USER MOD reduce.3.24.130724 H: found=0, std=0, add=681, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 679 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 36 THR OG1 : rot 111:sc= -0.526 USER MOD Set 1.2: A 43 GLN : amide:sc= -4.96! C(o=-6!,f=-5.4!) USER MOD Set 1.3: A 74 MET CE :methyl 151:sc= -0.544 (180deg=0) USER MOD Set 2.1: A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -155:sc= -0.214 (180deg=-0.911) USER MOD Single : A 12 GLN : amide:sc= -0.641 K(o=-0.64,f=-2.7!) USER MOD Single : A 14 TYR OH : rot 30:sc= -0.0064 USER MOD Single : A 15 SER OG : rot 180:sc= 0.0294 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 75:sc= 1.23 USER MOD Single : A 24 THR OG1 : rot 180:sc= -1.13 USER MOD Single : A 29 LYS NZ :NH3+ -111:sc= -2.83! (180deg=-5.35!) USER MOD Single : A 30 GLN : amide:sc= -0.618 K(o=-0.62,f=-3!) USER MOD Single : A 33 LYS NZ :NH3+ -125:sc= 1.06 (180deg=-3.08!) 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+ 159:sc= -0.0447 (180deg=-0.357) USER MOD Single : A 51 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0921) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -0.105 K(o=-0.11,f=-0.71) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 159:sc= 0.568 (180deg=0.0778) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 70 THR OG1 : rot -160:sc= -0.202 USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 150:sc= -0.138 (180deg=-1.05) 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 1.336 0.322 -0.832 1.00 0.00 N ATOM 2 CA MET A 1 2.231 0.148 -1.970 1.00 0.00 C ATOM 3 C MET A 1 2.462 -1.332 -2.258 1.00 0.00 C ATOM 4 O MET A 1 2.428 -2.163 -1.350 1.00 0.00 O ATOM 5 CB MET A 1 3.567 0.844 -1.707 1.00 0.00 C ATOM 6 CG MET A 1 3.432 2.329 -1.413 1.00 0.00 C ATOM 7 SD MET A 1 3.263 3.321 -2.910 1.00 0.00 S ATOM 8 CE MET A 1 4.970 3.771 -3.212 1.00 0.00 C ATOM 0 H1 MET A 1 0.861 1.245 -0.902 1.00 0.00 H new ATOM 0 H2 MET A 1 0.623 -0.435 -0.832 1.00 0.00 H new ATOM 0 H3 MET A 1 1.885 0.281 0.051 1.00 0.00 H new ATOM 0 HA MET A 1 1.761 0.601 -2.843 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.060 0.359 -0.865 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.213 0.711 -2.575 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.564 2.492 -0.774 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.306 2.666 -0.855 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.030 4.388 -4.108 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.355 4.331 -2.360 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.565 2.868 -3.352 1.00 0.00 H new ATOM 18 N ALA A 2 2.698 -1.655 -3.525 1.00 0.00 N ATOM 19 CA ALA A 2 2.938 -3.034 -3.931 1.00 0.00 C ATOM 20 C ALA A 2 4.383 -3.233 -4.374 1.00 0.00 C ATOM 21 O ALA A 2 4.838 -2.614 -5.337 1.00 0.00 O ATOM 22 CB ALA A 2 1.982 -3.430 -5.046 1.00 0.00 C ATOM 0 H ALA A 2 2.728 -0.980 -4.289 1.00 0.00 H new ATOM 0 HA ALA A 2 2.759 -3.677 -3.069 1.00 0.00 H new ATOM 0 HB1 ALA A 2 2.173 -4.462 -5.339 1.00 0.00 H new ATOM 0 HB2 ALA A 2 0.954 -3.336 -4.695 1.00 0.00 H new ATOM 0 HB3 ALA A 2 2.133 -2.775 -5.904 1.00 0.00 H new ATOM 28 N LEU A 3 5.100 -4.099 -3.667 1.00 0.00 N ATOM 29 CA LEU A 3 6.495 -4.379 -3.988 1.00 0.00 C ATOM 30 C LEU A 3 6.602 -5.471 -5.048 1.00 0.00 C ATOM 31 O LEU A 3 6.235 -6.625 -4.826 1.00 0.00 O ATOM 32 CB LEU A 3 7.254 -4.801 -2.728 1.00 0.00 C ATOM 33 CG LEU A 3 7.928 -3.676 -1.942 1.00 0.00 C ATOM 34 CD1 LEU A 3 8.673 -4.236 -0.741 1.00 0.00 C ATOM 35 CD2 LEU A 3 8.873 -2.890 -2.840 1.00 0.00 C ATOM 0 H LEU A 3 4.739 -4.619 -2.868 1.00 0.00 H new ATOM 0 HA LEU A 3 6.940 -3.467 -4.386 1.00 0.00 H new ATOM 0 HB2 LEU A 3 6.559 -5.315 -2.064 1.00 0.00 H new ATOM 0 HB3 LEU A 3 8.017 -5.525 -3.013 1.00 0.00 H new ATOM 0 HG LEU A 3 7.155 -2.998 -1.580 1.00 0.00 H new ATOM 0 HD11 LEU A 3 9.146 -3.421 -0.194 1.00 0.00 H new ATOM 0 HD12 LEU A 3 7.971 -4.753 -0.086 1.00 0.00 H new ATOM 0 HD13 LEU A 3 9.436 -4.936 -1.080 1.00 0.00 H new ATOM 0 HD21 LEU A 3 9.344 -2.093 -2.264 1.00 0.00 H new ATOM 0 HD22 LEU A 3 9.641 -3.557 -3.232 1.00 0.00 H new ATOM 0 HD23 LEU A 3 8.312 -2.456 -3.668 1.00 0.00 H new ATOM 47 N PRO A 4 7.117 -5.100 -6.230 1.00 0.00 N ATOM 48 CA PRO A 4 7.287 -6.033 -7.347 1.00 0.00 C ATOM 49 C PRO A 4 8.380 -7.062 -7.083 1.00 0.00 C ATOM 50 O PRO A 4 9.282 -6.830 -6.277 1.00 0.00 O ATOM 51 CB PRO A 4 7.680 -5.122 -8.513 1.00 0.00 C ATOM 52 CG PRO A 4 8.298 -3.929 -7.870 1.00 0.00 C ATOM 53 CD PRO A 4 7.575 -3.741 -6.565 1.00 0.00 C ATOM 0 HA PRO A 4 6.386 -6.618 -7.530 1.00 0.00 H new ATOM 0 HB2 PRO A 4 8.381 -5.618 -9.184 1.00 0.00 H new ATOM 0 HB3 PRO A 4 6.811 -4.845 -9.109 1.00 0.00 H new ATOM 0 HG2 PRO A 4 9.365 -4.082 -7.707 1.00 0.00 H new ATOM 0 HG3 PRO A 4 8.196 -3.048 -8.503 1.00 0.00 H new ATOM 0 HD2 PRO A 4 8.233 -3.338 -5.795 1.00 0.00 H new ATOM 0 HD3 PRO A 4 6.739 -3.048 -6.665 1.00 0.00 H new ATOM 61 N ILE A 5 8.295 -8.198 -7.766 1.00 0.00 N ATOM 62 CA ILE A 5 9.279 -9.261 -7.605 1.00 0.00 C ATOM 63 C ILE A 5 9.475 -10.030 -8.907 1.00 0.00 C ATOM 64 O ILE A 5 8.509 -10.462 -9.537 1.00 0.00 O ATOM 65 CB ILE A 5 8.865 -10.248 -6.497 1.00 0.00 C ATOM 66 CG1 ILE A 5 9.083 -9.621 -5.118 1.00 0.00 C ATOM 67 CG2 ILE A 5 9.649 -11.546 -6.624 1.00 0.00 C ATOM 68 CD1 ILE A 5 9.649 -10.584 -4.099 1.00 0.00 C ATOM 0 H ILE A 5 7.555 -8.406 -8.436 1.00 0.00 H new ATOM 0 HA ILE A 5 10.217 -8.783 -7.323 1.00 0.00 H new ATOM 0 HB ILE A 5 7.805 -10.474 -6.610 1.00 0.00 H new ATOM 0 HG12 ILE A 5 9.758 -8.771 -5.217 1.00 0.00 H new ATOM 0 HG13 ILE A 5 8.133 -9.232 -4.750 1.00 0.00 H new ATOM 0 HG21 ILE A 5 9.345 -12.233 -5.834 1.00 0.00 H new ATOM 0 HG22 ILE A 5 9.449 -11.998 -7.595 1.00 0.00 H new ATOM 0 HG23 ILE A 5 10.715 -11.338 -6.534 1.00 0.00 H new ATOM 0 HD11 ILE A 5 9.777 -10.071 -3.146 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.964 -11.422 -3.971 1.00 0.00 H new ATOM 0 HD13 ILE A 5 10.614 -10.954 -4.445 1.00 0.00 H new ATOM 80 N ILE A 6 10.732 -10.200 -9.304 1.00 0.00 N ATOM 81 CA ILE A 6 11.055 -10.920 -10.530 1.00 0.00 C ATOM 82 C ILE A 6 11.364 -12.385 -10.242 1.00 0.00 C ATOM 83 O ILE A 6 12.096 -12.704 -9.305 1.00 0.00 O ATOM 84 CB ILE A 6 12.257 -10.286 -11.254 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.868 -8.928 -11.843 1.00 0.00 C ATOM 86 CG2 ILE A 6 12.768 -11.216 -12.345 1.00 0.00 C ATOM 87 CD1 ILE A 6 12.948 -7.878 -11.705 1.00 0.00 C ATOM 0 H ILE A 6 11.543 -9.849 -8.795 1.00 0.00 H new ATOM 0 HA ILE A 6 10.178 -10.856 -11.174 1.00 0.00 H new ATOM 0 HB ILE A 6 13.058 -10.131 -10.531 1.00 0.00 H new ATOM 0 HG12 ILE A 6 11.628 -9.054 -12.899 1.00 0.00 H new ATOM 0 HG13 ILE A 6 10.963 -8.573 -11.351 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.618 -10.754 -12.848 1.00 0.00 H new ATOM 0 HG22 ILE A 6 13.079 -12.162 -11.901 1.00 0.00 H new ATOM 0 HG23 ILE A 6 11.974 -11.399 -13.069 1.00 0.00 H new ATOM 0 HD11 ILE A 6 12.603 -6.942 -12.144 1.00 0.00 H new ATOM 0 HD12 ILE A 6 13.172 -7.723 -10.650 1.00 0.00 H new ATOM 0 HD13 ILE A 6 13.848 -8.211 -12.222 1.00 0.00 H new ATOM 99 N VAL A 7 10.801 -13.273 -11.055 1.00 0.00 N ATOM 100 CA VAL A 7 11.019 -14.706 -10.890 1.00 0.00 C ATOM 101 C VAL A 7 11.690 -15.305 -12.120 1.00 0.00 C ATOM 102 O VAL A 7 11.428 -14.888 -13.249 1.00 0.00 O ATOM 103 CB VAL A 7 9.695 -15.448 -10.628 1.00 0.00 C ATOM 104 CG1 VAL A 7 9.947 -16.934 -10.424 1.00 0.00 C ATOM 105 CG2 VAL A 7 8.978 -14.850 -9.426 1.00 0.00 C ATOM 0 H VAL A 7 10.191 -13.026 -11.834 1.00 0.00 H new ATOM 0 HA VAL A 7 11.673 -14.830 -10.027 1.00 0.00 H new ATOM 0 HB VAL A 7 9.053 -15.329 -11.501 1.00 0.00 H new ATOM 0 HG11 VAL A 7 9.000 -17.442 -10.240 1.00 0.00 H new ATOM 0 HG12 VAL A 7 10.414 -17.350 -11.317 1.00 0.00 H new ATOM 0 HG13 VAL A 7 10.607 -17.077 -9.569 1.00 0.00 H new ATOM 0 HG21 VAL A 7 8.045 -15.386 -9.255 1.00 0.00 H new ATOM 0 HG22 VAL A 7 9.613 -14.936 -8.544 1.00 0.00 H new ATOM 0 HG23 VAL A 7 8.763 -13.799 -9.617 1.00 0.00 H new ATOM 115 N LYS A 8 12.556 -16.287 -11.896 1.00 0.00 N ATOM 116 CA LYS A 8 13.265 -16.947 -12.986 1.00 0.00 C ATOM 117 C LYS A 8 13.025 -18.453 -12.957 1.00 0.00 C ATOM 118 O LYS A 8 13.420 -19.136 -12.012 1.00 0.00 O ATOM 119 CB LYS A 8 14.765 -16.657 -12.896 1.00 0.00 C ATOM 120 CG LYS A 8 15.435 -16.494 -14.249 1.00 0.00 C ATOM 121 CD LYS A 8 16.658 -15.597 -14.161 1.00 0.00 C ATOM 122 CE LYS A 8 16.270 -14.149 -13.907 1.00 0.00 C ATOM 123 NZ LYS A 8 17.282 -13.200 -14.448 1.00 0.00 N ATOM 0 H LYS A 8 12.784 -16.644 -10.968 1.00 0.00 H new ATOM 0 HA LYS A 8 12.881 -16.553 -13.927 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.917 -15.749 -12.313 1.00 0.00 H new ATOM 0 HB3 LYS A 8 15.252 -17.468 -12.354 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.727 -17.472 -14.632 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.724 -16.073 -14.960 1.00 0.00 H new ATOM 0 HD2 LYS A 8 17.310 -15.946 -13.360 1.00 0.00 H new ATOM 0 HD3 LYS A 8 17.228 -15.665 -15.088 1.00 0.00 H new ATOM 0 HE2 LYS A 8 15.302 -13.947 -14.365 1.00 0.00 H new ATOM 0 HE3 LYS A 8 16.156 -13.986 -12.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 16.981 -12.224 -14.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 18.201 -13.375 -13.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 17.373 -13.337 -15.475 1.00 0.00 H new ATOM 137 N TRP A 9 12.377 -18.964 -13.998 1.00 0.00 N ATOM 138 CA TRP A 9 12.086 -20.390 -14.093 1.00 0.00 C ATOM 139 C TRP A 9 12.325 -20.902 -15.509 1.00 0.00 C ATOM 140 O TRP A 9 11.706 -20.431 -16.462 1.00 0.00 O ATOM 141 CB TRP A 9 10.641 -20.666 -13.674 1.00 0.00 C ATOM 142 CG TRP A 9 10.169 -22.041 -14.039 1.00 0.00 C ATOM 143 CD1 TRP A 9 8.993 -22.368 -14.649 1.00 0.00 C ATOM 144 CD2 TRP A 9 10.863 -23.273 -13.813 1.00 0.00 C ATOM 145 NE1 TRP A 9 8.913 -23.730 -14.817 1.00 0.00 N ATOM 146 CE2 TRP A 9 10.048 -24.307 -14.313 1.00 0.00 C ATOM 147 CE3 TRP A 9 12.094 -23.602 -13.239 1.00 0.00 C ATOM 148 CZ2 TRP A 9 10.426 -25.646 -14.254 1.00 0.00 C ATOM 149 CZ3 TRP A 9 12.467 -24.931 -13.181 1.00 0.00 C ATOM 150 CH2 TRP A 9 11.636 -25.940 -13.686 1.00 0.00 C ATOM 0 H TRP A 9 12.043 -18.412 -14.788 1.00 0.00 H new ATOM 0 HA TRP A 9 12.759 -20.918 -13.418 1.00 0.00 H new ATOM 0 HB2 TRP A 9 10.551 -20.533 -12.596 1.00 0.00 H new ATOM 0 HB3 TRP A 9 9.988 -19.929 -14.142 1.00 0.00 H new ATOM 0 HD1 TRP A 9 8.236 -21.661 -14.955 1.00 0.00 H new ATOM 0 HE1 TRP A 9 8.135 -24.230 -15.247 1.00 0.00 H new ATOM 0 HE3 TRP A 9 12.742 -22.831 -12.848 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 9.787 -26.425 -14.643 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 13.416 -25.197 -12.739 1.00 0.00 H new ATOM 0 HH2 TRP A 9 11.957 -26.970 -13.626 1.00 0.00 H new ATOM 161 N GLY A 10 13.228 -21.869 -15.640 1.00 0.00 N ATOM 162 CA GLY A 10 13.532 -22.429 -16.944 1.00 0.00 C ATOM 163 C GLY A 10 13.956 -21.371 -17.944 1.00 0.00 C ATOM 164 O GLY A 10 13.684 -21.491 -19.137 1.00 0.00 O ATOM 0 H GLY A 10 13.755 -22.275 -14.866 1.00 0.00 H new ATOM 0 HA2 GLY A 10 14.327 -23.168 -16.842 1.00 0.00 H new ATOM 0 HA3 GLY A 10 12.655 -22.954 -17.324 1.00 0.00 H new ATOM 168 N GLY A 11 14.624 -20.331 -17.455 1.00 0.00 N ATOM 169 CA GLY A 11 15.073 -19.262 -18.328 1.00 0.00 C ATOM 170 C GLY A 11 14.004 -18.212 -18.556 1.00 0.00 C ATOM 171 O GLY A 11 14.269 -17.167 -19.151 1.00 0.00 O ATOM 0 H GLY A 11 14.862 -20.210 -16.471 1.00 0.00 H new ATOM 0 HA2 GLY A 11 15.955 -18.790 -17.895 1.00 0.00 H new ATOM 0 HA3 GLY A 11 15.375 -19.683 -19.287 1.00 0.00 H new ATOM 175 N GLN A 12 12.793 -18.490 -18.085 1.00 0.00 N ATOM 176 CA GLN A 12 11.680 -17.561 -18.244 1.00 0.00 C ATOM 177 C GLN A 12 11.650 -16.548 -17.104 1.00 0.00 C ATOM 178 O GLN A 12 11.945 -16.882 -15.957 1.00 0.00 O ATOM 179 CB GLN A 12 10.356 -18.325 -18.299 1.00 0.00 C ATOM 180 CG GLN A 12 10.281 -19.331 -19.435 1.00 0.00 C ATOM 181 CD GLN A 12 10.364 -18.678 -20.801 1.00 0.00 C ATOM 182 OE1 GLN A 12 10.376 -17.452 -20.915 1.00 0.00 O ATOM 183 NE2 GLN A 12 10.422 -19.495 -21.846 1.00 0.00 N ATOM 0 H GLN A 12 12.557 -19.350 -17.590 1.00 0.00 H new ATOM 0 HA GLN A 12 11.819 -17.022 -19.181 1.00 0.00 H new ATOM 0 HB2 GLN A 12 10.207 -18.846 -17.353 1.00 0.00 H new ATOM 0 HB3 GLN A 12 9.538 -17.612 -18.402 1.00 0.00 H new ATOM 0 HG2 GLN A 12 11.092 -20.051 -19.331 1.00 0.00 H new ATOM 0 HG3 GLN A 12 9.348 -19.889 -19.360 1.00 0.00 H new ATOM 0 HE21 GLN A 12 10.409 -20.505 -21.705 1.00 0.00 H new ATOM 0 HE22 GLN A 12 10.479 -19.113 -22.790 1.00 0.00 H new ATOM 192 N GLU A 13 11.292 -15.310 -17.429 1.00 0.00 N ATOM 193 CA GLU A 13 11.225 -14.248 -16.432 1.00 0.00 C ATOM 194 C GLU A 13 9.782 -13.806 -16.205 1.00 0.00 C ATOM 195 O GLU A 13 9.059 -13.497 -17.153 1.00 0.00 O ATOM 196 CB GLU A 13 12.073 -13.053 -16.869 1.00 0.00 C ATOM 197 CG GLU A 13 12.988 -12.524 -15.777 1.00 0.00 C ATOM 198 CD GLU A 13 13.358 -11.067 -15.981 1.00 0.00 C ATOM 199 OE1 GLU A 13 12.538 -10.192 -15.636 1.00 0.00 O ATOM 200 OE2 GLU A 13 14.470 -10.804 -16.486 1.00 0.00 O ATOM 0 H GLU A 13 11.044 -15.018 -18.374 1.00 0.00 H new ATOM 0 HA GLU A 13 11.619 -14.640 -15.494 1.00 0.00 H new ATOM 0 HB2 GLU A 13 12.677 -13.342 -17.729 1.00 0.00 H new ATOM 0 HB3 GLU A 13 11.413 -12.251 -17.198 1.00 0.00 H new ATOM 0 HG2 GLU A 13 12.498 -12.639 -14.810 1.00 0.00 H new ATOM 0 HG3 GLU A 13 13.897 -13.125 -15.747 1.00 0.00 H new ATOM 207 N TYR A 14 9.370 -13.778 -14.942 1.00 0.00 N ATOM 208 CA TYR A 14 8.013 -13.377 -14.590 1.00 0.00 C ATOM 209 C TYR A 14 8.018 -12.437 -13.388 1.00 0.00 C ATOM 210 O TYR A 14 8.404 -12.823 -12.285 1.00 0.00 O ATOM 211 CB TYR A 14 7.158 -14.608 -14.285 1.00 0.00 C ATOM 212 CG TYR A 14 7.155 -15.634 -15.395 1.00 0.00 C ATOM 213 CD1 TYR A 14 6.380 -15.453 -16.533 1.00 0.00 C ATOM 214 CD2 TYR A 14 7.930 -16.784 -15.306 1.00 0.00 C ATOM 215 CE1 TYR A 14 6.374 -16.388 -17.550 1.00 0.00 C ATOM 216 CE2 TYR A 14 7.931 -17.724 -16.318 1.00 0.00 C ATOM 217 CZ TYR A 14 7.151 -17.522 -17.438 1.00 0.00 C ATOM 218 OH TYR A 14 7.150 -18.456 -18.449 1.00 0.00 O ATOM 0 H TYR A 14 9.956 -14.028 -14.146 1.00 0.00 H new ATOM 0 HA TYR A 14 7.585 -12.848 -15.441 1.00 0.00 H new ATOM 0 HB2 TYR A 14 7.523 -15.076 -13.371 1.00 0.00 H new ATOM 0 HB3 TYR A 14 6.133 -14.290 -14.093 1.00 0.00 H new ATOM 0 HD1 TYR A 14 5.771 -14.566 -16.625 1.00 0.00 H new ATOM 0 HD2 TYR A 14 8.542 -16.945 -14.431 1.00 0.00 H new ATOM 0 HE1 TYR A 14 5.764 -16.232 -18.428 1.00 0.00 H new ATOM 0 HE2 TYR A 14 8.539 -18.612 -16.233 1.00 0.00 H new ATOM 0 HH TYR A 14 6.980 -18.011 -19.305 1.00 0.00 H new ATOM 228 N SER A 15 7.585 -11.200 -13.612 1.00 0.00 N ATOM 229 CA SER A 15 7.542 -10.202 -12.549 1.00 0.00 C ATOM 230 C SER A 15 6.166 -10.168 -11.891 1.00 0.00 C ATOM 231 O SER A 15 5.164 -10.545 -12.500 1.00 0.00 O ATOM 232 CB SER A 15 7.887 -8.819 -13.105 1.00 0.00 C ATOM 233 OG SER A 15 7.477 -8.695 -14.456 1.00 0.00 O ATOM 0 H SER A 15 7.259 -10.865 -14.519 1.00 0.00 H new ATOM 0 HA SER A 15 8.280 -10.478 -11.796 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.403 -8.050 -12.503 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.962 -8.652 -13.031 1.00 0.00 H new ATOM 0 HG SER A 15 7.707 -7.802 -14.787 1.00 0.00 H new ATOM 239 N VAL A 16 6.125 -9.715 -10.642 1.00 0.00 N ATOM 240 CA VAL A 16 4.873 -9.630 -9.900 1.00 0.00 C ATOM 241 C VAL A 16 4.469 -8.179 -9.667 1.00 0.00 C ATOM 242 O VAL A 16 5.319 -7.308 -9.480 1.00 0.00 O ATOM 243 CB VAL A 16 4.977 -10.347 -8.541 1.00 0.00 C ATOM 244 CG1 VAL A 16 5.051 -9.335 -7.408 1.00 0.00 C ATOM 245 CG2 VAL A 16 3.801 -11.292 -8.346 1.00 0.00 C ATOM 0 H VAL A 16 6.945 -9.401 -10.123 1.00 0.00 H new ATOM 0 HA VAL A 16 4.112 -10.123 -10.506 1.00 0.00 H new ATOM 0 HB VAL A 16 5.894 -10.937 -8.530 1.00 0.00 H new ATOM 0 HG11 VAL A 16 5.124 -9.860 -6.456 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.928 -8.702 -7.542 1.00 0.00 H new ATOM 0 HG13 VAL A 16 4.154 -8.716 -7.413 1.00 0.00 H new ATOM 0 HG21 VAL A 16 3.891 -11.790 -7.381 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.870 -10.726 -8.377 1.00 0.00 H new ATOM 0 HG23 VAL A 16 3.798 -12.038 -9.140 1.00 0.00 H new ATOM 255 N THR A 17 3.164 -7.924 -9.680 1.00 0.00 N ATOM 256 CA THR A 17 2.646 -6.578 -9.471 1.00 0.00 C ATOM 257 C THR A 17 1.247 -6.615 -8.866 1.00 0.00 C ATOM 258 O THR A 17 0.337 -5.931 -9.337 1.00 0.00 O ATOM 259 CB THR A 17 2.603 -5.782 -10.789 1.00 0.00 C ATOM 260 OG1 THR A 17 1.931 -6.542 -11.799 1.00 0.00 O ATOM 261 CG2 THR A 17 4.008 -5.435 -11.258 1.00 0.00 C ATOM 0 H THR A 17 2.447 -8.633 -9.833 1.00 0.00 H new ATOM 0 HA THR A 17 3.325 -6.082 -8.778 1.00 0.00 H new ATOM 0 HB THR A 17 2.058 -4.855 -10.610 1.00 0.00 H new ATOM 0 HG1 THR A 17 1.907 -6.028 -12.633 1.00 0.00 H new ATOM 0 HG21 THR A 17 3.952 -4.873 -12.190 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.506 -4.831 -10.500 1.00 0.00 H new ATOM 0 HG23 THR A 17 4.574 -6.352 -11.421 1.00 0.00 H new ATOM 269 N THR A 18 1.081 -7.417 -7.820 1.00 0.00 N ATOM 270 CA THR A 18 -0.208 -7.544 -7.151 1.00 0.00 C ATOM 271 C THR A 18 -0.062 -7.382 -5.642 1.00 0.00 C ATOM 272 O THR A 18 -0.931 -6.811 -4.981 1.00 0.00 O ATOM 273 CB THR A 18 -0.865 -8.905 -7.449 1.00 0.00 C ATOM 274 OG1 THR A 18 -1.931 -9.147 -6.524 1.00 0.00 O ATOM 275 CG2 THR A 18 0.156 -10.029 -7.360 1.00 0.00 C ATOM 0 H THR A 18 1.823 -7.989 -7.417 1.00 0.00 H new ATOM 0 HA THR A 18 -0.845 -6.749 -7.539 1.00 0.00 H new ATOM 0 HB THR A 18 -1.264 -8.877 -8.463 1.00 0.00 H new ATOM 0 HG1 THR A 18 -2.345 -10.013 -6.721 1.00 0.00 H new ATOM 0 HG21 THR A 18 -0.331 -10.980 -7.574 1.00 0.00 H new ATOM 0 HG22 THR A 18 0.951 -9.857 -8.086 1.00 0.00 H new ATOM 0 HG23 THR A 18 0.580 -10.056 -6.356 1.00 0.00 H new ATOM 283 N LEU A 19 1.041 -7.888 -5.101 1.00 0.00 N ATOM 284 CA LEU A 19 1.301 -7.799 -3.669 1.00 0.00 C ATOM 285 C LEU A 19 2.740 -7.369 -3.402 1.00 0.00 C ATOM 286 O LEU A 19 3.513 -7.143 -4.333 1.00 0.00 O ATOM 287 CB LEU A 19 1.026 -9.145 -2.996 1.00 0.00 C ATOM 288 CG LEU A 19 1.937 -10.301 -3.410 1.00 0.00 C ATOM 289 CD1 LEU A 19 2.222 -11.207 -2.223 1.00 0.00 C ATOM 290 CD2 LEU A 19 1.310 -11.092 -4.549 1.00 0.00 C ATOM 0 H LEU A 19 1.770 -8.364 -5.633 1.00 0.00 H new ATOM 0 HA LEU A 19 0.633 -7.047 -3.250 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.108 -9.013 -1.917 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -0.005 -9.429 -3.205 1.00 0.00 H new ATOM 0 HG LEU A 19 2.883 -9.886 -3.759 1.00 0.00 H new ATOM 0 HD11 LEU A 19 2.872 -12.024 -2.537 1.00 0.00 H new ATOM 0 HD12 LEU A 19 2.714 -10.633 -1.437 1.00 0.00 H new ATOM 0 HD13 LEU A 19 1.285 -11.614 -1.843 1.00 0.00 H new ATOM 0 HD21 LEU A 19 1.972 -11.911 -4.831 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.350 -11.496 -4.226 1.00 0.00 H new ATOM 0 HD23 LEU A 19 1.158 -10.437 -5.407 1.00 0.00 H new ATOM 302 N SER A 20 3.093 -7.259 -2.125 1.00 0.00 N ATOM 303 CA SER A 20 4.439 -6.855 -1.736 1.00 0.00 C ATOM 304 C SER A 20 5.232 -8.046 -1.208 1.00 0.00 C ATOM 305 O SER A 20 4.675 -9.114 -0.956 1.00 0.00 O ATOM 306 CB SER A 20 4.377 -5.756 -0.673 1.00 0.00 C ATOM 307 OG SER A 20 3.037 -5.377 -0.409 1.00 0.00 O ATOM 0 H SER A 20 2.466 -7.444 -1.342 1.00 0.00 H new ATOM 0 HA SER A 20 4.946 -6.467 -2.620 1.00 0.00 H new ATOM 0 HB2 SER A 20 4.847 -6.107 0.246 1.00 0.00 H new ATOM 0 HB3 SER A 20 4.944 -4.888 -1.009 1.00 0.00 H new ATOM 0 HG SER A 20 2.600 -6.072 0.126 1.00 0.00 H new ATOM 313 N GLU A 21 6.537 -7.853 -1.042 1.00 0.00 N ATOM 314 CA GLU A 21 7.408 -8.911 -0.544 1.00 0.00 C ATOM 315 C GLU A 21 7.135 -9.192 0.931 1.00 0.00 C ATOM 316 O GLU A 21 7.455 -10.266 1.439 1.00 0.00 O ATOM 317 CB GLU A 21 8.876 -8.528 -0.739 1.00 0.00 C ATOM 318 CG GLU A 21 9.383 -7.523 0.282 1.00 0.00 C ATOM 319 CD GLU A 21 10.832 -7.140 0.053 1.00 0.00 C ATOM 320 OE1 GLU A 21 11.509 -7.827 -0.740 1.00 0.00 O ATOM 321 OE2 GLU A 21 11.290 -6.153 0.667 1.00 0.00 O ATOM 0 H GLU A 21 7.014 -6.974 -1.245 1.00 0.00 H new ATOM 0 HA GLU A 21 7.198 -9.817 -1.113 1.00 0.00 H new ATOM 0 HB2 GLU A 21 9.488 -9.428 -0.685 1.00 0.00 H new ATOM 0 HB3 GLU A 21 9.005 -8.114 -1.739 1.00 0.00 H new ATOM 0 HG2 GLU A 21 8.764 -6.627 0.243 1.00 0.00 H new ATOM 0 HG3 GLU A 21 9.275 -7.941 1.283 1.00 0.00 H new ATOM 328 N ASP A 22 6.543 -8.217 1.613 1.00 0.00 N ATOM 329 CA ASP A 22 6.226 -8.358 3.029 1.00 0.00 C ATOM 330 C ASP A 22 4.870 -9.031 3.219 1.00 0.00 C ATOM 331 O ASP A 22 4.390 -9.176 4.343 1.00 0.00 O ATOM 332 CB ASP A 22 6.230 -6.990 3.713 1.00 0.00 C ATOM 333 CG ASP A 22 6.073 -7.094 5.217 1.00 0.00 C ATOM 334 OD1 ASP A 22 7.093 -7.300 5.908 1.00 0.00 O ATOM 335 OD2 ASP A 22 4.930 -6.969 5.704 1.00 0.00 O ATOM 0 H ASP A 22 6.273 -7.321 1.208 1.00 0.00 H new ATOM 0 HA ASP A 22 6.990 -8.987 3.486 1.00 0.00 H new ATOM 0 HB2 ASP A 22 7.163 -6.475 3.483 1.00 0.00 H new ATOM 0 HB3 ASP A 22 5.421 -6.382 3.307 1.00 0.00 H new ATOM 340 N ASP A 23 4.259 -9.439 2.112 1.00 0.00 N ATOM 341 CA ASP A 23 2.958 -10.097 2.156 1.00 0.00 C ATOM 342 C ASP A 23 3.095 -11.542 2.624 1.00 0.00 C ATOM 343 O ASP A 23 2.820 -11.860 3.782 1.00 0.00 O ATOM 344 CB ASP A 23 2.295 -10.055 0.779 1.00 0.00 C ATOM 345 CG ASP A 23 1.635 -8.720 0.494 1.00 0.00 C ATOM 346 OD1 ASP A 23 2.342 -7.691 0.524 1.00 0.00 O ATOM 347 OD2 ASP A 23 0.412 -8.703 0.241 1.00 0.00 O ATOM 0 H ASP A 23 4.643 -9.326 1.174 1.00 0.00 H new ATOM 0 HA ASP A 23 2.332 -9.561 2.869 1.00 0.00 H new ATOM 0 HB2 ASP A 23 3.043 -10.258 0.013 1.00 0.00 H new ATOM 0 HB3 ASP A 23 1.549 -10.847 0.714 1.00 0.00 H new ATOM 352 N THR A 24 3.522 -12.415 1.717 1.00 0.00 N ATOM 353 CA THR A 24 3.694 -13.827 2.036 1.00 0.00 C ATOM 354 C THR A 24 4.144 -14.616 0.812 1.00 0.00 C ATOM 355 O THR A 24 3.781 -14.289 -0.318 1.00 0.00 O ATOM 356 CB THR A 24 2.391 -14.442 2.579 1.00 0.00 C ATOM 357 OG1 THR A 24 1.284 -13.581 2.290 1.00 0.00 O ATOM 358 CG2 THR A 24 2.484 -14.669 4.080 1.00 0.00 C ATOM 0 H THR A 24 3.755 -12.169 0.755 1.00 0.00 H new ATOM 0 HA THR A 24 4.463 -13.886 2.806 1.00 0.00 H new ATOM 0 HB THR A 24 2.239 -15.404 2.090 1.00 0.00 H new ATOM 0 HG1 THR A 24 0.459 -13.981 2.637 1.00 0.00 H new ATOM 0 HG21 THR A 24 1.552 -15.104 4.441 1.00 0.00 H new ATOM 0 HG22 THR A 24 3.309 -15.349 4.295 1.00 0.00 H new ATOM 0 HG23 THR A 24 2.658 -13.717 4.582 1.00 0.00 H new ATOM 366 N VAL A 25 4.936 -15.658 1.044 1.00 0.00 N ATOM 367 CA VAL A 25 5.435 -16.495 -0.041 1.00 0.00 C ATOM 368 C VAL A 25 4.286 -17.103 -0.838 1.00 0.00 C ATOM 369 O VAL A 25 4.234 -16.983 -2.063 1.00 0.00 O ATOM 370 CB VAL A 25 6.331 -17.629 0.492 1.00 0.00 C ATOM 371 CG1 VAL A 25 6.147 -18.890 -0.337 1.00 0.00 C ATOM 372 CG2 VAL A 25 7.789 -17.195 0.502 1.00 0.00 C ATOM 0 H VAL A 25 5.246 -15.943 1.973 1.00 0.00 H new ATOM 0 HA VAL A 25 6.025 -15.851 -0.693 1.00 0.00 H new ATOM 0 HB VAL A 25 6.035 -17.851 1.517 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.788 -19.680 0.055 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.106 -19.209 -0.287 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.415 -18.686 -1.374 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.408 -18.008 0.881 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.101 -16.944 -0.512 1.00 0.00 H new ATOM 0 HG23 VAL A 25 7.904 -16.321 1.144 1.00 0.00 H new ATOM 382 N LEU A 26 3.366 -17.755 -0.136 1.00 0.00 N ATOM 383 CA LEU A 26 2.216 -18.382 -0.779 1.00 0.00 C ATOM 384 C LEU A 26 1.390 -17.352 -1.543 1.00 0.00 C ATOM 385 O LEU A 26 0.658 -17.693 -2.471 1.00 0.00 O ATOM 386 CB LEU A 26 1.342 -19.080 0.265 1.00 0.00 C ATOM 387 CG LEU A 26 -0.047 -18.480 0.488 1.00 0.00 C ATOM 388 CD1 LEU A 26 -1.021 -18.983 -0.566 1.00 0.00 C ATOM 389 CD2 LEU A 26 -0.552 -18.809 1.885 1.00 0.00 C ATOM 0 H LEU A 26 3.394 -17.863 0.878 1.00 0.00 H new ATOM 0 HA LEU A 26 2.586 -19.122 -1.489 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.222 -20.123 -0.029 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.874 -19.076 1.216 1.00 0.00 H new ATOM 0 HG LEU A 26 0.027 -17.396 0.397 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.004 -18.546 -0.391 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.666 -18.695 -1.556 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.092 -20.069 -0.507 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.541 -18.374 2.026 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.611 -19.891 2.005 1.00 0.00 H new ATOM 0 HD23 LEU A 26 0.134 -18.398 2.626 1.00 0.00 H new ATOM 401 N ASP A 27 1.516 -16.090 -1.147 1.00 0.00 N ATOM 402 CA ASP A 27 0.784 -15.008 -1.796 1.00 0.00 C ATOM 403 C ASP A 27 1.424 -14.644 -3.132 1.00 0.00 C ATOM 404 O ASP A 27 0.733 -14.467 -4.136 1.00 0.00 O ATOM 405 CB ASP A 27 0.735 -13.779 -0.888 1.00 0.00 C ATOM 406 CG ASP A 27 -0.299 -12.766 -1.339 1.00 0.00 C ATOM 407 OD1 ASP A 27 -0.655 -12.775 -2.536 1.00 0.00 O ATOM 408 OD2 ASP A 27 -0.751 -11.963 -0.495 1.00 0.00 O ATOM 0 H ASP A 27 2.118 -15.791 -0.380 1.00 0.00 H new ATOM 0 HA ASP A 27 -0.233 -15.352 -1.983 1.00 0.00 H new ATOM 0 HB2 ASP A 27 0.511 -14.093 0.131 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.717 -13.307 -0.868 1.00 0.00 H new ATOM 413 N LEU A 28 2.748 -14.533 -3.137 1.00 0.00 N ATOM 414 CA LEU A 28 3.483 -14.189 -4.349 1.00 0.00 C ATOM 415 C LEU A 28 3.715 -15.423 -5.214 1.00 0.00 C ATOM 416 O LEU A 28 3.401 -15.428 -6.405 1.00 0.00 O ATOM 417 CB LEU A 28 4.823 -13.544 -3.991 1.00 0.00 C ATOM 418 CG LEU A 28 5.363 -12.520 -4.989 1.00 0.00 C ATOM 419 CD1 LEU A 28 5.971 -11.332 -4.260 1.00 0.00 C ATOM 420 CD2 LEU A 28 6.388 -13.163 -5.912 1.00 0.00 C ATOM 0 H LEU A 28 3.335 -14.676 -2.315 1.00 0.00 H new ATOM 0 HA LEU A 28 2.884 -13.477 -4.917 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.722 -13.057 -3.021 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.564 -14.335 -3.875 1.00 0.00 H new ATOM 0 HG LEU A 28 4.532 -12.161 -5.596 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.350 -10.614 -4.987 1.00 0.00 H new ATOM 0 HD12 LEU A 28 5.210 -10.856 -3.642 1.00 0.00 H new ATOM 0 HD13 LEU A 28 6.790 -11.674 -3.627 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.761 -12.419 -6.616 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.217 -13.551 -5.321 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.921 -13.980 -6.462 1.00 0.00 H new ATOM 432 N LYS A 29 4.264 -16.470 -4.608 1.00 0.00 N ATOM 433 CA LYS A 29 4.535 -17.713 -5.320 1.00 0.00 C ATOM 434 C LYS A 29 3.306 -18.173 -6.099 1.00 0.00 C ATOM 435 O LYS A 29 3.409 -18.572 -7.258 1.00 0.00 O ATOM 436 CB LYS A 29 4.968 -18.804 -4.339 1.00 0.00 C ATOM 437 CG LYS A 29 6.473 -18.898 -4.159 1.00 0.00 C ATOM 438 CD LYS A 29 7.040 -17.635 -3.532 1.00 0.00 C ATOM 439 CE LYS A 29 7.438 -16.618 -4.591 1.00 0.00 C ATOM 440 NZ LYS A 29 8.793 -16.055 -4.337 1.00 0.00 N ATOM 0 H LYS A 29 4.530 -16.482 -3.623 1.00 0.00 H new ATOM 0 HA LYS A 29 5.344 -17.528 -6.027 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.506 -18.614 -3.370 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.592 -19.765 -4.689 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.712 -19.756 -3.531 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.946 -19.069 -5.126 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.300 -17.195 -2.864 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.909 -17.888 -2.924 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.419 -17.090 -5.573 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.707 -15.810 -4.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 8.708 -15.055 -4.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.252 -16.587 -3.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.367 -16.129 -5.201 1.00 0.00 H new ATOM 454 N GLN A 30 2.146 -18.112 -5.454 1.00 0.00 N ATOM 455 CA GLN A 30 0.898 -18.521 -6.087 1.00 0.00 C ATOM 456 C GLN A 30 0.648 -17.725 -7.363 1.00 0.00 C ATOM 457 O GLN A 30 0.140 -18.257 -8.350 1.00 0.00 O ATOM 458 CB GLN A 30 -0.273 -18.339 -5.120 1.00 0.00 C ATOM 459 CG GLN A 30 -0.638 -16.883 -4.874 1.00 0.00 C ATOM 460 CD GLN A 30 -1.776 -16.410 -5.756 1.00 0.00 C ATOM 461 OE1 GLN A 30 -2.164 -17.089 -6.707 1.00 0.00 O ATOM 462 NE2 GLN A 30 -2.319 -15.239 -5.445 1.00 0.00 N ATOM 0 H GLN A 30 2.044 -17.783 -4.494 1.00 0.00 H new ATOM 0 HA GLN A 30 0.982 -19.576 -6.350 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -1.144 -18.862 -5.515 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -0.024 -18.808 -4.168 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -0.916 -16.754 -3.828 1.00 0.00 H new ATOM 0 HG3 GLN A 30 0.237 -16.258 -5.051 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -1.966 -14.709 -4.648 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -3.089 -14.870 -6.003 1.00 0.00 H new ATOM 471 N PHE A 31 1.008 -16.446 -7.337 1.00 0.00 N ATOM 472 CA PHE A 31 0.821 -15.575 -8.491 1.00 0.00 C ATOM 473 C PHE A 31 1.736 -15.991 -9.640 1.00 0.00 C ATOM 474 O PHE A 31 1.273 -16.280 -10.744 1.00 0.00 O ATOM 475 CB PHE A 31 1.096 -14.119 -8.109 1.00 0.00 C ATOM 476 CG PHE A 31 0.606 -13.129 -9.127 1.00 0.00 C ATOM 477 CD1 PHE A 31 -0.717 -12.719 -9.133 1.00 0.00 C ATOM 478 CD2 PHE A 31 1.469 -12.609 -10.077 1.00 0.00 C ATOM 479 CE1 PHE A 31 -1.170 -11.809 -10.069 1.00 0.00 C ATOM 480 CE2 PHE A 31 1.022 -11.698 -11.016 1.00 0.00 C ATOM 481 CZ PHE A 31 -0.299 -11.297 -11.011 1.00 0.00 C ATOM 0 H PHE A 31 1.431 -15.990 -6.529 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.214 -15.668 -8.820 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.622 -13.907 -7.151 1.00 0.00 H new ATOM 0 HB3 PHE A 31 2.169 -13.985 -7.970 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.402 -13.115 -8.398 1.00 0.00 H new ATOM 0 HD2 PHE A 31 2.504 -12.919 -10.084 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -2.204 -11.498 -10.064 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.705 -11.301 -11.752 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.651 -10.584 -11.742 1.00 0.00 H new ATOM 491 N LEU A 32 3.037 -16.020 -9.372 1.00 0.00 N ATOM 492 CA LEU A 32 4.018 -16.400 -10.382 1.00 0.00 C ATOM 493 C LEU A 32 3.831 -17.855 -10.802 1.00 0.00 C ATOM 494 O LEU A 32 4.172 -18.238 -11.921 1.00 0.00 O ATOM 495 CB LEU A 32 5.436 -16.190 -9.849 1.00 0.00 C ATOM 496 CG LEU A 32 5.734 -16.796 -8.477 1.00 0.00 C ATOM 497 CD1 LEU A 32 6.400 -18.155 -8.627 1.00 0.00 C ATOM 498 CD2 LEU A 32 6.609 -15.858 -7.658 1.00 0.00 C ATOM 0 H LEU A 32 3.437 -15.785 -8.464 1.00 0.00 H new ATOM 0 HA LEU A 32 3.867 -15.766 -11.256 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.139 -16.608 -10.569 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.629 -15.118 -9.800 1.00 0.00 H new ATOM 0 HG LEU A 32 4.790 -16.933 -7.949 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.605 -18.571 -7.640 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.738 -18.826 -9.174 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.336 -18.043 -9.175 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.811 -16.306 -6.685 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.550 -15.688 -8.181 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.094 -14.907 -7.520 1.00 0.00 H new ATOM 510 N LYS A 33 3.285 -18.661 -9.898 1.00 0.00 N ATOM 511 CA LYS A 33 3.048 -20.072 -10.175 1.00 0.00 C ATOM 512 C LYS A 33 2.160 -20.245 -11.403 1.00 0.00 C ATOM 513 O LYS A 33 2.336 -21.182 -12.183 1.00 0.00 O ATOM 514 CB LYS A 33 2.399 -20.749 -8.965 1.00 0.00 C ATOM 515 CG LYS A 33 1.209 -21.621 -9.321 1.00 0.00 C ATOM 516 CD LYS A 33 1.646 -22.921 -9.976 1.00 0.00 C ATOM 517 CE LYS A 33 0.493 -23.593 -10.706 1.00 0.00 C ATOM 518 NZ LYS A 33 0.497 -23.276 -12.161 1.00 0.00 N ATOM 0 H LYS A 33 2.998 -18.360 -8.966 1.00 0.00 H new ATOM 0 HA LYS A 33 4.011 -20.543 -10.375 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.146 -21.359 -8.457 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.079 -19.983 -8.259 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.636 -21.841 -8.420 1.00 0.00 H new ATOM 0 HG3 LYS A 33 0.547 -21.077 -9.995 1.00 0.00 H new ATOM 0 HD2 LYS A 33 2.456 -22.722 -10.678 1.00 0.00 H new ATOM 0 HD3 LYS A 33 2.041 -23.597 -9.218 1.00 0.00 H new ATOM 0 HE2 LYS A 33 0.557 -24.673 -10.569 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.451 -23.271 -10.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -0.424 -22.876 -12.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.248 -22.585 -12.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 0.670 -24.145 -12.705 1.00 0.00 H new ATOM 532 N THR A 34 1.206 -19.334 -11.571 1.00 0.00 N ATOM 533 CA THR A 34 0.291 -19.385 -12.704 1.00 0.00 C ATOM 534 C THR A 34 1.004 -19.026 -14.003 1.00 0.00 C ATOM 535 O THR A 34 0.586 -19.435 -15.087 1.00 0.00 O ATOM 536 CB THR A 34 -0.902 -18.432 -12.506 1.00 0.00 C ATOM 537 OG1 THR A 34 -2.013 -18.866 -13.299 1.00 0.00 O ATOM 538 CG2 THR A 34 -0.526 -17.008 -12.889 1.00 0.00 C ATOM 0 H THR A 34 1.047 -18.552 -10.936 1.00 0.00 H new ATOM 0 HA THR A 34 -0.078 -20.409 -12.766 1.00 0.00 H new ATOM 0 HB THR A 34 -1.180 -18.448 -11.452 1.00 0.00 H new ATOM 0 HG1 THR A 34 -2.768 -18.255 -13.166 1.00 0.00 H new ATOM 0 HG21 THR A 34 -1.384 -16.353 -12.741 1.00 0.00 H new ATOM 0 HG22 THR A 34 0.301 -16.670 -12.265 1.00 0.00 H new ATOM 0 HG23 THR A 34 -0.225 -16.980 -13.936 1.00 0.00 H new ATOM 546 N LEU A 35 2.083 -18.260 -13.888 1.00 0.00 N ATOM 547 CA LEU A 35 2.856 -17.846 -15.054 1.00 0.00 C ATOM 548 C LEU A 35 4.034 -18.786 -15.288 1.00 0.00 C ATOM 549 O LEU A 35 4.580 -18.853 -16.390 1.00 0.00 O ATOM 550 CB LEU A 35 3.360 -16.413 -14.874 1.00 0.00 C ATOM 551 CG LEU A 35 2.333 -15.399 -14.368 1.00 0.00 C ATOM 552 CD1 LEU A 35 2.945 -14.009 -14.301 1.00 0.00 C ATOM 553 CD2 LEU A 35 1.100 -15.399 -15.260 1.00 0.00 C ATOM 0 H LEU A 35 2.443 -17.913 -12.999 1.00 0.00 H new ATOM 0 HA LEU A 35 2.203 -17.888 -15.926 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.199 -16.429 -14.178 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.746 -16.062 -15.831 1.00 0.00 H new ATOM 0 HG LEU A 35 2.029 -15.689 -13.362 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.200 -13.300 -13.939 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.797 -14.019 -13.621 1.00 0.00 H new ATOM 0 HD13 LEU A 35 3.278 -13.710 -15.295 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.380 -14.672 -14.885 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.387 -15.134 -16.278 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.649 -16.391 -15.257 1.00 0.00 H new ATOM 565 N THR A 36 4.422 -19.513 -14.244 1.00 0.00 N ATOM 566 CA THR A 36 5.534 -20.450 -14.336 1.00 0.00 C ATOM 567 C THR A 36 5.035 -21.886 -14.459 1.00 0.00 C ATOM 568 O THR A 36 5.741 -22.757 -14.963 1.00 0.00 O ATOM 569 CB THR A 36 6.460 -20.344 -13.110 1.00 0.00 C ATOM 570 OG1 THR A 36 5.742 -20.694 -11.921 1.00 0.00 O ATOM 571 CG2 THR A 36 7.020 -18.936 -12.975 1.00 0.00 C ATOM 0 H THR A 36 3.982 -19.470 -13.325 1.00 0.00 H new ATOM 0 HA THR A 36 6.097 -20.186 -15.231 1.00 0.00 H new ATOM 0 HB THR A 36 7.290 -21.036 -13.249 1.00 0.00 H new ATOM 0 HG1 THR A 36 6.080 -21.545 -11.573 1.00 0.00 H new ATOM 0 HG21 THR A 36 7.671 -18.885 -12.102 1.00 0.00 H new ATOM 0 HG22 THR A 36 7.591 -18.684 -13.869 1.00 0.00 H new ATOM 0 HG23 THR A 36 6.200 -18.228 -12.857 1.00 0.00 H new ATOM 579 N GLY A 37 3.812 -22.124 -13.995 1.00 0.00 N ATOM 580 CA GLY A 37 3.240 -23.456 -14.063 1.00 0.00 C ATOM 581 C GLY A 37 3.588 -24.299 -12.852 1.00 0.00 C ATOM 582 O GLY A 37 2.887 -25.260 -12.534 1.00 0.00 O ATOM 0 H GLY A 37 3.208 -21.419 -13.574 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.156 -23.379 -14.149 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.596 -23.955 -14.964 1.00 0.00 H new ATOM 586 N VAL A 38 4.674 -23.941 -12.176 1.00 0.00 N ATOM 587 CA VAL A 38 5.115 -24.672 -10.994 1.00 0.00 C ATOM 588 C VAL A 38 4.678 -23.964 -9.716 1.00 0.00 C ATOM 589 O VAL A 38 4.757 -22.739 -9.613 1.00 0.00 O ATOM 590 CB VAL A 38 6.646 -24.841 -10.977 1.00 0.00 C ATOM 591 CG1 VAL A 38 7.055 -25.899 -9.964 1.00 0.00 C ATOM 592 CG2 VAL A 38 7.158 -25.194 -12.365 1.00 0.00 C ATOM 0 H VAL A 38 5.265 -23.149 -12.427 1.00 0.00 H new ATOM 0 HA VAL A 38 4.649 -25.657 -11.038 1.00 0.00 H new ATOM 0 HB VAL A 38 7.096 -23.894 -10.679 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.140 -26.005 -9.966 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.721 -25.600 -8.970 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.597 -26.852 -10.228 1.00 0.00 H new ATOM 0 HG21 VAL A 38 8.241 -25.310 -12.335 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.702 -26.128 -12.694 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.898 -24.398 -13.062 1.00 0.00 H new ATOM 602 N LEU A 39 4.218 -24.743 -8.743 1.00 0.00 N ATOM 603 CA LEU A 39 3.769 -24.191 -7.469 1.00 0.00 C ATOM 604 C LEU A 39 4.845 -24.346 -6.399 1.00 0.00 C ATOM 605 O LEU A 39 5.757 -25.165 -6.514 1.00 0.00 O ATOM 606 CB LEU A 39 2.481 -24.883 -7.017 1.00 0.00 C ATOM 607 CG LEU A 39 2.315 -26.340 -7.449 1.00 0.00 C ATOM 608 CD1 LEU A 39 2.026 -26.425 -8.940 1.00 0.00 C ATOM 609 CD2 LEU A 39 3.557 -27.146 -7.097 1.00 0.00 C ATOM 0 H LEU A 39 4.146 -25.758 -8.812 1.00 0.00 H new ATOM 0 HA LEU A 39 3.573 -23.128 -7.610 1.00 0.00 H new ATOM 0 HB2 LEU A 39 2.432 -24.840 -5.929 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.633 -24.313 -7.398 1.00 0.00 H new ATOM 0 HG LEU A 39 1.467 -26.764 -6.911 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.911 -27.470 -9.229 1.00 0.00 H new ATOM 0 HD12 LEU A 39 1.107 -25.883 -9.164 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.853 -25.983 -9.497 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.421 -28.181 -7.412 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.422 -26.722 -7.607 1.00 0.00 H new ATOM 0 HD23 LEU A 39 3.719 -27.113 -6.020 1.00 0.00 H new ATOM 621 N PRO A 40 4.738 -23.541 -5.331 1.00 0.00 N ATOM 622 CA PRO A 40 5.691 -23.571 -4.218 1.00 0.00 C ATOM 623 C PRO A 40 5.577 -24.847 -3.391 1.00 0.00 C ATOM 624 O PRO A 40 6.523 -25.243 -2.711 1.00 0.00 O ATOM 625 CB PRO A 40 5.296 -22.353 -3.380 1.00 0.00 C ATOM 626 CG PRO A 40 3.858 -22.128 -3.693 1.00 0.00 C ATOM 627 CD PRO A 40 3.677 -22.541 -5.128 1.00 0.00 C ATOM 0 HA PRO A 40 6.724 -23.550 -4.565 1.00 0.00 H new ATOM 0 HB2 PRO A 40 5.445 -22.539 -2.316 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.898 -21.482 -3.639 1.00 0.00 H new ATOM 0 HG2 PRO A 40 3.219 -22.716 -3.034 1.00 0.00 H new ATOM 0 HG3 PRO A 40 3.587 -21.082 -3.551 1.00 0.00 H new ATOM 0 HD2 PRO A 40 2.688 -22.964 -5.303 1.00 0.00 H new ATOM 0 HD3 PRO A 40 3.787 -21.695 -5.807 1.00 0.00 H new ATOM 635 N GLU A 41 4.413 -25.487 -3.456 1.00 0.00 N ATOM 636 CA GLU A 41 4.177 -26.718 -2.711 1.00 0.00 C ATOM 637 C GLU A 41 5.083 -27.839 -3.213 1.00 0.00 C ATOM 638 O GLU A 41 5.296 -28.835 -2.521 1.00 0.00 O ATOM 639 CB GLU A 41 2.711 -27.140 -2.832 1.00 0.00 C ATOM 640 CG GLU A 41 2.320 -27.589 -4.230 1.00 0.00 C ATOM 641 CD GLU A 41 0.962 -28.263 -4.268 1.00 0.00 C ATOM 642 OE1 GLU A 41 0.798 -29.303 -3.597 1.00 0.00 O ATOM 643 OE2 GLU A 41 0.064 -27.750 -4.969 1.00 0.00 O ATOM 0 H GLU A 41 3.620 -25.174 -4.016 1.00 0.00 H new ATOM 0 HA GLU A 41 4.408 -26.529 -1.663 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.516 -27.952 -2.131 1.00 0.00 H new ATOM 0 HB3 GLU A 41 2.076 -26.305 -2.537 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.312 -26.726 -4.896 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.074 -28.278 -4.610 1.00 0.00 H new ATOM 650 N ARG A 42 5.613 -27.669 -4.419 1.00 0.00 N ATOM 651 CA ARG A 42 6.494 -28.666 -5.015 1.00 0.00 C ATOM 652 C ARG A 42 7.955 -28.246 -4.886 1.00 0.00 C ATOM 653 O ARG A 42 8.820 -29.063 -4.570 1.00 0.00 O ATOM 654 CB ARG A 42 6.140 -28.876 -6.488 1.00 0.00 C ATOM 655 CG ARG A 42 5.046 -29.907 -6.710 1.00 0.00 C ATOM 656 CD ARG A 42 5.563 -31.322 -6.505 1.00 0.00 C ATOM 657 NE ARG A 42 4.481 -32.268 -6.241 1.00 0.00 N ATOM 658 CZ ARG A 42 3.872 -32.378 -5.066 1.00 0.00 C ATOM 659 NH1 ARG A 42 4.236 -31.606 -4.052 1.00 0.00 N ATOM 660 NH2 ARG A 42 2.896 -33.263 -4.905 1.00 0.00 N ATOM 0 H ARG A 42 5.448 -26.850 -5.003 1.00 0.00 H new ATOM 0 HA ARG A 42 6.355 -29.605 -4.479 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.824 -27.925 -6.916 1.00 0.00 H new ATOM 0 HB3 ARG A 42 7.035 -29.186 -7.027 1.00 0.00 H new ATOM 0 HG2 ARG A 42 4.221 -29.717 -6.023 1.00 0.00 H new ATOM 0 HG3 ARG A 42 4.649 -29.806 -7.720 1.00 0.00 H new ATOM 0 HD2 ARG A 42 6.113 -31.639 -7.391 1.00 0.00 H new ATOM 0 HD3 ARG A 42 6.266 -31.334 -5.672 1.00 0.00 H new ATOM 0 HE ARG A 42 4.177 -32.877 -7.001 1.00 0.00 H new ATOM 0 HH11 ARG A 42 4.986 -30.925 -4.173 1.00 0.00 H new ATOM 0 HH12 ARG A 42 3.766 -31.693 -3.151 1.00 0.00 H new ATOM 0 HH21 ARG A 42 2.614 -33.858 -5.684 1.00 0.00 H new ATOM 0 HH22 ARG A 42 2.428 -33.348 -4.003 1.00 0.00 H new ATOM 674 N GLN A 43 8.222 -26.968 -5.134 1.00 0.00 N ATOM 675 CA GLN A 43 9.579 -26.441 -5.047 1.00 0.00 C ATOM 676 C GLN A 43 9.596 -25.098 -4.324 1.00 0.00 C ATOM 677 O GLN A 43 8.548 -24.563 -3.960 1.00 0.00 O ATOM 678 CB GLN A 43 10.180 -26.288 -6.445 1.00 0.00 C ATOM 679 CG GLN A 43 9.151 -25.972 -7.519 1.00 0.00 C ATOM 680 CD GLN A 43 9.590 -24.847 -8.435 1.00 0.00 C ATOM 681 OE1 GLN A 43 9.472 -23.670 -8.093 1.00 0.00 O ATOM 682 NE2 GLN A 43 10.100 -25.204 -9.608 1.00 0.00 N ATOM 0 H GLN A 43 7.517 -26.279 -5.397 1.00 0.00 H new ATOM 0 HA GLN A 43 10.180 -27.148 -4.476 1.00 0.00 H new ATOM 0 HB2 GLN A 43 10.927 -25.495 -6.425 1.00 0.00 H new ATOM 0 HB3 GLN A 43 10.699 -27.209 -6.711 1.00 0.00 H new ATOM 0 HG2 GLN A 43 8.965 -26.867 -8.113 1.00 0.00 H new ATOM 0 HG3 GLN A 43 8.208 -25.702 -7.045 1.00 0.00 H new ATOM 0 HE21 GLN A 43 10.179 -26.192 -9.850 1.00 0.00 H new ATOM 0 HE22 GLN A 43 10.413 -24.491 -10.267 1.00 0.00 H new ATOM 691 N LYS A 44 10.792 -24.557 -4.120 1.00 0.00 N ATOM 692 CA LYS A 44 10.946 -23.275 -3.441 1.00 0.00 C ATOM 693 C LYS A 44 11.890 -22.360 -4.215 1.00 0.00 C ATOM 694 O LYS A 44 12.760 -22.828 -4.952 1.00 0.00 O ATOM 695 CB LYS A 44 11.476 -23.487 -2.021 1.00 0.00 C ATOM 696 CG LYS A 44 12.905 -24.000 -1.975 1.00 0.00 C ATOM 697 CD LYS A 44 12.983 -25.375 -1.333 1.00 0.00 C ATOM 698 CE LYS A 44 14.242 -26.117 -1.755 1.00 0.00 C ATOM 699 NZ LYS A 44 14.479 -27.327 -0.921 1.00 0.00 N ATOM 0 H LYS A 44 11.669 -24.986 -4.415 1.00 0.00 H new ATOM 0 HA LYS A 44 9.967 -22.799 -3.390 1.00 0.00 H new ATOM 0 HB2 LYS A 44 11.420 -22.544 -1.477 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.828 -24.194 -1.502 1.00 0.00 H new ATOM 0 HG2 LYS A 44 13.309 -24.046 -2.986 1.00 0.00 H new ATOM 0 HG3 LYS A 44 13.526 -23.300 -1.416 1.00 0.00 H new ATOM 0 HD2 LYS A 44 12.966 -25.272 -0.248 1.00 0.00 H new ATOM 0 HD3 LYS A 44 12.105 -25.958 -1.612 1.00 0.00 H new ATOM 0 HE2 LYS A 44 14.158 -26.408 -2.802 1.00 0.00 H new ATOM 0 HE3 LYS A 44 15.100 -25.449 -1.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 15.346 -27.804 -1.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 14.585 -27.047 0.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 13.672 -27.976 -1.014 1.00 0.00 H new ATOM 713 N LEU A 45 11.714 -21.055 -4.043 1.00 0.00 N ATOM 714 CA LEU A 45 12.551 -20.074 -4.725 1.00 0.00 C ATOM 715 C LEU A 45 13.789 -19.745 -3.896 1.00 0.00 C ATOM 716 O LEU A 45 13.708 -19.580 -2.678 1.00 0.00 O ATOM 717 CB LEU A 45 11.754 -18.798 -5.000 1.00 0.00 C ATOM 718 CG LEU A 45 10.858 -18.820 -6.239 1.00 0.00 C ATOM 719 CD1 LEU A 45 9.391 -18.806 -5.837 1.00 0.00 C ATOM 720 CD2 LEU A 45 11.175 -17.642 -7.148 1.00 0.00 C ATOM 0 H LEU A 45 10.999 -20.651 -3.437 1.00 0.00 H new ATOM 0 HA LEU A 45 12.874 -20.504 -5.673 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.132 -18.588 -4.130 1.00 0.00 H new ATOM 0 HB3 LEU A 45 12.455 -17.969 -5.098 1.00 0.00 H new ATOM 0 HG LEU A 45 11.054 -19.740 -6.789 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.768 -18.822 -6.732 1.00 0.00 H new ATOM 0 HD12 LEU A 45 9.172 -19.683 -5.227 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.179 -17.903 -5.264 1.00 0.00 H new ATOM 0 HD21 LEU A 45 10.528 -17.674 -8.024 1.00 0.00 H new ATOM 0 HD22 LEU A 45 11.008 -16.710 -6.608 1.00 0.00 H new ATOM 0 HD23 LEU A 45 12.217 -17.696 -7.464 1.00 0.00 H new ATOM 732 N LEU A 46 14.933 -19.649 -4.564 1.00 0.00 N ATOM 733 CA LEU A 46 16.189 -19.337 -3.890 1.00 0.00 C ATOM 734 C LEU A 46 15.994 -18.230 -2.860 1.00 0.00 C ATOM 735 O LEU A 46 15.178 -17.329 -3.049 1.00 0.00 O ATOM 736 CB LEU A 46 17.248 -18.918 -4.911 1.00 0.00 C ATOM 737 CG LEU A 46 18.076 -20.049 -5.522 1.00 0.00 C ATOM 738 CD1 LEU A 46 17.253 -20.825 -6.539 1.00 0.00 C ATOM 739 CD2 LEU A 46 19.340 -19.498 -6.166 1.00 0.00 C ATOM 0 H LEU A 46 15.017 -19.783 -5.572 1.00 0.00 H new ATOM 0 HA LEU A 46 16.527 -20.234 -3.372 1.00 0.00 H new ATOM 0 HB2 LEU A 46 16.752 -18.380 -5.719 1.00 0.00 H new ATOM 0 HB3 LEU A 46 17.929 -18.215 -4.431 1.00 0.00 H new ATOM 0 HG LEU A 46 18.367 -20.732 -4.723 1.00 0.00 H new ATOM 0 HD11 LEU A 46 17.859 -21.626 -6.963 1.00 0.00 H new ATOM 0 HD12 LEU A 46 16.378 -21.253 -6.049 1.00 0.00 H new ATOM 0 HD13 LEU A 46 16.931 -20.154 -7.335 1.00 0.00 H new ATOM 0 HD21 LEU A 46 19.916 -20.317 -6.595 1.00 0.00 H new ATOM 0 HD22 LEU A 46 19.070 -18.793 -6.952 1.00 0.00 H new ATOM 0 HD23 LEU A 46 19.940 -18.988 -5.412 1.00 0.00 H new ATOM 751 N GLY A 47 16.750 -18.304 -1.769 1.00 0.00 N ATOM 752 CA GLY A 47 16.646 -17.301 -0.725 1.00 0.00 C ATOM 753 C GLY A 47 17.282 -17.750 0.576 1.00 0.00 C ATOM 754 O GLY A 47 18.475 -17.539 0.798 1.00 0.00 O ATOM 0 H GLY A 47 17.433 -19.040 -1.589 1.00 0.00 H new ATOM 0 HA2 GLY A 47 17.124 -16.381 -1.061 1.00 0.00 H new ATOM 0 HA3 GLY A 47 15.595 -17.070 -0.551 1.00 0.00 H new ATOM 758 N LEU A 48 16.485 -18.369 1.439 1.00 0.00 N ATOM 759 CA LEU A 48 16.976 -18.848 2.727 1.00 0.00 C ATOM 760 C LEU A 48 15.898 -19.639 3.461 1.00 0.00 C ATOM 761 O LEU A 48 14.716 -19.554 3.129 1.00 0.00 O ATOM 762 CB LEU A 48 17.437 -17.671 3.589 1.00 0.00 C ATOM 763 CG LEU A 48 18.319 -18.022 4.787 1.00 0.00 C ATOM 764 CD1 LEU A 48 19.600 -18.700 4.327 1.00 0.00 C ATOM 765 CD2 LEU A 48 18.636 -16.774 5.600 1.00 0.00 C ATOM 0 H LEU A 48 15.496 -18.551 1.271 1.00 0.00 H new ATOM 0 HA LEU A 48 17.823 -19.509 2.542 1.00 0.00 H new ATOM 0 HB2 LEU A 48 17.982 -16.973 2.954 1.00 0.00 H new ATOM 0 HB3 LEU A 48 16.554 -17.146 3.954 1.00 0.00 H new ATOM 0 HG LEU A 48 17.773 -18.718 5.424 1.00 0.00 H new ATOM 0 HD11 LEU A 48 20.215 -18.942 5.194 1.00 0.00 H new ATOM 0 HD12 LEU A 48 19.354 -19.616 3.789 1.00 0.00 H new ATOM 0 HD13 LEU A 48 20.150 -18.029 3.668 1.00 0.00 H new ATOM 0 HD21 LEU A 48 19.265 -17.043 6.449 1.00 0.00 H new ATOM 0 HD22 LEU A 48 19.162 -16.055 4.972 1.00 0.00 H new ATOM 0 HD23 LEU A 48 17.709 -16.330 5.962 1.00 0.00 H new ATOM 777 N LYS A 49 16.314 -20.408 4.462 1.00 0.00 N ATOM 778 CA LYS A 49 15.385 -21.212 5.246 1.00 0.00 C ATOM 779 C LYS A 49 15.263 -20.671 6.667 1.00 0.00 C ATOM 780 O LYS A 49 16.264 -20.354 7.310 1.00 0.00 O ATOM 781 CB LYS A 49 15.847 -22.671 5.283 1.00 0.00 C ATOM 782 CG LYS A 49 16.455 -23.149 3.976 1.00 0.00 C ATOM 783 CD LYS A 49 16.405 -24.664 3.859 1.00 0.00 C ATOM 784 CE LYS A 49 17.341 -25.170 2.772 1.00 0.00 C ATOM 785 NZ LYS A 49 18.771 -24.951 3.125 1.00 0.00 N ATOM 0 H LYS A 49 17.289 -20.491 4.749 1.00 0.00 H new ATOM 0 HA LYS A 49 14.406 -21.159 4.770 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.580 -22.791 6.081 1.00 0.00 H new ATOM 0 HB3 LYS A 49 14.997 -23.306 5.533 1.00 0.00 H new ATOM 0 HG2 LYS A 49 15.920 -22.701 3.139 1.00 0.00 H new ATOM 0 HG3 LYS A 49 17.489 -22.812 3.910 1.00 0.00 H new ATOM 0 HD2 LYS A 49 16.678 -25.113 4.814 1.00 0.00 H new ATOM 0 HD3 LYS A 49 15.385 -24.980 3.639 1.00 0.00 H new ATOM 0 HE2 LYS A 49 17.166 -26.233 2.608 1.00 0.00 H new ATOM 0 HE3 LYS A 49 17.117 -24.662 1.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 19.368 -25.597 2.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 19.034 -23.968 2.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 18.910 -25.135 4.139 1.00 0.00 H new ATOM 799 N VAL A 50 14.029 -20.568 7.152 1.00 0.00 N ATOM 800 CA VAL A 50 13.776 -20.068 8.498 1.00 0.00 C ATOM 801 C VAL A 50 13.213 -21.165 9.395 1.00 0.00 C ATOM 802 O VAL A 50 12.364 -21.951 8.975 1.00 0.00 O ATOM 803 CB VAL A 50 12.795 -18.881 8.480 1.00 0.00 C ATOM 804 CG1 VAL A 50 11.435 -19.320 7.961 1.00 0.00 C ATOM 805 CG2 VAL A 50 12.674 -18.269 9.868 1.00 0.00 C ATOM 0 H VAL A 50 13.189 -20.824 6.633 1.00 0.00 H new ATOM 0 HA VAL A 50 14.734 -19.733 8.897 1.00 0.00 H new ATOM 0 HB VAL A 50 13.185 -18.119 7.805 1.00 0.00 H new ATOM 0 HG11 VAL A 50 10.755 -18.468 7.956 1.00 0.00 H new ATOM 0 HG12 VAL A 50 11.540 -19.707 6.947 1.00 0.00 H new ATOM 0 HG13 VAL A 50 11.033 -20.100 8.607 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.977 -17.432 9.837 1.00 0.00 H new ATOM 0 HG22 VAL A 50 12.307 -19.021 10.566 1.00 0.00 H new ATOM 0 HG23 VAL A 50 13.651 -17.915 10.196 1.00 0.00 H new ATOM 815 N LYS A 51 13.692 -21.211 10.634 1.00 0.00 N ATOM 816 CA LYS A 51 13.236 -22.210 11.593 1.00 0.00 C ATOM 817 C LYS A 51 13.550 -23.620 11.102 1.00 0.00 C ATOM 818 O LYS A 51 12.985 -24.598 11.590 1.00 0.00 O ATOM 819 CB LYS A 51 11.731 -22.066 11.835 1.00 0.00 C ATOM 820 CG LYS A 51 11.293 -20.637 12.107 1.00 0.00 C ATOM 821 CD LYS A 51 10.317 -20.565 13.269 1.00 0.00 C ATOM 822 CE LYS A 51 8.894 -20.865 12.821 1.00 0.00 C ATOM 823 NZ LYS A 51 8.607 -22.326 12.827 1.00 0.00 N ATOM 0 H LYS A 51 14.396 -20.568 10.997 1.00 0.00 H new ATOM 0 HA LYS A 51 13.766 -22.045 12.531 1.00 0.00 H new ATOM 0 HB2 LYS A 51 11.194 -22.442 10.964 1.00 0.00 H new ATOM 0 HB3 LYS A 51 11.446 -22.692 12.681 1.00 0.00 H new ATOM 0 HG2 LYS A 51 12.167 -20.023 12.326 1.00 0.00 H new ATOM 0 HG3 LYS A 51 10.827 -20.222 11.213 1.00 0.00 H new ATOM 0 HD2 LYS A 51 10.614 -21.276 14.040 1.00 0.00 H new ATOM 0 HD3 LYS A 51 10.357 -19.573 13.718 1.00 0.00 H new ATOM 0 HE2 LYS A 51 8.191 -20.354 13.479 1.00 0.00 H new ATOM 0 HE3 LYS A 51 8.738 -20.468 11.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 7.589 -22.480 12.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 9.140 -22.788 12.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 8.892 -22.732 13.741 1.00 0.00 H new ATOM 837 N GLY A 52 14.455 -23.716 10.134 1.00 0.00 N ATOM 838 CA GLY A 52 14.829 -25.010 9.594 1.00 0.00 C ATOM 839 C GLY A 52 13.935 -25.441 8.448 1.00 0.00 C ATOM 840 O GLY A 52 14.158 -26.486 7.836 1.00 0.00 O ATOM 0 H GLY A 52 14.936 -22.921 9.714 1.00 0.00 H new ATOM 0 HA2 GLY A 52 15.862 -24.972 9.250 1.00 0.00 H new ATOM 0 HA3 GLY A 52 14.785 -25.757 10.386 1.00 0.00 H new ATOM 844 N LYS A 53 12.919 -24.636 8.158 1.00 0.00 N ATOM 845 CA LYS A 53 11.987 -24.938 7.078 1.00 0.00 C ATOM 846 C LYS A 53 12.323 -24.133 5.827 1.00 0.00 C ATOM 847 O LYS A 53 12.752 -22.981 5.898 1.00 0.00 O ATOM 848 CB LYS A 53 10.551 -24.642 7.518 1.00 0.00 C ATOM 849 CG LYS A 53 9.982 -25.676 8.473 1.00 0.00 C ATOM 850 CD LYS A 53 8.882 -26.495 7.818 1.00 0.00 C ATOM 851 CE LYS A 53 8.218 -27.434 8.813 1.00 0.00 C ATOM 852 NZ LYS A 53 7.450 -28.512 8.130 1.00 0.00 N ATOM 0 H LYS A 53 12.720 -23.769 8.656 1.00 0.00 H new ATOM 0 HA LYS A 53 12.077 -25.998 6.841 1.00 0.00 H new ATOM 0 HB2 LYS A 53 10.521 -23.663 7.996 1.00 0.00 H new ATOM 0 HB3 LYS A 53 9.914 -24.585 6.635 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.779 -26.339 8.810 1.00 0.00 H new ATOM 0 HG3 LYS A 53 9.587 -25.177 9.358 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.134 -25.826 7.392 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.299 -27.073 6.993 1.00 0.00 H new ATOM 0 HE2 LYS A 53 8.978 -27.880 9.455 1.00 0.00 H new ATOM 0 HE3 LYS A 53 7.549 -26.865 9.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 7.012 -29.131 8.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 6.708 -28.088 7.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 8.092 -29.071 7.533 1.00 0.00 H new ATOM 866 N PRO A 54 12.123 -24.750 4.653 1.00 0.00 N ATOM 867 CA PRO A 54 12.397 -24.108 3.364 1.00 0.00 C ATOM 868 C PRO A 54 11.411 -22.988 3.054 1.00 0.00 C ATOM 869 O PRO A 54 10.643 -23.072 2.096 1.00 0.00 O ATOM 870 CB PRO A 54 12.242 -25.251 2.358 1.00 0.00 C ATOM 871 CG PRO A 54 11.322 -26.218 3.022 1.00 0.00 C ATOM 872 CD PRO A 54 11.615 -26.123 4.494 1.00 0.00 C ATOM 0 HA PRO A 54 13.379 -23.636 3.344 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.828 -24.895 1.415 1.00 0.00 H new ATOM 0 HB3 PRO A 54 13.203 -25.711 2.131 1.00 0.00 H new ATOM 0 HG2 PRO A 54 10.281 -25.972 2.815 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.489 -27.231 2.655 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.721 -26.292 5.093 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.352 -26.863 4.806 1.00 0.00 H new ATOM 880 N ALA A 55 11.438 -21.939 3.870 1.00 0.00 N ATOM 881 CA ALA A 55 10.547 -20.800 3.681 1.00 0.00 C ATOM 882 C ALA A 55 9.105 -21.257 3.491 1.00 0.00 C ATOM 883 O ALA A 55 8.636 -21.412 2.364 1.00 0.00 O ATOM 884 CB ALA A 55 11.000 -19.969 2.490 1.00 0.00 C ATOM 0 H ALA A 55 12.067 -21.854 4.668 1.00 0.00 H new ATOM 0 HA ALA A 55 10.590 -20.183 4.579 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.326 -19.122 2.360 1.00 0.00 H new ATOM 0 HB2 ALA A 55 12.012 -19.604 2.665 1.00 0.00 H new ATOM 0 HB3 ALA A 55 10.987 -20.585 1.591 1.00 0.00 H new ATOM 890 N GLU A 56 8.406 -21.472 4.602 1.00 0.00 N ATOM 891 CA GLU A 56 7.017 -21.913 4.557 1.00 0.00 C ATOM 892 C GLU A 56 6.186 -21.002 3.657 1.00 0.00 C ATOM 893 O GLU A 56 6.663 -19.966 3.195 1.00 0.00 O ATOM 894 CB GLU A 56 6.421 -21.939 5.966 1.00 0.00 C ATOM 895 CG GLU A 56 5.411 -23.054 6.179 1.00 0.00 C ATOM 896 CD GLU A 56 5.937 -24.151 7.084 1.00 0.00 C ATOM 897 OE1 GLU A 56 6.407 -23.829 8.196 1.00 0.00 O ATOM 898 OE2 GLU A 56 5.877 -25.332 6.681 1.00 0.00 O ATOM 0 H GLU A 56 8.779 -21.348 5.543 1.00 0.00 H new ATOM 0 HA GLU A 56 6.996 -22.921 4.143 1.00 0.00 H new ATOM 0 HB2 GLU A 56 7.228 -22.048 6.691 1.00 0.00 H new ATOM 0 HB3 GLU A 56 5.940 -20.981 6.166 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.501 -22.637 6.610 1.00 0.00 H new ATOM 0 HG3 GLU A 56 5.139 -23.483 5.214 1.00 0.00 H new ATOM 905 N ASN A 57 4.940 -21.396 3.414 1.00 0.00 N ATOM 906 CA ASN A 57 4.043 -20.616 2.570 1.00 0.00 C ATOM 907 C ASN A 57 3.658 -19.306 3.250 1.00 0.00 C ATOM 908 O ASN A 57 3.460 -18.286 2.588 1.00 0.00 O ATOM 909 CB ASN A 57 2.785 -21.424 2.245 1.00 0.00 C ATOM 910 CG ASN A 57 3.062 -22.912 2.148 1.00 0.00 C ATOM 911 OD1 ASN A 57 2.963 -23.639 3.137 1.00 0.00 O ATOM 912 ND2 ASN A 57 3.411 -23.372 0.952 1.00 0.00 N ATOM 0 H ASN A 57 4.529 -22.251 3.790 1.00 0.00 H new ATOM 0 HA ASN A 57 4.567 -20.383 1.643 1.00 0.00 H new ATOM 0 HB2 ASN A 57 2.034 -21.247 3.015 1.00 0.00 H new ATOM 0 HB3 ASN A 57 2.365 -21.073 1.302 1.00 0.00 H new ATOM 0 HD21 ASN A 57 3.610 -24.364 0.825 1.00 0.00 H new ATOM 0 HD22 ASN A 57 3.480 -22.733 0.160 1.00 0.00 H new ATOM 919 N ASP A 58 3.554 -19.341 4.573 1.00 0.00 N ATOM 920 CA ASP A 58 3.194 -18.156 5.344 1.00 0.00 C ATOM 921 C ASP A 58 4.398 -17.236 5.519 1.00 0.00 C ATOM 922 O ASP A 58 4.264 -16.103 5.982 1.00 0.00 O ATOM 923 CB ASP A 58 2.641 -18.559 6.712 1.00 0.00 C ATOM 924 CG ASP A 58 1.231 -19.108 6.627 1.00 0.00 C ATOM 925 OD1 ASP A 58 0.685 -19.174 5.505 1.00 0.00 O ATOM 926 OD2 ASP A 58 0.672 -19.473 7.683 1.00 0.00 O ATOM 0 H ASP A 58 3.714 -20.177 5.135 1.00 0.00 H new ATOM 0 HA ASP A 58 2.423 -17.616 4.795 1.00 0.00 H new ATOM 0 HB2 ASP A 58 3.294 -19.309 7.158 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.652 -17.693 7.374 1.00 0.00 H new ATOM 931 N VAL A 59 5.574 -17.731 5.147 1.00 0.00 N ATOM 932 CA VAL A 59 6.802 -16.953 5.263 1.00 0.00 C ATOM 933 C VAL A 59 6.845 -15.836 4.227 1.00 0.00 C ATOM 934 O VAL A 59 6.619 -16.066 3.038 1.00 0.00 O ATOM 935 CB VAL A 59 8.048 -17.843 5.094 1.00 0.00 C ATOM 936 CG1 VAL A 59 9.311 -16.995 5.072 1.00 0.00 C ATOM 937 CG2 VAL A 59 8.113 -18.884 6.201 1.00 0.00 C ATOM 0 H VAL A 59 5.702 -18.667 4.763 1.00 0.00 H new ATOM 0 HA VAL A 59 6.808 -16.518 6.262 1.00 0.00 H new ATOM 0 HB VAL A 59 7.974 -18.365 4.140 1.00 0.00 H new ATOM 0 HG11 VAL A 59 10.181 -17.641 4.952 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.263 -16.292 4.240 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.395 -16.443 6.008 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.999 -19.504 6.066 1.00 0.00 H new ATOM 0 HG22 VAL A 59 8.164 -18.384 7.168 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.222 -19.511 6.163 1.00 0.00 H new ATOM 947 N LYS A 60 7.136 -14.623 4.684 1.00 0.00 N ATOM 948 CA LYS A 60 7.211 -13.467 3.798 1.00 0.00 C ATOM 949 C LYS A 60 8.357 -13.618 2.803 1.00 0.00 C ATOM 950 O LYS A 60 9.281 -14.404 3.019 1.00 0.00 O ATOM 951 CB LYS A 60 7.394 -12.185 4.613 1.00 0.00 C ATOM 952 CG LYS A 60 6.692 -12.215 5.960 1.00 0.00 C ATOM 953 CD LYS A 60 6.043 -10.879 6.279 1.00 0.00 C ATOM 954 CE LYS A 60 4.563 -11.039 6.591 1.00 0.00 C ATOM 955 NZ LYS A 60 4.340 -11.582 7.960 1.00 0.00 N ATOM 0 H LYS A 60 7.324 -14.415 5.665 1.00 0.00 H new ATOM 0 HA LYS A 60 6.276 -13.406 3.241 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.459 -12.014 4.771 1.00 0.00 H new ATOM 0 HB3 LYS A 60 7.018 -11.340 4.035 1.00 0.00 H new ATOM 0 HG2 LYS A 60 5.934 -12.998 5.959 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.410 -12.468 6.740 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.548 -10.422 7.130 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.167 -10.202 5.434 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.066 -10.073 6.498 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.107 -11.704 5.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.319 -11.676 8.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.793 -12.515 8.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.752 -10.935 8.662 1.00 0.00 H new ATOM 969 N LEU A 61 8.293 -12.859 1.715 1.00 0.00 N ATOM 970 CA LEU A 61 9.327 -12.907 0.687 1.00 0.00 C ATOM 971 C LEU A 61 10.610 -12.240 1.173 1.00 0.00 C ATOM 972 O LEU A 61 11.633 -12.897 1.358 1.00 0.00 O ATOM 973 CB LEU A 61 8.836 -12.225 -0.591 1.00 0.00 C ATOM 974 CG LEU A 61 7.697 -12.927 -1.332 1.00 0.00 C ATOM 975 CD1 LEU A 61 8.007 -14.405 -1.508 1.00 0.00 C ATOM 976 CD2 LEU A 61 6.383 -12.740 -0.589 1.00 0.00 C ATOM 0 H LEU A 61 7.536 -12.203 1.522 1.00 0.00 H new ATOM 0 HA LEU A 61 9.543 -13.954 0.473 1.00 0.00 H new ATOM 0 HB2 LEU A 61 8.511 -11.216 -0.338 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.680 -12.126 -1.273 1.00 0.00 H new ATOM 0 HG LEU A 61 7.599 -12.477 -2.320 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.186 -14.889 -2.037 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.926 -14.518 -2.083 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.132 -14.870 -0.530 1.00 0.00 H new ATOM 0 HD21 LEU A 61 5.584 -13.246 -1.130 1.00 0.00 H new ATOM 0 HD22 LEU A 61 6.468 -13.163 0.412 1.00 0.00 H new ATOM 0 HD23 LEU A 61 6.155 -11.677 -0.515 1.00 0.00 H new ATOM 988 N GLY A 62 10.546 -10.928 1.380 1.00 0.00 N ATOM 989 CA GLY A 62 11.708 -10.193 1.845 1.00 0.00 C ATOM 990 C GLY A 62 12.280 -10.764 3.127 1.00 0.00 C ATOM 991 O GLY A 62 13.390 -10.416 3.528 1.00 0.00 O ATOM 0 H GLY A 62 9.711 -10.361 1.234 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.476 -10.205 1.071 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.434 -9.150 2.006 1.00 0.00 H new ATOM 995 N ALA A 63 11.520 -11.643 3.772 1.00 0.00 N ATOM 996 CA ALA A 63 11.959 -12.264 5.016 1.00 0.00 C ATOM 997 C ALA A 63 13.252 -13.047 4.813 1.00 0.00 C ATOM 998 O ALA A 63 14.260 -12.781 5.469 1.00 0.00 O ATOM 999 CB ALA A 63 10.869 -13.174 5.564 1.00 0.00 C ATOM 0 H ALA A 63 10.598 -11.941 3.454 1.00 0.00 H new ATOM 0 HA ALA A 63 12.155 -11.472 5.739 1.00 0.00 H new ATOM 0 HB1 ALA A 63 11.210 -13.631 6.493 1.00 0.00 H new ATOM 0 HB2 ALA A 63 9.969 -12.589 5.756 1.00 0.00 H new ATOM 0 HB3 ALA A 63 10.646 -13.954 4.836 1.00 0.00 H new ATOM 1005 N LEU A 64 13.216 -14.013 3.902 1.00 0.00 N ATOM 1006 CA LEU A 64 14.386 -14.836 3.613 1.00 0.00 C ATOM 1007 C LEU A 64 14.725 -14.797 2.127 1.00 0.00 C ATOM 1008 O LEU A 64 15.895 -14.819 1.745 1.00 0.00 O ATOM 1009 CB LEU A 64 14.140 -16.279 4.055 1.00 0.00 C ATOM 1010 CG LEU A 64 12.678 -16.677 4.268 1.00 0.00 C ATOM 1011 CD1 LEU A 64 11.941 -16.731 2.939 1.00 0.00 C ATOM 1012 CD2 LEU A 64 12.589 -18.016 4.984 1.00 0.00 C ATOM 0 H LEU A 64 12.390 -14.246 3.351 1.00 0.00 H new ATOM 0 HA LEU A 64 15.231 -14.432 4.170 1.00 0.00 H new ATOM 0 HB2 LEU A 64 14.572 -16.945 3.308 1.00 0.00 H new ATOM 0 HB3 LEU A 64 14.681 -16.450 4.985 1.00 0.00 H new ATOM 0 HG LEU A 64 12.203 -15.921 4.893 1.00 0.00 H new ATOM 0 HD11 LEU A 64 10.903 -17.016 3.110 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.975 -15.751 2.464 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.416 -17.466 2.289 1.00 0.00 H new ATOM 0 HD21 LEU A 64 11.542 -18.283 5.127 1.00 0.00 H new ATOM 0 HD22 LEU A 64 13.081 -18.782 4.385 1.00 0.00 H new ATOM 0 HD23 LEU A 64 13.081 -17.943 5.954 1.00 0.00 H new ATOM 1024 N LYS A 65 13.693 -14.737 1.291 1.00 0.00 N ATOM 1025 CA LYS A 65 13.880 -14.691 -0.154 1.00 0.00 C ATOM 1026 C LYS A 65 14.909 -13.632 -0.536 1.00 0.00 C ATOM 1027 O LYS A 65 16.093 -13.930 -0.697 1.00 0.00 O ATOM 1028 CB LYS A 65 12.550 -14.401 -0.852 1.00 0.00 C ATOM 1029 CG LYS A 65 11.470 -15.426 -0.552 1.00 0.00 C ATOM 1030 CD LYS A 65 11.788 -16.772 -1.181 1.00 0.00 C ATOM 1031 CE LYS A 65 11.806 -17.882 -0.141 1.00 0.00 C ATOM 1032 NZ LYS A 65 11.576 -19.220 -0.754 1.00 0.00 N ATOM 0 H LYS A 65 12.718 -14.719 1.590 1.00 0.00 H new ATOM 0 HA LYS A 65 14.249 -15.664 -0.479 1.00 0.00 H new ATOM 0 HB2 LYS A 65 12.198 -13.415 -0.549 1.00 0.00 H new ATOM 0 HB3 LYS A 65 12.715 -14.364 -1.929 1.00 0.00 H new ATOM 0 HG2 LYS A 65 11.368 -15.543 0.527 1.00 0.00 H new ATOM 0 HG3 LYS A 65 10.512 -15.066 -0.926 1.00 0.00 H new ATOM 0 HD2 LYS A 65 11.047 -17.001 -1.947 1.00 0.00 H new ATOM 0 HD3 LYS A 65 12.756 -16.723 -1.679 1.00 0.00 H new ATOM 0 HE2 LYS A 65 12.765 -17.880 0.376 1.00 0.00 H new ATOM 0 HE3 LYS A 65 11.039 -17.689 0.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 11.937 -19.960 -0.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.557 -19.361 -0.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 12.073 -19.274 -1.666 1.00 0.00 H new ATOM 1046 N LEU A 66 14.450 -12.393 -0.679 1.00 0.00 N ATOM 1047 CA LEU A 66 15.331 -11.288 -1.041 1.00 0.00 C ATOM 1048 C LEU A 66 14.535 -10.005 -1.257 1.00 0.00 C ATOM 1049 O LEU A 66 13.335 -9.952 -0.983 1.00 0.00 O ATOM 1050 CB LEU A 66 16.119 -11.631 -2.306 1.00 0.00 C ATOM 1051 CG LEU A 66 15.356 -12.403 -3.384 1.00 0.00 C ATOM 1052 CD1 LEU A 66 14.216 -11.562 -3.936 1.00 0.00 C ATOM 1053 CD2 LEU A 66 16.297 -12.830 -4.501 1.00 0.00 C ATOM 0 H LEU A 66 13.473 -12.129 -0.550 1.00 0.00 H new ATOM 0 HA LEU A 66 16.028 -11.128 -0.218 1.00 0.00 H new ATOM 0 HB2 LEU A 66 16.487 -10.703 -2.744 1.00 0.00 H new ATOM 0 HB3 LEU A 66 16.993 -12.216 -2.018 1.00 0.00 H new ATOM 0 HG LEU A 66 14.932 -13.299 -2.931 1.00 0.00 H new ATOM 0 HD11 LEU A 66 13.684 -12.127 -4.702 1.00 0.00 H new ATOM 0 HD12 LEU A 66 13.528 -11.307 -3.130 1.00 0.00 H new ATOM 0 HD13 LEU A 66 14.617 -10.648 -4.373 1.00 0.00 H new ATOM 0 HD21 LEU A 66 15.737 -13.378 -5.259 1.00 0.00 H new ATOM 0 HD22 LEU A 66 16.750 -11.947 -4.952 1.00 0.00 H new ATOM 0 HD23 LEU A 66 17.079 -13.471 -4.093 1.00 0.00 H new ATOM 1065 N LYS A 67 15.209 -8.973 -1.752 1.00 0.00 N ATOM 1066 CA LYS A 67 14.565 -7.690 -2.009 1.00 0.00 C ATOM 1067 C LYS A 67 13.475 -7.830 -3.068 1.00 0.00 C ATOM 1068 O LYS A 67 13.387 -8.836 -3.772 1.00 0.00 O ATOM 1069 CB LYS A 67 15.600 -6.658 -2.461 1.00 0.00 C ATOM 1070 CG LYS A 67 16.035 -5.709 -1.357 1.00 0.00 C ATOM 1071 CD LYS A 67 17.281 -4.933 -1.748 1.00 0.00 C ATOM 1072 CE LYS A 67 18.528 -5.800 -1.660 1.00 0.00 C ATOM 1073 NZ LYS A 67 19.053 -5.878 -0.269 1.00 0.00 N ATOM 0 H LYS A 67 16.202 -9.000 -1.984 1.00 0.00 H new ATOM 0 HA LYS A 67 14.104 -7.351 -1.081 1.00 0.00 H new ATOM 0 HB2 LYS A 67 16.476 -7.179 -2.847 1.00 0.00 H new ATOM 0 HB3 LYS A 67 15.186 -6.078 -3.285 1.00 0.00 H new ATOM 0 HG2 LYS A 67 15.226 -5.013 -1.135 1.00 0.00 H new ATOM 0 HG3 LYS A 67 16.228 -6.274 -0.445 1.00 0.00 H new ATOM 0 HD2 LYS A 67 17.171 -4.554 -2.764 1.00 0.00 H new ATOM 0 HD3 LYS A 67 17.392 -4.067 -1.095 1.00 0.00 H new ATOM 0 HE2 LYS A 67 18.298 -6.804 -2.018 1.00 0.00 H new ATOM 0 HE3 LYS A 67 19.298 -5.396 -2.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 19.903 -6.478 -0.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 19.296 -4.923 0.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 18.327 -6.288 0.353 1.00 0.00 H new ATOM 1087 N PRO A 68 12.627 -6.798 -3.186 1.00 0.00 N ATOM 1088 CA PRO A 68 11.530 -6.782 -4.158 1.00 0.00 C ATOM 1089 C PRO A 68 12.029 -6.663 -5.593 1.00 0.00 C ATOM 1090 O PRO A 68 11.825 -7.561 -6.409 1.00 0.00 O ATOM 1091 CB PRO A 68 10.726 -5.540 -3.766 1.00 0.00 C ATOM 1092 CG PRO A 68 11.710 -4.653 -3.083 1.00 0.00 C ATOM 1093 CD PRO A 68 12.673 -5.567 -2.379 1.00 0.00 C ATOM 0 HA PRO A 68 10.951 -7.705 -4.134 1.00 0.00 H new ATOM 0 HB2 PRO A 68 10.296 -5.054 -4.642 1.00 0.00 H new ATOM 0 HB3 PRO A 68 9.898 -5.796 -3.105 1.00 0.00 H new ATOM 0 HG2 PRO A 68 12.229 -4.019 -3.802 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.212 -3.991 -2.375 1.00 0.00 H new ATOM 0 HD2 PRO A 68 13.677 -5.145 -2.347 1.00 0.00 H new ATOM 0 HD3 PRO A 68 12.372 -5.751 -1.348 1.00 0.00 H new ATOM 1101 N ASN A 69 12.685 -5.547 -5.896 1.00 0.00 N ATOM 1102 CA ASN A 69 13.214 -5.310 -7.234 1.00 0.00 C ATOM 1103 C ASN A 69 14.148 -6.439 -7.658 1.00 0.00 C ATOM 1104 O ASN A 69 14.374 -6.660 -8.849 1.00 0.00 O ATOM 1105 CB ASN A 69 13.958 -3.973 -7.282 1.00 0.00 C ATOM 1106 CG ASN A 69 13.013 -2.787 -7.314 1.00 0.00 C ATOM 1107 OD1 ASN A 69 12.308 -2.515 -6.342 1.00 0.00 O ATOM 1108 ND2 ASN A 69 12.996 -2.075 -8.434 1.00 0.00 N ATOM 0 H ASN A 69 12.863 -4.793 -5.233 1.00 0.00 H new ATOM 0 HA ASN A 69 12.374 -5.277 -7.928 1.00 0.00 H new ATOM 0 HB2 ASN A 69 14.610 -3.891 -6.412 1.00 0.00 H new ATOM 0 HB3 ASN A 69 14.598 -3.948 -8.164 1.00 0.00 H new ATOM 0 HD21 ASN A 69 12.381 -1.265 -8.514 1.00 0.00 H new ATOM 0 HD22 ASN A 69 13.598 -2.338 -9.214 1.00 0.00 H new ATOM 1115 N THR A 70 14.687 -7.154 -6.676 1.00 0.00 N ATOM 1116 CA THR A 70 15.596 -8.261 -6.946 1.00 0.00 C ATOM 1117 C THR A 70 14.851 -9.455 -7.531 1.00 0.00 C ATOM 1118 O THR A 70 13.688 -9.695 -7.205 1.00 0.00 O ATOM 1119 CB THR A 70 16.334 -8.706 -5.670 1.00 0.00 C ATOM 1120 OG1 THR A 70 17.105 -7.620 -5.145 1.00 0.00 O ATOM 1121 CG2 THR A 70 17.247 -9.889 -5.957 1.00 0.00 C ATOM 0 H THR A 70 14.510 -6.986 -5.686 1.00 0.00 H new ATOM 0 HA THR A 70 16.325 -7.901 -7.672 1.00 0.00 H new ATOM 0 HB THR A 70 15.589 -9.011 -4.935 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.799 -7.970 -4.549 1.00 0.00 H new ATOM 0 HG21 THR A 70 17.757 -10.185 -5.041 1.00 0.00 H new ATOM 0 HG22 THR A 70 16.654 -10.725 -6.328 1.00 0.00 H new ATOM 0 HG23 THR A 70 17.985 -9.606 -6.708 1.00 0.00 H new ATOM 1129 N LYS A 71 15.527 -10.202 -8.398 1.00 0.00 N ATOM 1130 CA LYS A 71 14.929 -11.373 -9.028 1.00 0.00 C ATOM 1131 C LYS A 71 15.338 -12.650 -8.300 1.00 0.00 C ATOM 1132 O LYS A 71 16.449 -12.749 -7.778 1.00 0.00 O ATOM 1133 CB LYS A 71 15.346 -11.455 -10.498 1.00 0.00 C ATOM 1134 CG LYS A 71 16.848 -11.555 -10.700 1.00 0.00 C ATOM 1135 CD LYS A 71 17.474 -10.188 -10.919 1.00 0.00 C ATOM 1136 CE LYS A 71 17.740 -9.927 -12.394 1.00 0.00 C ATOM 1137 NZ LYS A 71 18.981 -10.605 -12.862 1.00 0.00 N ATOM 0 H LYS A 71 16.490 -10.017 -8.680 1.00 0.00 H new ATOM 0 HA LYS A 71 13.845 -11.273 -8.969 1.00 0.00 H new ATOM 0 HB2 LYS A 71 14.868 -12.322 -10.955 1.00 0.00 H new ATOM 0 HB3 LYS A 71 14.975 -10.574 -11.022 1.00 0.00 H new ATOM 0 HG2 LYS A 71 17.302 -12.029 -9.830 1.00 0.00 H new ATOM 0 HG3 LYS A 71 17.059 -12.194 -11.557 1.00 0.00 H new ATOM 0 HD2 LYS A 71 16.812 -9.416 -10.525 1.00 0.00 H new ATOM 0 HD3 LYS A 71 18.409 -10.121 -10.362 1.00 0.00 H new ATOM 0 HE2 LYS A 71 16.892 -10.275 -12.983 1.00 0.00 H new ATOM 0 HE3 LYS A 71 17.827 -8.854 -12.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 19.127 -10.403 -13.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 19.795 -10.255 -12.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 18.889 -11.632 -12.724 1.00 0.00 H new ATOM 1151 N ILE A 72 14.435 -13.625 -8.273 1.00 0.00 N ATOM 1152 CA ILE A 72 14.704 -14.896 -7.612 1.00 0.00 C ATOM 1153 C ILE A 72 14.699 -16.047 -8.612 1.00 0.00 C ATOM 1154 O ILE A 72 14.078 -15.960 -9.670 1.00 0.00 O ATOM 1155 CB ILE A 72 13.671 -15.186 -6.507 1.00 0.00 C ATOM 1156 CG1 ILE A 72 12.615 -14.080 -6.464 1.00 0.00 C ATOM 1157 CG2 ILE A 72 14.362 -15.319 -5.158 1.00 0.00 C ATOM 1158 CD1 ILE A 72 11.581 -14.273 -5.376 1.00 0.00 C ATOM 0 H ILE A 72 13.511 -13.559 -8.701 1.00 0.00 H new ATOM 0 HA ILE A 72 15.693 -14.814 -7.161 1.00 0.00 H new ATOM 0 HB ILE A 72 13.174 -16.129 -6.733 1.00 0.00 H new ATOM 0 HG12 ILE A 72 13.111 -13.121 -6.316 1.00 0.00 H new ATOM 0 HG13 ILE A 72 12.111 -14.033 -7.429 1.00 0.00 H new ATOM 0 HG21 ILE A 72 13.619 -15.524 -4.387 1.00 0.00 H new ATOM 0 HG22 ILE A 72 15.080 -16.138 -5.196 1.00 0.00 H new ATOM 0 HG23 ILE A 72 14.882 -14.391 -4.923 1.00 0.00 H new ATOM 0 HD11 ILE A 72 10.865 -13.452 -5.405 1.00 0.00 H new ATOM 0 HD12 ILE A 72 11.058 -15.216 -5.534 1.00 0.00 H new ATOM 0 HD13 ILE A 72 12.074 -14.290 -4.404 1.00 0.00 H new ATOM 1170 N MET A 73 15.395 -17.126 -8.267 1.00 0.00 N ATOM 1171 CA MET A 73 15.468 -18.296 -9.134 1.00 0.00 C ATOM 1172 C MET A 73 14.569 -19.414 -8.614 1.00 0.00 C ATOM 1173 O MET A 73 14.451 -19.617 -7.406 1.00 0.00 O ATOM 1174 CB MET A 73 16.912 -18.793 -9.236 1.00 0.00 C ATOM 1175 CG MET A 73 17.661 -18.240 -10.437 1.00 0.00 C ATOM 1176 SD MET A 73 18.968 -19.343 -11.009 1.00 0.00 S ATOM 1177 CE MET A 73 20.391 -18.260 -10.912 1.00 0.00 C ATOM 0 H MET A 73 15.916 -17.214 -7.394 1.00 0.00 H new ATOM 0 HA MET A 73 15.121 -18.005 -10.125 1.00 0.00 H new ATOM 0 HB2 MET A 73 17.447 -18.519 -8.327 1.00 0.00 H new ATOM 0 HB3 MET A 73 16.910 -19.882 -9.289 1.00 0.00 H new ATOM 0 HG2 MET A 73 16.957 -18.065 -11.250 1.00 0.00 H new ATOM 0 HG3 MET A 73 18.094 -17.274 -10.177 1.00 0.00 H new ATOM 0 HE1 MET A 73 21.281 -18.799 -11.235 1.00 0.00 H new ATOM 0 HE2 MET A 73 20.236 -17.396 -11.558 1.00 0.00 H new ATOM 0 HE3 MET A 73 20.523 -17.924 -9.883 1.00 0.00 H new ATOM 1187 N MET A 74 13.938 -20.136 -9.535 1.00 0.00 N ATOM 1188 CA MET A 74 13.051 -21.233 -9.168 1.00 0.00 C ATOM 1189 C MET A 74 13.720 -22.581 -9.421 1.00 0.00 C ATOM 1190 O MET A 74 14.166 -22.864 -10.532 1.00 0.00 O ATOM 1191 CB MET A 74 11.743 -21.145 -9.956 1.00 0.00 C ATOM 1192 CG MET A 74 10.661 -20.342 -9.251 1.00 0.00 C ATOM 1193 SD MET A 74 9.140 -20.233 -10.212 1.00 0.00 S ATOM 1194 CE MET A 74 7.999 -21.105 -9.142 1.00 0.00 C ATOM 0 H MET A 74 14.025 -19.981 -10.539 1.00 0.00 H new ATOM 0 HA MET A 74 12.832 -21.149 -8.103 1.00 0.00 H new ATOM 0 HB2 MET A 74 11.944 -20.694 -10.928 1.00 0.00 H new ATOM 0 HB3 MET A 74 11.372 -22.153 -10.143 1.00 0.00 H new ATOM 0 HG2 MET A 74 10.444 -20.800 -8.286 1.00 0.00 H new ATOM 0 HG3 MET A 74 11.032 -19.337 -9.050 1.00 0.00 H new ATOM 0 HE1 MET A 74 6.992 -20.714 -9.288 1.00 0.00 H new ATOM 0 HE2 MET A 74 8.014 -22.168 -9.383 1.00 0.00 H new ATOM 0 HE3 MET A 74 8.295 -20.964 -8.103 1.00 0.00 H new ATOM 1204 N MET A 75 13.786 -23.407 -8.382 1.00 0.00 N ATOM 1205 CA MET A 75 14.400 -24.725 -8.493 1.00 0.00 C ATOM 1206 C MET A 75 13.377 -25.826 -8.230 1.00 0.00 C ATOM 1207 O MET A 75 12.895 -25.983 -7.109 1.00 0.00 O ATOM 1208 CB MET A 75 15.567 -24.852 -7.511 1.00 0.00 C ATOM 1209 CG MET A 75 16.586 -23.731 -7.630 1.00 0.00 C ATOM 1210 SD MET A 75 18.129 -24.272 -8.391 1.00 0.00 S ATOM 1211 CE MET A 75 19.276 -24.034 -7.036 1.00 0.00 C ATOM 0 H MET A 75 13.422 -23.187 -7.455 1.00 0.00 H new ATOM 0 HA MET A 75 14.776 -24.838 -9.510 1.00 0.00 H new ATOM 0 HB2 MET A 75 15.175 -24.869 -6.494 1.00 0.00 H new ATOM 0 HB3 MET A 75 16.068 -25.806 -7.676 1.00 0.00 H new ATOM 0 HG2 MET A 75 16.160 -22.919 -8.219 1.00 0.00 H new ATOM 0 HG3 MET A 75 16.796 -23.329 -6.639 1.00 0.00 H new ATOM 0 HE1 MET A 75 20.085 -24.760 -7.113 1.00 0.00 H new ATOM 0 HE2 MET A 75 19.688 -23.026 -7.081 1.00 0.00 H new ATOM 0 HE3 MET A 75 18.754 -24.171 -6.089 1.00 0.00 H new ATOM 1221 N GLY A 76 13.050 -26.585 -9.271 1.00 0.00 N ATOM 1222 CA GLY A 76 12.086 -27.661 -9.131 1.00 0.00 C ATOM 1223 C GLY A 76 11.484 -28.076 -10.459 1.00 0.00 C ATOM 1224 O GLY A 76 12.070 -27.841 -11.516 1.00 0.00 O ATOM 0 H GLY A 76 13.435 -26.474 -10.209 1.00 0.00 H new ATOM 0 HA2 GLY A 76 12.571 -28.522 -8.671 1.00 0.00 H new ATOM 0 HA3 GLY A 76 11.289 -27.346 -8.457 1.00 0.00 H new ATOM 1228 N THR A 77 10.310 -28.697 -10.406 1.00 0.00 N ATOM 1229 CA THR A 77 9.629 -29.149 -11.613 1.00 0.00 C ATOM 1230 C THR A 77 8.148 -28.787 -11.577 1.00 0.00 C ATOM 1231 O THR A 77 7.561 -28.642 -10.505 1.00 0.00 O ATOM 1232 CB THR A 77 9.769 -30.671 -11.800 1.00 0.00 C ATOM 1233 OG1 THR A 77 9.406 -31.036 -13.136 1.00 0.00 O ATOM 1234 CG2 THR A 77 8.893 -31.422 -10.808 1.00 0.00 C ATOM 0 H THR A 77 9.811 -28.899 -9.540 1.00 0.00 H new ATOM 0 HA THR A 77 10.104 -28.642 -12.453 1.00 0.00 H new ATOM 0 HB THR A 77 10.809 -30.942 -11.619 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.499 -32.005 -13.247 1.00 0.00 H new ATOM 0 HG21 THR A 77 9.009 -32.495 -10.960 1.00 0.00 H new ATOM 0 HG22 THR A 77 9.191 -31.165 -9.792 1.00 0.00 H new ATOM 0 HG23 THR A 77 7.850 -31.145 -10.961 1.00 0.00 H new ATOM 1242 N ARG A 78 7.551 -28.643 -12.755 1.00 0.00 N ATOM 1243 CA ARG A 78 6.138 -28.298 -12.858 1.00 0.00 C ATOM 1244 C ARG A 78 5.259 -29.489 -12.490 1.00 0.00 C ATOM 1245 O ARG A 78 5.703 -30.636 -12.530 1.00 0.00 O ATOM 1246 CB ARG A 78 5.808 -27.826 -14.276 1.00 0.00 C ATOM 1247 CG ARG A 78 6.865 -26.912 -14.875 1.00 0.00 C ATOM 1248 CD ARG A 78 7.394 -27.460 -16.191 1.00 0.00 C ATOM 1249 NE ARG A 78 6.315 -27.821 -17.107 1.00 0.00 N ATOM 1250 CZ ARG A 78 6.517 -28.365 -18.302 1.00 0.00 C ATOM 1251 NH1 ARG A 78 7.750 -28.609 -18.723 1.00 0.00 N ATOM 1252 NH2 ARG A 78 5.483 -28.667 -19.078 1.00 0.00 N ATOM 0 H ARG A 78 8.023 -28.760 -13.651 1.00 0.00 H new ATOM 0 HA ARG A 78 5.936 -27.489 -12.156 1.00 0.00 H new ATOM 0 HB2 ARG A 78 5.685 -28.697 -14.920 1.00 0.00 H new ATOM 0 HB3 ARG A 78 4.852 -27.302 -14.262 1.00 0.00 H new ATOM 0 HG2 ARG A 78 6.441 -25.921 -15.036 1.00 0.00 H new ATOM 0 HG3 ARG A 78 7.689 -26.796 -14.171 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.035 -26.715 -16.662 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.013 -28.336 -15.996 1.00 0.00 H new ATOM 0 HE ARG A 78 5.354 -27.646 -16.813 1.00 0.00 H new ATOM 0 HH11 ARG A 78 8.547 -28.379 -18.129 1.00 0.00 H new ATOM 0 HH12 ARG A 78 7.902 -29.027 -19.641 1.00 0.00 H new ATOM 0 HH21 ARG A 78 4.533 -28.481 -18.757 1.00 0.00 H new ATOM 0 HH22 ARG A 78 5.639 -29.085 -19.995 1.00 0.00 H new ATOM 1266 N GLU A 79 4.010 -29.208 -12.130 1.00 0.00 N ATOM 1267 CA GLU A 79 3.070 -30.257 -11.753 1.00 0.00 C ATOM 1268 C GLU A 79 1.635 -29.836 -12.059 1.00 0.00 C ATOM 1269 O GLU A 79 1.385 -28.709 -12.485 1.00 0.00 O ATOM 1270 CB GLU A 79 3.210 -30.587 -10.266 1.00 0.00 C ATOM 1271 CG GLU A 79 2.714 -29.483 -9.347 1.00 0.00 C ATOM 1272 CD GLU A 79 2.075 -30.020 -8.081 1.00 0.00 C ATOM 1273 OE1 GLU A 79 2.320 -31.199 -7.748 1.00 0.00 O ATOM 1274 OE2 GLU A 79 1.331 -29.263 -7.424 1.00 0.00 O ATOM 0 H GLU A 79 3.626 -28.264 -12.092 1.00 0.00 H new ATOM 0 HA GLU A 79 3.303 -31.146 -12.339 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.657 -31.502 -10.052 1.00 0.00 H new ATOM 0 HB3 GLU A 79 4.258 -30.789 -10.045 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.549 -28.834 -9.081 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.990 -28.868 -9.882 1.00 0.00 H new ATOM 1281 N GLU A 80 0.697 -30.752 -11.840 1.00 0.00 N ATOM 1282 CA GLU A 80 -0.713 -30.477 -12.093 1.00 0.00 C ATOM 1283 C GLU A 80 -1.565 -30.841 -10.881 1.00 0.00 C ATOM 1284 O GLU A 80 -1.475 -31.950 -10.356 1.00 0.00 O ATOM 1285 CB GLU A 80 -1.194 -31.255 -13.320 1.00 0.00 C ATOM 1286 CG GLU A 80 -0.748 -32.707 -13.334 1.00 0.00 C ATOM 1287 CD GLU A 80 -1.570 -33.561 -14.280 1.00 0.00 C ATOM 1288 OE1 GLU A 80 -2.262 -32.988 -15.147 1.00 0.00 O ATOM 1289 OE2 GLU A 80 -1.520 -34.802 -14.153 1.00 0.00 O ATOM 0 H GLU A 80 0.887 -31.690 -11.488 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.820 -29.409 -12.283 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -2.283 -31.218 -13.359 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.826 -30.762 -14.220 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.302 -32.758 -13.624 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -0.821 -33.115 -12.326 1.00 0.00 H new ATOM 1296 N SER A 81 -2.391 -29.897 -10.441 1.00 0.00 N ATOM 1297 CA SER A 81 -3.256 -30.115 -9.288 1.00 0.00 C ATOM 1298 C SER A 81 -4.680 -30.439 -9.731 1.00 0.00 C ATOM 1299 O SER A 81 -5.209 -29.823 -10.654 1.00 0.00 O ATOM 1300 CB SER A 81 -3.260 -28.879 -8.386 1.00 0.00 C ATOM 1301 OG SER A 81 -3.582 -29.225 -7.050 1.00 0.00 O ATOM 0 H SER A 81 -2.479 -28.974 -10.866 1.00 0.00 H new ATOM 0 HA SER A 81 -2.866 -30.964 -8.727 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.281 -28.400 -8.415 1.00 0.00 H new ATOM 0 HB3 SER A 81 -3.981 -28.153 -8.761 1.00 0.00 H new ATOM 0 HG SER A 81 -3.576 -28.419 -6.493 1.00 0.00 H new TER 1307 SER A 81