USER MOD reduce.3.24.130724 H: found=0, std=0, add=681, rem=0, adj=18 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 36 THR OG1 : rot -145:sc= -0.939 USER MOD Set 1.2: A 43 GLN : amide:sc= -4.52! C(o=-8!,f=-10!) USER MOD Set 1.3: A 74 MET CE :methyl 161:sc= -2.5 (180deg=-1.94) USER MOD Set 2.1: A 12 GLN : amide:sc= 0.0567 X(o=0.048,f=-0.031) USER MOD Set 2.2: A 14 TYR OH : rot 30:sc=-0.00825 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -155:sc= -0.211 (180deg=-1.06) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0.0146 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 -131:sc= 0.113 USER MOD Single : A 24 THR OG1 : rot 180:sc= -1.62 USER MOD Single : A 29 LYS NZ :NH3+ 140:sc= -2.55 (180deg=-4.33!) USER MOD Single : A 30 GLN : amide:sc= -0.513 K(o=-0.51,f=-1.4) USER MOD Single : A 33 LYS NZ :NH3+ -148:sc= 0.112 (180deg=-1.42!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 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= 0.115 K(o=0.12,f=-0.99) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ -127:sc= -1.37 (180deg=-2.66!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -0.207 X(o=-0.21,f=-0.21) USER MOD Single : A 70 THR OG1 : rot -160:sc= -0.267 USER MOD Single : A 71 LYS NZ :NH3+ -111:sc= -0.422 (180deg=-3.2!) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -173:sc= 0 (180deg=-0.043) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.711 0.018 0.035 1.00 0.00 N ATOM 2 CA MET A 1 2.227 0.008 -1.329 1.00 0.00 C ATOM 3 C MET A 1 2.569 -1.411 -1.771 1.00 0.00 C ATOM 4 O MET A 1 2.893 -2.266 -0.947 1.00 0.00 O ATOM 5 CB MET A 1 3.466 0.900 -1.434 1.00 0.00 C ATOM 6 CG MET A 1 3.241 2.316 -0.929 1.00 0.00 C ATOM 7 SD MET A 1 2.327 3.335 -2.103 1.00 0.00 S ATOM 8 CE MET A 1 1.260 4.252 -0.995 1.00 0.00 C ATOM 0 H1 MET A 1 1.110 0.855 0.173 1.00 0.00 H new ATOM 0 H2 MET A 1 1.150 -0.842 0.200 1.00 0.00 H new ATOM 0 H3 MET A 1 2.505 0.048 0.706 1.00 0.00 H new ATOM 0 HA MET A 1 1.450 0.397 -1.988 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.279 0.446 -0.868 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.787 0.941 -2.475 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.697 2.279 0.015 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.205 2.782 -0.723 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.630 4.928 -1.573 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.631 3.558 -0.438 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.868 4.829 -0.298 1.00 0.00 H new ATOM 18 N ALA A 2 2.493 -1.655 -3.075 1.00 0.00 N ATOM 19 CA ALA A 2 2.796 -2.970 -3.625 1.00 0.00 C ATOM 20 C ALA A 2 4.255 -3.061 -4.059 1.00 0.00 C ATOM 21 O ALA A 2 4.792 -2.134 -4.666 1.00 0.00 O ATOM 22 CB ALA A 2 1.875 -3.277 -4.797 1.00 0.00 C ATOM 0 H ALA A 2 2.224 -0.959 -3.770 1.00 0.00 H new ATOM 0 HA ALA A 2 2.630 -3.711 -2.843 1.00 0.00 H new ATOM 0 HB1 ALA A 2 2.113 -4.262 -5.198 1.00 0.00 H new ATOM 0 HB2 ALA A 2 0.839 -3.263 -4.459 1.00 0.00 H new ATOM 0 HB3 ALA A 2 2.013 -2.526 -5.575 1.00 0.00 H new ATOM 28 N LEU A 3 4.892 -4.183 -3.743 1.00 0.00 N ATOM 29 CA LEU A 3 6.291 -4.395 -4.100 1.00 0.00 C ATOM 30 C LEU A 3 6.423 -5.476 -5.168 1.00 0.00 C ATOM 31 O LEU A 3 6.018 -6.624 -4.978 1.00 0.00 O ATOM 32 CB LEU A 3 7.100 -4.785 -2.862 1.00 0.00 C ATOM 33 CG LEU A 3 7.600 -3.628 -1.996 1.00 0.00 C ATOM 34 CD1 LEU A 3 8.747 -2.904 -2.683 1.00 0.00 C ATOM 35 CD2 LEU A 3 6.465 -2.662 -1.688 1.00 0.00 C ATOM 0 H LEU A 3 4.463 -4.960 -3.241 1.00 0.00 H new ATOM 0 HA LEU A 3 6.683 -3.461 -4.504 1.00 0.00 H new ATOM 0 HB2 LEU A 3 6.486 -5.438 -2.242 1.00 0.00 H new ATOM 0 HB3 LEU A 3 7.961 -5.370 -3.185 1.00 0.00 H new ATOM 0 HG LEU A 3 7.967 -4.037 -1.055 1.00 0.00 H new ATOM 0 HD11 LEU A 3 9.090 -2.084 -2.052 1.00 0.00 H new ATOM 0 HD12 LEU A 3 9.568 -3.601 -2.851 1.00 0.00 H new ATOM 0 HD13 LEU A 3 8.406 -2.508 -3.640 1.00 0.00 H new ATOM 0 HD21 LEU A 3 6.840 -1.845 -1.071 1.00 0.00 H new ATOM 0 HD22 LEU A 3 6.067 -2.260 -2.619 1.00 0.00 H new ATOM 0 HD23 LEU A 3 5.675 -3.188 -1.153 1.00 0.00 H new ATOM 47 N PRO A 4 7.003 -5.104 -6.318 1.00 0.00 N ATOM 48 CA PRO A 4 7.205 -6.028 -7.439 1.00 0.00 C ATOM 49 C PRO A 4 8.259 -7.087 -7.135 1.00 0.00 C ATOM 50 O PRO A 4 9.121 -6.889 -6.277 1.00 0.00 O ATOM 51 CB PRO A 4 7.676 -5.114 -8.572 1.00 0.00 C ATOM 52 CG PRO A 4 8.290 -3.944 -7.884 1.00 0.00 C ATOM 53 CD PRO A 4 7.509 -3.753 -6.614 1.00 0.00 C ATOM 0 HA PRO A 4 6.300 -6.588 -7.674 1.00 0.00 H new ATOM 0 HB2 PRO A 4 8.397 -5.619 -9.214 1.00 0.00 H new ATOM 0 HB3 PRO A 4 6.844 -4.808 -9.206 1.00 0.00 H new ATOM 0 HG2 PRO A 4 9.343 -4.126 -7.671 1.00 0.00 H new ATOM 0 HG3 PRO A 4 8.241 -3.053 -8.510 1.00 0.00 H new ATOM 0 HD2 PRO A 4 8.138 -3.374 -5.809 1.00 0.00 H new ATOM 0 HD3 PRO A 4 6.696 -3.039 -6.746 1.00 0.00 H new ATOM 61 N ILE A 5 8.185 -8.209 -7.842 1.00 0.00 N ATOM 62 CA ILE A 5 9.135 -9.297 -7.649 1.00 0.00 C ATOM 63 C ILE A 5 9.378 -10.054 -8.950 1.00 0.00 C ATOM 64 O ILE A 5 8.434 -10.470 -9.623 1.00 0.00 O ATOM 65 CB ILE A 5 8.645 -10.288 -6.576 1.00 0.00 C ATOM 66 CG1 ILE A 5 9.038 -9.798 -5.181 1.00 0.00 C ATOM 67 CG2 ILE A 5 9.214 -11.675 -6.836 1.00 0.00 C ATOM 68 CD1 ILE A 5 9.885 -10.786 -4.410 1.00 0.00 C ATOM 0 H ILE A 5 7.477 -8.389 -8.554 1.00 0.00 H new ATOM 0 HA ILE A 5 10.069 -8.844 -7.316 1.00 0.00 H new ATOM 0 HB ILE A 5 7.558 -10.348 -6.627 1.00 0.00 H new ATOM 0 HG12 ILE A 5 9.584 -8.859 -5.275 1.00 0.00 H new ATOM 0 HG13 ILE A 5 8.133 -9.585 -4.611 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.859 -12.364 -6.069 1.00 0.00 H new ATOM 0 HG22 ILE A 5 8.889 -12.024 -7.816 1.00 0.00 H new ATOM 0 HG23 ILE A 5 10.303 -11.633 -6.809 1.00 0.00 H new ATOM 0 HD11 ILE A 5 10.126 -10.372 -3.431 1.00 0.00 H new ATOM 0 HD12 ILE A 5 9.334 -11.718 -4.285 1.00 0.00 H new ATOM 0 HD13 ILE A 5 10.807 -10.981 -4.958 1.00 0.00 H new ATOM 80 N ILE A 6 10.648 -10.229 -9.299 1.00 0.00 N ATOM 81 CA ILE A 6 11.014 -10.938 -10.518 1.00 0.00 C ATOM 82 C ILE A 6 11.355 -12.395 -10.226 1.00 0.00 C ATOM 83 O ILE A 6 12.150 -12.691 -9.333 1.00 0.00 O ATOM 84 CB ILE A 6 12.213 -10.272 -11.218 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.854 -8.849 -11.651 1.00 0.00 C ATOM 86 CG2 ILE A 6 12.654 -11.100 -12.416 1.00 0.00 C ATOM 87 CD1 ILE A 6 13.041 -7.914 -11.698 1.00 0.00 C ATOM 0 H ILE A 6 11.441 -9.889 -8.754 1.00 0.00 H new ATOM 0 HA ILE A 6 10.148 -10.896 -11.179 1.00 0.00 H new ATOM 0 HB ILE A 6 13.042 -10.218 -10.512 1.00 0.00 H new ATOM 0 HG12 ILE A 6 11.390 -8.884 -12.637 1.00 0.00 H new ATOM 0 HG13 ILE A 6 11.111 -8.445 -10.963 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.502 -10.616 -12.900 1.00 0.00 H new ATOM 0 HG22 ILE A 6 12.946 -12.096 -12.082 1.00 0.00 H new ATOM 0 HG23 ILE A 6 11.830 -11.182 -13.125 1.00 0.00 H new ATOM 0 HD11 ILE A 6 12.712 -6.924 -12.013 1.00 0.00 H new ATOM 0 HD12 ILE A 6 13.492 -7.849 -10.708 1.00 0.00 H new ATOM 0 HD13 ILE A 6 13.776 -8.294 -12.407 1.00 0.00 H new ATOM 99 N VAL A 7 10.750 -13.303 -10.985 1.00 0.00 N ATOM 100 CA VAL A 7 10.992 -14.730 -10.810 1.00 0.00 C ATOM 101 C VAL A 7 11.673 -15.327 -12.036 1.00 0.00 C ATOM 102 O VAL A 7 11.390 -14.937 -13.169 1.00 0.00 O ATOM 103 CB VAL A 7 9.681 -15.493 -10.542 1.00 0.00 C ATOM 104 CG1 VAL A 7 8.975 -15.817 -11.850 1.00 0.00 C ATOM 105 CG2 VAL A 7 9.955 -16.760 -9.746 1.00 0.00 C ATOM 0 H VAL A 7 10.088 -13.076 -11.727 1.00 0.00 H new ATOM 0 HA VAL A 7 11.648 -14.836 -9.946 1.00 0.00 H new ATOM 0 HB VAL A 7 9.024 -14.855 -9.951 1.00 0.00 H new ATOM 0 HG11 VAL A 7 8.051 -16.356 -11.641 1.00 0.00 H new ATOM 0 HG12 VAL A 7 8.744 -14.892 -12.378 1.00 0.00 H new ATOM 0 HG13 VAL A 7 9.624 -16.436 -12.470 1.00 0.00 H new ATOM 0 HG21 VAL A 7 9.018 -17.286 -9.566 1.00 0.00 H new ATOM 0 HG22 VAL A 7 10.631 -17.404 -10.309 1.00 0.00 H new ATOM 0 HG23 VAL A 7 10.413 -16.499 -8.792 1.00 0.00 H new ATOM 115 N LYS A 8 12.573 -16.276 -11.803 1.00 0.00 N ATOM 116 CA LYS A 8 13.295 -16.930 -12.888 1.00 0.00 C ATOM 117 C LYS A 8 13.055 -18.436 -12.871 1.00 0.00 C ATOM 118 O LYS A 8 13.342 -19.109 -11.881 1.00 0.00 O ATOM 119 CB LYS A 8 14.794 -16.641 -12.778 1.00 0.00 C ATOM 120 CG LYS A 8 15.472 -16.426 -14.120 1.00 0.00 C ATOM 121 CD LYS A 8 16.692 -15.530 -13.991 1.00 0.00 C ATOM 122 CE LYS A 8 16.307 -14.059 -13.994 1.00 0.00 C ATOM 123 NZ LYS A 8 17.496 -13.173 -13.852 1.00 0.00 N ATOM 0 H LYS A 8 12.820 -16.610 -10.871 1.00 0.00 H new ATOM 0 HA LYS A 8 12.922 -16.531 -13.831 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.940 -15.755 -12.160 1.00 0.00 H new ATOM 0 HB3 LYS A 8 15.279 -17.471 -12.264 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.769 -17.388 -14.537 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.764 -15.980 -14.819 1.00 0.00 H new ATOM 0 HD2 LYS A 8 17.222 -15.766 -13.068 1.00 0.00 H new ATOM 0 HD3 LYS A 8 17.379 -15.729 -14.813 1.00 0.00 H new ATOM 0 HE2 LYS A 8 15.786 -13.822 -14.922 1.00 0.00 H new ATOM 0 HE3 LYS A 8 15.610 -13.865 -13.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 17.191 -12.179 -13.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 17.979 -13.381 -12.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 18.150 -13.340 -14.644 1.00 0.00 H new ATOM 137 N TRP A 9 12.528 -18.959 -13.973 1.00 0.00 N ATOM 138 CA TRP A 9 12.251 -20.386 -14.085 1.00 0.00 C ATOM 139 C TRP A 9 12.464 -20.872 -15.514 1.00 0.00 C ATOM 140 O TRP A 9 11.855 -20.357 -16.451 1.00 0.00 O ATOM 141 CB TRP A 9 10.818 -20.685 -13.639 1.00 0.00 C ATOM 142 CG TRP A 9 10.372 -22.077 -13.968 1.00 0.00 C ATOM 143 CD1 TRP A 9 9.218 -22.440 -14.600 1.00 0.00 C ATOM 144 CD2 TRP A 9 11.072 -23.292 -13.678 1.00 0.00 C ATOM 145 NE1 TRP A 9 9.158 -23.808 -14.722 1.00 0.00 N ATOM 146 CE2 TRP A 9 10.284 -24.353 -14.165 1.00 0.00 C ATOM 147 CE3 TRP A 9 12.289 -23.587 -13.058 1.00 0.00 C ATOM 148 CZ2 TRP A 9 10.674 -25.685 -14.047 1.00 0.00 C ATOM 149 CZ3 TRP A 9 12.675 -24.909 -12.942 1.00 0.00 C ATOM 150 CH2 TRP A 9 11.870 -25.944 -13.435 1.00 0.00 C ATOM 0 H TRP A 9 12.284 -18.416 -14.801 1.00 0.00 H new ATOM 0 HA TRP A 9 12.945 -20.917 -13.434 1.00 0.00 H new ATOM 0 HB2 TRP A 9 10.741 -20.531 -12.563 1.00 0.00 H new ATOM 0 HB3 TRP A 9 10.142 -19.973 -14.112 1.00 0.00 H new ATOM 0 HD1 TRP A 9 8.463 -21.753 -14.953 1.00 0.00 H new ATOM 0 HE1 TRP A 9 8.398 -24.332 -15.157 1.00 0.00 H new ATOM 0 HE3 TRP A 9 12.917 -22.796 -12.676 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 10.054 -26.485 -14.425 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 13.613 -25.148 -12.463 1.00 0.00 H new ATOM 0 HH2 TRP A 9 12.200 -26.967 -13.330 1.00 0.00 H new ATOM 161 N GLY A 10 13.331 -21.867 -15.674 1.00 0.00 N ATOM 162 CA GLY A 10 13.608 -22.405 -16.993 1.00 0.00 C ATOM 163 C GLY A 10 14.049 -21.337 -17.974 1.00 0.00 C ATOM 164 O GLY A 10 13.698 -21.384 -19.153 1.00 0.00 O ATOM 0 H GLY A 10 13.847 -22.310 -14.914 1.00 0.00 H new ATOM 0 HA2 GLY A 10 14.385 -23.166 -16.916 1.00 0.00 H new ATOM 0 HA3 GLY A 10 12.715 -22.899 -17.376 1.00 0.00 H new ATOM 168 N GLY A 11 14.819 -20.369 -17.487 1.00 0.00 N ATOM 169 CA GLY A 11 15.293 -19.297 -18.342 1.00 0.00 C ATOM 170 C GLY A 11 14.231 -18.246 -18.599 1.00 0.00 C ATOM 171 O GLY A 11 14.474 -17.270 -19.308 1.00 0.00 O ATOM 0 H GLY A 11 15.123 -20.308 -16.515 1.00 0.00 H new ATOM 0 HA2 GLY A 11 16.161 -18.826 -17.881 1.00 0.00 H new ATOM 0 HA3 GLY A 11 15.624 -19.715 -19.293 1.00 0.00 H new ATOM 175 N GLN A 12 13.051 -18.448 -18.022 1.00 0.00 N ATOM 176 CA GLN A 12 11.947 -17.510 -18.194 1.00 0.00 C ATOM 177 C GLN A 12 12.000 -16.407 -17.142 1.00 0.00 C ATOM 178 O GLN A 12 12.613 -16.572 -16.088 1.00 0.00 O ATOM 179 CB GLN A 12 10.608 -18.246 -18.113 1.00 0.00 C ATOM 180 CG GLN A 12 10.515 -19.445 -19.042 1.00 0.00 C ATOM 181 CD GLN A 12 10.724 -19.074 -20.497 1.00 0.00 C ATOM 182 OE1 GLN A 12 9.938 -18.324 -21.076 1.00 0.00 O ATOM 183 NE2 GLN A 12 11.786 -19.599 -21.095 1.00 0.00 N ATOM 0 H GLN A 12 12.835 -19.251 -17.432 1.00 0.00 H new ATOM 0 HA GLN A 12 12.043 -17.052 -19.178 1.00 0.00 H new ATOM 0 HB2 GLN A 12 10.447 -18.578 -17.087 1.00 0.00 H new ATOM 0 HB3 GLN A 12 9.805 -17.549 -18.352 1.00 0.00 H new ATOM 0 HG2 GLN A 12 11.260 -20.185 -18.749 1.00 0.00 H new ATOM 0 HG3 GLN A 12 9.538 -19.914 -18.927 1.00 0.00 H new ATOM 0 HE21 GLN A 12 12.411 -20.216 -20.576 1.00 0.00 H new ATOM 0 HE22 GLN A 12 11.978 -19.386 -22.074 1.00 0.00 H new ATOM 192 N GLU A 13 11.354 -15.284 -17.437 1.00 0.00 N ATOM 193 CA GLU A 13 11.329 -14.154 -16.516 1.00 0.00 C ATOM 194 C GLU A 13 9.908 -13.629 -16.336 1.00 0.00 C ATOM 195 O GLU A 13 9.250 -13.242 -17.302 1.00 0.00 O ATOM 196 CB GLU A 13 12.238 -13.032 -17.025 1.00 0.00 C ATOM 197 CG GLU A 13 13.552 -12.924 -16.270 1.00 0.00 C ATOM 198 CD GLU A 13 14.666 -12.345 -17.120 1.00 0.00 C ATOM 199 OE1 GLU A 13 14.681 -11.113 -17.321 1.00 0.00 O ATOM 200 OE2 GLU A 13 15.524 -13.125 -17.584 1.00 0.00 O ATOM 0 H GLU A 13 10.841 -15.132 -18.306 1.00 0.00 H new ATOM 0 HA GLU A 13 11.695 -14.499 -15.549 1.00 0.00 H new ATOM 0 HB2 GLU A 13 12.448 -13.197 -18.082 1.00 0.00 H new ATOM 0 HB3 GLU A 13 11.707 -12.083 -16.950 1.00 0.00 H new ATOM 0 HG2 GLU A 13 13.410 -12.299 -15.388 1.00 0.00 H new ATOM 0 HG3 GLU A 13 13.846 -13.912 -15.916 1.00 0.00 H new ATOM 207 N TYR A 14 9.440 -13.621 -15.092 1.00 0.00 N ATOM 208 CA TYR A 14 8.096 -13.147 -14.785 1.00 0.00 C ATOM 209 C TYR A 14 8.106 -12.236 -13.562 1.00 0.00 C ATOM 210 O TYR A 14 8.558 -12.627 -12.486 1.00 0.00 O ATOM 211 CB TYR A 14 7.158 -14.331 -14.545 1.00 0.00 C ATOM 212 CG TYR A 14 7.222 -15.384 -15.628 1.00 0.00 C ATOM 213 CD1 TYR A 14 6.597 -15.189 -16.853 1.00 0.00 C ATOM 214 CD2 TYR A 14 7.910 -16.575 -15.426 1.00 0.00 C ATOM 215 CE1 TYR A 14 6.653 -16.149 -17.845 1.00 0.00 C ATOM 216 CE2 TYR A 14 7.972 -17.540 -16.413 1.00 0.00 C ATOM 217 CZ TYR A 14 7.342 -17.322 -17.620 1.00 0.00 C ATOM 218 OH TYR A 14 7.401 -18.280 -18.606 1.00 0.00 O ATOM 0 H TYR A 14 9.972 -13.937 -14.281 1.00 0.00 H new ATOM 0 HA TYR A 14 7.736 -12.574 -15.639 1.00 0.00 H new ATOM 0 HB2 TYR A 14 7.405 -14.791 -13.588 1.00 0.00 H new ATOM 0 HB3 TYR A 14 6.135 -13.963 -14.468 1.00 0.00 H new ATOM 0 HD1 TYR A 14 6.058 -14.271 -17.033 1.00 0.00 H new ATOM 0 HD2 TYR A 14 8.404 -16.749 -14.482 1.00 0.00 H new ATOM 0 HE1 TYR A 14 6.160 -15.982 -18.791 1.00 0.00 H new ATOM 0 HE2 TYR A 14 8.511 -18.460 -16.240 1.00 0.00 H new ATOM 0 HH TYR A 14 7.358 -17.848 -19.485 1.00 0.00 H new ATOM 228 N SER A 15 7.602 -11.018 -13.735 1.00 0.00 N ATOM 229 CA SER A 15 7.555 -10.048 -12.647 1.00 0.00 C ATOM 230 C SER A 15 6.166 -10.004 -12.018 1.00 0.00 C ATOM 231 O SER A 15 5.166 -10.302 -12.671 1.00 0.00 O ATOM 232 CB SER A 15 7.940 -8.658 -13.158 1.00 0.00 C ATOM 233 OG SER A 15 7.450 -8.443 -14.470 1.00 0.00 O ATOM 0 H SER A 15 7.220 -10.680 -14.618 1.00 0.00 H new ATOM 0 HA SER A 15 8.270 -10.358 -11.885 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.540 -7.897 -12.488 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.025 -8.552 -13.150 1.00 0.00 H new ATOM 0 HG SER A 15 7.708 -7.547 -14.773 1.00 0.00 H new ATOM 239 N VAL A 16 6.112 -9.631 -10.743 1.00 0.00 N ATOM 240 CA VAL A 16 4.847 -9.546 -10.024 1.00 0.00 C ATOM 241 C VAL A 16 4.455 -8.095 -9.770 1.00 0.00 C ATOM 242 O VAL A 16 5.313 -7.221 -9.641 1.00 0.00 O ATOM 243 CB VAL A 16 4.915 -10.292 -8.678 1.00 0.00 C ATOM 244 CG1 VAL A 16 4.957 -9.304 -7.522 1.00 0.00 C ATOM 245 CG2 VAL A 16 3.737 -11.243 -8.535 1.00 0.00 C ATOM 0 H VAL A 16 6.930 -9.383 -10.187 1.00 0.00 H new ATOM 0 HA VAL A 16 4.093 -10.017 -10.654 1.00 0.00 H new ATOM 0 HB VAL A 16 5.832 -10.881 -8.655 1.00 0.00 H new ATOM 0 HG11 VAL A 16 5.005 -9.849 -6.579 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.837 -8.668 -7.619 1.00 0.00 H new ATOM 0 HG13 VAL A 16 4.059 -8.686 -7.539 1.00 0.00 H new ATOM 0 HG21 VAL A 16 3.802 -11.761 -7.578 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.806 -10.678 -8.579 1.00 0.00 H new ATOM 0 HG23 VAL A 16 3.758 -11.972 -9.345 1.00 0.00 H new ATOM 255 N THR A 17 3.151 -7.844 -9.697 1.00 0.00 N ATOM 256 CA THR A 17 2.644 -6.499 -9.458 1.00 0.00 C ATOM 257 C THR A 17 1.238 -6.537 -8.872 1.00 0.00 C ATOM 258 O THR A 17 0.347 -5.813 -9.318 1.00 0.00 O ATOM 259 CB THR A 17 2.625 -5.667 -10.755 1.00 0.00 C ATOM 260 OG1 THR A 17 2.194 -6.480 -11.852 1.00 0.00 O ATOM 261 CG2 THR A 17 4.003 -5.096 -11.051 1.00 0.00 C ATOM 0 H THR A 17 2.427 -8.555 -9.800 1.00 0.00 H new ATOM 0 HA THR A 17 3.320 -6.029 -8.743 1.00 0.00 H new ATOM 0 HB THR A 17 1.928 -4.840 -10.620 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.183 -5.944 -12.672 1.00 0.00 H new ATOM 0 HG21 THR A 17 3.965 -4.513 -11.971 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.316 -4.455 -10.227 1.00 0.00 H new ATOM 0 HG23 THR A 17 4.717 -5.911 -11.167 1.00 0.00 H new ATOM 269 N THR A 18 1.043 -7.387 -7.868 1.00 0.00 N ATOM 270 CA THR A 18 -0.256 -7.520 -7.220 1.00 0.00 C ATOM 271 C THR A 18 -0.129 -7.403 -5.706 1.00 0.00 C ATOM 272 O THR A 18 -1.019 -6.876 -5.037 1.00 0.00 O ATOM 273 CB THR A 18 -0.921 -8.865 -7.567 1.00 0.00 C ATOM 274 OG1 THR A 18 -2.036 -9.098 -6.699 1.00 0.00 O ATOM 275 CG2 THR A 18 0.074 -10.009 -7.442 1.00 0.00 C ATOM 0 H THR A 18 1.769 -7.994 -7.486 1.00 0.00 H new ATOM 0 HA THR A 18 -0.881 -6.708 -7.593 1.00 0.00 H new ATOM 0 HB THR A 18 -1.268 -8.818 -8.599 1.00 0.00 H new ATOM 0 HG1 THR A 18 -2.455 -9.954 -6.927 1.00 0.00 H new ATOM 0 HG21 THR A 18 -0.419 -10.949 -7.692 1.00 0.00 H new ATOM 0 HG22 THR A 18 0.907 -9.843 -8.125 1.00 0.00 H new ATOM 0 HG23 THR A 18 0.448 -10.056 -6.419 1.00 0.00 H new ATOM 283 N LEU A 19 0.981 -7.898 -5.170 1.00 0.00 N ATOM 284 CA LEU A 19 1.224 -7.849 -3.732 1.00 0.00 C ATOM 285 C LEU A 19 2.625 -7.324 -3.435 1.00 0.00 C ATOM 286 O LEU A 19 3.316 -6.830 -4.326 1.00 0.00 O ATOM 287 CB LEU A 19 1.047 -9.239 -3.117 1.00 0.00 C ATOM 288 CG LEU A 19 2.066 -10.296 -3.544 1.00 0.00 C ATOM 289 CD1 LEU A 19 2.289 -11.304 -2.427 1.00 0.00 C ATOM 290 CD2 LEU A 19 1.606 -10.998 -4.814 1.00 0.00 C ATOM 0 H LEU A 19 1.727 -8.338 -5.709 1.00 0.00 H new ATOM 0 HA LEU A 19 0.498 -7.167 -3.289 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.087 -9.142 -2.032 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.050 -9.601 -3.368 1.00 0.00 H new ATOM 0 HG LEU A 19 3.013 -9.798 -3.751 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.017 -12.049 -2.749 1.00 0.00 H new ATOM 0 HD12 LEU A 19 2.663 -10.789 -1.542 1.00 0.00 H new ATOM 0 HD13 LEU A 19 1.347 -11.797 -2.189 1.00 0.00 H new ATOM 0 HD21 LEU A 19 2.343 -11.747 -5.103 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.647 -11.484 -4.634 1.00 0.00 H new ATOM 0 HD23 LEU A 19 1.498 -10.267 -5.615 1.00 0.00 H new ATOM 302 N SER A 20 3.039 -7.435 -2.177 1.00 0.00 N ATOM 303 CA SER A 20 4.357 -6.970 -1.761 1.00 0.00 C ATOM 304 C SER A 20 5.168 -8.110 -1.152 1.00 0.00 C ATOM 305 O SER A 20 4.609 -9.090 -0.661 1.00 0.00 O ATOM 306 CB SER A 20 4.223 -5.829 -0.752 1.00 0.00 C ATOM 307 OG SER A 20 2.870 -5.438 -0.599 1.00 0.00 O ATOM 0 H SER A 20 2.480 -7.843 -1.428 1.00 0.00 H new ATOM 0 HA SER A 20 4.882 -6.605 -2.644 1.00 0.00 H new ATOM 0 HB2 SER A 20 4.625 -6.143 0.211 1.00 0.00 H new ATOM 0 HB3 SER A 20 4.816 -4.976 -1.082 1.00 0.00 H new ATOM 0 HG SER A 20 2.800 -4.464 -0.677 1.00 0.00 H new ATOM 313 N GLU A 21 6.490 -7.973 -1.189 1.00 0.00 N ATOM 314 CA GLU A 21 7.379 -8.991 -0.643 1.00 0.00 C ATOM 315 C GLU A 21 7.095 -9.222 0.839 1.00 0.00 C ATOM 316 O GLU A 21 7.406 -10.282 1.384 1.00 0.00 O ATOM 317 CB GLU A 21 8.840 -8.582 -0.835 1.00 0.00 C ATOM 318 CG GLU A 21 9.253 -7.386 0.006 1.00 0.00 C ATOM 319 CD GLU A 21 10.758 -7.256 0.137 1.00 0.00 C ATOM 320 OE1 GLU A 21 11.479 -8.036 -0.521 1.00 0.00 O ATOM 321 OE2 GLU A 21 11.215 -6.377 0.897 1.00 0.00 O ATOM 0 H GLU A 21 6.968 -7.167 -1.591 1.00 0.00 H new ATOM 0 HA GLU A 21 7.197 -9.921 -1.181 1.00 0.00 H new ATOM 0 HB2 GLU A 21 9.481 -9.428 -0.587 1.00 0.00 H new ATOM 0 HB3 GLU A 21 9.009 -8.351 -1.887 1.00 0.00 H new ATOM 0 HG2 GLU A 21 8.851 -6.477 -0.441 1.00 0.00 H new ATOM 0 HG3 GLU A 21 8.812 -7.475 0.999 1.00 0.00 H new ATOM 328 N ASP A 22 6.504 -8.223 1.485 1.00 0.00 N ATOM 329 CA ASP A 22 6.178 -8.316 2.903 1.00 0.00 C ATOM 330 C ASP A 22 4.822 -8.986 3.106 1.00 0.00 C ATOM 331 O ASP A 22 4.311 -9.049 4.224 1.00 0.00 O ATOM 332 CB ASP A 22 6.174 -6.925 3.540 1.00 0.00 C ATOM 333 CG ASP A 22 7.541 -6.272 3.511 1.00 0.00 C ATOM 334 OD1 ASP A 22 8.471 -6.814 4.144 1.00 0.00 O ATOM 335 OD2 ASP A 22 7.682 -5.217 2.856 1.00 0.00 O ATOM 0 H ASP A 22 6.241 -7.339 1.049 1.00 0.00 H new ATOM 0 HA ASP A 22 6.941 -8.926 3.387 1.00 0.00 H new ATOM 0 HB2 ASP A 22 5.460 -6.290 3.015 1.00 0.00 H new ATOM 0 HB3 ASP A 22 5.833 -7.002 4.572 1.00 0.00 H new ATOM 340 N ASP A 23 4.245 -9.483 2.018 1.00 0.00 N ATOM 341 CA ASP A 23 2.948 -10.148 2.076 1.00 0.00 C ATOM 342 C ASP A 23 3.100 -11.594 2.537 1.00 0.00 C ATOM 343 O ASP A 23 2.762 -11.935 3.671 1.00 0.00 O ATOM 344 CB ASP A 23 2.267 -10.105 0.707 1.00 0.00 C ATOM 345 CG ASP A 23 0.765 -10.287 0.802 1.00 0.00 C ATOM 346 OD1 ASP A 23 0.319 -11.123 1.616 1.00 0.00 O ATOM 347 OD2 ASP A 23 0.036 -9.594 0.063 1.00 0.00 O ATOM 0 H ASP A 23 4.655 -9.438 1.085 1.00 0.00 H new ATOM 0 HA ASP A 23 2.327 -9.618 2.798 1.00 0.00 H new ATOM 0 HB2 ASP A 23 2.485 -9.152 0.226 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.685 -10.886 0.072 1.00 0.00 H new ATOM 352 N THR A 24 3.609 -12.443 1.649 1.00 0.00 N ATOM 353 CA THR A 24 3.802 -13.853 1.963 1.00 0.00 C ATOM 354 C THR A 24 4.295 -14.625 0.745 1.00 0.00 C ATOM 355 O THR A 24 3.970 -14.284 -0.392 1.00 0.00 O ATOM 356 CB THR A 24 2.501 -14.499 2.474 1.00 0.00 C ATOM 357 OG1 THR A 24 1.384 -13.652 2.176 1.00 0.00 O ATOM 358 CG2 THR A 24 2.571 -14.745 3.974 1.00 0.00 C ATOM 0 H THR A 24 3.895 -12.178 0.706 1.00 0.00 H new ATOM 0 HA THR A 24 4.555 -13.901 2.750 1.00 0.00 H new ATOM 0 HB THR A 24 2.375 -15.457 1.970 1.00 0.00 H new ATOM 0 HG1 THR A 24 0.560 -14.070 2.503 1.00 0.00 H new ATOM 0 HG21 THR A 24 1.641 -15.202 4.312 1.00 0.00 H new ATOM 0 HG22 THR A 24 3.404 -15.412 4.195 1.00 0.00 H new ATOM 0 HG23 THR A 24 2.719 -13.797 4.492 1.00 0.00 H new ATOM 366 N VAL A 25 5.081 -15.669 0.990 1.00 0.00 N ATOM 367 CA VAL A 25 5.617 -16.492 -0.088 1.00 0.00 C ATOM 368 C VAL A 25 4.497 -17.119 -0.910 1.00 0.00 C ATOM 369 O VAL A 25 4.469 -16.998 -2.136 1.00 0.00 O ATOM 370 CB VAL A 25 6.526 -17.609 0.458 1.00 0.00 C ATOM 371 CG1 VAL A 25 6.375 -18.874 -0.374 1.00 0.00 C ATOM 372 CG2 VAL A 25 7.976 -17.150 0.486 1.00 0.00 C ATOM 0 H VAL A 25 5.361 -15.965 1.925 1.00 0.00 H new ATOM 0 HA VAL A 25 6.206 -15.833 -0.726 1.00 0.00 H new ATOM 0 HB VAL A 25 6.221 -17.835 1.480 1.00 0.00 H new ATOM 0 HG11 VAL A 25 7.025 -19.652 0.026 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.339 -19.212 -0.338 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.653 -18.665 -1.407 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.604 -17.952 0.875 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.297 -16.895 -0.524 1.00 0.00 H new ATOM 0 HG23 VAL A 25 8.068 -16.274 1.128 1.00 0.00 H new ATOM 382 N LEU A 26 3.574 -17.789 -0.229 1.00 0.00 N ATOM 383 CA LEU A 26 2.450 -18.436 -0.896 1.00 0.00 C ATOM 384 C LEU A 26 1.608 -17.416 -1.657 1.00 0.00 C ATOM 385 O LEU A 26 0.892 -17.764 -2.596 1.00 0.00 O ATOM 386 CB LEU A 26 1.580 -19.171 0.125 1.00 0.00 C ATOM 387 CG LEU A 26 0.183 -18.593 0.357 1.00 0.00 C ATOM 388 CD1 LEU A 26 -0.787 -19.104 -0.697 1.00 0.00 C ATOM 389 CD2 LEU A 26 -0.312 -18.940 1.753 1.00 0.00 C ATOM 0 H LEU A 26 3.582 -17.898 0.785 1.00 0.00 H new ATOM 0 HA LEU A 26 2.849 -19.156 -1.610 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.474 -20.207 -0.197 1.00 0.00 H new ATOM 0 HB3 LEU A 26 2.108 -19.186 1.078 1.00 0.00 H new ATOM 0 HG LEU A 26 0.240 -17.508 0.273 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.776 -18.683 -0.516 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.440 -18.805 -1.686 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.841 -20.191 -0.645 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.307 -18.521 1.901 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.354 -20.023 1.865 1.00 0.00 H new ATOM 0 HD23 LEU A 26 0.370 -18.525 2.495 1.00 0.00 H new ATOM 401 N ASP A 27 1.702 -16.156 -1.247 1.00 0.00 N ATOM 402 CA ASP A 27 0.952 -15.084 -1.892 1.00 0.00 C ATOM 403 C ASP A 27 1.579 -14.712 -3.232 1.00 0.00 C ATOM 404 O ASP A 27 0.881 -14.552 -4.234 1.00 0.00 O ATOM 405 CB ASP A 27 0.894 -13.855 -0.984 1.00 0.00 C ATOM 406 CG ASP A 27 -0.170 -12.865 -1.416 1.00 0.00 C ATOM 407 OD1 ASP A 27 -0.286 -12.614 -2.634 1.00 0.00 O ATOM 408 OD2 ASP A 27 -0.887 -12.342 -0.537 1.00 0.00 O ATOM 0 H ASP A 27 2.290 -15.852 -0.471 1.00 0.00 H new ATOM 0 HA ASP A 27 -0.062 -15.441 -2.072 1.00 0.00 H new ATOM 0 HB2 ASP A 27 0.696 -14.172 0.040 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.866 -13.362 -0.983 1.00 0.00 H new ATOM 413 N LEU A 28 2.901 -14.575 -3.243 1.00 0.00 N ATOM 414 CA LEU A 28 3.623 -14.221 -4.460 1.00 0.00 C ATOM 415 C LEU A 28 3.865 -15.452 -5.328 1.00 0.00 C ATOM 416 O LEU A 28 3.552 -15.457 -6.519 1.00 0.00 O ATOM 417 CB LEU A 28 4.957 -13.559 -4.111 1.00 0.00 C ATOM 418 CG LEU A 28 5.501 -12.564 -5.136 1.00 0.00 C ATOM 419 CD1 LEU A 28 6.258 -11.442 -4.442 1.00 0.00 C ATOM 420 CD2 LEU A 28 6.398 -13.271 -6.142 1.00 0.00 C ATOM 0 H LEU A 28 3.494 -14.704 -2.423 1.00 0.00 H new ATOM 0 HA LEU A 28 3.011 -13.517 -5.024 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.845 -13.043 -3.157 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.701 -14.342 -3.964 1.00 0.00 H new ATOM 0 HG LEU A 28 4.658 -12.129 -5.673 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.638 -10.744 -5.188 1.00 0.00 H new ATOM 0 HD12 LEU A 28 5.587 -10.917 -3.762 1.00 0.00 H new ATOM 0 HD13 LEU A 28 7.092 -11.860 -3.878 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.776 -12.547 -6.864 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.235 -13.734 -5.620 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.826 -14.038 -6.663 1.00 0.00 H new ATOM 432 N LYS A 29 4.422 -16.496 -4.723 1.00 0.00 N ATOM 433 CA LYS A 29 4.704 -17.735 -5.438 1.00 0.00 C ATOM 434 C LYS A 29 3.476 -18.209 -6.209 1.00 0.00 C ATOM 435 O LYS A 29 3.572 -18.581 -7.378 1.00 0.00 O ATOM 436 CB LYS A 29 5.156 -18.821 -4.459 1.00 0.00 C ATOM 437 CG LYS A 29 6.665 -18.927 -4.323 1.00 0.00 C ATOM 438 CD LYS A 29 7.251 -17.701 -3.644 1.00 0.00 C ATOM 439 CE LYS A 29 7.564 -16.603 -4.649 1.00 0.00 C ATOM 440 NZ LYS A 29 8.869 -15.945 -4.364 1.00 0.00 N ATOM 0 H LYS A 29 4.687 -16.508 -3.738 1.00 0.00 H new ATOM 0 HA LYS A 29 5.506 -17.540 -6.150 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.725 -18.617 -3.479 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.761 -19.782 -4.788 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.918 -19.818 -3.748 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.113 -19.046 -5.310 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.549 -17.325 -2.900 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.161 -17.979 -3.112 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.582 -17.025 -5.654 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.770 -15.857 -4.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.367 -15.761 -5.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.703 -15.046 -3.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.449 -16.568 -3.767 1.00 0.00 H new ATOM 454 N GLN A 30 2.324 -18.191 -5.546 1.00 0.00 N ATOM 455 CA GLN A 30 1.078 -18.619 -6.171 1.00 0.00 C ATOM 456 C GLN A 30 0.809 -17.829 -7.447 1.00 0.00 C ATOM 457 O GLN A 30 0.295 -18.369 -8.427 1.00 0.00 O ATOM 458 CB GLN A 30 -0.090 -18.450 -5.197 1.00 0.00 C ATOM 459 CG GLN A 30 -0.475 -17.000 -4.954 1.00 0.00 C ATOM 460 CD GLN A 30 -1.633 -16.550 -5.823 1.00 0.00 C ATOM 461 OE1 GLN A 30 -1.512 -15.600 -6.597 1.00 0.00 O ATOM 462 NE2 GLN A 30 -2.765 -17.233 -5.700 1.00 0.00 N ATOM 0 H GLN A 30 2.228 -17.885 -4.578 1.00 0.00 H new ATOM 0 HA GLN A 30 1.175 -19.673 -6.432 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -0.956 -18.987 -5.584 1.00 0.00 H new ATOM 0 HB3 GLN A 30 0.172 -18.912 -4.245 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -0.741 -16.870 -3.905 1.00 0.00 H new ATOM 0 HG3 GLN A 30 0.388 -16.362 -5.146 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -2.821 -18.014 -5.046 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -3.578 -16.977 -6.260 1.00 0.00 H new ATOM 471 N PHE A 31 1.159 -16.547 -7.428 1.00 0.00 N ATOM 472 CA PHE A 31 0.954 -15.682 -8.584 1.00 0.00 C ATOM 473 C PHE A 31 1.825 -16.125 -9.756 1.00 0.00 C ATOM 474 O PHE A 31 1.322 -16.429 -10.838 1.00 0.00 O ATOM 475 CB PHE A 31 1.267 -14.229 -8.222 1.00 0.00 C ATOM 476 CG PHE A 31 0.712 -13.234 -9.200 1.00 0.00 C ATOM 477 CD1 PHE A 31 -0.605 -12.812 -9.107 1.00 0.00 C ATOM 478 CD2 PHE A 31 1.506 -12.720 -10.213 1.00 0.00 C ATOM 479 CE1 PHE A 31 -1.118 -11.897 -10.007 1.00 0.00 C ATOM 480 CE2 PHE A 31 0.998 -11.805 -11.115 1.00 0.00 C ATOM 481 CZ PHE A 31 -0.315 -11.392 -11.011 1.00 0.00 C ATOM 0 H PHE A 31 1.586 -16.084 -6.625 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.092 -15.758 -8.882 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.865 -14.015 -7.231 1.00 0.00 H new ATOM 0 HB3 PHE A 31 2.348 -14.103 -8.162 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.237 -13.202 -8.323 1.00 0.00 H new ATOM 0 HD2 PHE A 31 2.534 -13.039 -10.298 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -2.146 -11.577 -9.925 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.627 -11.413 -11.900 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.714 -10.675 -11.714 1.00 0.00 H new ATOM 491 N LEU A 32 3.135 -16.157 -9.533 1.00 0.00 N ATOM 492 CA LEU A 32 4.078 -16.562 -10.570 1.00 0.00 C ATOM 493 C LEU A 32 3.863 -18.020 -10.961 1.00 0.00 C ATOM 494 O LEU A 32 4.150 -18.420 -12.090 1.00 0.00 O ATOM 495 CB LEU A 32 5.515 -16.358 -10.087 1.00 0.00 C ATOM 496 CG LEU A 32 5.851 -16.940 -8.714 1.00 0.00 C ATOM 497 CD1 LEU A 32 6.261 -18.399 -8.839 1.00 0.00 C ATOM 498 CD2 LEU A 32 6.952 -16.130 -8.046 1.00 0.00 C ATOM 0 H LEU A 32 3.568 -15.907 -8.644 1.00 0.00 H new ATOM 0 HA LEU A 32 3.905 -15.940 -11.448 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.190 -16.799 -10.821 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.722 -15.288 -10.066 1.00 0.00 H new ATOM 0 HG LEU A 32 4.959 -16.887 -8.090 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.497 -18.797 -7.852 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.442 -18.971 -9.275 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.139 -18.477 -9.480 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.178 -16.559 -7.070 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.847 -16.151 -8.668 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.621 -15.099 -7.921 1.00 0.00 H new ATOM 510 N LYS A 33 3.355 -18.811 -10.022 1.00 0.00 N ATOM 511 CA LYS A 33 3.098 -20.225 -10.269 1.00 0.00 C ATOM 512 C LYS A 33 2.129 -20.407 -11.433 1.00 0.00 C ATOM 513 O LYS A 33 2.252 -21.350 -12.216 1.00 0.00 O ATOM 514 CB LYS A 33 2.531 -20.888 -9.012 1.00 0.00 C ATOM 515 CG LYS A 33 1.269 -21.694 -9.266 1.00 0.00 C ATOM 516 CD LYS A 33 1.569 -22.978 -10.021 1.00 0.00 C ATOM 517 CE LYS A 33 0.392 -23.406 -10.884 1.00 0.00 C ATOM 518 NZ LYS A 33 0.363 -24.880 -11.091 1.00 0.00 N ATOM 0 H LYS A 33 3.113 -18.497 -9.082 1.00 0.00 H new ATOM 0 HA LYS A 33 4.044 -20.700 -10.529 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.290 -21.542 -8.583 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.317 -20.118 -8.270 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.792 -21.933 -8.316 1.00 0.00 H new ATOM 0 HG3 LYS A 33 0.561 -21.093 -9.836 1.00 0.00 H new ATOM 0 HD2 LYS A 33 2.449 -22.835 -10.649 1.00 0.00 H new ATOM 0 HD3 LYS A 33 1.809 -23.770 -9.312 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.538 -23.087 -10.414 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.449 -22.905 -11.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -0.038 -25.091 -12.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.330 -25.257 -11.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -0.224 -25.322 -10.355 1.00 0.00 H new ATOM 532 N THR A 34 1.166 -19.497 -11.544 1.00 0.00 N ATOM 533 CA THR A 34 0.177 -19.557 -12.613 1.00 0.00 C ATOM 534 C THR A 34 0.820 -19.301 -13.971 1.00 0.00 C ATOM 535 O THR A 34 0.315 -19.748 -15.002 1.00 0.00 O ATOM 536 CB THR A 34 -0.952 -18.534 -12.391 1.00 0.00 C ATOM 537 OG1 THR A 34 -2.144 -18.968 -13.055 1.00 0.00 O ATOM 538 CG2 THR A 34 -0.549 -17.161 -12.909 1.00 0.00 C ATOM 0 H THR A 34 1.050 -18.709 -10.906 1.00 0.00 H new ATOM 0 HA THR A 34 -0.245 -20.562 -12.598 1.00 0.00 H new ATOM 0 HB THR A 34 -1.139 -18.460 -11.320 1.00 0.00 H new ATOM 0 HG1 THR A 34 -2.858 -18.313 -12.908 1.00 0.00 H new ATOM 0 HG21 THR A 34 -1.363 -16.455 -12.741 1.00 0.00 H new ATOM 0 HG22 THR A 34 0.342 -16.820 -12.381 1.00 0.00 H new ATOM 0 HG23 THR A 34 -0.337 -17.223 -13.976 1.00 0.00 H new ATOM 546 N LEU A 35 1.935 -18.579 -13.966 1.00 0.00 N ATOM 547 CA LEU A 35 2.648 -18.264 -15.199 1.00 0.00 C ATOM 548 C LEU A 35 3.791 -19.246 -15.434 1.00 0.00 C ATOM 549 O LEU A 35 4.279 -19.393 -16.555 1.00 0.00 O ATOM 550 CB LEU A 35 3.191 -16.835 -15.147 1.00 0.00 C ATOM 551 CG LEU A 35 2.188 -15.750 -14.756 1.00 0.00 C ATOM 552 CD1 LEU A 35 2.825 -14.372 -14.857 1.00 0.00 C ATOM 553 CD2 LEU A 35 0.946 -15.831 -15.632 1.00 0.00 C ATOM 0 H LEU A 35 2.365 -18.201 -13.122 1.00 0.00 H new ATOM 0 HA LEU A 35 1.945 -18.349 -16.027 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.019 -16.808 -14.439 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.600 -16.587 -16.126 1.00 0.00 H new ATOM 0 HG LEU A 35 1.889 -15.914 -13.721 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.096 -13.613 -14.575 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.683 -14.318 -14.187 1.00 0.00 H new ATOM 0 HD13 LEU A 35 3.153 -14.197 -15.882 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.243 -15.051 -15.339 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.227 -15.693 -16.676 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.477 -16.807 -15.509 1.00 0.00 H new ATOM 565 N THR A 36 4.214 -19.920 -14.369 1.00 0.00 N ATOM 566 CA THR A 36 5.299 -20.889 -14.458 1.00 0.00 C ATOM 567 C THR A 36 4.761 -22.315 -14.498 1.00 0.00 C ATOM 568 O THR A 36 5.430 -23.228 -14.978 1.00 0.00 O ATOM 569 CB THR A 36 6.273 -20.753 -13.273 1.00 0.00 C ATOM 570 OG1 THR A 36 5.644 -21.203 -12.068 1.00 0.00 O ATOM 571 CG2 THR A 36 6.725 -19.310 -13.106 1.00 0.00 C ATOM 0 H THR A 36 3.821 -19.812 -13.434 1.00 0.00 H new ATOM 0 HA THR A 36 5.834 -20.679 -15.384 1.00 0.00 H new ATOM 0 HB THR A 36 7.148 -21.370 -13.478 1.00 0.00 H new ATOM 0 HG1 THR A 36 5.953 -20.658 -11.314 1.00 0.00 H new ATOM 0 HG21 THR A 36 7.412 -19.239 -12.263 1.00 0.00 H new ATOM 0 HG22 THR A 36 7.229 -18.979 -14.014 1.00 0.00 H new ATOM 0 HG23 THR A 36 5.858 -18.676 -12.921 1.00 0.00 H new ATOM 579 N GLY A 37 3.546 -22.498 -13.990 1.00 0.00 N ATOM 580 CA GLY A 37 2.938 -23.816 -13.978 1.00 0.00 C ATOM 581 C GLY A 37 3.312 -24.616 -12.746 1.00 0.00 C ATOM 582 O GLY A 37 2.676 -25.622 -12.434 1.00 0.00 O ATOM 0 H GLY A 37 2.972 -21.757 -13.587 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.854 -23.713 -14.025 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.245 -24.363 -14.870 1.00 0.00 H new ATOM 586 N VAL A 38 4.348 -24.168 -12.044 1.00 0.00 N ATOM 587 CA VAL A 38 4.807 -24.850 -10.840 1.00 0.00 C ATOM 588 C VAL A 38 4.414 -24.075 -9.587 1.00 0.00 C ATOM 589 O VAL A 38 4.588 -22.858 -9.516 1.00 0.00 O ATOM 590 CB VAL A 38 6.335 -25.043 -10.852 1.00 0.00 C ATOM 591 CG1 VAL A 38 7.034 -23.757 -11.264 1.00 0.00 C ATOM 592 CG2 VAL A 38 6.823 -25.512 -9.489 1.00 0.00 C ATOM 0 H VAL A 38 4.885 -23.336 -12.288 1.00 0.00 H new ATOM 0 HA VAL A 38 4.325 -25.828 -10.826 1.00 0.00 H new ATOM 0 HB VAL A 38 6.580 -25.811 -11.585 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.113 -23.914 -11.266 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.707 -23.469 -12.263 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.784 -22.965 -10.558 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.905 -25.643 -9.515 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.566 -24.768 -8.735 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.348 -26.461 -9.239 1.00 0.00 H new ATOM 602 N LEU A 39 3.884 -24.788 -8.599 1.00 0.00 N ATOM 603 CA LEU A 39 3.466 -24.168 -7.347 1.00 0.00 C ATOM 604 C LEU A 39 4.559 -24.286 -6.290 1.00 0.00 C ATOM 605 O LEU A 39 5.460 -25.119 -6.384 1.00 0.00 O ATOM 606 CB LEU A 39 2.177 -24.816 -6.839 1.00 0.00 C ATOM 607 CG LEU A 39 2.022 -26.311 -7.120 1.00 0.00 C ATOM 608 CD1 LEU A 39 1.667 -26.546 -8.580 1.00 0.00 C ATOM 609 CD2 LEU A 39 3.296 -27.058 -6.752 1.00 0.00 C ATOM 0 H LEU A 39 3.734 -25.796 -8.641 1.00 0.00 H new ATOM 0 HA LEU A 39 3.283 -23.111 -7.537 1.00 0.00 H new ATOM 0 HB2 LEU A 39 2.116 -24.661 -5.762 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.331 -24.293 -7.285 1.00 0.00 H new ATOM 0 HG LEU A 39 1.209 -26.694 -6.504 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.561 -27.616 -8.761 1.00 0.00 H new ATOM 0 HD12 LEU A 39 0.728 -26.044 -8.811 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.458 -26.147 -9.215 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.167 -28.120 -6.959 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.127 -26.672 -7.342 1.00 0.00 H new ATOM 0 HD23 LEU A 39 3.507 -26.917 -5.692 1.00 0.00 H new ATOM 621 N PRO A 40 4.478 -23.434 -5.257 1.00 0.00 N ATOM 622 CA PRO A 40 5.451 -23.425 -4.160 1.00 0.00 C ATOM 623 C PRO A 40 5.338 -24.662 -3.275 1.00 0.00 C ATOM 624 O PRO A 40 6.300 -25.053 -2.615 1.00 0.00 O ATOM 625 CB PRO A 40 5.082 -22.167 -3.370 1.00 0.00 C ATOM 626 CG PRO A 40 3.640 -21.941 -3.668 1.00 0.00 C ATOM 627 CD PRO A 40 3.431 -22.414 -5.080 1.00 0.00 C ATOM 0 HA PRO A 40 6.478 -23.430 -4.525 1.00 0.00 H new ATOM 0 HB2 PRO A 40 5.248 -22.308 -2.302 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.688 -21.315 -3.677 1.00 0.00 H new ATOM 0 HG2 PRO A 40 3.007 -22.493 -2.974 1.00 0.00 H new ATOM 0 HG3 PRO A 40 3.381 -20.887 -3.567 1.00 0.00 H new ATOM 0 HD2 PRO A 40 2.434 -22.833 -5.220 1.00 0.00 H new ATOM 0 HD3 PRO A 40 3.538 -21.600 -5.797 1.00 0.00 H new ATOM 635 N GLU A 41 4.158 -25.273 -3.268 1.00 0.00 N ATOM 636 CA GLU A 41 3.921 -26.466 -2.463 1.00 0.00 C ATOM 637 C GLU A 41 4.822 -27.613 -2.912 1.00 0.00 C ATOM 638 O GLU A 41 5.013 -28.588 -2.186 1.00 0.00 O ATOM 639 CB GLU A 41 2.454 -26.889 -2.557 1.00 0.00 C ATOM 640 CG GLU A 41 2.048 -27.375 -3.938 1.00 0.00 C ATOM 641 CD GLU A 41 0.797 -28.231 -3.911 1.00 0.00 C ATOM 642 OE1 GLU A 41 -0.289 -27.688 -3.619 1.00 0.00 O ATOM 643 OE2 GLU A 41 0.904 -29.446 -4.182 1.00 0.00 O ATOM 0 H GLU A 41 3.352 -24.962 -3.810 1.00 0.00 H new ATOM 0 HA GLU A 41 4.157 -26.226 -1.426 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.266 -27.681 -1.832 1.00 0.00 H new ATOM 0 HB3 GLU A 41 1.823 -26.045 -2.278 1.00 0.00 H new ATOM 0 HG2 GLU A 41 1.881 -26.515 -4.587 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.867 -27.949 -4.372 1.00 0.00 H new ATOM 650 N ARG A 42 5.374 -27.488 -4.115 1.00 0.00 N ATOM 651 CA ARG A 42 6.253 -28.514 -4.663 1.00 0.00 C ATOM 652 C ARG A 42 7.714 -28.085 -4.567 1.00 0.00 C ATOM 653 O ARG A 42 8.586 -28.889 -4.236 1.00 0.00 O ATOM 654 CB ARG A 42 5.889 -28.803 -6.120 1.00 0.00 C ATOM 655 CG ARG A 42 4.791 -29.841 -6.280 1.00 0.00 C ATOM 656 CD ARG A 42 5.361 -31.250 -6.342 1.00 0.00 C ATOM 657 NE ARG A 42 4.312 -32.260 -6.451 1.00 0.00 N ATOM 658 CZ ARG A 42 4.489 -33.540 -6.141 1.00 0.00 C ATOM 659 NH1 ARG A 42 5.667 -33.962 -5.705 1.00 0.00 N ATOM 660 NH2 ARG A 42 3.486 -34.399 -6.268 1.00 0.00 N ATOM 0 H ARG A 42 5.228 -26.686 -4.728 1.00 0.00 H new ATOM 0 HA ARG A 42 6.120 -29.423 -4.076 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.573 -27.876 -6.597 1.00 0.00 H new ATOM 0 HB3 ARG A 42 6.780 -29.145 -6.647 1.00 0.00 H new ATOM 0 HG2 ARG A 42 4.093 -29.766 -5.446 1.00 0.00 H new ATOM 0 HG3 ARG A 42 4.225 -29.636 -7.189 1.00 0.00 H new ATOM 0 HD2 ARG A 42 6.033 -31.332 -7.196 1.00 0.00 H new ATOM 0 HD3 ARG A 42 5.956 -31.440 -5.449 1.00 0.00 H new ATOM 0 HE ARG A 42 3.393 -31.967 -6.783 1.00 0.00 H new ATOM 0 HH11 ARG A 42 6.440 -33.304 -5.607 1.00 0.00 H new ATOM 0 HH12 ARG A 42 5.801 -34.945 -5.468 1.00 0.00 H new ATOM 0 HH21 ARG A 42 2.578 -34.077 -6.604 1.00 0.00 H new ATOM 0 HH22 ARG A 42 3.623 -35.381 -6.030 1.00 0.00 H new ATOM 674 N GLN A 43 7.973 -26.815 -4.860 1.00 0.00 N ATOM 675 CA GLN A 43 9.329 -26.281 -4.809 1.00 0.00 C ATOM 676 C GLN A 43 9.359 -24.942 -4.079 1.00 0.00 C ATOM 677 O GLN A 43 8.316 -24.397 -3.716 1.00 0.00 O ATOM 678 CB GLN A 43 9.890 -26.117 -6.222 1.00 0.00 C ATOM 679 CG GLN A 43 8.853 -25.669 -7.240 1.00 0.00 C ATOM 680 CD GLN A 43 9.337 -24.516 -8.097 1.00 0.00 C ATOM 681 OE1 GLN A 43 9.620 -24.685 -9.283 1.00 0.00 O ATOM 682 NE2 GLN A 43 9.435 -23.334 -7.499 1.00 0.00 N ATOM 0 H GLN A 43 7.262 -26.137 -5.135 1.00 0.00 H new ATOM 0 HA GLN A 43 9.950 -26.989 -4.260 1.00 0.00 H new ATOM 0 HB2 GLN A 43 10.702 -25.391 -6.199 1.00 0.00 H new ATOM 0 HB3 GLN A 43 10.319 -27.065 -6.546 1.00 0.00 H new ATOM 0 HG2 GLN A 43 8.593 -26.510 -7.883 1.00 0.00 H new ATOM 0 HG3 GLN A 43 7.943 -25.372 -6.719 1.00 0.00 H new ATOM 0 HE21 GLN A 43 9.190 -23.239 -6.513 1.00 0.00 H new ATOM 0 HE22 GLN A 43 9.755 -22.521 -8.025 1.00 0.00 H new ATOM 691 N LYS A 44 10.561 -24.416 -3.866 1.00 0.00 N ATOM 692 CA LYS A 44 10.728 -23.141 -3.181 1.00 0.00 C ATOM 693 C LYS A 44 11.676 -22.228 -3.952 1.00 0.00 C ATOM 694 O LYS A 44 12.534 -22.699 -4.701 1.00 0.00 O ATOM 695 CB LYS A 44 11.260 -23.366 -1.764 1.00 0.00 C ATOM 696 CG LYS A 44 12.588 -24.101 -1.722 1.00 0.00 C ATOM 697 CD LYS A 44 12.392 -25.596 -1.529 1.00 0.00 C ATOM 698 CE LYS A 44 13.712 -26.300 -1.253 1.00 0.00 C ATOM 699 NZ LYS A 44 14.605 -26.292 -2.445 1.00 0.00 N ATOM 0 H LYS A 44 11.434 -24.854 -4.159 1.00 0.00 H new ATOM 0 HA LYS A 44 9.753 -22.658 -3.124 1.00 0.00 H new ATOM 0 HB2 LYS A 44 11.373 -22.401 -1.270 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.523 -23.932 -1.194 1.00 0.00 H new ATOM 0 HG2 LYS A 44 13.134 -23.921 -2.648 1.00 0.00 H new ATOM 0 HG3 LYS A 44 13.198 -23.705 -0.910 1.00 0.00 H new ATOM 0 HD2 LYS A 44 11.705 -25.770 -0.701 1.00 0.00 H new ATOM 0 HD3 LYS A 44 11.931 -26.022 -2.420 1.00 0.00 H new ATOM 0 HE2 LYS A 44 14.216 -25.813 -0.418 1.00 0.00 H new ATOM 0 HE3 LYS A 44 13.518 -27.329 -0.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 15.494 -26.781 -2.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 14.135 -26.779 -3.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 14.811 -25.310 -2.718 1.00 0.00 H new ATOM 713 N LEU A 45 11.518 -20.923 -3.764 1.00 0.00 N ATOM 714 CA LEU A 45 12.361 -19.944 -4.442 1.00 0.00 C ATOM 715 C LEU A 45 13.713 -19.817 -3.747 1.00 0.00 C ATOM 716 O LEU A 45 13.790 -19.774 -2.518 1.00 0.00 O ATOM 717 CB LEU A 45 11.666 -18.583 -4.482 1.00 0.00 C ATOM 718 CG LEU A 45 10.846 -18.285 -5.738 1.00 0.00 C ATOM 719 CD1 LEU A 45 11.712 -18.405 -6.982 1.00 0.00 C ATOM 720 CD2 LEU A 45 9.648 -19.219 -5.827 1.00 0.00 C ATOM 0 H LEU A 45 10.814 -20.518 -3.148 1.00 0.00 H new ATOM 0 HA LEU A 45 12.528 -20.289 -5.462 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.008 -18.508 -3.616 1.00 0.00 H new ATOM 0 HB3 LEU A 45 12.424 -17.807 -4.375 1.00 0.00 H new ATOM 0 HG LEU A 45 10.479 -17.261 -5.674 1.00 0.00 H new ATOM 0 HD11 LEU A 45 11.111 -18.189 -7.866 1.00 0.00 H new ATOM 0 HD12 LEU A 45 12.536 -17.694 -6.921 1.00 0.00 H new ATOM 0 HD13 LEU A 45 12.110 -19.417 -7.052 1.00 0.00 H new ATOM 0 HD21 LEU A 45 9.076 -18.992 -6.727 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.994 -20.252 -5.867 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.014 -19.083 -4.951 1.00 0.00 H new ATOM 732 N LEU A 46 14.777 -19.755 -4.541 1.00 0.00 N ATOM 733 CA LEU A 46 16.127 -19.631 -4.002 1.00 0.00 C ATOM 734 C LEU A 46 16.206 -18.492 -2.990 1.00 0.00 C ATOM 735 O LEU A 46 15.613 -17.432 -3.185 1.00 0.00 O ATOM 736 CB LEU A 46 17.128 -19.393 -5.134 1.00 0.00 C ATOM 737 CG LEU A 46 18.158 -20.500 -5.363 1.00 0.00 C ATOM 738 CD1 LEU A 46 19.016 -20.188 -6.579 1.00 0.00 C ATOM 739 CD2 LEU A 46 19.027 -20.684 -4.127 1.00 0.00 C ATOM 0 H LEU A 46 14.731 -19.789 -5.559 1.00 0.00 H new ATOM 0 HA LEU A 46 16.377 -20.562 -3.494 1.00 0.00 H new ATOM 0 HB2 LEU A 46 16.571 -19.245 -6.059 1.00 0.00 H new ATOM 0 HB3 LEU A 46 17.661 -18.464 -4.931 1.00 0.00 H new ATOM 0 HG LEU A 46 17.625 -21.432 -5.550 1.00 0.00 H new ATOM 0 HD11 LEU A 46 19.743 -20.987 -6.726 1.00 0.00 H new ATOM 0 HD12 LEU A 46 18.381 -20.108 -7.461 1.00 0.00 H new ATOM 0 HD13 LEU A 46 19.540 -19.245 -6.422 1.00 0.00 H new ATOM 0 HD21 LEU A 46 19.754 -21.476 -4.308 1.00 0.00 H new ATOM 0 HD22 LEU A 46 19.551 -19.753 -3.909 1.00 0.00 H new ATOM 0 HD23 LEU A 46 18.399 -20.955 -3.278 1.00 0.00 H new ATOM 751 N GLY A 47 16.947 -18.719 -1.909 1.00 0.00 N ATOM 752 CA GLY A 47 17.093 -17.702 -0.884 1.00 0.00 C ATOM 753 C GLY A 47 17.680 -18.254 0.400 1.00 0.00 C ATOM 754 O GLY A 47 18.854 -18.624 0.445 1.00 0.00 O ATOM 0 H GLY A 47 17.448 -19.588 -1.725 1.00 0.00 H new ATOM 0 HA2 GLY A 47 17.732 -16.902 -1.258 1.00 0.00 H new ATOM 0 HA3 GLY A 47 16.119 -17.259 -0.674 1.00 0.00 H new ATOM 758 N LEU A 48 16.864 -18.308 1.447 1.00 0.00 N ATOM 759 CA LEU A 48 17.311 -18.818 2.739 1.00 0.00 C ATOM 760 C LEU A 48 16.187 -19.567 3.447 1.00 0.00 C ATOM 761 O LEU A 48 15.021 -19.465 3.065 1.00 0.00 O ATOM 762 CB LEU A 48 17.805 -17.668 3.619 1.00 0.00 C ATOM 763 CG LEU A 48 18.600 -18.069 4.862 1.00 0.00 C ATOM 764 CD1 LEU A 48 19.771 -18.962 4.482 1.00 0.00 C ATOM 765 CD2 LEU A 48 19.089 -16.833 5.604 1.00 0.00 C ATOM 0 H LEU A 48 15.890 -18.005 1.427 1.00 0.00 H new ATOM 0 HA LEU A 48 18.132 -19.513 2.564 1.00 0.00 H new ATOM 0 HB2 LEU A 48 18.427 -17.012 3.010 1.00 0.00 H new ATOM 0 HB3 LEU A 48 16.942 -17.083 3.937 1.00 0.00 H new ATOM 0 HG LEU A 48 17.942 -18.630 5.525 1.00 0.00 H new ATOM 0 HD11 LEU A 48 20.325 -19.237 5.379 1.00 0.00 H new ATOM 0 HD12 LEU A 48 19.398 -19.863 3.995 1.00 0.00 H new ATOM 0 HD13 LEU A 48 20.430 -18.427 3.799 1.00 0.00 H new ATOM 0 HD21 LEU A 48 19.653 -17.137 6.486 1.00 0.00 H new ATOM 0 HD22 LEU A 48 19.731 -16.245 4.948 1.00 0.00 H new ATOM 0 HD23 LEU A 48 18.234 -16.230 5.910 1.00 0.00 H new ATOM 777 N LYS A 49 16.544 -20.320 4.482 1.00 0.00 N ATOM 778 CA LYS A 49 15.566 -21.085 5.246 1.00 0.00 C ATOM 779 C LYS A 49 15.400 -20.507 6.648 1.00 0.00 C ATOM 780 O LYS A 49 16.354 -20.002 7.240 1.00 0.00 O ATOM 781 CB LYS A 49 15.992 -22.552 5.335 1.00 0.00 C ATOM 782 CG LYS A 49 16.569 -23.097 4.040 1.00 0.00 C ATOM 783 CD LYS A 49 16.370 -24.599 3.929 1.00 0.00 C ATOM 784 CE LYS A 49 16.466 -25.069 2.486 1.00 0.00 C ATOM 785 NZ LYS A 49 16.374 -26.551 2.378 1.00 0.00 N ATOM 0 H LYS A 49 17.505 -20.417 4.811 1.00 0.00 H new ATOM 0 HA LYS A 49 14.608 -21.022 4.730 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.733 -22.659 6.127 1.00 0.00 H new ATOM 0 HB3 LYS A 49 15.130 -23.155 5.621 1.00 0.00 H new ATOM 0 HG2 LYS A 49 16.094 -22.603 3.193 1.00 0.00 H new ATOM 0 HG3 LYS A 49 17.633 -22.865 3.989 1.00 0.00 H new ATOM 0 HD2 LYS A 49 17.121 -25.112 4.530 1.00 0.00 H new ATOM 0 HD3 LYS A 49 15.396 -24.869 4.337 1.00 0.00 H new ATOM 0 HE2 LYS A 49 15.668 -24.612 1.901 1.00 0.00 H new ATOM 0 HE3 LYS A 49 17.409 -24.731 2.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 16.444 -26.831 1.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 17.151 -26.987 2.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 15.463 -26.871 2.765 1.00 0.00 H new ATOM 799 N VAL A 50 14.182 -20.587 7.176 1.00 0.00 N ATOM 800 CA VAL A 50 13.892 -20.075 8.509 1.00 0.00 C ATOM 801 C VAL A 50 13.376 -21.182 9.423 1.00 0.00 C ATOM 802 O VAL A 50 12.537 -21.989 9.025 1.00 0.00 O ATOM 803 CB VAL A 50 12.853 -18.939 8.460 1.00 0.00 C ATOM 804 CG1 VAL A 50 11.494 -19.476 8.037 1.00 0.00 C ATOM 805 CG2 VAL A 50 12.763 -18.241 9.809 1.00 0.00 C ATOM 0 H VAL A 50 13.381 -21.002 6.700 1.00 0.00 H new ATOM 0 HA VAL A 50 14.828 -19.685 8.909 1.00 0.00 H new ATOM 0 HB VAL A 50 13.175 -18.208 7.719 1.00 0.00 H new ATOM 0 HG11 VAL A 50 10.773 -18.659 8.008 1.00 0.00 H new ATOM 0 HG12 VAL A 50 11.573 -19.926 7.047 1.00 0.00 H new ATOM 0 HG13 VAL A 50 11.161 -20.228 8.752 1.00 0.00 H new ATOM 0 HG21 VAL A 50 12.024 -17.441 9.756 1.00 0.00 H new ATOM 0 HG22 VAL A 50 12.465 -18.960 10.572 1.00 0.00 H new ATOM 0 HG23 VAL A 50 13.735 -17.821 10.067 1.00 0.00 H new ATOM 815 N LYS A 51 13.884 -21.213 10.650 1.00 0.00 N ATOM 816 CA LYS A 51 13.475 -22.219 11.623 1.00 0.00 C ATOM 817 C LYS A 51 13.774 -23.624 11.111 1.00 0.00 C ATOM 818 O LYS A 51 13.202 -24.603 11.587 1.00 0.00 O ATOM 819 CB LYS A 51 11.982 -22.083 11.930 1.00 0.00 C ATOM 820 CG LYS A 51 11.541 -20.652 12.187 1.00 0.00 C ATOM 821 CD LYS A 51 10.646 -20.556 13.411 1.00 0.00 C ATOM 822 CE LYS A 51 10.605 -19.139 13.961 1.00 0.00 C ATOM 823 NZ LYS A 51 9.888 -19.070 15.265 1.00 0.00 N ATOM 0 H LYS A 51 14.580 -20.552 10.995 1.00 0.00 H new ATOM 0 HA LYS A 51 14.044 -22.056 12.538 1.00 0.00 H new ATOM 0 HB2 LYS A 51 11.410 -22.486 11.094 1.00 0.00 H new ATOM 0 HB3 LYS A 51 11.742 -22.690 12.803 1.00 0.00 H new ATOM 0 HG2 LYS A 51 12.418 -20.019 12.326 1.00 0.00 H new ATOM 0 HG3 LYS A 51 11.009 -20.272 11.315 1.00 0.00 H new ATOM 0 HD2 LYS A 51 9.637 -20.876 13.151 1.00 0.00 H new ATOM 0 HD3 LYS A 51 11.008 -21.236 14.182 1.00 0.00 H new ATOM 0 HE2 LYS A 51 11.622 -18.769 14.086 1.00 0.00 H new ATOM 0 HE3 LYS A 51 10.114 -18.484 13.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 9.882 -18.088 15.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 8.909 -19.399 15.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 10.371 -19.675 15.959 1.00 0.00 H new ATOM 837 N GLY A 52 14.675 -23.715 10.138 1.00 0.00 N ATOM 838 CA GLY A 52 15.035 -25.005 9.578 1.00 0.00 C ATOM 839 C GLY A 52 14.132 -25.412 8.431 1.00 0.00 C ATOM 840 O GLY A 52 14.399 -26.394 7.738 1.00 0.00 O ATOM 0 H GLY A 52 15.162 -22.919 9.727 1.00 0.00 H new ATOM 0 HA2 GLY A 52 16.067 -24.971 9.229 1.00 0.00 H new ATOM 0 HA3 GLY A 52 14.988 -25.763 10.360 1.00 0.00 H new ATOM 844 N LYS A 53 13.059 -24.655 8.228 1.00 0.00 N ATOM 845 CA LYS A 53 12.112 -24.941 7.157 1.00 0.00 C ATOM 846 C LYS A 53 12.446 -24.135 5.906 1.00 0.00 C ATOM 847 O LYS A 53 12.879 -22.985 5.977 1.00 0.00 O ATOM 848 CB LYS A 53 10.685 -24.628 7.612 1.00 0.00 C ATOM 849 CG LYS A 53 10.132 -25.629 8.612 1.00 0.00 C ATOM 850 CD LYS A 53 8.977 -26.423 8.025 1.00 0.00 C ATOM 851 CE LYS A 53 8.634 -27.629 8.887 1.00 0.00 C ATOM 852 NZ LYS A 53 8.060 -27.226 10.201 1.00 0.00 N ATOM 0 H LYS A 53 12.823 -23.838 8.792 1.00 0.00 H new ATOM 0 HA LYS A 53 12.185 -26.001 6.915 1.00 0.00 H new ATOM 0 HB2 LYS A 53 10.665 -23.633 8.057 1.00 0.00 H new ATOM 0 HB3 LYS A 53 10.032 -24.600 6.740 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.924 -26.311 8.921 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.796 -25.104 9.506 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.102 -25.780 7.933 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.236 -26.755 7.020 1.00 0.00 H new ATOM 0 HE2 LYS A 53 7.922 -28.262 8.358 1.00 0.00 H new ATOM 0 HE3 LYS A 53 9.531 -28.226 9.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 7.840 -28.076 10.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 8.749 -26.642 10.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 7.190 -26.678 10.046 1.00 0.00 H new ATOM 866 N PRO A 54 12.239 -24.750 4.732 1.00 0.00 N ATOM 867 CA PRO A 54 12.510 -24.106 3.443 1.00 0.00 C ATOM 868 C PRO A 54 11.527 -22.981 3.138 1.00 0.00 C ATOM 869 O PRO A 54 10.754 -23.060 2.184 1.00 0.00 O ATOM 870 CB PRO A 54 12.346 -25.247 2.435 1.00 0.00 C ATOM 871 CG PRO A 54 11.425 -26.211 3.101 1.00 0.00 C ATOM 872 CD PRO A 54 11.724 -26.120 4.572 1.00 0.00 C ATOM 0 HA PRO A 54 13.494 -23.637 3.421 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.930 -24.887 1.494 1.00 0.00 H new ATOM 0 HB3 PRO A 54 13.305 -25.711 2.203 1.00 0.00 H new ATOM 0 HG2 PRO A 54 10.384 -25.960 2.898 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.586 -27.224 2.732 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.831 -26.286 5.174 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.459 -26.864 4.879 1.00 0.00 H new ATOM 880 N ALA A 55 11.562 -21.934 3.956 1.00 0.00 N ATOM 881 CA ALA A 55 10.675 -20.791 3.772 1.00 0.00 C ATOM 882 C ALA A 55 9.230 -21.242 3.586 1.00 0.00 C ATOM 883 O ALA A 55 8.767 -21.418 2.460 1.00 0.00 O ATOM 884 CB ALA A 55 11.128 -19.958 2.582 1.00 0.00 C ATOM 0 H ALA A 55 12.195 -21.853 4.752 1.00 0.00 H new ATOM 0 HA ALA A 55 10.723 -20.176 4.671 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.457 -19.108 2.456 1.00 0.00 H new ATOM 0 HB2 ALA A 55 12.142 -19.597 2.755 1.00 0.00 H new ATOM 0 HB3 ALA A 55 11.110 -20.571 1.681 1.00 0.00 H new ATOM 890 N GLU A 56 8.525 -21.427 4.697 1.00 0.00 N ATOM 891 CA GLU A 56 7.133 -21.859 4.654 1.00 0.00 C ATOM 892 C GLU A 56 6.317 -20.972 3.718 1.00 0.00 C ATOM 893 O GLU A 56 6.793 -19.938 3.253 1.00 0.00 O ATOM 894 CB GLU A 56 6.524 -21.834 6.058 1.00 0.00 C ATOM 895 CG GLU A 56 5.505 -22.935 6.299 1.00 0.00 C ATOM 896 CD GLU A 56 5.934 -23.898 7.389 1.00 0.00 C ATOM 897 OE1 GLU A 56 6.282 -23.429 8.493 1.00 0.00 O ATOM 898 OE2 GLU A 56 5.922 -25.121 7.138 1.00 0.00 O ATOM 0 H GLU A 56 8.894 -21.285 5.637 1.00 0.00 H new ATOM 0 HA GLU A 56 7.108 -22.880 4.273 1.00 0.00 H new ATOM 0 HB2 GLU A 56 7.324 -21.923 6.793 1.00 0.00 H new ATOM 0 HB3 GLU A 56 6.047 -20.867 6.221 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.549 -22.487 6.571 1.00 0.00 H new ATOM 0 HG3 GLU A 56 5.347 -23.487 5.373 1.00 0.00 H new ATOM 905 N ASN A 57 5.083 -21.387 3.446 1.00 0.00 N ATOM 906 CA ASN A 57 4.201 -20.631 2.564 1.00 0.00 C ATOM 907 C ASN A 57 3.773 -19.320 3.216 1.00 0.00 C ATOM 908 O ASN A 57 3.551 -18.319 2.534 1.00 0.00 O ATOM 909 CB ASN A 57 2.967 -21.463 2.209 1.00 0.00 C ATOM 910 CG ASN A 57 3.269 -22.948 2.144 1.00 0.00 C ATOM 911 OD1 ASN A 57 3.209 -23.649 3.154 1.00 0.00 O ATOM 912 ND2 ASN A 57 3.598 -23.434 0.953 1.00 0.00 N ATOM 0 H ASN A 57 4.672 -22.241 3.823 1.00 0.00 H new ATOM 0 HA ASN A 57 4.751 -20.400 1.652 1.00 0.00 H new ATOM 0 HB2 ASN A 57 2.187 -21.286 2.950 1.00 0.00 H new ATOM 0 HB3 ASN A 57 2.574 -21.133 1.248 1.00 0.00 H new ATOM 0 HD21 ASN A 57 3.814 -24.425 0.849 1.00 0.00 H new ATOM 0 HD22 ASN A 57 3.635 -22.816 0.142 1.00 0.00 H new ATOM 919 N ASP A 58 3.660 -19.333 4.539 1.00 0.00 N ATOM 920 CA ASP A 58 3.261 -18.145 5.285 1.00 0.00 C ATOM 921 C ASP A 58 4.446 -17.206 5.486 1.00 0.00 C ATOM 922 O ASP A 58 4.285 -16.076 5.947 1.00 0.00 O ATOM 923 CB ASP A 58 2.671 -18.540 6.639 1.00 0.00 C ATOM 924 CG ASP A 58 1.298 -19.169 6.511 1.00 0.00 C ATOM 925 OD1 ASP A 58 0.474 -18.641 5.736 1.00 0.00 O ATOM 926 OD2 ASP A 58 1.046 -20.189 7.187 1.00 0.00 O ATOM 0 H ASP A 58 3.839 -20.154 5.118 1.00 0.00 H new ATOM 0 HA ASP A 58 2.500 -17.622 4.706 1.00 0.00 H new ATOM 0 HB2 ASP A 58 3.343 -19.240 7.135 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.605 -17.657 7.275 1.00 0.00 H new ATOM 931 N VAL A 59 5.638 -17.682 5.140 1.00 0.00 N ATOM 932 CA VAL A 59 6.851 -16.886 5.283 1.00 0.00 C ATOM 933 C VAL A 59 6.901 -15.770 4.245 1.00 0.00 C ATOM 934 O VAL A 59 6.691 -16.004 3.055 1.00 0.00 O ATOM 935 CB VAL A 59 8.113 -17.757 5.146 1.00 0.00 C ATOM 936 CG1 VAL A 59 9.362 -16.888 5.119 1.00 0.00 C ATOM 937 CG2 VAL A 59 8.185 -18.773 6.276 1.00 0.00 C ATOM 0 H VAL A 59 5.789 -18.616 4.758 1.00 0.00 H new ATOM 0 HA VAL A 59 6.827 -16.449 6.281 1.00 0.00 H new ATOM 0 HB VAL A 59 8.057 -18.300 4.203 1.00 0.00 H new ATOM 0 HG11 VAL A 59 10.244 -17.521 5.022 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.311 -16.204 4.272 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.427 -16.315 6.044 1.00 0.00 H new ATOM 0 HG21 VAL A 59 9.083 -19.380 6.163 1.00 0.00 H new ATOM 0 HG22 VAL A 59 8.217 -18.252 7.233 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.306 -19.417 6.243 1.00 0.00 H new ATOM 947 N LYS A 60 7.182 -14.556 4.704 1.00 0.00 N ATOM 948 CA LYS A 60 7.262 -13.402 3.816 1.00 0.00 C ATOM 949 C LYS A 60 8.447 -13.529 2.864 1.00 0.00 C ATOM 950 O LYS A 60 9.401 -14.258 3.138 1.00 0.00 O ATOM 951 CB LYS A 60 7.386 -12.113 4.632 1.00 0.00 C ATOM 952 CG LYS A 60 6.661 -12.165 5.965 1.00 0.00 C ATOM 953 CD LYS A 60 6.000 -10.836 6.293 1.00 0.00 C ATOM 954 CE LYS A 60 4.498 -10.991 6.475 1.00 0.00 C ATOM 955 NZ LYS A 60 4.152 -11.486 7.836 1.00 0.00 N ATOM 0 H LYS A 60 7.358 -14.345 5.686 1.00 0.00 H new ATOM 0 HA LYS A 60 6.347 -13.365 3.226 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.441 -11.906 4.810 1.00 0.00 H new ATOM 0 HB3 LYS A 60 6.992 -11.283 4.046 1.00 0.00 H new ATOM 0 HG2 LYS A 60 5.906 -12.951 5.939 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.366 -12.426 6.754 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.437 -10.426 7.203 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.199 -10.122 5.494 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.010 -10.031 6.303 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.111 -11.684 5.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.119 -11.578 7.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.596 -12.413 7.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.498 -10.813 8.549 1.00 0.00 H new ATOM 969 N LEU A 61 8.380 -12.815 1.746 1.00 0.00 N ATOM 970 CA LEU A 61 9.449 -12.847 0.753 1.00 0.00 C ATOM 971 C LEU A 61 10.702 -12.154 1.279 1.00 0.00 C ATOM 972 O LEU A 61 11.733 -12.790 1.492 1.00 0.00 O ATOM 973 CB LEU A 61 8.988 -12.179 -0.543 1.00 0.00 C ATOM 974 CG LEU A 61 7.886 -12.903 -1.317 1.00 0.00 C ATOM 975 CD1 LEU A 61 8.210 -14.383 -1.448 1.00 0.00 C ATOM 976 CD2 LEU A 61 6.539 -12.709 -0.636 1.00 0.00 C ATOM 0 H LEU A 61 7.598 -12.207 1.504 1.00 0.00 H new ATOM 0 HA LEU A 61 9.692 -13.890 0.550 1.00 0.00 H new ATOM 0 HB2 LEU A 61 8.638 -11.175 -0.306 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.852 -12.069 -1.198 1.00 0.00 H new ATOM 0 HG LEU A 61 7.830 -12.474 -2.317 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.415 -14.882 -2.002 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.153 -14.503 -1.981 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.295 -14.826 -0.456 1.00 0.00 H new ATOM 0 HD21 LEU A 61 5.767 -13.231 -1.201 1.00 0.00 H new ATOM 0 HD22 LEU A 61 6.582 -13.111 0.376 1.00 0.00 H new ATOM 0 HD23 LEU A 61 6.302 -11.646 -0.595 1.00 0.00 H new ATOM 988 N GLY A 62 10.603 -10.844 1.488 1.00 0.00 N ATOM 989 CA GLY A 62 11.735 -10.086 1.989 1.00 0.00 C ATOM 990 C GLY A 62 12.293 -10.661 3.276 1.00 0.00 C ATOM 991 O GLY A 62 13.387 -10.294 3.704 1.00 0.00 O ATOM 0 H GLY A 62 9.760 -10.295 1.319 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.520 -10.068 1.233 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.431 -9.053 2.158 1.00 0.00 H new ATOM 995 N ALA A 63 11.539 -11.563 3.896 1.00 0.00 N ATOM 996 CA ALA A 63 11.965 -12.189 5.141 1.00 0.00 C ATOM 997 C ALA A 63 13.271 -12.954 4.952 1.00 0.00 C ATOM 998 O ALA A 63 14.276 -12.656 5.599 1.00 0.00 O ATOM 999 CB ALA A 63 10.879 -13.118 5.664 1.00 0.00 C ATOM 0 H ALA A 63 10.630 -11.876 3.556 1.00 0.00 H new ATOM 0 HA ALA A 63 12.138 -11.401 5.874 1.00 0.00 H new ATOM 0 HB1 ALA A 63 11.211 -13.579 6.594 1.00 0.00 H new ATOM 0 HB2 ALA A 63 9.969 -12.547 5.847 1.00 0.00 H new ATOM 0 HB3 ALA A 63 10.678 -13.895 4.926 1.00 0.00 H new ATOM 1005 N LEU A 64 13.250 -13.941 4.063 1.00 0.00 N ATOM 1006 CA LEU A 64 14.433 -14.749 3.790 1.00 0.00 C ATOM 1007 C LEU A 64 14.769 -14.736 2.302 1.00 0.00 C ATOM 1008 O LEU A 64 15.939 -14.749 1.918 1.00 0.00 O ATOM 1009 CB LEU A 64 14.213 -16.187 4.262 1.00 0.00 C ATOM 1010 CG LEU A 64 12.761 -16.595 4.516 1.00 0.00 C ATOM 1011 CD1 LEU A 64 11.978 -16.619 3.213 1.00 0.00 C ATOM 1012 CD2 LEU A 64 12.701 -17.952 5.202 1.00 0.00 C ATOM 0 H LEU A 64 12.427 -14.201 3.519 1.00 0.00 H new ATOM 0 HA LEU A 64 15.271 -14.318 4.337 1.00 0.00 H new ATOM 0 HB2 LEU A 64 14.634 -16.861 3.516 1.00 0.00 H new ATOM 0 HB3 LEU A 64 14.778 -16.337 5.182 1.00 0.00 H new ATOM 0 HG LEU A 64 12.306 -15.856 5.176 1.00 0.00 H new ATOM 0 HD11 LEU A 64 10.947 -16.911 3.413 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.993 -15.627 2.761 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.432 -17.336 2.529 1.00 0.00 H new ATOM 0 HD21 LEU A 64 11.660 -18.227 5.375 1.00 0.00 H new ATOM 0 HD22 LEU A 64 13.173 -18.702 4.567 1.00 0.00 H new ATOM 0 HD23 LEU A 64 13.226 -17.901 6.156 1.00 0.00 H new ATOM 1024 N LYS A 65 13.736 -14.710 1.467 1.00 0.00 N ATOM 1025 CA LYS A 65 13.920 -14.691 0.021 1.00 0.00 C ATOM 1026 C LYS A 65 14.924 -13.618 -0.386 1.00 0.00 C ATOM 1027 O LYS A 65 16.114 -13.893 -0.541 1.00 0.00 O ATOM 1028 CB LYS A 65 12.582 -14.446 -0.681 1.00 0.00 C ATOM 1029 CG LYS A 65 11.538 -15.510 -0.388 1.00 0.00 C ATOM 1030 CD LYS A 65 11.833 -16.801 -1.133 1.00 0.00 C ATOM 1031 CE LYS A 65 12.330 -17.887 -0.191 1.00 0.00 C ATOM 1032 NZ LYS A 65 13.801 -18.092 -0.309 1.00 0.00 N ATOM 0 H LYS A 65 12.761 -14.702 1.768 1.00 0.00 H new ATOM 0 HA LYS A 65 14.310 -15.662 -0.283 1.00 0.00 H new ATOM 0 HB2 LYS A 65 12.194 -13.474 -0.376 1.00 0.00 H new ATOM 0 HB3 LYS A 65 12.749 -14.399 -1.757 1.00 0.00 H new ATOM 0 HG2 LYS A 65 11.508 -15.706 0.684 1.00 0.00 H new ATOM 0 HG3 LYS A 65 10.552 -15.142 -0.672 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.931 -17.143 -1.641 1.00 0.00 H new ATOM 0 HD3 LYS A 65 12.582 -16.615 -1.903 1.00 0.00 H new ATOM 0 HE2 LYS A 65 12.082 -17.619 0.836 1.00 0.00 H new ATOM 0 HE3 LYS A 65 11.814 -18.822 -0.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 13.999 -19.098 -0.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 14.168 -17.527 -1.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 14.265 -17.794 0.573 1.00 0.00 H new ATOM 1046 N LEU A 66 14.437 -12.394 -0.557 1.00 0.00 N ATOM 1047 CA LEU A 66 15.293 -11.277 -0.945 1.00 0.00 C ATOM 1048 C LEU A 66 14.468 -10.016 -1.183 1.00 0.00 C ATOM 1049 O LEU A 66 13.267 -9.987 -0.915 1.00 0.00 O ATOM 1050 CB LEU A 66 16.083 -11.629 -2.206 1.00 0.00 C ATOM 1051 CG LEU A 66 15.332 -12.435 -3.266 1.00 0.00 C ATOM 1052 CD1 LEU A 66 14.188 -11.619 -3.846 1.00 0.00 C ATOM 1053 CD2 LEU A 66 16.281 -12.884 -4.368 1.00 0.00 C ATOM 0 H LEU A 66 13.455 -12.149 -0.433 1.00 0.00 H new ATOM 0 HA LEU A 66 15.990 -11.084 -0.129 1.00 0.00 H new ATOM 0 HB2 LEU A 66 16.432 -10.703 -2.662 1.00 0.00 H new ATOM 0 HB3 LEU A 66 16.969 -12.192 -1.910 1.00 0.00 H new ATOM 0 HG LEU A 66 14.914 -13.322 -2.790 1.00 0.00 H new ATOM 0 HD11 LEU A 66 13.665 -12.209 -4.599 1.00 0.00 H new ATOM 0 HD12 LEU A 66 13.494 -11.349 -3.050 1.00 0.00 H new ATOM 0 HD13 LEU A 66 14.584 -10.713 -4.306 1.00 0.00 H new ATOM 0 HD21 LEU A 66 15.728 -13.456 -5.113 1.00 0.00 H new ATOM 0 HD22 LEU A 66 16.729 -12.010 -4.841 1.00 0.00 H new ATOM 0 HD23 LEU A 66 17.066 -13.508 -3.940 1.00 0.00 H new ATOM 1065 N LYS A 67 15.120 -8.976 -1.691 1.00 0.00 N ATOM 1066 CA LYS A 67 14.448 -7.713 -1.970 1.00 0.00 C ATOM 1067 C LYS A 67 13.378 -7.891 -3.042 1.00 0.00 C ATOM 1068 O LYS A 67 13.332 -8.900 -3.747 1.00 0.00 O ATOM 1069 CB LYS A 67 15.464 -6.659 -2.419 1.00 0.00 C ATOM 1070 CG LYS A 67 15.838 -5.672 -1.327 1.00 0.00 C ATOM 1071 CD LYS A 67 16.985 -6.191 -0.476 1.00 0.00 C ATOM 1072 CE LYS A 67 17.508 -5.119 0.469 1.00 0.00 C ATOM 1073 NZ LYS A 67 18.375 -5.693 1.534 1.00 0.00 N ATOM 0 H LYS A 67 16.114 -8.983 -1.918 1.00 0.00 H new ATOM 0 HA LYS A 67 13.966 -7.377 -1.052 1.00 0.00 H new ATOM 0 HB2 LYS A 67 16.366 -7.161 -2.768 1.00 0.00 H new ATOM 0 HB3 LYS A 67 15.056 -6.111 -3.268 1.00 0.00 H new ATOM 0 HG2 LYS A 67 16.119 -4.720 -1.777 1.00 0.00 H new ATOM 0 HG3 LYS A 67 14.971 -5.482 -0.694 1.00 0.00 H new ATOM 0 HD2 LYS A 67 16.651 -7.054 0.100 1.00 0.00 H new ATOM 0 HD3 LYS A 67 17.793 -6.533 -1.122 1.00 0.00 H new ATOM 0 HE2 LYS A 67 18.072 -4.379 -0.098 1.00 0.00 H new ATOM 0 HE3 LYS A 67 16.668 -4.597 0.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 18.711 -4.931 2.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 17.830 -6.381 2.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 19.191 -6.169 1.099 1.00 0.00 H new ATOM 1087 N PRO A 68 12.495 -6.889 -3.171 1.00 0.00 N ATOM 1088 CA PRO A 68 11.411 -6.911 -4.156 1.00 0.00 C ATOM 1089 C PRO A 68 11.923 -6.774 -5.586 1.00 0.00 C ATOM 1090 O PRO A 68 11.718 -7.658 -6.416 1.00 0.00 O ATOM 1091 CB PRO A 68 10.560 -5.697 -3.775 1.00 0.00 C ATOM 1092 CG PRO A 68 11.503 -4.776 -3.081 1.00 0.00 C ATOM 1093 CD PRO A 68 12.489 -5.657 -2.364 1.00 0.00 C ATOM 0 HA PRO A 68 10.865 -7.854 -4.139 1.00 0.00 H new ATOM 0 HB2 PRO A 68 10.124 -5.227 -4.656 1.00 0.00 H new ATOM 0 HB3 PRO A 68 9.733 -5.982 -3.124 1.00 0.00 H new ATOM 0 HG2 PRO A 68 12.008 -4.125 -3.794 1.00 0.00 H new ATOM 0 HG3 PRO A 68 10.974 -4.131 -2.380 1.00 0.00 H new ATOM 0 HD2 PRO A 68 13.478 -5.201 -2.320 1.00 0.00 H new ATOM 0 HD3 PRO A 68 12.181 -5.851 -1.336 1.00 0.00 H new ATOM 1101 N ASN A 69 12.591 -5.660 -5.866 1.00 0.00 N ATOM 1102 CA ASN A 69 13.133 -5.407 -7.196 1.00 0.00 C ATOM 1103 C ASN A 69 14.104 -6.511 -7.606 1.00 0.00 C ATOM 1104 O ASN A 69 14.366 -6.714 -8.792 1.00 0.00 O ATOM 1105 CB ASN A 69 13.841 -4.051 -7.232 1.00 0.00 C ATOM 1106 CG ASN A 69 13.028 -2.957 -6.566 1.00 0.00 C ATOM 1107 OD1 ASN A 69 13.417 -2.426 -5.527 1.00 0.00 O ATOM 1108 ND2 ASN A 69 11.893 -2.617 -7.165 1.00 0.00 N ATOM 0 H ASN A 69 12.770 -4.918 -5.190 1.00 0.00 H new ATOM 0 HA ASN A 69 12.304 -5.395 -7.903 1.00 0.00 H new ATOM 0 HB2 ASN A 69 14.808 -4.135 -6.735 1.00 0.00 H new ATOM 0 HB3 ASN A 69 14.038 -3.774 -8.268 1.00 0.00 H new ATOM 0 HD21 ASN A 69 11.303 -1.887 -6.764 1.00 0.00 H new ATOM 0 HD22 ASN A 69 11.611 -3.085 -8.026 1.00 0.00 H new ATOM 1115 N THR A 70 14.634 -7.223 -6.617 1.00 0.00 N ATOM 1116 CA THR A 70 15.576 -8.305 -6.874 1.00 0.00 C ATOM 1117 C THR A 70 14.875 -9.508 -7.497 1.00 0.00 C ATOM 1118 O THR A 70 13.701 -9.762 -7.229 1.00 0.00 O ATOM 1119 CB THR A 70 16.285 -8.752 -5.582 1.00 0.00 C ATOM 1120 OG1 THR A 70 17.019 -7.656 -5.022 1.00 0.00 O ATOM 1121 CG2 THR A 70 17.229 -9.913 -5.855 1.00 0.00 C ATOM 0 H THR A 70 14.427 -7.070 -5.630 1.00 0.00 H new ATOM 0 HA THR A 70 16.318 -7.918 -7.572 1.00 0.00 H new ATOM 0 HB THR A 70 15.525 -9.082 -4.873 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.703 -7.999 -4.410 1.00 0.00 H new ATOM 0 HG21 THR A 70 17.718 -10.210 -4.927 1.00 0.00 H new ATOM 0 HG22 THR A 70 16.664 -10.755 -6.254 1.00 0.00 H new ATOM 0 HG23 THR A 70 17.983 -9.606 -6.580 1.00 0.00 H new ATOM 1129 N LYS A 71 15.603 -10.245 -8.329 1.00 0.00 N ATOM 1130 CA LYS A 71 15.052 -11.423 -8.989 1.00 0.00 C ATOM 1131 C LYS A 71 15.390 -12.690 -8.211 1.00 0.00 C ATOM 1132 O LYS A 71 16.465 -12.800 -7.621 1.00 0.00 O ATOM 1133 CB LYS A 71 15.590 -11.530 -10.418 1.00 0.00 C ATOM 1134 CG LYS A 71 15.547 -10.219 -11.184 1.00 0.00 C ATOM 1135 CD LYS A 71 16.931 -9.607 -11.321 1.00 0.00 C ATOM 1136 CE LYS A 71 17.120 -8.955 -12.682 1.00 0.00 C ATOM 1137 NZ LYS A 71 16.195 -7.805 -12.879 1.00 0.00 N ATOM 0 H LYS A 71 16.576 -10.047 -8.562 1.00 0.00 H new ATOM 0 HA LYS A 71 13.968 -11.317 -9.022 1.00 0.00 H new ATOM 0 HB2 LYS A 71 16.619 -11.888 -10.384 1.00 0.00 H new ATOM 0 HB3 LYS A 71 15.011 -12.277 -10.960 1.00 0.00 H new ATOM 0 HG2 LYS A 71 15.124 -10.389 -12.174 1.00 0.00 H new ATOM 0 HG3 LYS A 71 14.888 -9.519 -10.671 1.00 0.00 H new ATOM 0 HD2 LYS A 71 17.081 -8.865 -10.537 1.00 0.00 H new ATOM 0 HD3 LYS A 71 17.687 -10.379 -11.178 1.00 0.00 H new ATOM 0 HE2 LYS A 71 18.150 -8.613 -12.781 1.00 0.00 H new ATOM 0 HE3 LYS A 71 16.952 -9.694 -13.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 15.488 -8.048 -13.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 15.713 -7.589 -11.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 16.736 -6.973 -13.190 1.00 0.00 H new ATOM 1151 N ILE A 72 14.466 -13.645 -8.215 1.00 0.00 N ATOM 1152 CA ILE A 72 14.667 -14.906 -7.511 1.00 0.00 C ATOM 1153 C ILE A 72 14.695 -16.080 -8.484 1.00 0.00 C ATOM 1154 O ILE A 72 14.134 -16.007 -9.576 1.00 0.00 O ATOM 1155 CB ILE A 72 13.565 -15.148 -6.463 1.00 0.00 C ATOM 1156 CG1 ILE A 72 12.575 -13.981 -6.453 1.00 0.00 C ATOM 1157 CG2 ILE A 72 14.179 -15.341 -5.084 1.00 0.00 C ATOM 1158 CD1 ILE A 72 11.504 -14.107 -5.393 1.00 0.00 C ATOM 0 H ILE A 72 13.571 -13.570 -8.698 1.00 0.00 H new ATOM 0 HA ILE A 72 15.629 -14.834 -7.004 1.00 0.00 H new ATOM 0 HB ILE A 72 13.024 -16.056 -6.729 1.00 0.00 H new ATOM 0 HG12 ILE A 72 13.123 -13.052 -6.296 1.00 0.00 H new ATOM 0 HG13 ILE A 72 12.100 -13.910 -7.431 1.00 0.00 H new ATOM 0 HG21 ILE A 72 13.388 -15.511 -4.354 1.00 0.00 H new ATOM 0 HG22 ILE A 72 14.848 -16.201 -5.101 1.00 0.00 H new ATOM 0 HG23 ILE A 72 14.742 -14.449 -4.808 1.00 0.00 H new ATOM 0 HD11 ILE A 72 10.838 -13.245 -5.444 1.00 0.00 H new ATOM 0 HD12 ILE A 72 10.931 -15.019 -5.561 1.00 0.00 H new ATOM 0 HD13 ILE A 72 11.970 -14.148 -4.408 1.00 0.00 H new ATOM 1170 N MET A 73 15.352 -17.162 -8.078 1.00 0.00 N ATOM 1171 CA MET A 73 15.450 -18.353 -8.913 1.00 0.00 C ATOM 1172 C MET A 73 14.473 -19.427 -8.445 1.00 0.00 C ATOM 1173 O MET A 73 14.276 -19.619 -7.245 1.00 0.00 O ATOM 1174 CB MET A 73 16.878 -18.902 -8.890 1.00 0.00 C ATOM 1175 CG MET A 73 17.731 -18.425 -10.055 1.00 0.00 C ATOM 1176 SD MET A 73 19.195 -19.446 -10.307 1.00 0.00 S ATOM 1177 CE MET A 73 18.625 -20.542 -11.604 1.00 0.00 C ATOM 0 H MET A 73 15.824 -17.238 -7.177 1.00 0.00 H new ATOM 0 HA MET A 73 15.192 -18.072 -9.934 1.00 0.00 H new ATOM 0 HB2 MET A 73 17.356 -18.608 -7.956 1.00 0.00 H new ATOM 0 HB3 MET A 73 16.840 -19.991 -8.900 1.00 0.00 H new ATOM 0 HG2 MET A 73 17.131 -18.427 -10.965 1.00 0.00 H new ATOM 0 HG3 MET A 73 18.038 -17.394 -9.878 1.00 0.00 H new ATOM 0 HE1 MET A 73 19.422 -21.236 -11.870 1.00 0.00 H new ATOM 0 HE2 MET A 73 17.759 -21.102 -11.252 1.00 0.00 H new ATOM 0 HE3 MET A 73 18.347 -19.956 -12.480 1.00 0.00 H new ATOM 1187 N MET A 74 13.864 -20.124 -9.399 1.00 0.00 N ATOM 1188 CA MET A 74 12.909 -21.179 -9.083 1.00 0.00 C ATOM 1189 C MET A 74 13.540 -22.556 -9.262 1.00 0.00 C ATOM 1190 O MET A 74 13.925 -22.933 -10.368 1.00 0.00 O ATOM 1191 CB MET A 74 11.668 -21.055 -9.970 1.00 0.00 C ATOM 1192 CG MET A 74 10.600 -20.139 -9.395 1.00 0.00 C ATOM 1193 SD MET A 74 9.075 -20.162 -10.357 1.00 0.00 S ATOM 1194 CE MET A 74 7.991 -21.063 -9.251 1.00 0.00 C ATOM 0 H MET A 74 14.015 -19.977 -10.397 1.00 0.00 H new ATOM 0 HA MET A 74 12.614 -21.067 -8.040 1.00 0.00 H new ATOM 0 HB2 MET A 74 11.967 -20.681 -10.949 1.00 0.00 H new ATOM 0 HB3 MET A 74 11.241 -22.046 -10.124 1.00 0.00 H new ATOM 0 HG2 MET A 74 10.383 -20.439 -8.370 1.00 0.00 H new ATOM 0 HG3 MET A 74 10.984 -19.120 -9.354 1.00 0.00 H new ATOM 0 HE1 MET A 74 6.953 -20.877 -9.527 1.00 0.00 H new ATOM 0 HE2 MET A 74 8.201 -22.130 -9.325 1.00 0.00 H new ATOM 0 HE3 MET A 74 8.159 -20.731 -8.226 1.00 0.00 H new ATOM 1204 N MET A 75 13.644 -23.301 -8.166 1.00 0.00 N ATOM 1205 CA MET A 75 14.229 -24.637 -8.203 1.00 0.00 C ATOM 1206 C MET A 75 13.165 -25.702 -7.959 1.00 0.00 C ATOM 1207 O MET A 75 12.644 -25.831 -6.852 1.00 0.00 O ATOM 1208 CB MET A 75 15.340 -24.759 -7.159 1.00 0.00 C ATOM 1209 CG MET A 75 16.328 -23.604 -7.184 1.00 0.00 C ATOM 1210 SD MET A 75 18.028 -24.138 -6.909 1.00 0.00 S ATOM 1211 CE MET A 75 17.899 -24.847 -5.270 1.00 0.00 C ATOM 0 H MET A 75 13.331 -23.003 -7.242 1.00 0.00 H new ATOM 0 HA MET A 75 14.654 -24.794 -9.194 1.00 0.00 H new ATOM 0 HB2 MET A 75 14.891 -24.820 -6.168 1.00 0.00 H new ATOM 0 HB3 MET A 75 15.880 -25.692 -7.322 1.00 0.00 H new ATOM 0 HG2 MET A 75 16.262 -23.095 -8.146 1.00 0.00 H new ATOM 0 HG3 MET A 75 16.051 -22.878 -6.420 1.00 0.00 H new ATOM 0 HE1 MET A 75 18.893 -25.109 -4.908 1.00 0.00 H new ATOM 0 HE2 MET A 75 17.446 -24.121 -4.594 1.00 0.00 H new ATOM 0 HE3 MET A 75 17.279 -25.743 -5.309 1.00 0.00 H new ATOM 1221 N GLY A 76 12.847 -26.465 -9.000 1.00 0.00 N ATOM 1222 CA GLY A 76 11.847 -27.509 -8.877 1.00 0.00 C ATOM 1223 C GLY A 76 11.292 -27.942 -10.220 1.00 0.00 C ATOM 1224 O GLY A 76 11.970 -27.842 -11.243 1.00 0.00 O ATOM 0 H GLY A 76 13.264 -26.379 -9.927 1.00 0.00 H new ATOM 0 HA2 GLY A 76 12.286 -28.371 -8.374 1.00 0.00 H new ATOM 0 HA3 GLY A 76 11.031 -27.154 -8.248 1.00 0.00 H new ATOM 1228 N THR A 77 10.054 -28.426 -10.219 1.00 0.00 N ATOM 1229 CA THR A 77 9.408 -28.878 -11.445 1.00 0.00 C ATOM 1230 C THR A 77 7.967 -28.387 -11.521 1.00 0.00 C ATOM 1231 O THR A 77 7.353 -28.075 -10.501 1.00 0.00 O ATOM 1232 CB THR A 77 9.422 -30.414 -11.553 1.00 0.00 C ATOM 1233 OG1 THR A 77 9.169 -30.813 -12.905 1.00 0.00 O ATOM 1234 CG2 THR A 77 8.378 -31.031 -10.634 1.00 0.00 C ATOM 0 H THR A 77 9.478 -28.515 -9.382 1.00 0.00 H new ATOM 0 HA THR A 77 9.976 -28.458 -12.275 1.00 0.00 H new ATOM 0 HB THR A 77 10.407 -30.768 -11.248 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.181 -31.791 -12.965 1.00 0.00 H new ATOM 0 HG21 THR A 77 8.407 -32.117 -10.728 1.00 0.00 H new ATOM 0 HG22 THR A 77 8.590 -30.750 -9.602 1.00 0.00 H new ATOM 0 HG23 THR A 77 7.388 -30.669 -10.913 1.00 0.00 H new ATOM 1242 N ARG A 78 7.433 -28.322 -12.736 1.00 0.00 N ATOM 1243 CA ARG A 78 6.063 -27.868 -12.945 1.00 0.00 C ATOM 1244 C ARG A 78 5.176 -29.017 -13.415 1.00 0.00 C ATOM 1245 O ARG A 78 5.641 -29.939 -14.084 1.00 0.00 O ATOM 1246 CB ARG A 78 6.030 -26.732 -13.969 1.00 0.00 C ATOM 1247 CG ARG A 78 7.013 -26.915 -15.114 1.00 0.00 C ATOM 1248 CD ARG A 78 6.622 -28.087 -16.001 1.00 0.00 C ATOM 1249 NE ARG A 78 7.071 -27.905 -17.378 1.00 0.00 N ATOM 1250 CZ ARG A 78 6.570 -26.990 -18.200 1.00 0.00 C ATOM 1251 NH1 ARG A 78 5.608 -26.177 -17.785 1.00 0.00 N ATOM 1252 NH2 ARG A 78 7.031 -26.885 -19.440 1.00 0.00 N ATOM 0 H ARG A 78 7.928 -28.578 -13.591 1.00 0.00 H new ATOM 0 HA ARG A 78 5.679 -27.501 -11.993 1.00 0.00 H new ATOM 0 HB2 ARG A 78 5.022 -26.650 -14.376 1.00 0.00 H new ATOM 0 HB3 ARG A 78 6.246 -25.791 -13.463 1.00 0.00 H new ATOM 0 HG2 ARG A 78 7.053 -26.003 -15.710 1.00 0.00 H new ATOM 0 HG3 ARG A 78 8.014 -27.078 -14.714 1.00 0.00 H new ATOM 0 HD2 ARG A 78 7.050 -29.005 -15.598 1.00 0.00 H new ATOM 0 HD3 ARG A 78 5.539 -28.207 -15.986 1.00 0.00 H new ATOM 0 HE ARG A 78 7.810 -28.514 -17.728 1.00 0.00 H new ATOM 0 HH11 ARG A 78 5.251 -26.254 -16.833 1.00 0.00 H new ATOM 0 HH12 ARG A 78 5.225 -25.475 -18.418 1.00 0.00 H new ATOM 0 HH21 ARG A 78 7.771 -27.508 -19.763 1.00 0.00 H new ATOM 0 HH22 ARG A 78 6.645 -26.182 -20.070 1.00 0.00 H new ATOM 1266 N GLU A 79 3.896 -28.953 -13.060 1.00 0.00 N ATOM 1267 CA GLU A 79 2.945 -29.989 -13.445 1.00 0.00 C ATOM 1268 C GLU A 79 2.172 -29.580 -14.696 1.00 0.00 C ATOM 1269 O GLU A 79 2.176 -28.413 -15.086 1.00 0.00 O ATOM 1270 CB GLU A 79 1.970 -30.268 -12.299 1.00 0.00 C ATOM 1271 CG GLU A 79 1.093 -29.080 -11.942 1.00 0.00 C ATOM 1272 CD GLU A 79 -0.133 -28.973 -12.828 1.00 0.00 C ATOM 1273 OE1 GLU A 79 -0.691 -30.028 -13.198 1.00 0.00 O ATOM 1274 OE2 GLU A 79 -0.535 -27.836 -13.152 1.00 0.00 O ATOM 0 H GLU A 79 3.495 -28.196 -12.507 1.00 0.00 H new ATOM 0 HA GLU A 79 3.506 -30.897 -13.666 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.333 -31.110 -12.572 1.00 0.00 H new ATOM 0 HB3 GLU A 79 2.536 -30.569 -11.417 1.00 0.00 H new ATOM 0 HG2 GLU A 79 0.779 -29.165 -10.902 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.678 -28.164 -12.025 1.00 0.00 H new ATOM 1281 N GLU A 80 1.512 -30.551 -15.319 1.00 0.00 N ATOM 1282 CA GLU A 80 0.736 -30.292 -16.527 1.00 0.00 C ATOM 1283 C GLU A 80 -0.600 -31.027 -16.483 1.00 0.00 C ATOM 1284 O GLU A 80 -0.725 -32.074 -15.847 1.00 0.00 O ATOM 1285 CB GLU A 80 1.524 -30.719 -17.767 1.00 0.00 C ATOM 1286 CG GLU A 80 1.157 -29.940 -19.019 1.00 0.00 C ATOM 1287 CD GLU A 80 2.247 -29.982 -20.073 1.00 0.00 C ATOM 1288 OE1 GLU A 80 2.958 -31.005 -20.150 1.00 0.00 O ATOM 1289 OE2 GLU A 80 2.387 -28.992 -20.821 1.00 0.00 O ATOM 0 H GLU A 80 1.499 -31.522 -15.008 1.00 0.00 H new ATOM 0 HA GLU A 80 0.541 -29.221 -16.580 1.00 0.00 H new ATOM 0 HB2 GLU A 80 2.589 -30.595 -17.571 1.00 0.00 H new ATOM 0 HB3 GLU A 80 1.355 -31.781 -17.947 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.236 -30.346 -19.438 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.956 -28.903 -18.751 1.00 0.00 H new ATOM 1296 N SER A 81 -1.598 -30.471 -17.163 1.00 0.00 N ATOM 1297 CA SER A 81 -2.927 -31.070 -17.198 1.00 0.00 C ATOM 1298 C SER A 81 -2.971 -32.236 -18.181 1.00 0.00 C ATOM 1299 O SER A 81 -2.451 -32.144 -19.292 1.00 0.00 O ATOM 1300 CB SER A 81 -3.972 -30.022 -17.586 1.00 0.00 C ATOM 1301 OG SER A 81 -4.242 -29.147 -16.505 1.00 0.00 O ATOM 0 H SER A 81 -1.511 -29.606 -17.697 1.00 0.00 H new ATOM 0 HA SER A 81 -3.155 -31.448 -16.201 1.00 0.00 H new ATOM 0 HB2 SER A 81 -3.616 -29.449 -18.442 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.892 -30.518 -17.895 1.00 0.00 H new ATOM 0 HG SER A 81 -4.911 -28.486 -16.779 1.00 0.00 H new TER 1307 SER A 81