU A 41 6.426 -13.696 16.440 1.00 0.00 O ATOM 641 OE2 GLU A 41 7.877 -13.971 14.813 1.00 0.00 O ATOM 0 H GLU A 41 5.582 -10.380 12.107 1.00 0.00 H new ATOM 0 HA GLU A 41 3.722 -11.134 14.274 1.00 0.00 H new ATOM 0 HB2 GLU A 41 6.748 -10.868 14.132 1.00 0.00 H new ATOM 0 HB3 GLU A 41 5.872 -11.127 15.627 1.00 0.00 H new ATOM 0 HG2 GLU A 41 4.854 -13.204 14.409 1.00 0.00 H new ATOM 0 HG3 GLU A 41 6.178 -13.000 13.278 1.00 0.00 H new ATOM 648 N ARG A 42 5.686 -8.481 14.438 1.00 0.00 N ATOM 649 CA ARG A 42 5.753 -7.100 14.899 1.00 0.00 C ATOM 650 C ARG A 42 6.577 -6.246 13.939 1.00 0.00 C ATOM 651 O ARG A 42 7.751 -6.526 13.697 1.00 0.00 O ATOM 652 CB ARG A 42 6.357 -7.036 16.303 1.00 0.00 C ATOM 653 CG ARG A 42 7.734 -7.674 16.403 1.00 0.00 C ATOM 654 CD ARG A 42 8.131 -7.918 17.850 1.00 0.00 C ATOM 655 NE ARG A 42 8.101 -6.690 18.640 1.00 0.00 N ATOM 656 CZ ARG A 42 9.080 -5.792 18.640 1.00 0.00 C ATOM 657 NH1 ARG A 42 10.160 -5.984 17.895 1.00 0.00 N ATOM 658 NH2 ARG A 42 8.980 -4.700 19.386 1.00 0.00 N ATOM 0 H ARG A 42 6.572 -8.856 14.100 1.00 0.00 H new ATOM 0 HA ARG A 42 4.738 -6.704 14.930 1.00 0.00 H new ATOM 0 HB2 ARG A 42 6.426 -5.993 16.613 1.00 0.00 H new ATOM 0 HB3 ARG A 42 5.684 -7.533 17.002 1.00 0.00 H new ATOM 0 HG2 ARG A 42 7.739 -8.619 15.859 1.00 0.00 H new ATOM 0 HG3 ARG A 42 8.471 -7.028 15.926 1.00 0.00 H new ATOM 0 HD2 ARG A 42 7.456 -8.650 18.293 1.00 0.00 H new ATOM 0 HD3 ARG A 42 9.133 -8.346 17.884 1.00 0.00 H new ATOM 0 HE ARG A 42 7.284 -6.512 19.224 1.00 0.00 H new ATOM 0 HH11 ARG A 42 10.240 -6.823 17.320 1.00 0.00 H new ATOM 0 HH12 ARG A 42 10.910 -5.293 17.897 1.00 0.00 H new ATOM 0 HH21 ARG A 42 8.151 -4.549 19.961 1.00 0.00 H new ATOM 0 HH22 ARG A 42 9.732 -4.011 19.385 1.00 0.00 H new ATOM 672 N GLN A 43 5.954 -5.205 13.397 1.00 0.00 N ATOM 673 CA GLN A 43 6.630 -4.312 12.463 1.00 0.00 C ATOM 674 C GLN A 43 6.092 -2.890 12.584 1.00 0.00 C ATOM 675 O GLN A 43 4.901 -2.683 12.819 1.00 0.00 O ATOM 676 CB GLN A 43 6.458 -4.815 11.029 1.00 0.00 C ATOM 677 CG GLN A 43 5.006 -4.999 10.618 1.00 0.00 C ATOM 678 CD GLN A 43 4.408 -3.744 10.013 1.00 0.00 C ATOM 679 OE1 GLN A 43 4.946 -3.185 9.057 1.00 0.00 O ATOM 680 NE2 GLN A 43 3.288 -3.296 10.566 1.00 0.00 N ATOM 0 H GLN A 43 4.983 -4.959 13.588 1.00 0.00 H new ATOM 0 HA GLN A 43 7.691 -4.302 12.712 1.00 0.00 H new ATOM 0 HB2 GLN A 43 6.934 -4.111 10.346 1.00 0.00 H new ATOM 0 HB3 GLN A 43 6.981 -5.765 10.921 1.00 0.00 H new ATOM 0 HG2 GLN A 43 4.937 -5.814 9.897 1.00 0.00 H new ATOM 0 HG3 GLN A 43 4.420 -5.293 11.489 1.00 0.00 H new ATOM 0 HE21 GLN A 43 2.876 -3.791 11.357 1.00 0.00 H new ATOM 0 HE22 GLN A 43 2.839 -2.457 10.200 1.00 0.00 H new ATOM 689 N LYS A 44 6.977 -1.912 12.423 1.00 0.00 N ATOM 690 CA LYS A 44 6.593 -0.509 12.512 1.00 0.00 C ATOM 691 C LYS A 44 7.360 0.332 11.496 1.00 0.00 C ATOM 692 O LYS A 44 7.894 1.391 11.828 1.00 0.00 O ATOM 693 CB LYS A 44 6.847 0.022 13.925 1.00 0.00 C ATOM 694 CG LYS A 44 5.684 0.814 14.496 1.00 0.00 C ATOM 695 CD LYS A 44 5.597 2.200 13.880 1.00 0.00 C ATOM 696 CE LYS A 44 6.432 3.208 14.655 1.00 0.00 C ATOM 697 NZ LYS A 44 6.215 4.598 14.169 1.00 0.00 N ATOM 0 H LYS A 44 7.967 -2.066 12.230 1.00 0.00 H new ATOM 0 HA LYS A 44 5.529 -0.435 12.288 1.00 0.00 H new ATOM 0 HB2 LYS A 44 7.063 -0.817 14.586 1.00 0.00 H new ATOM 0 HB3 LYS A 44 7.735 0.654 13.912 1.00 0.00 H new ATOM 0 HG2 LYS A 44 4.753 0.276 14.316 1.00 0.00 H new ATOM 0 HG3 LYS A 44 5.798 0.902 15.576 1.00 0.00 H new ATOM 0 HD2 LYS A 44 5.939 2.162 12.846 1.00 0.00 H new ATOM 0 HD3 LYS A 44 4.557 2.526 13.860 1.00 0.00 H new ATOM 0 HE2 LYS A 44 6.180 3.150 15.714 1.00 0.00 H new ATOM 0 HE3 LYS A 44 7.488 2.952 14.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 6.802 5.255 14.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 6.479 4.660 13.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 5.213 4.852 14.280 1.00 0.00 H new ATOM 711 N LEU A 45 7.410 -0.146 10.258 1.00 0.00 N ATOM 712 CA LEU A 45 8.111 0.562 9.192 1.00 0.00 C ATOM 713 C LEU A 45 7.709 2.033 9.161 1.00 0.00 C ATOM 714 O LEU A 45 6.607 2.396 9.576 1.00 0.00 O ATOM 715 CB LEU A 45 7.815 -0.088 7.840 1.00 0.00 C ATOM 716 CG LEU A 45 8.677 -1.297 7.473 1.00 0.00 C ATOM 717 CD1 LEU A 45 8.002 -2.587 7.912 1.00 0.00 C ATOM 718 CD2 LEU A 45 8.955 -1.319 5.977 1.00 0.00 C ATOM 0 H LEU A 45 6.974 -1.021 9.967 1.00 0.00 H new ATOM 0 HA LEU A 45 9.181 0.500 9.391 1.00 0.00 H new ATOM 0 HB2 LEU A 45 6.769 -0.396 7.829 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.934 0.667 7.063 1.00 0.00 H new ATOM 0 HG LEU A 45 9.629 -1.214 7.997 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.630 -3.436 7.642 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.856 -2.572 8.992 1.00 0.00 H new ATOM 0 HD13 LEU A 45 7.035 -2.679 7.417 1.00 0.00 H new ATOM 0 HD21 LEU A 45 9.570 -2.186 5.734 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.013 -1.378 5.433 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.482 -0.409 5.692 1.00 0.00 H new ATOM 730 N LEU A 46 8.607 2.876 8.664 1.00 0.00 N ATOM 731 CA LEU A 46 8.346 4.309 8.575 1.00 0.00 C ATOM 732 C LEU A 46 8.029 4.717 7.140 1.00 0.00 C ATOM 733 O LEU A 46 8.292 5.848 6.733 1.00 0.00 O ATOM 734 CB LEU A 46 9.550 5.100 9.088 1.00 0.00 C ATOM 735 CG LEU A 46 10.926 4.542 8.720 1.00 0.00 C ATOM 736 CD1 LEU A 46 11.085 4.468 7.210 1.00 0.00 C ATOM 737 CD2 LEU A 46 12.028 5.394 9.333 1.00 0.00 C ATOM 0 H LEU A 46 9.523 2.592 8.316 1.00 0.00 H new ATOM 0 HA LEU A 46 7.480 4.534 9.197 1.00 0.00 H new ATOM 0 HB2 LEU A 46 9.479 6.119 8.707 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.483 5.161 10.174 1.00 0.00 H new ATOM 0 HG LEU A 46 11.008 3.533 9.123 1.00 0.00 H new ATOM 0 HD11 LEU A 46 12.070 4.069 6.967 1.00 0.00 H new ATOM 0 HD12 LEU A 46 10.317 3.816 6.795 1.00 0.00 H new ATOM 0 HD13 LEU A 46 10.983 5.466 6.784 1.00 0.00 H new ATOM 0 HD21 LEU A 46 13.000 4.982 9.061 1.00 0.00 H new ATOM 0 HD22 LEU A 46 11.949 6.415 8.960 1.00 0.00 H new ATOM 0 HD23 LEU A 46 11.926 5.396 10.418 1.00 0.00 H new ATOM 749 N GLY A 47 7.461 3.787 6.377 1.00 0.00 N ATOM 750 CA GLY A 47 7.116 4.070 4.996 1.00 0.00 C ATOM 751 C GLY A 47 6.484 2.880 4.302 1.00 0.00 C ATOM 752 O GLY A 47 5.263 2.815 4.153 1.00 0.00 O ATOM 0 H GLY A 47 7.234 2.843 6.691 1.00 0.00 H new ATOM 0 HA2 GLY A 47 6.428 4.914 4.962 1.00 0.00 H new ATOM 0 HA3 GLY A 47 8.013 4.369 4.454 1.00 0.00 H new ATOM 756 N LEU A 48 7.316 1.937 3.873 1.00 0.00 N ATOM 757 CA LEU A 48 6.832 0.744 3.188 1.00 0.00 C ATOM 758 C LEU A 48 6.054 -0.155 4.143 1.00 0.00 C ATOM 759 O LEU A 48 6.299 -0.157 5.350 1.00 0.00 O ATOM 760 CB LEU A 48 8.003 -0.031 2.581 1.00 0.00 C ATOM 761 CG LEU A 48 7.637 -1.266 1.758 1.00 0.00 C ATOM 762 CD1 LEU A 48 8.517 -1.363 0.521 1.00 0.00 C ATOM 763 CD2 LEU A 48 7.760 -2.526 2.602 1.00 0.00 C ATOM 0 H LEU A 48 8.329 1.976 3.988 1.00 0.00 H new ATOM 0 HA LEU A 48 6.161 1.062 2.390 1.00 0.00 H new ATOM 0 HB2 LEU A 48 8.572 0.648 1.946 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.665 -0.341 3.389 1.00 0.00 H new ATOM 0 HG LEU A 48 6.600 -1.169 1.435 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.242 -2.248 -0.053 1.00 0.00 H new ATOM 0 HD12 LEU A 48 8.379 -0.474 -0.095 1.00 0.00 H new ATOM 0 HD13 LEU A 48 9.562 -1.436 0.823 1.00 0.00 H new ATOM 0 HD21 LEU A 48 7.496 -3.395 1.999 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.786 -2.628 2.956 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.087 -2.459 3.457 1.00 0.00 H new ATOM 775 N LYS A 49 5.115 -0.919 3.596 1.00 0.00 N ATOM 776 CA LYS A 49 4.302 -1.826 4.398 1.00 0.00 C ATOM 777 C LYS A 49 3.483 -1.055 5.429 1.00 0.00 C ATOM 778 O LYS A 49 3.807 -1.050 6.616 1.00 0.00 O ATOM 779 CB LYS A 49 5.191 -2.853 5.103 1.00 0.00 C ATOM 780 CG LYS A 49 5.298 -4.175 4.362 1.00 0.00 C ATOM 781 CD LYS A 49 4.032 -5.001 4.510 1.00 0.00 C ATOM 782 CE LYS A 49 4.187 -6.376 3.880 1.00 0.00 C ATOM 783 NZ LYS A 49 2.974 -7.218 4.080 1.00 0.00 N ATOM 0 H LYS A 49 4.898 -0.928 2.599 1.00 0.00 H new ATOM 0 HA LYS A 49 3.616 -2.346 3.729 1.00 0.00 H new ATOM 0 HB2 LYS A 49 6.189 -2.433 5.226 1.00 0.00 H new ATOM 0 HB3 LYS A 49 4.797 -3.037 6.102 1.00 0.00 H new ATOM 0 HG2 LYS A 49 5.489 -3.987 3.306 1.00 0.00 H new ATOM 0 HG3 LYS A 49 6.149 -4.739 4.744 1.00 0.00 H new ATOM 0 HD2 LYS A 49 3.788 -5.109 5.567 1.00 0.00 H new ATOM 0 HD3 LYS A 49 3.198 -4.477 4.043 1.00 0.00 H new ATOM 0 HE2 LYS A 49 4.381 -6.267 2.813 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.053 -6.878 4.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 3.119 -8.147 3.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 2.803 -7.344 5.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 2.152 -6.752 3.646 1.00 0.00 H new ATOM 797 N VAL A 50 2.419 -0.405 4.967 1.00 0.00 N ATOM 798 CA VAL A 50 1.552 0.367 5.849 1.00 0.00 C ATOM 799 C VAL A 50 0.439 -0.502 6.423 1.00 0.00 C ATOM 800 O VAL A 50 0.182 -1.604 5.936 1.00 0.00 O ATOM 801 CB VAL A 50 0.925 1.565 5.111 1.00 0.00 C ATOM 802 CG1 VAL A 50 1.988 2.599 4.773 1.00 0.00 C ATOM 803 CG2 VAL A 50 0.204 1.099 3.856 1.00 0.00 C ATOM 0 H VAL A 50 2.137 -0.398 3.987 1.00 0.00 H new ATOM 0 HA VAL A 50 2.176 0.737 6.663 1.00 0.00 H new ATOM 0 HB VAL A 50 0.193 2.033 5.769 1.00 0.00 H new ATOM 0 HG11 VAL A 50 1.527 3.438 4.252 1.00 0.00 H new ATOM 0 HG12 VAL A 50 2.455 2.955 5.692 1.00 0.00 H new ATOM 0 HG13 VAL A 50 2.745 2.146 4.133 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -0.233 1.958 3.347 1.00 0.00 H new ATOM 0 HG22 VAL A 50 0.913 0.605 3.191 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.586 0.399 4.129 1.00 0.00 H new ATOM 813 N LYS A 51 -0.221 0.001 7.461 1.00 0.00 N ATOM 814 CA LYS A 51 -1.309 -0.727 8.102 1.00 0.00 C ATOM 815 C LYS A 51 -2.658 -0.306 7.527 1.00 0.00 C ATOM 816 O LYS A 51 -2.812 0.809 7.032 1.00 0.00 O ATOM 817 CB LYS A 51 -1.290 -0.488 9.613 1.00 0.00 C ATOM 818 CG LYS A 51 -1.694 0.921 10.012 1.00 0.00 C ATOM 819 CD LYS A 51 -1.399 1.192 11.477 1.00 0.00 C ATOM 820 CE LYS A 51 -1.842 2.589 11.886 1.00 0.00 C ATOM 821 NZ LYS A 51 -3.267 2.843 11.534 1.00 0.00 N ATOM 0 H LYS A 51 -0.021 0.911 7.876 1.00 0.00 H new ATOM 0 HA LYS A 51 -1.166 -1.790 7.907 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -1.962 -1.199 10.093 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -0.288 -0.691 9.992 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -1.161 1.642 9.393 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -2.758 1.063 9.822 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -1.908 0.452 12.095 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -0.331 1.080 11.661 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -1.705 2.714 12.960 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -1.209 3.329 11.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -3.600 3.695 12.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -3.351 2.984 10.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -3.846 2.028 11.820 1.00 0.00 H new ATOM 835 N GLY A 52 -3.634 -1.206 7.599 1.00 0.00 N ATOM 836 CA GLY A 52 -4.958 -0.908 7.084 1.00 0.00 C ATOM 837 C GLY A 52 -5.001 -0.897 5.569 1.00 0.00 C ATOM 838 O GLY A 52 -6.006 -0.511 4.971 1.00 0.00 O ATOM 0 H GLY A 52 -3.532 -2.136 8.005 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -5.665 -1.647 7.459 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -5.281 0.062 7.461 1.00 0.00 H new ATOM 842 N LYS A 53 -3.906 -1.319 4.944 1.00 0.00 N ATOM 843 CA LYS A 53 -3.822 -1.356 3.489 1.00 0.00 C ATOM 844 C LYS A 53 -2.470 -1.899 3.036 1.00 0.00 C ATOM 845 O LYS A 53 -1.610 -1.165 2.550 1.00 0.00 O ATOM 846 CB LYS A 53 -4.041 0.044 2.909 1.00 0.00 C ATOM 847 CG LYS A 53 -3.304 1.137 3.663 1.00 0.00 C ATOM 848 CD LYS A 53 -3.021 2.336 2.773 1.00 0.00 C ATOM 849 CE LYS A 53 -4.299 3.083 2.424 1.00 0.00 C ATOM 850 NZ LYS A 53 -4.015 4.407 1.803 1.00 0.00 N ATOM 0 H LYS A 53 -3.065 -1.640 5.423 1.00 0.00 H new ATOM 0 HA LYS A 53 -4.603 -2.021 3.122 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -3.718 0.051 1.868 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -5.108 0.267 2.913 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -3.898 1.452 4.521 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -2.366 0.742 4.052 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -2.330 3.011 3.278 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -2.531 2.004 1.858 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -4.896 2.481 1.739 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -4.895 3.225 3.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -4.911 4.885 1.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -3.467 4.991 2.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -3.468 4.270 0.929 1.00 0.00 H new ATOM 864 N PRO A 54 -2.277 -3.217 3.197 1.00 0.00 N ATOM 865 CA PRO A 54 -1.033 -3.888 2.809 1.00 0.00 C ATOM 866 C PRO A 54 -0.854 -3.947 1.296 1.00 0.00 C ATOM 867 O PRO A 54 -1.829 -3.938 0.546 1.00 0.00 O ATOM 868 CB PRO A 54 -1.196 -5.297 3.384 1.00 0.00 C ATOM 869 CG PRO A 54 -2.669 -5.503 3.470 1.00 0.00 C ATOM 870 CD PRO A 54 -3.259 -4.153 3.770 1.00 0.00 C ATOM 0 HA PRO A 54 -0.153 -3.361 3.179 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -0.729 -6.043 2.741 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.727 -5.381 4.364 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -3.063 -5.902 2.535 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -2.918 -6.220 4.252 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -4.242 -4.034 3.314 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -3.384 -3.998 4.842 1.00 0.00 H new ATOM 878 N ALA A 55 0.399 -4.008 0.855 1.00 0.00 N ATOM 879 CA ALA A 55 0.705 -4.071 -0.568 1.00 0.00 C ATOM 880 C ALA A 55 -0.061 -5.203 -1.245 1.00 0.00 C ATOM 881 O ALA A 55 -0.713 -6.007 -0.580 1.00 0.00 O ATOM 882 CB ALA A 55 2.202 -4.244 -0.779 1.00 0.00 C ATOM 0 H ALA A 55 1.218 -4.015 1.463 1.00 0.00 H new ATOM 0 HA ALA A 55 0.391 -3.132 -1.024 1.00 0.00 H new ATOM 0 HB1 ALA A 55 2.416 -4.290 -1.847 1.00 0.00 H new ATOM 0 HB2 ALA A 55 2.732 -3.399 -0.338 1.00 0.00 H new ATOM 0 HB3 ALA A 55 2.532 -5.167 -0.303 1.00 0.00 H new ATOM 888 N GLU A 56 0.024 -5.259 -2.570 1.00 0.00 N ATOM 889 CA GLU A 56 -0.663 -6.293 -3.336 1.00 0.00 C ATOM 890 C GLU A 56 0.330 -7.118 -4.148 1.00 0.00 C ATOM 891 O GLU A 56 1.413 -6.646 -4.489 1.00 0.00 O ATOM 892 CB GLU A 56 -1.702 -5.664 -4.266 1.00 0.00 C ATOM 893 CG GLU A 56 -2.708 -6.661 -4.817 1.00 0.00 C ATOM 894 CD GLU A 56 -4.006 -6.004 -5.246 1.00 0.00 C ATOM 895 OE1 GLU A 56 -3.951 -5.065 -6.069 1.00 0.00 O ATOM 896 OE2 GLU A 56 -5.075 -6.427 -4.761 1.00 0.00 O ATOM 0 H GLU A 56 0.561 -4.601 -3.135 1.00 0.00 H new ATOM 0 HA GLU A 56 -1.169 -6.955 -2.633 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -2.236 -4.883 -3.725 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -1.188 -5.182 -5.098 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -2.269 -7.181 -5.669 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -2.920 -7.414 -4.058 1.00 0.00 H new ATOM 903 N ASN A 57 -0.048 -8.355 -4.455 1.00 0.00 N ATOM 904 CA ASN A 57 0.809 -9.248 -5.226 1.00 0.00 C ATOM 905 C ASN A 57 0.938 -8.766 -6.668 1.00 0.00 C ATOM 906 O ASN A 57 2.007 -8.860 -7.272 1.00 0.00 O ATOM 907 CB ASN A 57 0.252 -10.673 -5.200 1.00 0.00 C ATOM 908 CG ASN A 57 -1.225 -10.722 -5.541 1.00 0.00 C ATOM 909 OD1 ASN A 57 -2.070 -10.639 -4.520 1.00 0.00 O flip ATOM 910 ND2 ASN A 57 -1.602 -10.833 -6.707 1.00 0.00 N flip ATOM 0 H ASN A 57 -0.943 -8.762 -4.181 1.00 0.00 H new ATOM 0 HA ASN A 57 1.799 -9.245 -4.770 1.00 0.00 H new ATOM 0 HB2 ASN A 57 0.806 -11.290 -5.907 1.00 0.00 H new ATOM 0 HB3 ASN A 57 0.408 -11.103 -4.211 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -0.917 -10.894 -7.461 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -2.599 -10.864 -6.920 1.00 0.00 H new ATOM 917 N ASP A 58 -0.158 -8.251 -7.214 1.00 0.00 N ATOM 918 CA ASP A 58 -0.168 -7.752 -8.584 1.00 0.00 C ATOM 919 C ASP A 58 0.922 -6.704 -8.789 1.00 0.00 C ATOM 920 O ASP A 58 1.400 -6.501 -9.905 1.00 0.00 O ATOM 921 CB ASP A 58 -1.535 -7.158 -8.924 1.00 0.00 C ATOM 922 CG ASP A 58 -1.753 -7.022 -10.418 1.00 0.00 C ATOM 923 OD1 ASP A 58 -1.551 -8.021 -11.140 1.00 0.00 O ATOM 924 OD2 ASP A 58 -2.127 -5.917 -10.865 1.00 0.00 O ATOM 0 H ASP A 58 -1.051 -8.168 -6.729 1.00 0.00 H new ATOM 0 HA ASP A 58 0.030 -8.591 -9.251 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -2.317 -7.789 -8.502 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -1.629 -6.178 -8.456 1.00 0.00 H new ATOM 929 N VAL A 59 1.308 -6.040 -7.705 1.00 0.00 N ATOM 930 CA VAL A 59 2.341 -5.013 -7.765 1.00 0.00 C ATOM 931 C VAL A 59 3.643 -5.574 -8.326 1.00 0.00 C ATOM 932 O VAL A 59 4.062 -6.675 -7.968 1.00 0.00 O ATOM 933 CB VAL A 59 2.613 -4.407 -6.375 1.00 0.00 C ATOM 934 CG1 VAL A 59 3.723 -3.371 -6.451 1.00 0.00 C ATOM 935 CG2 VAL A 59 1.342 -3.798 -5.802 1.00 0.00 C ATOM 0 H VAL A 59 0.921 -6.195 -6.774 1.00 0.00 H new ATOM 0 HA VAL A 59 1.970 -4.231 -8.428 1.00 0.00 H new ATOM 0 HB VAL A 59 2.940 -5.205 -5.708 1.00 0.00 H new ATOM 0 HG11 VAL A 59 3.900 -2.954 -5.459 1.00 0.00 H new ATOM 0 HG12 VAL A 59 4.636 -3.842 -6.815 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.430 -2.573 -7.133 1.00 0.00 H new ATOM 0 HG21 VAL A 59 1.552 -3.375 -4.820 1.00 0.00 H new ATOM 0 HG22 VAL A 59 0.983 -3.012 -6.467 1.00 0.00 H new ATOM 0 HG23 VAL A 59 0.579 -4.570 -5.708 1.00 0.00 H new ATOM 945 N LYS A 60 4.279 -4.810 -9.207 1.00 0.00 N ATOM 946 CA LYS A 60 5.535 -5.229 -9.818 1.00 0.00 C ATOM 947 C LYS A 60 6.432 -4.027 -10.097 1.00 0.00 C ATOM 948 O LYS A 60 6.107 -2.898 -9.727 1.00 0.00 O ATOM 949 CB LYS A 60 5.265 -5.990 -11.118 1.00 0.00 C ATOM 950 CG LYS A 60 4.281 -5.290 -12.039 1.00 0.00 C ATOM 951 CD LYS A 60 4.975 -4.717 -13.264 1.00 0.00 C ATOM 952 CE LYS A 60 4.783 -5.608 -14.481 1.00 0.00 C ATOM 953 NZ LYS A 60 3.485 -5.344 -15.163 1.00 0.00 N ATOM 0 H LYS A 60 3.945 -3.896 -9.514 1.00 0.00 H new ATOM 0 HA LYS A 60 6.048 -5.889 -9.118 1.00 0.00 H new ATOM 0 HB2 LYS A 60 6.207 -6.133 -11.648 1.00 0.00 H new ATOM 0 HB3 LYS A 60 4.881 -6.981 -10.876 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.510 -5.994 -12.352 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.779 -4.489 -11.496 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.582 -3.722 -13.474 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.040 -4.602 -13.060 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.601 -5.446 -15.183 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.827 -6.654 -14.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.392 -5.971 -15.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.703 -5.523 -14.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.453 -4.353 -15.477 1.00 0.00 H new ATOM 967 N LEU A 61 7.561 -4.277 -10.751 1.00 0.00 N ATOM 968 CA LEU A 61 8.505 -3.214 -11.081 1.00 0.00 C ATOM 969 C LEU A 61 7.840 -2.144 -11.941 1.00 0.00 C ATOM 970 O LEU A 61 7.717 -0.991 -11.529 1.00 0.00 O ATOM 971 CB LEU A 61 9.718 -3.792 -11.812 1.00 0.00 C ATOM 972 CG LEU A 61 10.578 -2.789 -12.581 1.00 0.00 C ATOM 973 CD1 LEU A 61 11.141 -1.736 -11.639 1.00 0.00 C ATOM 974 CD2 LEU A 61 11.702 -3.504 -13.317 1.00 0.00 C ATOM 0 H LEU A 61 7.845 -5.206 -11.063 1.00 0.00 H new ATOM 0 HA LEU A 61 8.836 -2.752 -10.151 1.00 0.00 H new ATOM 0 HB2 LEU A 61 10.350 -4.298 -11.082 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.368 -4.551 -12.511 1.00 0.00 H new ATOM 0 HG LEU A 61 9.949 -2.289 -13.317 1.00 0.00 H new ATOM 0 HD11 LEU A 61 11.750 -1.031 -12.204 1.00 0.00 H new ATOM 0 HD12 LEU A 61 10.321 -1.203 -11.158 1.00 0.00 H new ATOM 0 HD13 LEU A 61 11.755 -2.219 -10.879 1.00 0.00 H new ATOM 0 HD21 LEU A 61 12.304 -2.774 -13.859 1.00 0.00 H new ATOM 0 HD22 LEU A 61 12.330 -4.031 -12.599 1.00 0.00 H new ATOM 0 HD23 LEU A 61 11.278 -4.220 -14.021 1.00 0.00 H new ATOM 986 N GLY A 62 7.412 -2.534 -13.138 1.00 0.00 N ATOM 987 CA GLY A 62 6.764 -1.597 -14.036 1.00 0.00 C ATOM 988 C GLY A 62 5.641 -0.832 -13.363 1.00 0.00 C ATOM 989 O GLY A 62 5.281 0.263 -13.796 1.00 0.00 O ATOM 0 H GLY A 62 7.503 -3.483 -13.502 1.00 0.00 H new ATOM 0 HA2 GLY A 62 7.503 -0.892 -14.416 1.00 0.00 H new ATOM 0 HA3 GLY A 62 6.367 -2.137 -14.896 1.00 0.00 H new ATOM 993 N ALA A 63 5.086 -1.409 -12.303 1.00 0.00 N ATOM 994 CA ALA A 63 3.998 -0.773 -11.570 1.00 0.00 C ATOM 995 C ALA A 63 4.509 0.395 -10.733 1.00 0.00 C ATOM 996 O ALA A 63 4.000 1.512 -10.832 1.00 0.00 O ATOM 997 CB ALA A 63 3.294 -1.791 -10.684 1.00 0.00 C ATOM 0 H ALA A 63 5.371 -2.315 -11.932 1.00 0.00 H new ATOM 0 HA ALA A 63 3.284 -0.382 -12.295 1.00 0.00 H new ATOM 0 HB1 ALA A 63 2.484 -1.303 -10.142 1.00 0.00 H new ATOM 0 HB2 ALA A 63 2.887 -2.591 -11.302 1.00 0.00 H new ATOM 0 HB3 ALA A 63 4.006 -2.208 -9.973 1.00 0.00 H new ATOM 1003 N LEU A 64 5.516 0.130 -9.908 1.00 0.00 N ATOM 1004 CA LEU A 64 6.096 1.160 -9.053 1.00 0.00 C ATOM 1005 C LEU A 64 7.059 2.042 -9.840 1.00 0.00 C ATOM 1006 O LEU A 64 6.846 3.248 -9.975 1.00 0.00 O ATOM 1007 CB LEU A 64 6.824 0.518 -7.871 1.00 0.00 C ATOM 1008 CG LEU A 64 6.039 -0.539 -7.093 1.00 0.00 C ATOM 1009 CD1 LEU A 64 6.909 -1.758 -6.824 1.00 0.00 C ATOM 1010 CD2 LEU A 64 5.511 0.040 -5.789 1.00 0.00 C ATOM 0 H LEU A 64 5.948 -0.789 -9.813 1.00 0.00 H new ATOM 0 HA LEU A 64 5.286 1.785 -8.677 1.00 0.00 H new ATOM 0 HB2 LEU A 64 7.742 0.061 -8.240 1.00 0.00 H new ATOM 0 HB3 LEU A 64 7.117 1.307 -7.178 1.00 0.00 H new ATOM 0 HG LEU A 64 5.188 -0.851 -7.699 1.00 0.00 H new ATOM 0 HD11 LEU A 64 6.334 -2.500 -6.270 1.00 0.00 H new ATOM 0 HD12 LEU A 64 7.237 -2.187 -7.771 1.00 0.00 H new ATOM 0 HD13 LEU A 64 7.779 -1.462 -6.239 1.00 0.00 H new ATOM 0 HD21 LEU A 64 4.955 -0.727 -5.249 1.00 0.00 H new ATOM 0 HD22 LEU A 64 6.347 0.381 -5.178 1.00 0.00 H new ATOM 0 HD23 LEU A 64 4.852 0.881 -6.005 1.00 0.00 H new ATOM 1022 N LYS A 65 8.120 1.434 -10.360 1.00 0.00 N ATOM 1023 CA LYS A 65 9.115 2.163 -11.138 1.00 0.00 C ATOM 1024 C LYS A 65 9.830 3.197 -10.274 1.00 0.00 C ATOM 1025 O LYS A 65 10.064 4.327 -10.706 1.00 0.00 O ATOM 1026 CB LYS A 65 8.455 2.851 -12.334 1.00 0.00 C ATOM 1027 CG LYS A 65 7.547 1.935 -13.138 1.00 0.00 C ATOM 1028 CD LYS A 65 7.909 1.946 -14.613 1.00 0.00 C ATOM 1029 CE LYS A 65 7.505 3.254 -15.276 1.00 0.00 C ATOM 1030 NZ LYS A 65 7.856 3.274 -16.723 1.00 0.00 N ATOM 0 H LYS A 65 8.313 0.438 -10.257 1.00 0.00 H new ATOM 0 HA LYS A 65 9.852 1.446 -11.501 1.00 0.00 H new ATOM 0 HB2 LYS A 65 7.875 3.703 -11.978 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.231 3.246 -12.989 1.00 0.00 H new ATOM 0 HG2 LYS A 65 7.620 0.918 -12.752 1.00 0.00 H new ATOM 0 HG3 LYS A 65 6.510 2.249 -13.014 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.983 1.796 -14.726 1.00 0.00 H new ATOM 0 HD3 LYS A 65 7.416 1.114 -15.116 1.00 0.00 H new ATOM 0 HE2 LYS A 65 6.431 3.403 -15.161 1.00 0.00 H new ATOM 0 HE3 LYS A 65 7.998 4.085 -14.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 7.565 4.182 -17.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.884 3.157 -16.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.365 2.497 -17.210 1.00 0.00 H new ATOM 1044 N LEU A 66 10.175 2.804 -9.052 1.00 0.00 N ATOM 1045 CA LEU A 66 10.865 3.698 -8.128 1.00 0.00 C ATOM 1046 C LEU A 66 12.352 3.366 -8.057 1.00 0.00 C ATOM 1047 O LEU A 66 12.835 2.477 -8.759 1.00 0.00 O ATOM 1048 CB LEU A 66 10.242 3.601 -6.734 1.00 0.00 C ATOM 1049 CG LEU A 66 9.408 4.802 -6.286 1.00 0.00 C ATOM 1050 CD1 LEU A 66 7.939 4.584 -6.615 1.00 0.00 C ATOM 1051 CD2 LEU A 66 9.592 5.053 -4.797 1.00 0.00 C ATOM 0 H LEU A 66 9.988 1.873 -8.679 1.00 0.00 H new ATOM 0 HA LEU A 66 10.757 4.718 -8.498 1.00 0.00 H new ATOM 0 HB2 LEU A 66 9.611 2.713 -6.701 1.00 0.00 H new ATOM 0 HB3 LEU A 66 11.043 3.450 -6.010 1.00 0.00 H new ATOM 0 HG LEU A 66 9.753 5.683 -6.828 1.00 0.00 H new ATOM 0 HD11 LEU A 66 7.361 5.449 -6.289 1.00 0.00 H new ATOM 0 HD12 LEU A 66 7.822 4.454 -7.691 1.00 0.00 H new ATOM 0 HD13 LEU A 66 7.579 3.693 -6.101 1.00 0.00 H new ATOM 0 HD21 LEU A 66 8.991 5.911 -4.496 1.00 0.00 H new ATOM 0 HD22 LEU A 66 9.274 4.173 -4.238 1.00 0.00 H new ATOM 0 HD23 LEU A 66 10.643 5.255 -4.589 1.00 0.00 H new ATOM 1063 N LYS A 67 13.073 4.084 -7.204 1.00 0.00 N ATOM 1064 CA LYS A 67 14.505 3.865 -7.037 1.00 0.00 C ATOM 1065 C LYS A 67 14.832 3.472 -5.600 1.00 0.00 C ATOM 1066 O LYS A 67 14.054 3.706 -4.675 1.00 0.00 O ATOM 1067 CB LYS A 67 15.283 5.125 -7.423 1.00 0.00 C ATOM 1068 CG LYS A 67 14.559 6.415 -7.079 1.00 0.00 C ATOM 1069 CD LYS A 67 15.477 7.620 -7.205 1.00 0.00 C ATOM 1070 CE LYS A 67 15.784 7.937 -8.661 1.00 0.00 C ATOM 1071 NZ LYS A 67 14.558 8.317 -9.416 1.00 0.00 N ATOM 0 H LYS A 67 12.689 4.824 -6.616 1.00 0.00 H new ATOM 0 HA LYS A 67 14.801 3.047 -7.694 1.00 0.00 H new ATOM 0 HB2 LYS A 67 16.249 5.114 -6.918 1.00 0.00 H new ATOM 0 HB3 LYS A 67 15.483 5.105 -8.494 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.701 6.539 -7.740 1.00 0.00 H new ATOM 0 HG3 LYS A 67 14.172 6.356 -6.062 1.00 0.00 H new ATOM 0 HD2 LYS A 67 15.010 8.485 -6.734 1.00 0.00 H new ATOM 0 HD3 LYS A 67 16.407 7.428 -6.669 1.00 0.00 H new ATOM 0 HE2 LYS A 67 16.508 8.750 -8.711 1.00 0.00 H new ATOM 0 HE3 LYS A 67 16.246 7.069 -9.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 14.827 8.825 -10.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 14.026 7.460 -9.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 13.963 8.932 -8.825 1.00 0.00 H new ATOM 1085 N PRO A 68 16.010 2.862 -5.406 1.00 0.00 N ATOM 1086 CA PRO A 68 16.468 2.426 -4.083 1.00 0.00 C ATOM 1087 C PRO A 68 16.815 3.599 -3.174 1.00 0.00 C ATOM 1088 O PRO A 68 16.921 3.444 -1.958 1.00 0.00 O ATOM 1089 CB PRO A 68 17.720 1.602 -4.395 1.00 0.00 C ATOM 1090 CG PRO A 68 18.212 2.138 -5.694 1.00 0.00 C ATOM 1091 CD PRO A 68 16.988 2.551 -6.463 1.00 0.00 C ATOM 0 HA PRO A 68 15.698 1.871 -3.548 1.00 0.00 H new ATOM 0 HB2 PRO A 68 18.471 1.711 -3.612 1.00 0.00 H new ATOM 0 HB3 PRO A 68 17.487 0.540 -4.468 1.00 0.00 H new ATOM 0 HG2 PRO A 68 18.879 2.986 -5.538 1.00 0.00 H new ATOM 0 HG3 PRO A 68 18.778 1.382 -6.238 1.00 0.00 H new ATOM 0 HD2 PRO A 68 17.184 3.416 -7.096 1.00 0.00 H new ATOM 0 HD3 PRO A 68 16.635 1.752 -7.115 1.00 0.00 H new ATOM 1099 N ASN A 69 16.989 4.774 -3.772 1.00 0.00 N ATOM 1100 CA ASN A 69 17.324 5.974 -3.014 1.00 0.00 C ATOM 1101 C ASN A 69 16.299 6.227 -1.913 1.00 0.00 C ATOM 1102 O ASN A 69 16.587 6.900 -0.923 1.00 0.00 O ATOM 1103 CB ASN A 69 17.397 7.186 -3.946 1.00 0.00 C ATOM 1104 CG ASN A 69 18.291 8.282 -3.400 1.00 0.00 C ATOM 1105 OD1 ASN A 69 17.862 9.424 -3.233 1.00 0.00 O ATOM 1106 ND2 ASN A 69 19.543 7.939 -3.118 1.00 0.00 N ATOM 0 H ASN A 69 16.904 4.920 -4.778 1.00 0.00 H new ATOM 0 HA ASN A 69 18.298 5.820 -2.550 1.00 0.00 H new ATOM 0 HB2 ASN A 69 17.769 6.870 -4.921 1.00 0.00 H new ATOM 0 HB3 ASN A 69 16.394 7.583 -4.101 1.00 0.00 H new ATOM 0 HD21 ASN A 69 20.191 8.634 -2.747 1.00 0.00 H new ATOM 0 HD22 ASN A 69 19.856 6.981 -3.272 1.00 0.00 H new ATOM 1113 N THR A 70 15.100 5.680 -2.091 1.00 0.00 N ATOM 1114 CA THR A 70 14.032 5.846 -1.114 1.00 0.00 C ATOM 1115 C THR A 70 14.507 5.480 0.287 1.00 0.00 C ATOM 1116 O THR A 70 13.961 5.956 1.283 1.00 0.00 O ATOM 1117 CB THR A 70 12.806 4.984 -1.470 1.00 0.00 C ATOM 1118 OG1 THR A 70 13.214 3.848 -2.240 1.00 0.00 O ATOM 1119 CG2 THR A 70 11.783 5.793 -2.253 1.00 0.00 C ATOM 0 H THR A 70 14.845 5.118 -2.903 1.00 0.00 H new ATOM 0 HA THR A 70 13.746 6.898 -1.134 1.00 0.00 H new ATOM 0 HB THR A 70 12.344 4.647 -0.542 1.00 0.00 H new ATOM 0 HG1 THR A 70 13.216 4.082 -3.192 1.00 0.00 H new ATOM 0 HG21 THR A 70 10.927 5.163 -2.493 1.00 0.00 H new ATOM 0 HG22 THR A 70 11.453 6.641 -1.653 1.00 0.00 H new ATOM 0 HG23 THR A 70 12.235 6.156 -3.176 1.00 0.00 H new ATOM 1127 N LYS A 71 15.528 4.632 0.358 1.00 0.00 N ATOM 1128 CA LYS A 71 16.079 4.203 1.638 1.00 0.00 C ATOM 1129 C LYS A 71 14.969 3.967 2.657 1.00 0.00 C ATOM 1130 O LYS A 71 14.512 4.901 3.318 1.00 0.00 O ATOM 1131 CB LYS A 71 17.061 5.250 2.171 1.00 0.00 C ATOM 1132 CG LYS A 71 16.485 6.654 2.221 1.00 0.00 C ATOM 1133 CD LYS A 71 17.507 7.658 2.727 1.00 0.00 C ATOM 1134 CE LYS A 71 16.888 9.034 2.920 1.00 0.00 C ATOM 1135 NZ LYS A 71 17.880 10.023 3.424 1.00 0.00 N ATOM 0 H LYS A 71 15.991 4.228 -0.456 1.00 0.00 H new ATOM 0 HA LYS A 71 16.609 3.264 1.480 1.00 0.00 H new ATOM 0 HB2 LYS A 71 17.379 4.961 3.173 1.00 0.00 H new ATOM 0 HB3 LYS A 71 17.952 5.254 1.543 1.00 0.00 H new ATOM 0 HG2 LYS A 71 16.149 6.946 1.226 1.00 0.00 H new ATOM 0 HG3 LYS A 71 15.609 6.666 2.870 1.00 0.00 H new ATOM 0 HD2 LYS A 71 17.924 7.310 3.672 1.00 0.00 H new ATOM 0 HD3 LYS A 71 18.333 7.726 2.020 1.00 0.00 H new ATOM 0 HE2 LYS A 71 16.476 9.383 1.973 1.00 0.00 H new ATOM 0 HE3 LYS A 71 16.057 8.963 3.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 17.419 10.948 3.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 18.254 9.703 4.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 18.661 10.110 2.742 1.00 0.00 H new ATOM 1149 N ILE A 72 14.541 2.716 2.780 1.00 0.00 N ATOM 1150 CA ILE A 72 13.486 2.358 3.721 1.00 0.00 C ATOM 1151 C ILE A 72 14.069 1.934 5.065 1.00 0.00 C ATOM 1152 O ILE A 72 15.144 1.338 5.126 1.00 0.00 O ATOM 1153 CB ILE A 72 12.606 1.219 3.173 1.00 0.00 C ATOM 1154 CG1 ILE A 72 11.478 0.899 4.156 1.00 0.00 C ATOM 1155 CG2 ILE A 72 13.448 -0.019 2.904 1.00 0.00 C ATOM 1156 CD1 ILE A 72 11.825 -0.199 5.137 1.00 0.00 C ATOM 0 H ILE A 72 14.908 1.932 2.240 1.00 0.00 H new ATOM 0 HA ILE A 72 12.871 3.247 3.859 1.00 0.00 H new ATOM 0 HB ILE A 72 12.162 1.544 2.232 1.00 0.00 H new ATOM 0 HG12 ILE A 72 11.222 1.802 4.710 1.00 0.00 H new ATOM 0 HG13 ILE A 72 10.590 0.607 3.595 1.00 0.00 H new ATOM 0 HG21 ILE A 72 12.812 -0.815 2.517 1.00 0.00 H new ATOM 0 HG22 ILE A 72 14.219 0.218 2.171 1.00 0.00 H new ATOM 0 HG23 ILE A 72 13.918 -0.348 3.831 1.00 0.00 H new ATOM 0 HD11 ILE A 72 10.980 -0.373 5.803 1.00 0.00 H new ATOM 0 HD12 ILE A 72 12.052 -1.115 4.592 1.00 0.00 H new ATOM 0 HD13 ILE A 72 12.694 0.099 5.724 1.00 0.00 H new ATOM 1168 N MET A 73 13.350 2.244 6.139 1.00 0.00 N ATOM 1169 CA MET A 73 13.795 1.893 7.483 1.00 0.00 C ATOM 1170 C MET A 73 12.754 1.032 8.191 1.00 0.00 C ATOM 1171 O MET A 73 11.604 1.439 8.352 1.00 0.00 O ATOM 1172 CB MET A 73 14.070 3.157 8.299 1.00 0.00 C ATOM 1173 CG MET A 73 15.468 3.204 8.893 1.00 0.00 C ATOM 1174 SD MET A 73 15.753 4.685 9.881 1.00 0.00 S ATOM 1175 CE MET A 73 17.275 5.290 9.155 1.00 0.00 C ATOM 0 H MET A 73 12.458 2.737 6.105 1.00 0.00 H new ATOM 0 HA MET A 73 14.718 1.319 7.396 1.00 0.00 H new ATOM 0 HB2 MET A 73 13.925 4.030 7.662 1.00 0.00 H new ATOM 0 HB3 MET A 73 13.339 3.226 9.105 1.00 0.00 H new ATOM 0 HG2 MET A 73 15.625 2.322 9.514 1.00 0.00 H new ATOM 0 HG3 MET A 73 16.202 3.162 8.088 1.00 0.00 H new ATOM 0 HE1 MET A 73 17.581 6.205 9.661 1.00 0.00 H new ATOM 0 HE2 MET A 73 18.055 4.537 9.265 1.00 0.00 H new ATOM 0 HE3 MET A 73 17.116 5.497 8.097 1.00 0.00 H new ATOM 1185 N MET A 74 13.166 -0.160 8.613 1.00 0.00 N ATOM 1186 CA MET A 74 12.268 -1.077 9.305 1.00 0.00 C ATOM 1187 C MET A 74 12.457 -0.985 10.816 1.00 0.00 C ATOM 1188 O MET A 74 13.583 -0.905 11.306 1.00 0.00 O ATOM 1189 CB MET A 74 12.510 -2.513 8.835 1.00 0.00 C ATOM 1190 CG MET A 74 12.076 -2.765 7.401 1.00 0.00 C ATOM 1191 SD MET A 74 12.020 -4.519 6.989 1.00 0.00 S ATOM 1192 CE MET A 74 10.337 -4.675 6.397 1.00 0.00 C ATOM 0 H MET A 74 14.115 -0.513 8.488 1.00 0.00 H new ATOM 0 HA MET A 74 11.243 -0.793 9.067 1.00 0.00 H new ATOM 0 HB2 MET A 74 13.571 -2.744 8.931 1.00 0.00 H new ATOM 0 HB3 MET A 74 11.975 -3.197 9.493 1.00 0.00 H new ATOM 0 HG2 MET A 74 11.091 -2.327 7.242 1.00 0.00 H new ATOM 0 HG3 MET A 74 12.763 -2.259 6.723 1.00 0.00 H new ATOM 0 HE1 MET A 74 10.235 -5.601 5.832 1.00 0.00 H new ATOM 0 HE2 MET A 74 9.653 -4.690 7.245 1.00 0.00 H new ATOM 0 HE3 MET A 74 10.098 -3.829 5.753 1.00 0.00 H new ATOM 1202 N MET A 75 11.348 -0.997 11.548 1.00 0.00 N ATOM 1203 CA MET A 75 11.392 -0.916 13.003 1.00 0.00 C ATOM 1204 C MET A 75 10.789 -2.166 13.636 1.00 0.00 C ATOM 1205 O MET A 75 9.822 -2.727 13.125 1.00 0.00 O ATOM 1206 CB MET A 75 10.644 0.327 13.489 1.00 0.00 C ATOM 1207 CG MET A 75 10.951 1.576 12.679 1.00 0.00 C ATOM 1208 SD MET A 75 11.036 3.062 13.697 1.00 0.00 S ATOM 1209 CE MET A 75 11.456 4.293 12.465 1.00 0.00 C ATOM 0 H MET A 75 10.408 -1.062 11.157 1.00 0.00 H new ATOM 0 HA MET A 75 12.437 -0.845 13.306 1.00 0.00 H new ATOM 0 HB2 MET A 75 9.572 0.134 13.451 1.00 0.00 H new ATOM 0 HB3 MET A 75 10.899 0.509 14.533 1.00 0.00 H new ATOM 0 HG2 MET A 75 11.899 1.442 12.158 1.00 0.00 H new ATOM 0 HG3 MET A 75 10.184 1.707 11.916 1.00 0.00 H new ATOM 0 HE1 MET A 75 11.154 5.279 12.818 1.00 0.00 H new ATOM 0 HE2 MET A 75 12.532 4.283 12.293 1.00 0.00 H new ATOM 0 HE3 MET A 75 10.938 4.067 11.533 1.00 0.00 H new ATOM 1219 N GLY A 76 11.369 -2.597 14.753 1.00 0.00 N ATOM 1220 CA GLY A 76 10.875 -3.778 15.437 1.00 0.00 C ATOM 1221 C GLY A 76 11.176 -5.055 14.678 1.00 0.00 C ATOM 1222 O GLY A 76 10.697 -6.130 15.041 1.00 0.00 O ATOM 0 H GLY A 76 12.172 -2.149 15.196 1.00 0.00 H new ATOM 0 HA2 GLY A 76 11.323 -3.834 16.429 1.00 0.00 H new ATOM 0 HA3 GLY A 76 9.798 -3.688 15.579 1.00 0.00 H new ATOM 1226 N THR A 77 11.971 -4.940 13.618 1.00 0.00 N ATOM 1227 CA THR A 77 12.332 -6.093 12.804 1.00 0.00 C ATOM 1228 C THR A 77 13.598 -6.761 13.329 1.00 0.00 C ATOM 1229 O THR A 77 14.689 -6.196 13.246 1.00 0.00 O ATOM 1230 CB THR A 77 12.547 -5.696 11.332 1.00 0.00 C ATOM 1231 OG1 THR A 77 13.195 -4.421 11.257 1.00 0.00 O ATOM 1232 CG2 THR A 77 11.222 -5.641 10.587 1.00 0.00 C ATOM 0 H THR A 77 12.377 -4.059 13.304 1.00 0.00 H new ATOM 0 HA THR A 77 11.501 -6.796 12.865 1.00 0.00 H new ATOM 0 HB THR A 77 13.178 -6.452 10.864 1.00 0.00 H new ATOM 0 HG1 THR A 77 13.967 -4.410 11.861 1.00 0.00 H new ATOM 0 HG21 THR A 77 11.399 -5.358 9.549 1.00 0.00 H new ATOM 0 HG22 THR A 77 10.745 -6.621 10.620 1.00 0.00 H new ATOM 0 HG23 THR A 77 10.571 -4.904 11.057 1.00 0.00 H new ATOM 1240 N ARG A 78 13.446 -7.966 13.868 1.00 0.00 N ATOM 1241 CA ARG A 78 14.578 -8.711 14.406 1.00 0.00 C ATOM 1242 C ARG A 78 15.035 -9.788 13.428 1.00 0.00 C ATOM 1243 O ARG A 78 14.379 -10.041 12.417 1.00 0.00 O ATOM 1244 CB ARG A 78 14.205 -9.349 15.746 1.00 0.00 C ATOM 1245 CG ARG A 78 15.369 -9.449 16.718 1.00 0.00 C ATOM 1246 CD ARG A 78 14.897 -9.388 18.162 1.00 0.00 C ATOM 1247 NE ARG A 78 15.986 -9.069 19.081 1.00 0.00 N ATOM 1248 CZ ARG A 78 16.500 -7.851 19.217 1.00 0.00 C ATOM 1249 NH1 ARG A 78 16.025 -6.844 18.498 1.00 0.00 N ATOM 1250 NH2 ARG A 78 17.490 -7.640 20.075 1.00 0.00 N ATOM 0 H ARG A 78 12.550 -8.447 13.944 1.00 0.00 H new ATOM 0 HA ARG A 78 15.400 -8.012 14.560 1.00 0.00 H new ATOM 0 HB2 ARG A 78 13.407 -8.766 16.207 1.00 0.00 H new ATOM 0 HB3 ARG A 78 13.807 -10.347 15.565 1.00 0.00 H new ATOM 0 HG2 ARG A 78 15.906 -10.382 16.549 1.00 0.00 H new ATOM 0 HG3 ARG A 78 16.072 -8.638 16.530 1.00 0.00 H new ATOM 0 HD2 ARG A 78 14.112 -8.637 18.255 1.00 0.00 H new ATOM 0 HD3 ARG A 78 14.457 -10.346 18.440 1.00 0.00 H new ATOM 0 HE ARG A 78 16.373 -9.822 19.650 1.00 0.00 H new ATOM 0 HH11 ARG A 78 15.263 -7.003 17.839 1.00 0.00 H new ATOM 0 HH12 ARG A 78 16.421 -5.910 18.604 1.00 0.00 H new ATOM 0 HH21 ARG A 78 17.857 -8.413 20.630 1.00 0.00 H new ATOM 0 HH22 ARG A 78 17.884 -6.705 20.179 1.00 0.00 H new ATOM 1264 N GLU A 79 16.164 -10.419 13.735 1.00 0.00 N ATOM 1265 CA GLU A 79 16.709 -11.468 12.881 1.00 0.00 C ATOM 1266 C GLU A 79 16.367 -12.850 13.431 1.00 0.00 C ATOM 1267 O GLU A 79 16.729 -13.187 14.558 1.00 0.00 O ATOM 1268 CB GLU A 79 18.226 -11.318 12.756 1.00 0.00 C ATOM 1269 CG GLU A 79 18.807 -12.006 11.532 1.00 0.00 C ATOM 1270 CD GLU A 79 18.682 -13.516 11.596 1.00 0.00 C ATOM 1271 OE1 GLU A 79 18.785 -14.073 12.708 1.00 0.00 O ATOM 1272 OE2 GLU A 79 18.480 -14.139 10.533 1.00 0.00 O ATOM 0 H GLU A 79 16.719 -10.222 14.568 1.00 0.00 H new ATOM 0 HA GLU A 79 16.259 -11.367 11.893 1.00 0.00 H new ATOM 0 HB2 GLU A 79 18.476 -10.258 12.719 1.00 0.00 H new ATOM 0 HB3 GLU A 79 18.698 -11.726 13.650 1.00 0.00 H new ATOM 0 HG2 GLU A 79 18.299 -11.641 10.639 1.00 0.00 H new ATOM 0 HG3 GLU A 79 19.858 -11.736 11.433 1.00 0.00 H new ATOM 1279 N GLU A 80 15.666 -13.644 12.627 1.00 0.00 N ATOM 1280 CA GLU A 80 15.274 -14.988 13.035 1.00 0.00 C ATOM 1281 C GLU A 80 16.134 -16.040 12.339 1.00 0.00 C ATOM 1282 O GLU A 80 15.850 -16.442 11.211 1.00 0.00 O ATOM 1283 CB GLU A 80 13.797 -15.231 12.718 1.00 0.00 C ATOM 1284 CG GLU A 80 12.866 -14.199 13.332 1.00 0.00 C ATOM 1285 CD GLU A 80 12.851 -14.255 14.847 1.00 0.00 C ATOM 1286 OE1 GLU A 80 13.905 -13.988 15.462 1.00 0.00 O ATOM 1287 OE2 GLU A 80 11.785 -14.566 15.419 1.00 0.00 O ATOM 0 H GLU A 80 15.358 -13.380 11.691 1.00 0.00 H new ATOM 0 HA GLU A 80 15.426 -15.072 14.111 1.00 0.00 H new ATOM 0 HB2 GLU A 80 13.662 -15.233 11.636 1.00 0.00 H new ATOM 0 HB3 GLU A 80 13.515 -16.221 13.076 1.00 0.00 H new ATOM 0 HG2 GLU A 80 13.172 -13.203 13.012 1.00 0.00 H new ATOM 0 HG3 GLU A 80 11.855 -14.358 12.956 1.00 0.00 H new ATOM 1294 N SER A 81 17.187 -16.481 13.021 1.00 0.00 N ATOM 1295 CA SER A 81 18.091 -17.482 12.468 1.00 0.00 C ATOM 1296 C SER A 81 17.367 -18.808 12.254 1.00 0.00 C ATOM 1297 O SER A 81 16.789 -19.368 13.183 1.00 0.00 O ATOM 1298 CB SER A 81 19.289 -17.686 13.397 1.00 0.00 C ATOM 1299 OG SER A 81 20.111 -16.532 13.431 1.00 0.00 O ATOM 0 H SER A 81 17.435 -16.160 13.957 1.00 0.00 H new ATOM 0 HA SER A 81 18.446 -17.122 11.502 1.00 0.00 H new ATOM 0 HB2 SER A 81 18.938 -17.916 14.403 1.00 0.00 H new ATOM 0 HB3 SER A 81 19.873 -18.542 13.060 1.00 0.00 H new ATOM 0 HG SER A 81 19.580 -15.745 13.187 1.00 0.00 H new TER 1305 SER A 81