USER MOD reduce.3.24.130724 H: found=0, std=0, add=371, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 369 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 12 CYS SG : rot -85:sc= 0.62 USER MOD Set 1.2: A 30 CYS SG : rot 52:sc= -1.71 USER MOD Single : A 1 ASP N :NH3+ -133:sc= 0.539 (180deg=-0.243) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= -0.566 USER MOD Single : A 11 THR OG1 : rot 102:sc= 1.18 USER MOD Single : A 13 HIS : no HD1:sc= -2.28! C(o=-2.3!,f=-6.5!) USER MOD Single : A 14 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0641) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= -3.44 K(o=-3.4,f=-6.6!) USER MOD Single : A 24 THR OG1 : rot 74:sc= 0.69 USER MOD Single : A 28 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 86:sc= 0.37 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN :FLIP amide:sc= 0.596 F(o=-0.016,f=0.6) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 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 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 1.304 -0.074 0.013 1.00 10.00 N ATOM 2 CA ASP A 1 2.077 -0.078 -1.247 1.00 10.00 C ATOM 3 C ASP A 1 1.574 1.054 -2.097 1.00 10.00 C ATOM 4 O ASP A 1 0.602 1.689 -1.684 1.00 10.00 O ATOM 5 CB ASP A 1 1.919 -1.379 -2.042 1.00 10.00 C ATOM 6 CG ASP A 1 1.821 -2.574 -1.113 1.00 10.00 C ATOM 7 OD1 ASP A 1 0.699 -2.733 -0.587 1.00 10.00 O ATOM 8 OD2 ASP A 1 2.889 -3.051 -0.692 1.00 10.00 O ATOM 0 H1 ASP A 1 1.954 -0.165 0.820 1.00 10.00 H new ATOM 0 H2 ASP A 1 0.776 0.818 0.093 1.00 10.00 H new ATOM 0 H3 ASP A 1 0.638 -0.872 0.014 1.00 10.00 H new ATOM 0 HA ASP A 1 3.132 0.024 -0.992 1.00 10.00 H new ATOM 0 HB2 ASP A 1 1.026 -1.323 -2.664 1.00 10.00 H new ATOM 0 HB3 ASP A 1 2.768 -1.505 -2.714 1.00 10.00 H new ATOM 15 N GLU A 2 2.230 1.322 -3.227 1.00 10.00 N ATOM 16 CA GLU A 2 1.843 2.339 -4.209 1.00 10.00 C ATOM 17 C GLU A 2 2.045 3.742 -3.652 1.00 10.00 C ATOM 18 O GLU A 2 2.831 4.506 -4.175 1.00 10.00 O ATOM 19 CB GLU A 2 0.380 2.181 -4.664 1.00 10.00 C ATOM 20 CG GLU A 2 0.269 1.866 -6.151 1.00 10.00 C ATOM 21 CD GLU A 2 0.400 0.359 -6.367 1.00 10.00 C ATOM 22 OE1 GLU A 2 -0.543 -0.349 -5.952 1.00 10.00 O ATOM 23 OE2 GLU A 2 1.464 -0.056 -6.871 1.00 10.00 O ATOM 0 H GLU A 2 3.076 0.819 -3.494 1.00 10.00 H new ATOM 0 HA GLU A 2 2.490 2.193 -5.074 1.00 10.00 H new ATOM 0 HB2 GLU A 2 -0.093 1.385 -4.090 1.00 10.00 H new ATOM 0 HB3 GLU A 2 -0.167 3.099 -4.447 1.00 10.00 H new ATOM 0 HG2 GLU A 2 -0.688 2.217 -6.537 1.00 10.00 H new ATOM 0 HG3 GLU A 2 1.048 2.392 -6.704 1.00 10.00 H new ATOM 30 N ALA A 3 1.376 4.098 -2.559 1.00 10.00 N ATOM 31 CA ALA A 3 1.524 5.352 -1.848 1.00 10.00 C ATOM 32 C ALA A 3 2.977 5.684 -1.560 1.00 10.00 C ATOM 33 O ALA A 3 3.391 6.782 -1.883 1.00 10.00 O ATOM 34 CB ALA A 3 0.760 5.301 -0.533 1.00 10.00 C ATOM 0 H ALA A 3 0.683 3.485 -2.129 1.00 10.00 H new ATOM 0 HA ALA A 3 1.119 6.132 -2.494 1.00 10.00 H new ATOM 0 HB1 ALA A 3 0.878 6.248 -0.007 1.00 10.00 H new ATOM 0 HB2 ALA A 3 -0.297 5.126 -0.733 1.00 10.00 H new ATOM 0 HB3 ALA A 3 1.151 4.492 0.084 1.00 10.00 H new ATOM 40 N GLN A 4 3.754 4.733 -1.033 1.00 10.00 N ATOM 41 CA GLN A 4 5.195 4.902 -0.830 1.00 10.00 C ATOM 42 C GLN A 4 5.915 5.501 -2.046 1.00 10.00 C ATOM 43 O GLN A 4 6.872 6.252 -1.907 1.00 10.00 O ATOM 44 CB GLN A 4 5.819 3.540 -0.477 1.00 10.00 C ATOM 45 CG GLN A 4 6.078 3.407 1.031 1.00 10.00 C ATOM 46 CD GLN A 4 7.565 3.371 1.361 1.00 10.00 C ATOM 47 OE1 GLN A 4 8.343 2.610 0.812 1.00 10.00 O ATOM 48 NE2 GLN A 4 7.998 4.194 2.285 1.00 10.00 N ATOM 0 H GLN A 4 3.401 3.824 -0.735 1.00 10.00 H new ATOM 0 HA GLN A 4 5.322 5.612 -0.013 1.00 10.00 H new ATOM 0 HB2 GLN A 4 5.155 2.740 -0.804 1.00 10.00 H new ATOM 0 HB3 GLN A 4 6.757 3.418 -1.019 1.00 10.00 H new ATOM 0 HG2 GLN A 4 5.612 4.243 1.553 1.00 10.00 H new ATOM 0 HG3 GLN A 4 5.604 2.497 1.400 1.00 10.00 H new ATOM 0 HE21 GLN A 4 7.348 4.831 2.745 1.00 10.00 H new ATOM 0 HE22 GLN A 4 8.985 4.197 2.544 1.00 10.00 H new ATOM 57 N PHE A 5 5.412 5.190 -3.237 1.00 10.00 N ATOM 58 CA PHE A 5 5.848 5.750 -4.492 1.00 10.00 C ATOM 59 C PHE A 5 5.117 7.027 -4.856 1.00 10.00 C ATOM 60 O PHE A 5 5.757 7.975 -5.276 1.00 10.00 O ATOM 61 CB PHE A 5 5.563 4.719 -5.569 1.00 10.00 C ATOM 62 CG PHE A 5 6.245 5.023 -6.855 1.00 10.00 C ATOM 63 CD1 PHE A 5 5.661 5.893 -7.797 1.00 10.00 C ATOM 64 CD2 PHE A 5 7.466 4.400 -7.110 1.00 10.00 C ATOM 65 CE1 PHE A 5 6.316 6.140 -9.013 1.00 10.00 C ATOM 66 CE2 PHE A 5 8.081 4.620 -8.338 1.00 10.00 C ATOM 67 CZ PHE A 5 7.542 5.516 -9.278 1.00 10.00 C ATOM 0 H PHE A 5 4.658 4.512 -3.348 1.00 10.00 H new ATOM 0 HA PHE A 5 6.907 5.995 -4.406 1.00 10.00 H new ATOM 0 HB2 PHE A 5 5.881 3.737 -5.218 1.00 10.00 H new ATOM 0 HB3 PHE A 5 4.487 4.665 -5.738 1.00 10.00 H new ATOM 0 HD1 PHE A 5 4.714 6.367 -7.584 1.00 10.00 H new ATOM 0 HD2 PHE A 5 7.924 3.761 -6.370 1.00 10.00 H new ATOM 0 HE1 PHE A 5 5.878 6.807 -9.740 1.00 10.00 H new ATOM 0 HE2 PHE A 5 8.992 4.091 -8.575 1.00 10.00 H new ATOM 0 HZ PHE A 5 8.069 5.722 -10.198 1.00 10.00 H new ATOM 77 N LYS A 6 3.792 7.090 -4.689 1.00 10.00 N ATOM 78 CA LYS A 6 3.007 8.299 -4.932 1.00 10.00 C ATOM 79 C LYS A 6 3.528 9.468 -4.117 1.00 10.00 C ATOM 80 O LYS A 6 3.470 10.586 -4.589 1.00 10.00 O ATOM 81 CB LYS A 6 1.527 8.031 -4.648 1.00 10.00 C ATOM 82 CG LYS A 6 0.651 9.147 -5.235 1.00 10.00 C ATOM 83 CD LYS A 6 -0.833 8.755 -5.215 1.00 10.00 C ATOM 84 CE LYS A 6 -1.602 9.601 -4.198 1.00 10.00 C ATOM 85 NZ LYS A 6 -2.966 9.059 -3.993 1.00 10.00 N ATOM 0 H LYS A 6 3.232 6.296 -4.379 1.00 10.00 H new ATOM 0 HA LYS A 6 3.109 8.573 -5.982 1.00 10.00 H new ATOM 0 HB2 LYS A 6 1.237 7.071 -5.076 1.00 10.00 H new ATOM 0 HB3 LYS A 6 1.365 7.962 -3.572 1.00 10.00 H new ATOM 0 HG2 LYS A 6 0.795 10.065 -4.665 1.00 10.00 H new ATOM 0 HG3 LYS A 6 0.961 9.356 -6.259 1.00 10.00 H new ATOM 0 HD2 LYS A 6 -1.263 8.890 -6.207 1.00 10.00 H new ATOM 0 HD3 LYS A 6 -0.932 7.699 -4.966 1.00 10.00 H new ATOM 0 HE2 LYS A 6 -1.065 9.617 -3.250 1.00 10.00 H new ATOM 0 HE3 LYS A 6 -1.663 10.632 -4.547 1.00 10.00 H new ATOM 0 HZ1 LYS A 6 -3.472 9.646 -3.300 1.00 10.00 H new ATOM 0 HZ2 LYS A 6 -3.482 9.067 -4.896 1.00 10.00 H new ATOM 0 HZ3 LYS A 6 -2.902 8.083 -3.639 1.00 10.00 H new ATOM 99 N GLU A 7 4.107 9.206 -2.956 1.00 10.00 N ATOM 100 CA GLU A 7 4.747 10.200 -2.135 1.00 10.00 C ATOM 101 C GLU A 7 6.099 10.573 -2.690 1.00 10.00 C ATOM 102 O GLU A 7 6.417 11.743 -2.677 1.00 10.00 O ATOM 103 CB GLU A 7 4.894 9.725 -0.685 1.00 10.00 C ATOM 104 CG GLU A 7 3.903 10.463 0.217 1.00 10.00 C ATOM 105 CD GLU A 7 4.292 10.289 1.686 1.00 10.00 C ATOM 106 OE1 GLU A 7 3.978 9.203 2.230 1.00 10.00 O ATOM 107 OE2 GLU A 7 4.921 11.221 2.232 1.00 10.00 O ATOM 0 H GLU A 7 4.141 8.269 -2.555 1.00 10.00 H new ATOM 0 HA GLU A 7 4.106 11.082 -2.144 1.00 10.00 H new ATOM 0 HB2 GLU A 7 4.719 8.651 -0.627 1.00 10.00 H new ATOM 0 HB3 GLU A 7 5.912 9.901 -0.339 1.00 10.00 H new ATOM 0 HG2 GLU A 7 3.887 11.522 -0.039 1.00 10.00 H new ATOM 0 HG3 GLU A 7 2.896 10.080 0.052 1.00 10.00 H new ATOM 114 N CYS A 8 6.868 9.634 -3.230 1.00 10.00 N ATOM 115 CA CYS A 8 8.141 9.935 -3.849 1.00 10.00 C ATOM 116 C CYS A 8 7.920 10.688 -5.139 1.00 10.00 C ATOM 117 O CYS A 8 8.582 11.663 -5.345 1.00 10.00 O ATOM 118 CB CYS A 8 8.909 8.654 -4.143 1.00 10.00 C ATOM 119 SG CYS A 8 10.698 8.829 -3.940 1.00 10.00 S ATOM 0 H CYS A 8 6.621 8.645 -3.248 1.00 10.00 H new ATOM 0 HA CYS A 8 8.721 10.548 -3.159 1.00 10.00 H new ATOM 0 HB2 CYS A 8 8.551 7.864 -3.482 1.00 10.00 H new ATOM 0 HB3 CYS A 8 8.696 8.337 -5.164 1.00 10.00 H new ATOM 124 N TYR A 9 6.976 10.318 -5.985 1.00 10.00 N ATOM 125 CA TYR A 9 6.655 10.999 -7.225 1.00 10.00 C ATOM 126 C TYR A 9 6.189 12.424 -6.978 1.00 10.00 C ATOM 127 O TYR A 9 6.722 13.350 -7.580 1.00 10.00 O ATOM 128 CB TYR A 9 5.544 10.200 -7.902 1.00 10.00 C ATOM 129 CG TYR A 9 5.370 10.516 -9.362 1.00 10.00 C ATOM 130 CD1 TYR A 9 4.674 11.669 -9.767 1.00 10.00 C ATOM 131 CD2 TYR A 9 5.897 9.637 -10.318 1.00 10.00 C ATOM 132 CE1 TYR A 9 4.489 11.924 -11.137 1.00 10.00 C ATOM 133 CE2 TYR A 9 5.682 9.880 -11.679 1.00 10.00 C ATOM 134 CZ TYR A 9 4.979 11.014 -12.099 1.00 10.00 C ATOM 135 OH TYR A 9 4.721 11.169 -13.419 1.00 10.00 O ATOM 0 H TYR A 9 6.388 9.501 -5.820 1.00 10.00 H new ATOM 0 HA TYR A 9 7.544 11.059 -7.853 1.00 10.00 H new ATOM 0 HB2 TYR A 9 5.756 9.136 -7.793 1.00 10.00 H new ATOM 0 HB3 TYR A 9 4.604 10.392 -7.384 1.00 10.00 H new ATOM 0 HD1 TYR A 9 4.284 12.355 -9.030 1.00 10.00 H new ATOM 0 HD2 TYR A 9 6.467 8.775 -10.005 1.00 10.00 H new ATOM 0 HE1 TYR A 9 3.971 12.817 -11.454 1.00 10.00 H new ATOM 0 HE2 TYR A 9 6.063 9.185 -12.413 1.00 10.00 H new ATOM 0 HH TYR A 9 5.144 10.443 -13.923 1.00 10.00 H new ATOM 145 N ASP A 10 5.204 12.598 -6.091 1.00 10.00 N ATOM 146 CA ASP A 10 4.650 13.912 -5.756 1.00 10.00 C ATOM 147 C ASP A 10 5.741 14.798 -5.148 1.00 10.00 C ATOM 148 O ASP A 10 6.058 15.894 -5.621 1.00 10.00 O ATOM 149 CB ASP A 10 3.493 13.748 -4.752 1.00 10.00 C ATOM 150 CG ASP A 10 2.442 14.852 -4.825 1.00 10.00 C ATOM 151 OD1 ASP A 10 2.826 16.005 -5.121 1.00 10.00 O ATOM 152 OD2 ASP A 10 1.253 14.514 -4.615 1.00 10.00 O ATOM 0 H ASP A 10 4.768 11.828 -5.584 1.00 10.00 H new ATOM 0 HA ASP A 10 4.274 14.383 -6.664 1.00 10.00 H new ATOM 0 HB2 ASP A 10 3.008 12.788 -4.927 1.00 10.00 H new ATOM 0 HB3 ASP A 10 3.904 13.719 -3.743 1.00 10.00 H new ATOM 157 N THR A 11 6.394 14.258 -4.120 1.00 10.00 N ATOM 158 CA THR A 11 7.445 14.947 -3.379 1.00 10.00 C ATOM 159 C THR A 11 8.647 15.222 -4.269 1.00 10.00 C ATOM 160 O THR A 11 9.134 16.351 -4.301 1.00 10.00 O ATOM 161 CB THR A 11 7.854 14.146 -2.145 1.00 10.00 C ATOM 162 OG1 THR A 11 6.697 13.984 -1.363 1.00 10.00 O ATOM 163 CG2 THR A 11 8.866 14.841 -1.252 1.00 10.00 C ATOM 0 H THR A 11 6.204 13.317 -3.775 1.00 10.00 H new ATOM 0 HA THR A 11 7.048 15.905 -3.044 1.00 10.00 H new ATOM 0 HB THR A 11 8.306 13.221 -2.504 1.00 10.00 H new ATOM 0 HG1 THR A 11 6.336 13.082 -1.495 1.00 10.00 H new ATOM 0 HG21 THR A 11 9.100 14.202 -0.401 1.00 10.00 H new ATOM 0 HG22 THR A 11 9.776 15.038 -1.818 1.00 10.00 H new ATOM 0 HG23 THR A 11 8.450 15.783 -0.895 1.00 10.00 H new ATOM 171 N CYS A 12 9.069 14.236 -5.064 1.00 10.00 N ATOM 172 CA CYS A 12 10.135 14.370 -6.049 1.00 10.00 C ATOM 173 C CYS A 12 9.753 15.487 -6.993 1.00 10.00 C ATOM 174 O CYS A 12 10.528 16.413 -7.144 1.00 10.00 O ATOM 175 CB CYS A 12 10.430 13.061 -6.796 1.00 10.00 C ATOM 176 SG CYS A 12 11.880 13.051 -7.856 1.00 10.00 S ATOM 0 H CYS A 12 8.666 13.300 -5.037 1.00 10.00 H new ATOM 0 HA CYS A 12 11.067 14.611 -5.537 1.00 10.00 H new ATOM 0 HB2 CYS A 12 10.541 12.265 -6.059 1.00 10.00 H new ATOM 0 HB3 CYS A 12 9.561 12.813 -7.405 1.00 10.00 H new ATOM 0 HG CYS A 12 11.565 13.520 -9.027 1.00 10.00 H new ATOM 181 N HIS A 13 8.512 15.520 -7.500 1.00 10.00 N ATOM 182 CA HIS A 13 8.015 16.589 -8.355 1.00 10.00 C ATOM 183 C HIS A 13 8.218 17.947 -7.727 1.00 10.00 C ATOM 184 O HIS A 13 8.527 18.882 -8.444 1.00 10.00 O ATOM 185 CB HIS A 13 6.542 16.401 -8.680 1.00 10.00 C ATOM 186 CG HIS A 13 6.178 16.975 -10.006 1.00 10.00 C ATOM 187 ND1 HIS A 13 5.510 18.162 -10.182 1.00 10.00 N ATOM 188 CD2 HIS A 13 6.393 16.391 -11.222 1.00 10.00 C ATOM 189 CE1 HIS A 13 5.305 18.302 -11.494 1.00 10.00 C ATOM 190 NE2 HIS A 13 5.833 17.243 -12.147 1.00 10.00 N ATOM 0 H HIS A 13 7.822 14.791 -7.321 1.00 10.00 H new ATOM 0 HA HIS A 13 8.592 16.540 -9.278 1.00 10.00 H new ATOM 0 HB2 HIS A 13 6.303 15.338 -8.669 1.00 10.00 H new ATOM 0 HB3 HIS A 13 5.938 16.872 -7.904 1.00 10.00 H new ATOM 0 HD2 HIS A 13 6.897 15.456 -11.417 1.00 10.00 H new ATOM 0 HE1 HIS A 13 4.796 19.132 -11.961 1.00 10.00 H new ATOM 0 HE2 HIS A 13 5.819 17.099 -13.157 1.00 10.00 H new ATOM 199 N LYS A 14 8.019 18.091 -6.422 1.00 10.00 N ATOM 200 CA LYS A 14 8.300 19.329 -5.700 1.00 10.00 C ATOM 201 C LYS A 14 9.723 19.818 -5.922 1.00 10.00 C ATOM 202 O LYS A 14 9.883 20.867 -6.539 1.00 10.00 O ATOM 203 CB LYS A 14 7.982 19.131 -4.212 1.00 10.00 C ATOM 204 CG LYS A 14 7.211 20.329 -3.667 1.00 10.00 C ATOM 205 CD LYS A 14 8.166 21.343 -3.028 1.00 10.00 C ATOM 206 CE LYS A 14 7.437 22.660 -2.758 1.00 10.00 C ATOM 207 NZ LYS A 14 7.275 23.433 -4.016 1.00 10.00 N ATOM 0 H LYS A 14 7.655 17.346 -5.829 1.00 10.00 H new ATOM 0 HA LYS A 14 7.657 20.115 -6.095 1.00 10.00 H new ATOM 0 HB2 LYS A 14 7.396 18.222 -4.077 1.00 10.00 H new ATOM 0 HB3 LYS A 14 8.907 19.000 -3.651 1.00 10.00 H new ATOM 0 HG2 LYS A 14 6.653 20.806 -4.473 1.00 10.00 H new ATOM 0 HG3 LYS A 14 6.482 19.994 -2.929 1.00 10.00 H new ATOM 0 HD2 LYS A 14 8.563 20.941 -2.096 1.00 10.00 H new ATOM 0 HD3 LYS A 14 9.016 21.518 -3.688 1.00 10.00 H new ATOM 0 HE2 LYS A 14 6.460 22.458 -2.320 1.00 10.00 H new ATOM 0 HE3 LYS A 14 7.996 23.250 -2.032 1.00 10.00 H new ATOM 0 HZ1 LYS A 14 6.935 24.390 -3.794 1.00 10.00 H new ATOM 0 HZ2 LYS A 14 8.191 23.496 -4.505 1.00 10.00 H new ATOM 0 HZ3 LYS A 14 6.586 22.955 -4.631 1.00 10.00 H new ATOM 221 N GLU A 15 10.712 19.064 -5.449 1.00 10.00 N ATOM 222 CA GLU A 15 12.127 19.355 -5.717 1.00 10.00 C ATOM 223 C GLU A 15 12.473 19.278 -7.221 1.00 10.00 C ATOM 224 O GLU A 15 13.474 19.800 -7.684 1.00 10.00 O ATOM 225 CB GLU A 15 13.005 18.404 -4.891 1.00 10.00 C ATOM 226 CG GLU A 15 14.484 18.819 -4.963 1.00 10.00 C ATOM 227 CD GLU A 15 15.324 17.889 -5.867 1.00 10.00 C ATOM 228 OE1 GLU A 15 14.825 17.439 -6.926 1.00 10.00 O ATOM 229 OE2 GLU A 15 16.467 17.587 -5.455 1.00 10.00 O ATOM 0 H GLU A 15 10.562 18.237 -4.871 1.00 10.00 H new ATOM 0 HA GLU A 15 12.326 20.384 -5.417 1.00 10.00 H new ATOM 0 HB2 GLU A 15 12.673 18.406 -3.853 1.00 10.00 H new ATOM 0 HB3 GLU A 15 12.891 17.385 -5.260 1.00 10.00 H new ATOM 0 HG2 GLU A 15 14.552 19.840 -5.337 1.00 10.00 H new ATOM 0 HG3 GLU A 15 14.906 18.819 -3.958 1.00 10.00 H new ATOM 236 N CYS A 16 11.583 18.724 -8.039 1.00 10.00 N ATOM 237 CA CYS A 16 11.786 18.586 -9.457 1.00 10.00 C ATOM 238 C CYS A 16 11.414 19.881 -10.148 1.00 10.00 C ATOM 239 O CYS A 16 12.246 20.476 -10.796 1.00 10.00 O ATOM 240 CB CYS A 16 10.966 17.447 -10.039 1.00 10.00 C ATOM 241 SG CYS A 16 11.479 16.891 -11.676 1.00 10.00 S ATOM 0 H CYS A 16 10.688 18.355 -7.718 1.00 10.00 H new ATOM 0 HA CYS A 16 12.839 18.357 -9.623 1.00 10.00 H new ATOM 0 HB2 CYS A 16 11.012 16.600 -9.354 1.00 10.00 H new ATOM 0 HB3 CYS A 16 9.923 17.760 -10.089 1.00 10.00 H new ATOM 246 N SER A 17 10.162 20.334 -10.049 1.00 10.00 N ATOM 247 CA SER A 17 9.678 21.613 -10.554 1.00 10.00 C ATOM 248 C SER A 17 10.551 22.771 -10.085 1.00 10.00 C ATOM 249 O SER A 17 10.599 23.780 -10.775 1.00 10.00 O ATOM 250 CB SER A 17 8.245 21.888 -10.085 1.00 10.00 C ATOM 251 OG SER A 17 7.366 22.201 -11.149 1.00 10.00 O ATOM 0 H SER A 17 9.428 19.792 -9.593 1.00 10.00 H new ATOM 0 HA SER A 17 9.712 21.543 -11.641 1.00 10.00 H new ATOM 0 HB2 SER A 17 7.868 21.014 -9.555 1.00 10.00 H new ATOM 0 HB3 SER A 17 8.254 22.713 -9.373 1.00 10.00 H new ATOM 0 HG SER A 17 6.468 22.365 -10.794 1.00 10.00 H new ATOM 257 N ASP A 18 11.250 22.631 -8.949 1.00 10.00 N ATOM 258 CA ASP A 18 12.282 23.575 -8.498 1.00 10.00 C ATOM 259 C ASP A 18 13.316 23.877 -9.585 1.00 10.00 C ATOM 260 O ASP A 18 13.748 25.021 -9.720 1.00 10.00 O ATOM 261 CB ASP A 18 13.006 23.026 -7.267 1.00 10.00 C ATOM 262 CG ASP A 18 14.384 23.658 -7.031 1.00 10.00 C ATOM 263 OD1 ASP A 18 15.371 23.184 -7.641 1.00 10.00 O ATOM 264 OD2 ASP A 18 14.411 24.634 -6.252 1.00 10.00 O ATOM 0 H ASP A 18 11.112 21.848 -8.310 1.00 10.00 H new ATOM 0 HA ASP A 18 11.766 24.503 -8.252 1.00 10.00 H new ATOM 0 HB2 ASP A 18 12.385 23.191 -6.387 1.00 10.00 H new ATOM 0 HB3 ASP A 18 13.124 21.948 -7.376 1.00 10.00 H new ATOM 269 N LYS A 19 13.623 22.897 -10.450 1.00 10.00 N ATOM 270 CA LYS A 19 14.501 23.080 -11.588 1.00 10.00 C ATOM 271 C LYS A 19 13.987 24.133 -12.561 1.00 10.00 C ATOM 272 O LYS A 19 14.707 24.491 -13.493 1.00 10.00 O ATOM 273 CB LYS A 19 14.759 21.722 -12.263 1.00 10.00 C ATOM 274 CG LYS A 19 16.156 21.184 -11.947 1.00 10.00 C ATOM 275 CD LYS A 19 17.015 21.142 -13.215 1.00 10.00 C ATOM 276 CE LYS A 19 18.415 21.688 -12.927 1.00 10.00 C ATOM 277 NZ LYS A 19 18.908 22.486 -14.076 1.00 10.00 N ATOM 0 H LYS A 19 13.257 21.948 -10.367 1.00 10.00 H new ATOM 0 HA LYS A 19 15.453 23.470 -11.229 1.00 10.00 H new ATOM 0 HB2 LYS A 19 14.010 21.003 -11.931 1.00 10.00 H new ATOM 0 HB3 LYS A 19 14.645 21.826 -13.342 1.00 10.00 H new ATOM 0 HG2 LYS A 19 16.634 21.815 -11.198 1.00 10.00 H new ATOM 0 HG3 LYS A 19 16.079 20.184 -11.520 1.00 10.00 H new ATOM 0 HD2 LYS A 19 17.085 20.118 -13.581 1.00 10.00 H new ATOM 0 HD3 LYS A 19 16.543 21.730 -14.002 1.00 10.00 H new ATOM 0 HE2 LYS A 19 18.393 22.307 -12.030 1.00 10.00 H new ATOM 0 HE3 LYS A 19 19.100 20.863 -12.729 1.00 10.00 H new ATOM 0 HZ1 LYS A 19 19.859 22.849 -13.864 1.00 10.00 H new ATOM 0 HZ2 LYS A 19 18.948 21.885 -14.924 1.00 10.00 H new ATOM 0 HZ3 LYS A 19 18.263 23.284 -14.247 1.00 10.00 H new ATOM 291 N GLY A 20 12.736 24.556 -12.393 1.00 10.00 N ATOM 292 CA GLY A 20 12.035 25.532 -13.201 1.00 10.00 C ATOM 293 C GLY A 20 11.474 24.894 -14.465 1.00 10.00 C ATOM 294 O GLY A 20 11.025 25.589 -15.370 1.00 10.00 O ATOM 0 H GLY A 20 12.153 24.198 -11.637 1.00 10.00 H new ATOM 0 HA2 GLY A 20 11.224 25.974 -12.622 1.00 10.00 H new ATOM 0 HA3 GLY A 20 12.713 26.342 -13.469 1.00 10.00 H new ATOM 298 N ASN A 21 11.561 23.567 -14.579 1.00 10.00 N ATOM 299 CA ASN A 21 10.989 22.820 -15.679 1.00 10.00 C ATOM 300 C ASN A 21 9.456 22.729 -15.572 1.00 10.00 C ATOM 301 O ASN A 21 8.814 23.182 -14.626 1.00 10.00 O ATOM 302 CB ASN A 21 11.636 21.426 -15.735 1.00 10.00 C ATOM 303 CG ASN A 21 11.651 20.742 -14.395 1.00 10.00 C ATOM 304 OD1 ASN A 21 10.793 20.953 -13.569 1.00 10.00 O ATOM 305 ND2 ASN A 21 12.653 19.934 -14.158 1.00 10.00 N ATOM 0 H ASN A 21 12.040 22.981 -13.895 1.00 10.00 H new ATOM 0 HA ASN A 21 11.200 23.347 -16.609 1.00 10.00 H new ATOM 0 HB2 ASN A 21 11.094 20.806 -16.449 1.00 10.00 H new ATOM 0 HB3 ASN A 21 12.658 21.518 -16.104 1.00 10.00 H new ATOM 0 HD21 ASN A 21 12.726 19.462 -13.257 1.00 10.00 H new ATOM 0 HD22 ASN A 21 13.361 19.776 -14.875 1.00 10.00 H new ATOM 312 N GLY A 22 8.863 22.070 -16.566 1.00 10.00 N ATOM 313 CA GLY A 22 7.436 21.815 -16.574 1.00 10.00 C ATOM 314 C GLY A 22 7.081 20.591 -15.758 1.00 10.00 C ATOM 315 O GLY A 22 7.866 19.650 -15.642 1.00 10.00 O ATOM 0 H GLY A 22 9.359 21.703 -17.379 1.00 10.00 H new ATOM 0 HA2 GLY A 22 6.909 22.683 -16.177 1.00 10.00 H new ATOM 0 HA3 GLY A 22 7.097 21.679 -17.601 1.00 10.00 H new ATOM 319 N PHE A 23 5.841 20.567 -15.280 1.00 10.00 N ATOM 320 CA PHE A 23 5.290 19.456 -14.544 1.00 10.00 C ATOM 321 C PHE A 23 5.359 18.181 -15.353 1.00 10.00 C ATOM 322 O PHE A 23 5.936 17.239 -14.857 1.00 10.00 O ATOM 323 CB PHE A 23 3.846 19.762 -14.140 1.00 10.00 C ATOM 324 CG PHE A 23 2.956 20.137 -15.304 1.00 10.00 C ATOM 325 CD1 PHE A 23 2.273 19.142 -16.031 1.00 10.00 C ATOM 326 CD2 PHE A 23 2.872 21.481 -15.706 1.00 10.00 C ATOM 327 CE1 PHE A 23 1.525 19.487 -17.166 1.00 10.00 C ATOM 328 CE2 PHE A 23 2.100 21.830 -16.826 1.00 10.00 C ATOM 329 CZ PHE A 23 1.427 20.833 -17.556 1.00 10.00 C ATOM 0 H PHE A 23 5.185 21.339 -15.401 1.00 10.00 H new ATOM 0 HA PHE A 23 5.885 19.310 -13.643 1.00 10.00 H new ATOM 0 HB2 PHE A 23 3.426 18.890 -13.639 1.00 10.00 H new ATOM 0 HB3 PHE A 23 3.845 20.577 -13.416 1.00 10.00 H new ATOM 0 HD1 PHE A 23 2.326 18.111 -15.713 1.00 10.00 H new ATOM 0 HD2 PHE A 23 3.400 22.244 -15.154 1.00 10.00 H new ATOM 0 HE1 PHE A 23 1.026 18.720 -17.739 1.00 10.00 H new ATOM 0 HE2 PHE A 23 2.023 22.864 -17.127 1.00 10.00 H new ATOM 0 HZ PHE A 23 0.834 21.103 -18.417 1.00 10.00 H new ATOM 339 N THR A 24 4.931 18.200 -16.607 1.00 10.00 N ATOM 340 CA THR A 24 4.840 17.018 -17.456 1.00 10.00 C ATOM 341 C THR A 24 6.208 16.374 -17.604 1.00 10.00 C ATOM 342 O THR A 24 6.414 15.204 -17.312 1.00 10.00 O ATOM 343 CB THR A 24 4.252 17.428 -18.811 1.00 10.00 C ATOM 344 OG1 THR A 24 2.908 17.046 -18.810 1.00 10.00 O ATOM 345 CG2 THR A 24 4.922 16.773 -20.015 1.00 10.00 C ATOM 0 H THR A 24 4.630 19.056 -17.074 1.00 10.00 H new ATOM 0 HA THR A 24 4.183 16.276 -17.003 1.00 10.00 H new ATOM 0 HB THR A 24 4.406 18.502 -18.917 1.00 10.00 H new ATOM 0 HG1 THR A 24 2.395 17.655 -18.239 1.00 10.00 H new ATOM 0 HG21 THR A 24 4.443 17.120 -20.931 1.00 10.00 H new ATOM 0 HG22 THR A 24 5.978 17.041 -20.034 1.00 10.00 H new ATOM 0 HG23 THR A 24 4.824 15.690 -19.942 1.00 10.00 H new ATOM 353 N PHE A 25 7.182 17.162 -18.053 1.00 10.00 N ATOM 354 CA PHE A 25 8.544 16.701 -18.211 1.00 10.00 C ATOM 355 C PHE A 25 9.064 16.130 -16.902 1.00 10.00 C ATOM 356 O PHE A 25 9.625 15.042 -16.901 1.00 10.00 O ATOM 357 CB PHE A 25 9.393 17.893 -18.636 1.00 10.00 C ATOM 358 CG PHE A 25 10.879 17.651 -18.496 1.00 10.00 C ATOM 359 CD1 PHE A 25 11.562 16.907 -19.472 1.00 10.00 C ATOM 360 CD2 PHE A 25 11.567 18.124 -17.361 1.00 10.00 C ATOM 361 CE1 PHE A 25 12.942 16.674 -19.336 1.00 10.00 C ATOM 362 CE2 PHE A 25 12.947 17.896 -17.227 1.00 10.00 C ATOM 363 CZ PHE A 25 13.635 17.176 -18.220 1.00 10.00 C ATOM 0 H PHE A 25 7.041 18.137 -18.316 1.00 10.00 H new ATOM 0 HA PHE A 25 8.590 15.913 -18.963 1.00 10.00 H new ATOM 0 HB2 PHE A 25 9.168 18.138 -19.674 1.00 10.00 H new ATOM 0 HB3 PHE A 25 9.115 18.760 -18.036 1.00 10.00 H new ATOM 0 HD1 PHE A 25 11.028 16.515 -20.325 1.00 10.00 H new ATOM 0 HD2 PHE A 25 11.033 18.663 -16.593 1.00 10.00 H new ATOM 0 HE1 PHE A 25 13.470 16.109 -20.090 1.00 10.00 H new ATOM 0 HE2 PHE A 25 13.477 18.272 -16.365 1.00 10.00 H new ATOM 0 HZ PHE A 25 14.698 17.008 -18.125 1.00 10.00 H new ATOM 373 N CYS A 26 8.859 16.859 -15.801 1.00 10.00 N ATOM 374 CA CYS A 26 9.221 16.386 -14.494 1.00 10.00 C ATOM 375 C CYS A 26 8.447 15.137 -14.117 1.00 10.00 C ATOM 376 O CYS A 26 8.982 14.326 -13.405 1.00 10.00 O ATOM 377 CB CYS A 26 8.976 17.453 -13.438 1.00 10.00 C ATOM 378 SG CYS A 26 10.488 18.191 -12.849 1.00 10.00 S ATOM 0 H CYS A 26 8.438 17.788 -15.807 1.00 10.00 H new ATOM 0 HA CYS A 26 10.284 16.147 -14.532 1.00 10.00 H new ATOM 0 HB2 CYS A 26 8.334 18.230 -13.853 1.00 10.00 H new ATOM 0 HB3 CYS A 26 8.440 17.012 -12.598 1.00 10.00 H new ATOM 383 N GLU A 27 7.208 14.966 -14.545 1.00 10.00 N ATOM 384 CA GLU A 27 6.367 13.805 -14.301 1.00 10.00 C ATOM 385 C GLU A 27 7.031 12.587 -14.899 1.00 10.00 C ATOM 386 O GLU A 27 7.476 11.725 -14.156 1.00 10.00 O ATOM 387 CB GLU A 27 4.959 14.017 -14.894 1.00 10.00 C ATOM 388 CG GLU A 27 3.882 14.066 -13.813 1.00 10.00 C ATOM 389 CD GLU A 27 2.786 15.085 -14.097 1.00 10.00 C ATOM 390 OE1 GLU A 27 3.146 16.265 -14.331 1.00 10.00 O ATOM 391 OE2 GLU A 27 1.601 14.704 -14.019 1.00 10.00 O ATOM 0 H GLU A 27 6.734 15.675 -15.105 1.00 10.00 H new ATOM 0 HA GLU A 27 6.248 13.658 -13.227 1.00 10.00 H new ATOM 0 HB2 GLU A 27 4.942 14.946 -15.464 1.00 10.00 H new ATOM 0 HB3 GLU A 27 4.735 13.210 -15.592 1.00 10.00 H new ATOM 0 HG2 GLU A 27 3.432 13.078 -13.713 1.00 10.00 H new ATOM 0 HG3 GLU A 27 4.348 14.302 -12.856 1.00 10.00 H new ATOM 398 N MET A 28 7.281 12.595 -16.209 1.00 10.00 N ATOM 399 CA MET A 28 7.986 11.497 -16.868 1.00 10.00 C ATOM 400 C MET A 28 9.417 11.309 -16.359 1.00 10.00 C ATOM 401 O MET A 28 10.062 10.312 -16.682 1.00 10.00 O ATOM 402 CB MET A 28 8.009 11.763 -18.375 1.00 10.00 C ATOM 403 CG MET A 28 6.929 10.961 -19.089 1.00 10.00 C ATOM 404 SD MET A 28 6.404 11.786 -20.612 1.00 10.00 S ATOM 405 CE MET A 28 5.169 10.597 -21.174 1.00 10.00 C ATOM 0 H MET A 28 7.005 13.352 -16.835 1.00 10.00 H new ATOM 0 HA MET A 28 7.449 10.577 -16.637 1.00 10.00 H new ATOM 0 HB2 MET A 28 7.860 12.826 -18.562 1.00 10.00 H new ATOM 0 HB3 MET A 28 8.987 11.502 -18.779 1.00 10.00 H new ATOM 0 HG2 MET A 28 7.306 9.965 -19.323 1.00 10.00 H new ATOM 0 HG3 MET A 28 6.072 10.831 -18.428 1.00 10.00 H new ATOM 0 HE1 MET A 28 4.732 10.942 -22.111 1.00 10.00 H new ATOM 0 HE2 MET A 28 5.642 9.627 -21.329 1.00 10.00 H new ATOM 0 HE3 MET A 28 4.386 10.503 -20.422 1.00 10.00 H new ATOM 415 N LYS A 29 9.930 12.275 -15.587 1.00 10.00 N ATOM 416 CA LYS A 29 11.261 12.239 -15.015 1.00 10.00 C ATOM 417 C LYS A 29 11.269 11.682 -13.613 1.00 10.00 C ATOM 418 O LYS A 29 11.869 10.641 -13.429 1.00 10.00 O ATOM 419 CB LYS A 29 11.892 13.620 -15.084 1.00 10.00 C ATOM 420 CG LYS A 29 13.414 13.483 -15.071 1.00 10.00 C ATOM 421 CD LYS A 29 14.005 13.826 -13.699 1.00 10.00 C ATOM 422 CE LYS A 29 14.906 15.059 -13.804 1.00 10.00 C ATOM 423 NZ LYS A 29 16.328 14.675 -13.651 1.00 10.00 N ATOM 0 H LYS A 29 9.411 13.118 -15.343 1.00 10.00 H new ATOM 0 HA LYS A 29 11.866 11.554 -15.609 1.00 10.00 H new ATOM 0 HB2 LYS A 29 11.570 14.134 -15.989 1.00 10.00 H new ATOM 0 HB3 LYS A 29 11.563 14.225 -14.239 1.00 10.00 H new ATOM 0 HG2 LYS A 29 13.689 12.463 -15.341 1.00 10.00 H new ATOM 0 HG3 LYS A 29 13.845 14.140 -15.827 1.00 10.00 H new ATOM 0 HD2 LYS A 29 13.202 14.013 -12.986 1.00 10.00 H new ATOM 0 HD3 LYS A 29 14.578 12.980 -13.320 1.00 10.00 H new ATOM 0 HE2 LYS A 29 14.756 15.546 -14.768 1.00 10.00 H new ATOM 0 HE3 LYS A 29 14.634 15.783 -13.036 1.00 10.00 H new ATOM 0 HZ1 LYS A 29 16.926 15.522 -13.725 1.00 10.00 H new ATOM 0 HZ2 LYS A 29 16.470 14.231 -12.721 1.00 10.00 H new ATOM 0 HZ3 LYS A 29 16.588 14.001 -14.400 1.00 10.00 H new ATOM 437 N CYS A 30 10.628 12.353 -12.662 1.00 10.00 N ATOM 438 CA CYS A 30 10.367 11.910 -11.303 1.00 10.00 C ATOM 439 C CYS A 30 9.876 10.458 -11.269 1.00 10.00 C ATOM 440 O CYS A 30 10.149 9.746 -10.309 1.00 10.00 O ATOM 441 CB CYS A 30 9.285 12.791 -10.674 1.00 10.00 C ATOM 442 SG CYS A 30 9.807 14.425 -10.211 1.00 10.00 S ATOM 0 H CYS A 30 10.252 13.285 -12.836 1.00 10.00 H new ATOM 0 HA CYS A 30 11.303 11.983 -10.749 1.00 10.00 H new ATOM 0 HB2 CYS A 30 8.457 12.878 -11.377 1.00 10.00 H new ATOM 0 HB3 CYS A 30 8.899 12.287 -9.788 1.00 10.00 H new ATOM 0 HG CYS A 30 10.395 14.995 -11.220 1.00 10.00 H new ATOM 447 N ASP A 31 9.186 10.031 -12.335 1.00 10.00 N ATOM 448 CA ASP A 31 8.780 8.648 -12.531 1.00 10.00 C ATOM 449 C ASP A 31 9.986 7.727 -12.556 1.00 10.00 C ATOM 450 O ASP A 31 10.127 6.853 -11.722 1.00 10.00 O ATOM 451 CB ASP A 31 8.030 8.487 -13.865 1.00 10.00 C ATOM 452 CG ASP A 31 6.973 7.388 -13.837 1.00 10.00 C ATOM 453 OD1 ASP A 31 6.979 6.555 -12.906 1.00 10.00 O ATOM 454 OD2 ASP A 31 6.101 7.456 -14.729 1.00 10.00 O ATOM 0 H ASP A 31 8.894 10.651 -13.091 1.00 10.00 H new ATOM 0 HA ASP A 31 8.128 8.382 -11.699 1.00 10.00 H new ATOM 0 HB2 ASP A 31 7.553 9.433 -14.122 1.00 10.00 H new ATOM 0 HB3 ASP A 31 8.750 8.269 -14.654 1.00 10.00 H new ATOM 459 N THR A 32 10.873 7.929 -13.532 1.00 10.00 N ATOM 460 CA THR A 32 12.097 7.149 -13.656 1.00 10.00 C ATOM 461 C THR A 32 13.073 7.448 -12.518 1.00 10.00 C ATOM 462 O THR A 32 13.875 6.579 -12.199 1.00 10.00 O ATOM 463 CB THR A 32 12.725 7.410 -15.033 1.00 10.00 C ATOM 464 OG1 THR A 32 12.116 6.587 -16.004 1.00 10.00 O ATOM 465 CG2 THR A 32 14.219 7.113 -15.110 1.00 10.00 C ATOM 0 H THR A 32 10.760 8.638 -14.256 1.00 10.00 H new ATOM 0 HA THR A 32 11.853 6.089 -13.577 1.00 10.00 H new ATOM 0 HB THR A 32 12.569 8.474 -15.210 1.00 10.00 H new ATOM 0 HG1 THR A 32 12.520 6.760 -16.880 1.00 10.00 H new ATOM 0 HG21 THR A 32 14.581 7.324 -16.116 1.00 10.00 H new ATOM 0 HG22 THR A 32 14.752 7.739 -14.394 1.00 10.00 H new ATOM 0 HG23 THR A 32 14.394 6.063 -14.875 1.00 10.00 H new ATOM 473 N ASP A 33 13.031 8.647 -11.928 1.00 10.00 N ATOM 474 CA ASP A 33 13.849 9.032 -10.782 1.00 10.00 C ATOM 475 C ASP A 33 13.657 8.031 -9.642 1.00 10.00 C ATOM 476 O ASP A 33 14.519 7.185 -9.382 1.00 10.00 O ATOM 477 CB ASP A 33 13.495 10.456 -10.320 1.00 10.00 C ATOM 478 CG ASP A 33 14.204 10.907 -9.035 1.00 10.00 C ATOM 479 OD1 ASP A 33 13.980 10.311 -7.960 1.00 10.00 O ATOM 480 OD2 ASP A 33 14.946 11.904 -9.155 1.00 10.00 O ATOM 0 H ASP A 33 12.411 9.392 -12.245 1.00 10.00 H new ATOM 0 HA ASP A 33 14.897 9.024 -11.080 1.00 10.00 H new ATOM 0 HB2 ASP A 33 13.741 11.155 -11.119 1.00 10.00 H new ATOM 0 HB3 ASP A 33 12.418 10.516 -10.165 1.00 10.00 H new ATOM 485 N CYS A 34 12.508 8.132 -8.972 1.00 10.00 N ATOM 486 CA CYS A 34 12.226 7.320 -7.817 1.00 10.00 C ATOM 487 C CYS A 34 11.518 6.102 -8.346 1.00 10.00 C ATOM 488 O CYS A 34 10.313 6.153 -8.507 1.00 10.00 O ATOM 489 CB CYS A 34 11.377 8.080 -6.789 1.00 10.00 C ATOM 490 SG CYS A 34 11.479 7.376 -5.120 1.00 10.00 S ATOM 0 H CYS A 34 11.760 8.778 -9.223 1.00 10.00 H new ATOM 0 HA CYS A 34 13.137 7.045 -7.285 1.00 10.00 H new ATOM 0 HB2 CYS A 34 11.700 9.121 -6.758 1.00 10.00 H new ATOM 0 HB3 CYS A 34 10.337 8.079 -7.114 1.00 10.00 H new ATOM 495 N SER A 35 12.249 5.034 -8.650 1.00 10.00 N ATOM 496 CA SER A 35 11.704 3.784 -9.170 1.00 10.00 C ATOM 497 C SER A 35 12.817 2.770 -9.321 1.00 10.00 C ATOM 498 O SER A 35 13.958 3.081 -9.662 1.00 10.00 O ATOM 499 CB SER A 35 11.022 3.978 -10.530 1.00 10.00 C ATOM 500 OG SER A 35 9.845 3.201 -10.643 1.00 10.00 O ATOM 0 H SER A 35 13.263 5.013 -8.539 1.00 10.00 H new ATOM 0 HA SER A 35 10.956 3.432 -8.460 1.00 10.00 H new ATOM 0 HB2 SER A 35 10.777 5.031 -10.667 1.00 10.00 H new ATOM 0 HB3 SER A 35 11.715 3.706 -11.326 1.00 10.00 H new ATOM 0 HG SER A 35 9.088 3.697 -10.267 1.00 10.00 H new ATOM 506 N VAL A 36 12.496 1.525 -9.008 1.00 10.00 N ATOM 507 CA VAL A 36 13.427 0.422 -9.086 1.00 10.00 C ATOM 508 C VAL A 36 13.582 0.002 -10.547 1.00 10.00 C ATOM 509 O VAL A 36 13.051 0.612 -11.474 1.00 10.00 O ATOM 510 CB VAL A 36 13.012 -0.733 -8.156 1.00 10.00 C ATOM 511 CG1 VAL A 36 14.244 -1.561 -7.728 1.00 10.00 C ATOM 512 CG2 VAL A 36 12.231 -0.233 -6.921 1.00 10.00 C ATOM 0 H VAL A 36 11.566 1.253 -8.688 1.00 10.00 H new ATOM 0 HA VAL A 36 14.406 0.738 -8.726 1.00 10.00 H new ATOM 0 HB VAL A 36 12.340 -1.377 -8.722 1.00 10.00 H new ATOM 0 HG11 VAL A 36 13.927 -2.371 -7.071 1.00 10.00 H new ATOM 0 HG12 VAL A 36 14.727 -1.978 -8.612 1.00 10.00 H new ATOM 0 HG13 VAL A 36 14.948 -0.919 -7.198 1.00 10.00 H new ATOM 0 HG21 VAL A 36 11.959 -1.082 -6.294 1.00 10.00 H new ATOM 0 HG22 VAL A 36 12.855 0.455 -6.350 1.00 10.00 H new ATOM 0 HG23 VAL A 36 11.327 0.282 -7.246 1.00 10.00 H new ATOM 522 N LYS A 37 14.338 -1.061 -10.778 1.00 10.00 N ATOM 523 CA LYS A 37 14.525 -1.601 -12.114 1.00 10.00 C ATOM 524 C LYS A 37 14.734 -3.104 -12.033 1.00 10.00 C ATOM 525 O LYS A 37 14.192 -3.751 -11.147 1.00 10.00 O ATOM 526 CB LYS A 37 15.667 -0.820 -12.787 1.00 10.00 C ATOM 527 CG LYS A 37 15.368 -0.669 -14.284 1.00 10.00 C ATOM 528 CD LYS A 37 16.661 -0.723 -15.098 1.00 10.00 C ATOM 529 CE LYS A 37 16.349 -0.838 -16.592 1.00 10.00 C ATOM 530 NZ LYS A 37 16.152 -2.259 -16.985 1.00 10.00 N ATOM 0 H LYS A 37 14.836 -1.570 -10.048 1.00 10.00 H new ATOM 0 HA LYS A 37 13.644 -1.472 -12.742 1.00 10.00 H new ATOM 0 HB2 LYS A 37 15.773 0.162 -12.325 1.00 10.00 H new ATOM 0 HB3 LYS A 37 16.613 -1.343 -12.645 1.00 10.00 H new ATOM 0 HG2 LYS A 37 14.694 -1.462 -14.608 1.00 10.00 H new ATOM 0 HG3 LYS A 37 14.857 0.277 -14.465 1.00 10.00 H new ATOM 0 HD2 LYS A 37 17.253 0.173 -14.912 1.00 10.00 H new ATOM 0 HD3 LYS A 37 17.263 -1.574 -14.780 1.00 10.00 H new ATOM 0 HE2 LYS A 37 15.452 -0.264 -16.826 1.00 10.00 H new ATOM 0 HE3 LYS A 37 17.164 -0.406 -17.172 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 15.942 -2.312 -18.002 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 17.018 -2.799 -16.782 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 15.359 -2.661 -16.446 1.00 10.00 H new ATOM 544 N ASP A 38 15.539 -3.636 -12.942 1.00 10.00 N ATOM 545 CA ASP A 38 15.895 -5.040 -12.991 1.00 10.00 C ATOM 546 C ASP A 38 17.404 -5.186 -12.897 1.00 10.00 C ATOM 547 O ASP A 38 18.132 -4.639 -13.732 1.00 10.00 O ATOM 548 CB ASP A 38 15.385 -5.641 -14.308 1.00 10.00 C ATOM 549 CG ASP A 38 14.586 -6.930 -14.135 1.00 10.00 C ATOM 550 OD1 ASP A 38 14.208 -7.264 -12.994 1.00 10.00 O ATOM 551 OD2 ASP A 38 14.411 -7.593 -15.178 1.00 10.00 O ATOM 0 H ASP A 38 15.972 -3.085 -13.683 1.00 10.00 H new ATOM 0 HA ASP A 38 15.439 -5.568 -12.154 1.00 10.00 H new ATOM 0 HB2 ASP A 38 14.761 -4.904 -14.814 1.00 10.00 H new ATOM 0 HB3 ASP A 38 16.237 -5.838 -14.959 1.00 10.00 H new ATOM 556 N VAL A 39 17.868 -5.927 -11.896 1.00 10.00 N ATOM 557 CA VAL A 39 19.287 -6.192 -11.669 1.00 10.00 C ATOM 558 C VAL A 39 19.550 -7.686 -11.770 1.00 10.00 C ATOM 559 O VAL A 39 19.921 -8.343 -10.810 1.00 10.00 O ATOM 560 CB VAL A 39 19.744 -5.563 -10.341 1.00 10.00 C ATOM 561 CG1 VAL A 39 19.208 -6.307 -9.102 1.00 10.00 C ATOM 562 CG2 VAL A 39 21.276 -5.410 -10.334 1.00 10.00 C ATOM 0 H VAL A 39 17.259 -6.369 -11.207 1.00 10.00 H new ATOM 0 HA VAL A 39 19.892 -5.718 -12.443 1.00 10.00 H new ATOM 0 HB VAL A 39 19.304 -4.568 -10.272 1.00 10.00 H new ATOM 0 HG11 VAL A 39 19.566 -5.814 -8.198 1.00 10.00 H new ATOM 0 HG12 VAL A 39 18.118 -6.296 -9.114 1.00 10.00 H new ATOM 0 HG13 VAL A 39 19.560 -7.338 -9.116 1.00 10.00 H new ATOM 0 HG21 VAL A 39 21.593 -4.964 -9.391 1.00 10.00 H new ATOM 0 HG22 VAL A 39 21.740 -6.390 -10.446 1.00 10.00 H new ATOM 0 HG23 VAL A 39 21.581 -4.767 -11.160 1.00 10.00 H new ATOM 572 N LYS A 40 19.293 -8.263 -12.946 1.00 10.00 N ATOM 573 CA LYS A 40 19.478 -9.699 -13.160 1.00 10.00 C ATOM 574 C LYS A 40 20.807 -10.169 -12.570 1.00 10.00 C ATOM 575 O LYS A 40 21.868 -9.705 -12.984 1.00 10.00 O ATOM 576 CB LYS A 40 19.375 -10.029 -14.644 1.00 10.00 C ATOM 577 CG LYS A 40 17.945 -9.785 -15.152 1.00 10.00 C ATOM 578 CD LYS A 40 17.643 -10.675 -16.357 1.00 10.00 C ATOM 579 CE LYS A 40 17.428 -12.133 -15.916 1.00 10.00 C ATOM 580 NZ LYS A 40 18.424 -13.041 -16.538 1.00 10.00 N ATOM 0 H LYS A 40 18.956 -7.757 -13.765 1.00 10.00 H new ATOM 0 HA LYS A 40 18.684 -10.236 -12.641 1.00 10.00 H new ATOM 0 HB2 LYS A 40 20.077 -9.416 -15.209 1.00 10.00 H new ATOM 0 HB3 LYS A 40 19.654 -11.069 -14.811 1.00 10.00 H new ATOM 0 HG2 LYS A 40 17.230 -9.989 -14.355 1.00 10.00 H new ATOM 0 HG3 LYS A 40 17.825 -8.737 -15.428 1.00 10.00 H new ATOM 0 HD2 LYS A 40 16.754 -10.310 -16.871 1.00 10.00 H new ATOM 0 HD3 LYS A 40 18.466 -10.623 -17.069 1.00 10.00 H new ATOM 0 HE2 LYS A 40 17.500 -12.200 -14.830 1.00 10.00 H new ATOM 0 HE3 LYS A 40 16.422 -12.452 -16.189 1.00 10.00 H new ATOM 0 HZ1 LYS A 40 18.251 -14.016 -16.220 1.00 10.00 H new ATOM 0 HZ2 LYS A 40 18.338 -12.994 -17.573 1.00 10.00 H new ATOM 0 HZ3 LYS A 40 19.382 -12.750 -16.257 1.00 10.00 H new ATOM 594 N GLU A 41 20.724 -11.050 -11.580 1.00 10.00 N ATOM 595 CA GLU A 41 21.894 -11.510 -10.847 1.00 10.00 C ATOM 596 C GLU A 41 22.642 -12.460 -11.760 1.00 10.00 C ATOM 597 O GLU A 41 22.099 -13.501 -12.134 1.00 10.00 O ATOM 598 CB GLU A 41 21.488 -12.200 -9.543 1.00 10.00 C ATOM 599 CG GLU A 41 21.018 -11.164 -8.512 1.00 10.00 C ATOM 600 CD GLU A 41 22.077 -10.960 -7.427 1.00 10.00 C ATOM 601 OE1 GLU A 41 22.136 -11.824 -6.525 1.00 10.00 O ATOM 602 OE2 GLU A 41 22.847 -9.981 -7.547 1.00 10.00 O ATOM 0 H GLU A 41 19.846 -11.463 -11.265 1.00 10.00 H new ATOM 0 HA GLU A 41 22.529 -10.670 -10.567 1.00 10.00 H new ATOM 0 HB2 GLU A 41 20.690 -12.917 -9.737 1.00 10.00 H new ATOM 0 HB3 GLU A 41 22.332 -12.762 -9.144 1.00 10.00 H new ATOM 0 HG2 GLU A 41 20.813 -10.216 -9.009 1.00 10.00 H new ATOM 0 HG3 GLU A 41 20.084 -11.494 -8.058 1.00 10.00 H new ATOM 609 N LYS A 42 23.834 -12.050 -12.209 1.00 10.00 N ATOM 610 CA LYS A 42 24.678 -12.841 -13.102 1.00 10.00 C ATOM 611 C LYS A 42 24.799 -14.254 -12.553 1.00 10.00 C ATOM 612 O LYS A 42 25.544 -14.456 -11.603 1.00 10.00 O ATOM 613 CB LYS A 42 26.059 -12.192 -13.228 1.00 10.00 C ATOM 614 CG LYS A 42 26.960 -13.024 -14.160 1.00 10.00 C ATOM 615 CD LYS A 42 28.435 -12.879 -13.773 1.00 10.00 C ATOM 616 CE LYS A 42 29.249 -14.058 -14.320 1.00 10.00 C ATOM 617 NZ LYS A 42 29.939 -13.694 -15.578 1.00 10.00 N ATOM 0 H LYS A 42 24.241 -11.149 -11.958 1.00 10.00 H new ATOM 0 HA LYS A 42 24.228 -12.881 -14.094 1.00 10.00 H new ATOM 0 HB2 LYS A 42 25.958 -11.179 -13.618 1.00 10.00 H new ATOM 0 HB3 LYS A 42 26.520 -12.110 -12.244 1.00 10.00 H new ATOM 0 HG2 LYS A 42 26.669 -14.073 -14.111 1.00 10.00 H new ATOM 0 HG3 LYS A 42 26.818 -12.702 -15.192 1.00 10.00 H new ATOM 0 HD2 LYS A 42 28.830 -11.942 -14.166 1.00 10.00 H new ATOM 0 HD3 LYS A 42 28.530 -12.835 -12.688 1.00 10.00 H new ATOM 0 HE2 LYS A 42 29.983 -14.372 -13.578 1.00 10.00 H new ATOM 0 HE3 LYS A 42 28.590 -14.908 -14.496 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 30.482 -14.510 -15.925 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 29.236 -13.417 -16.292 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 30.585 -12.898 -15.402 1.00 10.00 H new ATOM 631 N LEU A 43 24.128 -15.203 -13.194 1.00 10.00 N ATOM 632 CA LEU A 43 24.075 -16.593 -12.814 1.00 10.00 C ATOM 633 C LEU A 43 23.668 -17.425 -14.013 1.00 10.00 C ATOM 634 O LEU A 43 22.706 -17.102 -14.709 1.00 10.00 O ATOM 635 CB LEU A 43 23.103 -16.801 -11.633 1.00 10.00 C ATOM 636 CG LEU A 43 23.712 -16.501 -10.249 1.00 10.00 C ATOM 637 CD1 LEU A 43 22.775 -16.985 -9.145 1.00 10.00 C ATOM 638 CD2 LEU A 43 25.085 -17.175 -10.072 1.00 10.00 C ATOM 0 H LEU A 43 23.582 -15.005 -14.033 1.00 10.00 H new ATOM 0 HA LEU A 43 25.062 -16.914 -12.482 1.00 10.00 H new ATOM 0 HB2 LEU A 43 22.231 -16.164 -11.779 1.00 10.00 H new ATOM 0 HB3 LEU A 43 22.750 -17.832 -11.646 1.00 10.00 H new ATOM 0 HG LEU A 43 23.845 -15.421 -10.181 1.00 10.00 H new ATOM 0 HD11 LEU A 43 23.216 -16.768 -8.172 1.00 10.00 H new ATOM 0 HD12 LEU A 43 21.816 -16.474 -9.231 1.00 10.00 H new ATOM 0 HD13 LEU A 43 22.623 -18.060 -9.242 1.00 10.00 H new ATOM 0 HD21 LEU A 43 25.481 -16.940 -9.084 1.00 10.00 H new ATOM 0 HD22 LEU A 43 24.976 -18.255 -10.171 1.00 10.00 H new ATOM 0 HD23 LEU A 43 25.771 -16.808 -10.835 1.00 10.00 H new ATOM 650 N GLU A 44 24.427 -18.484 -14.254 1.00 10.00 N ATOM 651 CA GLU A 44 24.189 -19.416 -15.343 1.00 10.00 C ATOM 652 C GLU A 44 24.516 -20.837 -14.900 1.00 10.00 C ATOM 653 O GLU A 44 24.985 -21.055 -13.781 1.00 10.00 O ATOM 654 CB GLU A 44 24.992 -18.981 -16.581 1.00 10.00 C ATOM 655 CG GLU A 44 24.209 -17.919 -17.361 1.00 10.00 C ATOM 656 CD GLU A 44 24.807 -17.713 -18.748 1.00 10.00 C ATOM 657 OE1 GLU A 44 24.515 -18.566 -19.616 1.00 10.00 O ATOM 658 OE2 GLU A 44 25.537 -16.707 -18.909 1.00 10.00 O ATOM 0 H GLU A 44 25.240 -18.723 -13.687 1.00 10.00 H new ATOM 0 HA GLU A 44 23.135 -19.406 -15.619 1.00 10.00 H new ATOM 0 HB2 GLU A 44 25.960 -18.582 -16.276 1.00 10.00 H new ATOM 0 HB3 GLU A 44 25.189 -19.842 -17.219 1.00 10.00 H new ATOM 0 HG2 GLU A 44 23.166 -18.223 -17.452 1.00 10.00 H new ATOM 0 HG3 GLU A 44 24.220 -16.977 -16.812 1.00 10.00 H new ATOM 665 N ASN A 45 24.207 -21.803 -15.769 1.00 10.00 N ATOM 666 CA ASN A 45 24.581 -23.196 -15.575 1.00 10.00 C ATOM 667 C ASN A 45 26.090 -23.360 -15.328 1.00 10.00 C ATOM 668 O ASN A 45 26.892 -22.425 -15.368 1.00 10.00 O ATOM 669 CB ASN A 45 24.150 -24.035 -16.792 1.00 10.00 C ATOM 670 CG ASN A 45 24.938 -23.652 -18.032 1.00 10.00 C ATOM 671 OD1 ASN A 45 24.440 -22.696 -18.775 1.00 10.00 O flip ATOM 672 ND2 ASN A 45 25.987 -24.180 -18.329 1.00 10.00 N flip ATOM 0 H ASN A 45 23.687 -21.634 -16.630 1.00 10.00 H new ATOM 0 HA ASN A 45 24.063 -23.553 -14.685 1.00 10.00 H new ATOM 0 HB2 ASN A 45 24.297 -25.093 -16.577 1.00 10.00 H new ATOM 0 HB3 ASN A 45 23.085 -23.892 -16.976 1.00 10.00 H new ATOM 0 HD21 ASN A 45 26.367 -24.924 -17.744 1.00 10.00 H new ATOM 0 HD22 ASN A 45 26.490 -23.881 -19.164 1.00 10.00 H new ATOM 679 N TYR A 46 26.488 -24.605 -15.121 1.00 10.00 N ATOM 680 CA TYR A 46 27.870 -24.950 -14.892 1.00 10.00 C ATOM 681 C TYR A 46 28.456 -25.767 -16.034 1.00 10.00 C ATOM 682 O TYR A 46 27.812 -26.023 -17.043 1.00 10.00 O ATOM 683 CB TYR A 46 27.927 -25.685 -13.552 1.00 10.00 C ATOM 684 CG TYR A 46 29.200 -25.451 -12.775 1.00 10.00 C ATOM 685 CD1 TYR A 46 29.722 -24.148 -12.635 1.00 10.00 C ATOM 686 CD2 TYR A 46 29.843 -26.541 -12.165 1.00 10.00 C ATOM 687 CE1 TYR A 46 30.901 -23.940 -11.899 1.00 10.00 C ATOM 688 CE2 TYR A 46 31.013 -26.333 -11.415 1.00 10.00 C ATOM 689 CZ TYR A 46 31.545 -25.032 -11.283 1.00 10.00 C ATOM 690 OH TYR A 46 32.692 -24.839 -10.584 1.00 10.00 O ATOM 0 H TYR A 46 25.854 -25.404 -15.108 1.00 10.00 H new ATOM 0 HA TYR A 46 28.487 -24.053 -14.854 1.00 10.00 H new ATOM 0 HB2 TYR A 46 27.079 -25.373 -12.942 1.00 10.00 H new ATOM 0 HB3 TYR A 46 27.815 -26.754 -13.731 1.00 10.00 H new ATOM 0 HD1 TYR A 46 29.216 -23.311 -13.093 1.00 10.00 H new ATOM 0 HD2 TYR A 46 29.439 -27.537 -12.272 1.00 10.00 H new ATOM 0 HE1 TYR A 46 31.313 -22.946 -11.806 1.00 10.00 H new ATOM 0 HE2 TYR A 46 31.505 -27.168 -10.940 1.00 10.00 H new ATOM 0 HH TYR A 46 33.003 -25.695 -10.224 1.00 10.00 H new ATOM 700 N LYS A 47 29.674 -26.266 -15.833 1.00 10.00 N ATOM 701 CA LYS A 47 30.345 -27.154 -16.781 1.00 10.00 C ATOM 702 C LYS A 47 30.576 -28.536 -16.153 1.00 10.00 C ATOM 703 O LYS A 47 31.673 -28.847 -15.673 1.00 10.00 O ATOM 704 CB LYS A 47 31.579 -26.442 -17.329 1.00 10.00 C ATOM 705 CG LYS A 47 32.639 -26.202 -16.239 1.00 10.00 C ATOM 706 CD LYS A 47 33.906 -27.003 -16.557 1.00 10.00 C ATOM 707 CE LYS A 47 34.671 -27.341 -15.276 1.00 10.00 C ATOM 708 NZ LYS A 47 36.051 -26.811 -15.340 1.00 10.00 N ATOM 0 H LYS A 47 30.228 -26.064 -15.001 1.00 10.00 H new ATOM 0 HA LYS A 47 29.723 -27.370 -17.650 1.00 10.00 H new ATOM 0 HB2 LYS A 47 32.014 -27.037 -18.132 1.00 10.00 H new ATOM 0 HB3 LYS A 47 31.283 -25.487 -17.763 1.00 10.00 H new ATOM 0 HG2 LYS A 47 32.876 -25.140 -16.178 1.00 10.00 H new ATOM 0 HG3 LYS A 47 32.246 -26.498 -15.266 1.00 10.00 H new ATOM 0 HD2 LYS A 47 33.639 -27.922 -17.080 1.00 10.00 H new ATOM 0 HD3 LYS A 47 34.546 -26.429 -17.227 1.00 10.00 H new ATOM 0 HE2 LYS A 47 34.153 -26.920 -14.414 1.00 10.00 H new ATOM 0 HE3 LYS A 47 34.697 -28.422 -15.135 1.00 10.00 H new ATOM 0 HZ1 LYS A 47 36.556 -27.050 -14.462 1.00 10.00 H new ATOM 0 HZ2 LYS A 47 36.548 -27.233 -16.151 1.00 10.00 H new ATOM 0 HZ3 LYS A 47 36.021 -25.777 -15.452 1.00 10.00 H new ATOM 722 N PRO A 48 29.516 -29.344 -16.029 1.00 10.00 N ATOM 723 CA PRO A 48 29.651 -30.670 -15.465 1.00 10.00 C ATOM 724 C PRO A 48 30.491 -31.530 -16.400 1.00 10.00 C ATOM 725 O PRO A 48 30.569 -31.263 -17.603 1.00 10.00 O ATOM 726 CB PRO A 48 28.227 -31.179 -15.244 1.00 10.00 C ATOM 727 CG PRO A 48 27.327 -30.302 -16.120 1.00 10.00 C ATOM 728 CD PRO A 48 28.186 -29.128 -16.565 1.00 10.00 C ATOM 0 HA PRO A 48 30.177 -30.691 -14.511 1.00 10.00 H new ATOM 0 HB2 PRO A 48 28.140 -32.229 -15.523 1.00 10.00 H new ATOM 0 HB3 PRO A 48 27.944 -31.103 -14.194 1.00 10.00 H new ATOM 0 HG2 PRO A 48 26.955 -30.861 -16.979 1.00 10.00 H new ATOM 0 HG3 PRO A 48 26.456 -29.958 -15.562 1.00 10.00 H new ATOM 0 HD2 PRO A 48 28.215 -29.063 -17.653 1.00 10.00 H new ATOM 0 HD3 PRO A 48 27.772 -28.188 -16.200 1.00 10.00 H new ATOM 736 N LYS A 49 31.197 -32.509 -15.812 1.00 10.00 N ATOM 737 CA LYS A 49 31.951 -33.492 -16.590 1.00 10.00 C ATOM 738 C LYS A 49 31.031 -34.127 -17.649 1.00 10.00 C ATOM 739 O LYS A 49 29.822 -33.941 -17.565 1.00 10.00 O ATOM 740 CB LYS A 49 32.587 -34.533 -15.649 1.00 10.00 C ATOM 741 CG LYS A 49 34.017 -34.862 -16.107 1.00 10.00 C ATOM 742 CD LYS A 49 34.264 -36.369 -16.188 1.00 10.00 C ATOM 743 CE LYS A 49 34.481 -36.960 -14.790 1.00 10.00 C ATOM 744 NZ LYS A 49 35.747 -37.731 -14.735 1.00 10.00 N ATOM 0 H LYS A 49 31.258 -32.637 -14.802 1.00 10.00 H new ATOM 0 HA LYS A 49 32.769 -33.006 -17.122 1.00 10.00 H new ATOM 0 HB2 LYS A 49 32.604 -34.149 -14.629 1.00 10.00 H new ATOM 0 HB3 LYS A 49 31.983 -35.441 -15.638 1.00 10.00 H new ATOM 0 HG2 LYS A 49 34.196 -34.413 -17.084 1.00 10.00 H new ATOM 0 HG3 LYS A 49 34.731 -34.415 -15.415 1.00 10.00 H new ATOM 0 HD2 LYS A 49 33.414 -36.856 -16.666 1.00 10.00 H new ATOM 0 HD3 LYS A 49 35.136 -36.566 -16.811 1.00 10.00 H new ATOM 0 HE2 LYS A 49 34.505 -36.159 -14.051 1.00 10.00 H new ATOM 0 HE3 LYS A 49 33.644 -37.608 -14.530 1.00 10.00 H new ATOM 0 HZ1 LYS A 49 35.874 -38.122 -13.780 1.00 10.00 H new ATOM 0 HZ2 LYS A 49 35.711 -38.508 -15.425 1.00 10.00 H new ATOM 0 HZ3 LYS A 49 36.545 -37.104 -14.961 1.00 10.00 H new ATOM 758 N ASN A 50 31.640 -34.810 -18.625 1.00 10.00 N ATOM 759 CA ASN A 50 30.916 -35.518 -19.694 1.00 10.00 C ATOM 760 C ASN A 50 29.907 -36.603 -19.176 1.00 10.00 C ATOM 761 O ASN A 50 29.800 -37.646 -19.851 1.00 10.00 O ATOM 762 CB ASN A 50 31.955 -36.125 -20.675 1.00 10.00 C ATOM 763 CG ASN A 50 31.620 -35.880 -22.136 1.00 10.00 C ATOM 764 OD1 ASN A 50 30.510 -35.937 -22.624 1.00 10.00 O ATOM 765 ND2 ASN A 50 32.632 -35.555 -22.903 1.00 10.00 N ATOM 766 OXT ASN A 50 29.395 -36.491 -18.042 1.00 10.00 O ATOM 0 H ASN A 50 32.654 -34.889 -18.698 1.00 10.00 H new ATOM 0 HA ASN A 50 30.289 -34.790 -20.208 1.00 10.00 H new ATOM 0 HB2 ASN A 50 32.937 -35.703 -20.459 1.00 10.00 H new ATOM 0 HB3 ASN A 50 32.024 -37.199 -20.501 1.00 10.00 H new ATOM 0 HD21 ASN A 50 32.479 -35.355 -23.892 1.00 10.00 H new ATOM 0 HD22 ASN A 50 33.572 -35.502 -22.511 1.00 10.00 H new TER 773 ASN A 50