USER MOD reduce.3.24.130724 H: found=0, std=0, add=732, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 738 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 111:sc= 1.28 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -121:sc=-0.00878 (180deg=-0.565) USER MOD Single : A 52 SER OG : rot -30:sc= 1.2 USER MOD Single : A 53 LYS NZ :NH3+ 163:sc= 1.28 (180deg=0.575) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= -0.0697 K(o=-0.07,f=-1.3!) USER MOD Single : A 58 SER OG : rot 180:sc=-0.00633 USER MOD Single : A 61 ASN : amide:sc=-0.00412 K(o=-0.0041,f=-0.9) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -0.293 K(o=-0.29,f=-0.98) USER MOD Single : A 68 LYS NZ :NH3+ -157:sc= 1.25 (180deg=1.06) USER MOD Single : A 69 GLN : amide:sc= 0.664 K(o=0.66,f=-0.026) USER MOD Single : A 72 MET CE :methyl -165:sc= 0 (180deg=-0.193) USER MOD Single : A 78 ASN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 39 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot 96:sc= 1.23 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 MET CE :methyl -121:sc=-0.00426 (180deg=-0.548) USER MOD Single : B 52 SER OG : rot -52:sc= 1.32 USER MOD Single : B 53 LYS NZ :NH3+ 153:sc= 1.27 (180deg=0.586) USER MOD Single : B 54 TYR OH : rot 180:sc= 0 USER MOD Single : B 56 ASN : amide:sc= -0.0206 K(o=-0.021,f=-1.3!) USER MOD Single : B 58 SER OG : rot 180:sc=-0.00757 USER MOD Single : B 61 ASN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : B 65 SER OG : rot 180:sc= 0 USER MOD Single : B 66 GLN : amide:sc= -0.287 K(o=-0.29,f=-0.94) USER MOD Single : B 68 LYS NZ :NH3+ -170:sc= 1.26 (180deg=1.14) USER MOD Single : B 69 GLN : amide:sc= 0.673 K(o=0.67,f=-0.022) USER MOD Single : B 72 MET CE :methyl -165:sc= -0.0015 (180deg=-0.196) USER MOD Single : B 78 ASN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 38 16.015 -8.040 -50.860 1.00 0.00 N ATOM 2 CA ASP A 38 15.477 -8.516 -49.592 1.00 0.00 C ATOM 3 C ASP A 38 14.751 -7.403 -48.848 1.00 0.00 C ATOM 4 O ASP A 38 13.934 -7.663 -47.965 1.00 0.00 O ATOM 5 CB ASP A 38 16.595 -9.081 -48.712 1.00 0.00 C ATOM 6 CG ASP A 38 17.240 -10.329 -49.301 1.00 0.00 C ATOM 7 OD1 ASP A 38 16.520 -11.191 -49.748 1.00 0.00 O ATOM 8 OD2 ASP A 38 18.445 -10.408 -49.299 1.00 0.00 O ATOM 0 HA ASP A 38 14.761 -9.307 -49.814 1.00 0.00 H new ATOM 0 HB2 ASP A 38 17.359 -8.317 -48.568 1.00 0.00 H new ATOM 0 HB3 ASP A 38 16.191 -9.317 -47.727 1.00 0.00 H new ATOM 13 N TYR A 39 15.055 -6.161 -49.210 1.00 0.00 N ATOM 14 CA TYR A 39 14.494 -5.004 -48.523 1.00 0.00 C ATOM 15 C TYR A 39 13.124 -4.643 -49.083 1.00 0.00 C ATOM 16 O TYR A 39 12.119 -4.690 -48.371 1.00 0.00 O ATOM 17 CB TYR A 39 15.442 -3.807 -48.628 1.00 0.00 C ATOM 18 CG TYR A 39 14.922 -2.556 -47.955 1.00 0.00 C ATOM 19 CD1 TYR A 39 14.863 -2.486 -46.571 1.00 0.00 C ATOM 20 CD2 TYR A 39 14.504 -1.479 -48.721 1.00 0.00 C ATOM 21 CE1 TYR A 39 14.389 -1.344 -45.956 1.00 0.00 C ATOM 22 CE2 TYR A 39 14.029 -0.336 -48.107 1.00 0.00 C ATOM 23 CZ TYR A 39 13.971 -0.267 -46.730 1.00 0.00 C ATOM 24 OH TYR A 39 13.499 0.871 -46.117 1.00 0.00 O ATOM 0 H TYR A 39 15.688 -5.930 -49.976 1.00 0.00 H new ATOM 0 HA TYR A 39 14.372 -5.265 -47.472 1.00 0.00 H new ATOM 0 HB2 TYR A 39 16.401 -4.075 -48.185 1.00 0.00 H new ATOM 0 HB3 TYR A 39 15.626 -3.592 -49.681 1.00 0.00 H new ATOM 0 HD1 TYR A 39 15.188 -3.325 -45.974 1.00 0.00 H new ATOM 0 HD2 TYR A 39 14.550 -1.533 -49.799 1.00 0.00 H new ATOM 0 HE1 TYR A 39 14.343 -1.288 -44.878 1.00 0.00 H new ATOM 0 HE2 TYR A 39 13.703 0.503 -48.704 1.00 0.00 H new ATOM 0 HH TYR A 39 13.249 1.530 -46.798 1.00 0.00 H new ATOM 34 N LEU A 40 13.088 -4.282 -50.361 1.00 0.00 N ATOM 35 CA LEU A 40 11.859 -3.817 -50.992 1.00 0.00 C ATOM 36 C LEU A 40 10.860 -4.955 -51.159 1.00 0.00 C ATOM 37 O LEU A 40 9.664 -4.783 -50.925 1.00 0.00 O ATOM 38 CB LEU A 40 12.168 -3.195 -52.360 1.00 0.00 C ATOM 39 CG LEU A 40 12.938 -1.868 -52.328 1.00 0.00 C ATOM 40 CD1 LEU A 40 13.295 -1.454 -53.749 1.00 0.00 C ATOM 41 CD2 LEU A 40 12.091 -0.805 -51.645 1.00 0.00 C ATOM 0 H LEU A 40 13.898 -4.303 -50.981 1.00 0.00 H new ATOM 0 HA LEU A 40 11.415 -3.062 -50.343 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.743 -3.914 -52.944 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.227 -3.036 -52.887 1.00 0.00 H new ATOM 0 HG LEU A 40 13.862 -1.987 -51.762 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.842 -0.511 -53.727 1.00 0.00 H new ATOM 0 HD12 LEU A 40 13.917 -2.224 -54.207 1.00 0.00 H new ATOM 0 HD13 LEU A 40 12.382 -1.330 -54.332 1.00 0.00 H new ATOM 0 HD21 LEU A 40 12.638 0.137 -51.622 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.161 -0.671 -52.197 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.866 -1.118 -50.626 1.00 0.00 H new ATOM 53 N PRO A 41 11.359 -6.118 -51.564 1.00 0.00 N ATOM 54 CA PRO A 41 10.521 -7.303 -51.707 1.00 0.00 C ATOM 55 C PRO A 41 9.698 -7.549 -50.449 1.00 0.00 C ATOM 56 O PRO A 41 8.520 -7.901 -50.525 1.00 0.00 O ATOM 57 CB PRO A 41 11.541 -8.421 -51.942 1.00 0.00 C ATOM 58 CG PRO A 41 12.665 -7.746 -52.652 1.00 0.00 C ATOM 59 CD PRO A 41 12.790 -6.409 -51.970 1.00 0.00 C ATOM 0 HA PRO A 41 9.790 -7.221 -52.511 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.872 -8.863 -51.002 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.118 -9.227 -52.542 1.00 0.00 H new ATOM 0 HG2 PRO A 41 13.588 -8.321 -52.572 1.00 0.00 H new ATOM 0 HG3 PRO A 41 12.452 -7.632 -53.715 1.00 0.00 H new ATOM 0 HD2 PRO A 41 13.456 -6.453 -51.108 1.00 0.00 H new ATOM 0 HD3 PRO A 41 13.186 -5.646 -52.640 1.00 0.00 H new ATOM 67 N THR A 42 10.323 -7.363 -49.292 1.00 0.00 N ATOM 68 CA THR A 42 9.641 -7.534 -48.015 1.00 0.00 C ATOM 69 C THR A 42 8.576 -6.463 -47.813 1.00 0.00 C ATOM 70 O THR A 42 7.456 -6.760 -47.396 1.00 0.00 O ATOM 71 CB THR A 42 10.639 -7.497 -46.843 1.00 0.00 C ATOM 72 OG1 THR A 42 11.578 -8.573 -46.978 1.00 0.00 O ATOM 73 CG2 THR A 42 9.910 -7.630 -45.516 1.00 0.00 C ATOM 0 H THR A 42 11.303 -7.093 -49.212 1.00 0.00 H new ATOM 0 HA THR A 42 9.158 -8.511 -48.035 1.00 0.00 H new ATOM 0 HB THR A 42 11.164 -6.542 -46.863 1.00 0.00 H new ATOM 0 HG1 THR A 42 12.461 -8.211 -47.198 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.632 -7.602 -44.700 1.00 0.00 H new ATOM 0 HG22 THR A 42 9.204 -6.807 -45.405 1.00 0.00 H new ATOM 0 HG23 THR A 42 9.371 -8.577 -45.491 1.00 0.00 H new ATOM 81 N LEU A 43 8.931 -5.219 -48.110 1.00 0.00 N ATOM 82 CA LEU A 43 7.989 -4.110 -48.015 1.00 0.00 C ATOM 83 C LEU A 43 6.821 -4.296 -48.975 1.00 0.00 C ATOM 84 O LEU A 43 5.687 -3.927 -48.667 1.00 0.00 O ATOM 85 CB LEU A 43 8.699 -2.784 -48.316 1.00 0.00 C ATOM 86 CG LEU A 43 9.750 -2.344 -47.289 1.00 0.00 C ATOM 87 CD1 LEU A 43 10.501 -1.129 -47.818 1.00 0.00 C ATOM 88 CD2 LEU A 43 9.067 -2.031 -45.966 1.00 0.00 C ATOM 0 H LEU A 43 9.866 -4.952 -48.419 1.00 0.00 H new ATOM 0 HA LEU A 43 7.599 -4.089 -46.998 1.00 0.00 H new ATOM 0 HB2 LEU A 43 9.181 -2.864 -49.290 1.00 0.00 H new ATOM 0 HB3 LEU A 43 7.946 -2.000 -48.397 1.00 0.00 H new ATOM 0 HG LEU A 43 10.468 -3.147 -47.124 1.00 0.00 H new ATOM 0 HD11 LEU A 43 11.248 -0.817 -47.088 1.00 0.00 H new ATOM 0 HD12 LEU A 43 10.995 -1.386 -48.755 1.00 0.00 H new ATOM 0 HD13 LEU A 43 9.798 -0.314 -47.990 1.00 0.00 H new ATOM 0 HD21 LEU A 43 9.814 -1.718 -45.236 1.00 0.00 H new ATOM 0 HD22 LEU A 43 8.343 -1.229 -46.111 1.00 0.00 H new ATOM 0 HD23 LEU A 43 8.554 -2.921 -45.602 1.00 0.00 H new ATOM 100 N ARG A 44 7.103 -4.871 -50.139 1.00 0.00 N ATOM 101 CA ARG A 44 6.074 -5.118 -51.141 1.00 0.00 C ATOM 102 C ARG A 44 5.065 -6.150 -50.652 1.00 0.00 C ATOM 103 O ARG A 44 3.864 -6.018 -50.886 1.00 0.00 O ATOM 104 CB ARG A 44 6.698 -5.601 -52.442 1.00 0.00 C ATOM 105 CG ARG A 44 7.397 -4.523 -53.255 1.00 0.00 C ATOM 106 CD ARG A 44 8.451 -5.093 -54.132 1.00 0.00 C ATOM 107 NE ARG A 44 7.927 -6.131 -55.005 1.00 0.00 N ATOM 108 CZ ARG A 44 8.652 -6.792 -55.929 1.00 0.00 C ATOM 109 NH1 ARG A 44 9.926 -6.512 -56.088 1.00 0.00 N ATOM 110 NH2 ARG A 44 8.081 -7.722 -56.675 1.00 0.00 N ATOM 0 H ARG A 44 8.038 -5.175 -50.412 1.00 0.00 H new ATOM 0 HA ARG A 44 5.555 -4.175 -51.316 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.418 -6.387 -52.213 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.919 -6.051 -53.057 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.664 -3.994 -53.864 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.841 -3.790 -52.582 1.00 0.00 H new ATOM 0 HD2 ARG A 44 8.890 -4.299 -54.735 1.00 0.00 H new ATOM 0 HD3 ARG A 44 9.251 -5.505 -53.517 1.00 0.00 H new ATOM 0 HE ARG A 44 6.941 -6.376 -54.912 1.00 0.00 H new ATOM 0 HH11 ARG A 44 10.366 -5.794 -55.512 1.00 0.00 H new ATOM 0 HH12 ARG A 44 10.475 -7.012 -56.787 1.00 0.00 H new ATOM 0 HH21 ARG A 44 7.092 -7.939 -56.551 1.00 0.00 H new ATOM 0 HH22 ARG A 44 8.629 -8.223 -57.374 1.00 0.00 H new ATOM 124 N LYS A 45 5.561 -7.177 -49.971 1.00 0.00 N ATOM 125 CA LYS A 45 4.696 -8.149 -49.313 1.00 0.00 C ATOM 126 C LYS A 45 3.850 -7.490 -48.232 1.00 0.00 C ATOM 127 O LYS A 45 2.666 -7.796 -48.083 1.00 0.00 O ATOM 128 CB LYS A 45 5.526 -9.285 -48.711 1.00 0.00 C ATOM 129 CG LYS A 45 6.160 -10.213 -49.739 1.00 0.00 C ATOM 130 CD LYS A 45 7.013 -11.280 -49.068 1.00 0.00 C ATOM 131 CE LYS A 45 7.677 -12.185 -50.095 1.00 0.00 C ATOM 132 NZ LYS A 45 8.546 -13.209 -49.454 1.00 0.00 N ATOM 0 H LYS A 45 6.559 -7.358 -49.860 1.00 0.00 H new ATOM 0 HA LYS A 45 4.025 -8.562 -50.067 1.00 0.00 H new ATOM 0 HB2 LYS A 45 6.314 -8.855 -48.093 1.00 0.00 H new ATOM 0 HB3 LYS A 45 4.889 -9.874 -48.051 1.00 0.00 H new ATOM 0 HG2 LYS A 45 5.380 -10.689 -50.333 1.00 0.00 H new ATOM 0 HG3 LYS A 45 6.775 -9.632 -50.427 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.776 -10.804 -48.452 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.392 -11.878 -48.401 1.00 0.00 H new ATOM 0 HE2 LYS A 45 6.911 -12.681 -50.691 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.272 -11.581 -50.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 8.980 -13.805 -50.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.293 -12.737 -48.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 7.974 -13.802 -48.820 1.00 0.00 H new ATOM 146 N GLU A 46 4.462 -6.583 -47.479 1.00 0.00 N ATOM 147 CA GLU A 46 3.750 -5.831 -46.452 1.00 0.00 C ATOM 148 C GLU A 46 2.644 -4.979 -47.060 1.00 0.00 C ATOM 149 O GLU A 46 1.565 -4.842 -46.484 1.00 0.00 O ATOM 150 CB GLU A 46 4.718 -4.959 -45.666 1.00 0.00 C ATOM 0 H GLU A 46 5.452 -6.350 -47.561 1.00 0.00 H new ATOM 0 HA GLU A 46 3.288 -6.546 -45.771 1.00 0.00 H new ATOM 155 N LEU A 47 2.919 -4.409 -48.228 1.00 0.00 N ATOM 156 CA LEU A 47 1.935 -3.597 -48.935 1.00 0.00 C ATOM 157 C LEU A 47 0.722 -4.427 -49.337 1.00 0.00 C ATOM 158 O LEU A 47 -0.415 -3.966 -49.248 1.00 0.00 O ATOM 159 CB LEU A 47 2.565 -2.965 -50.182 1.00 0.00 C ATOM 160 CG LEU A 47 3.581 -1.845 -49.919 1.00 0.00 C ATOM 161 CD1 LEU A 47 4.276 -1.474 -51.222 1.00 0.00 C ATOM 162 CD2 LEU A 47 2.868 -0.644 -49.318 1.00 0.00 C ATOM 0 H LEU A 47 3.816 -4.494 -48.706 1.00 0.00 H new ATOM 0 HA LEU A 47 1.604 -2.809 -48.258 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.058 -3.750 -50.755 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.766 -2.567 -50.808 1.00 0.00 H new ATOM 0 HG LEU A 47 4.337 -2.185 -49.211 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.998 -0.679 -51.036 1.00 0.00 H new ATOM 0 HD12 LEU A 47 4.793 -2.347 -51.620 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.536 -1.130 -51.944 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.589 0.151 -49.131 1.00 0.00 H new ATOM 0 HD22 LEU A 47 2.107 -0.288 -50.012 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.396 -0.933 -48.379 1.00 0.00 H new ATOM 174 N MET A 48 0.972 -5.655 -49.779 1.00 0.00 N ATOM 175 CA MET A 48 -0.101 -6.571 -50.144 1.00 0.00 C ATOM 176 C MET A 48 -0.994 -6.877 -48.950 1.00 0.00 C ATOM 177 O MET A 48 -2.218 -6.934 -49.076 1.00 0.00 O ATOM 178 CB MET A 48 0.480 -7.862 -50.719 1.00 0.00 C ATOM 179 CG MET A 48 1.159 -7.699 -52.072 1.00 0.00 C ATOM 180 SD MET A 48 1.873 -9.239 -52.682 1.00 0.00 S ATOM 181 CE MET A 48 0.395 -10.130 -53.161 1.00 0.00 C ATOM 0 H MET A 48 1.910 -6.039 -49.893 1.00 0.00 H new ATOM 0 HA MET A 48 -0.714 -6.088 -50.906 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.202 -8.268 -50.011 1.00 0.00 H new ATOM 0 HB3 MET A 48 -0.321 -8.596 -50.814 1.00 0.00 H new ATOM 0 HG2 MET A 48 0.433 -7.328 -52.796 1.00 0.00 H new ATOM 0 HG3 MET A 48 1.943 -6.946 -51.992 1.00 0.00 H new ATOM 0 HE1 MET A 48 0.338 -11.066 -52.605 1.00 0.00 H new ATOM 0 HE2 MET A 48 -0.483 -9.523 -52.941 1.00 0.00 H new ATOM 0 HE3 MET A 48 0.429 -10.344 -54.229 1.00 0.00 H new ATOM 191 N GLU A 49 -0.377 -7.073 -47.790 1.00 0.00 N ATOM 192 CA GLU A 49 -1.119 -7.233 -46.544 1.00 0.00 C ATOM 193 C GLU A 49 -2.017 -6.032 -46.280 1.00 0.00 C ATOM 194 O GLU A 49 -3.207 -6.184 -46.001 1.00 0.00 O ATOM 195 CB GLU A 49 -0.156 -7.431 -45.372 1.00 0.00 C ATOM 196 CG GLU A 49 -0.835 -7.557 -44.015 1.00 0.00 C ATOM 197 CD GLU A 49 0.144 -7.674 -42.880 1.00 0.00 C ATOM 198 OE1 GLU A 49 1.293 -7.944 -43.136 1.00 0.00 O ATOM 199 OE2 GLU A 49 -0.258 -7.492 -41.755 1.00 0.00 O ATOM 0 H GLU A 49 0.636 -7.125 -47.686 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.749 -8.117 -46.642 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.437 -8.327 -45.552 1.00 0.00 H new ATOM 0 HB3 GLU A 49 0.537 -6.591 -45.341 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.472 -6.688 -43.851 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -1.485 -8.432 -44.019 1.00 0.00 H new ATOM 206 N VAL A 50 -1.442 -4.838 -46.368 1.00 0.00 N ATOM 207 CA VAL A 50 -2.187 -3.609 -46.128 1.00 0.00 C ATOM 208 C VAL A 50 -3.374 -3.490 -47.075 1.00 0.00 C ATOM 209 O VAL A 50 -4.464 -3.084 -46.672 1.00 0.00 O ATOM 210 CB VAL A 50 -1.269 -2.384 -46.305 1.00 0.00 C ATOM 211 CG1 VAL A 50 -2.085 -1.099 -46.289 1.00 0.00 C ATOM 212 CG2 VAL A 50 -0.213 -2.365 -45.210 1.00 0.00 C ATOM 0 H VAL A 50 -0.460 -4.695 -46.604 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.559 -3.643 -45.104 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.769 -2.454 -47.271 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.420 -0.244 -46.415 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.810 -1.118 -47.103 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.610 -1.013 -45.338 1.00 0.00 H new ATOM 0 HG21 VAL A 50 0.432 -1.496 -45.342 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.700 -2.311 -44.236 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.386 -3.274 -45.267 1.00 0.00 H new ATOM 222 N LEU A 51 -3.156 -3.847 -48.336 1.00 0.00 N ATOM 223 CA LEU A 51 -4.211 -3.792 -49.341 1.00 0.00 C ATOM 224 C LEU A 51 -5.335 -4.767 -49.015 1.00 0.00 C ATOM 225 O LEU A 51 -6.513 -4.423 -49.098 1.00 0.00 O ATOM 226 CB LEU A 51 -3.639 -4.108 -50.729 1.00 0.00 C ATOM 227 CG LEU A 51 -2.721 -3.034 -51.329 1.00 0.00 C ATOM 228 CD1 LEU A 51 -1.925 -3.633 -52.481 1.00 0.00 C ATOM 229 CD2 LEU A 51 -3.558 -1.854 -51.798 1.00 0.00 C ATOM 0 H LEU A 51 -2.257 -4.178 -48.687 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.621 -2.782 -49.339 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.083 -5.043 -50.668 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -4.469 -4.275 -51.415 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.020 -2.679 -50.574 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.273 -2.871 -52.908 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.321 -4.463 -52.113 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.610 -3.995 -53.248 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -2.906 -1.092 -52.224 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.267 -2.189 -52.555 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.102 -1.434 -50.952 1.00 0.00 H new ATOM 241 N SER A 52 -4.962 -5.988 -48.643 1.00 0.00 N ATOM 242 CA SER A 52 -5.938 -7.034 -48.359 1.00 0.00 C ATOM 243 C SER A 52 -6.821 -6.656 -47.176 1.00 0.00 C ATOM 244 O SER A 52 -7.969 -7.093 -47.083 1.00 0.00 O ATOM 245 CB SER A 52 -5.230 -8.344 -48.075 1.00 0.00 C ATOM 246 OG SER A 52 -4.537 -8.287 -46.859 1.00 0.00 O ATOM 0 H SER A 52 -3.990 -6.277 -48.531 1.00 0.00 H new ATOM 0 HA SER A 52 -6.574 -7.149 -49.237 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.957 -9.155 -48.046 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.535 -8.568 -48.884 1.00 0.00 H new ATOM 0 HG SER A 52 -4.244 -7.367 -46.692 1.00 0.00 H new ATOM 252 N LYS A 53 -6.279 -5.844 -46.275 1.00 0.00 N ATOM 253 CA LYS A 53 -6.994 -5.459 -45.064 1.00 0.00 C ATOM 254 C LYS A 53 -7.801 -4.185 -45.282 1.00 0.00 C ATOM 255 O LYS A 53 -8.858 -3.998 -44.679 1.00 0.00 O ATOM 256 CB LYS A 53 -6.017 -5.270 -43.903 1.00 0.00 C ATOM 257 CG LYS A 53 -5.384 -6.559 -43.397 1.00 0.00 C ATOM 258 CD LYS A 53 -4.367 -6.283 -42.299 1.00 0.00 C ATOM 259 CE LYS A 53 -3.846 -7.575 -41.688 1.00 0.00 C ATOM 260 NZ LYS A 53 -2.762 -7.326 -40.699 1.00 0.00 N ATOM 0 H LYS A 53 -5.347 -5.440 -46.361 1.00 0.00 H new ATOM 0 HA LYS A 53 -7.687 -6.263 -44.816 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -5.225 -4.590 -44.217 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -6.541 -4.789 -43.078 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -6.161 -7.223 -43.018 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.898 -7.077 -44.224 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -3.534 -5.710 -42.708 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -4.825 -5.670 -41.523 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -4.666 -8.103 -41.202 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -3.473 -8.226 -42.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -2.634 -8.170 -40.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -1.875 -7.118 -41.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -3.019 -6.516 -40.099 1.00 0.00 H new ATOM 274 N TYR A 54 -7.296 -3.312 -46.146 1.00 0.00 N ATOM 275 CA TYR A 54 -7.946 -2.033 -46.411 1.00 0.00 C ATOM 276 C TYR A 54 -9.189 -2.216 -47.272 1.00 0.00 C ATOM 277 O TYR A 54 -10.313 -2.071 -46.793 1.00 0.00 O ATOM 278 CB TYR A 54 -6.969 -1.067 -47.086 1.00 0.00 C ATOM 279 CG TYR A 54 -6.055 -0.348 -46.119 1.00 0.00 C ATOM 280 CD1 TYR A 54 -5.998 -0.747 -44.792 1.00 0.00 C ATOM 281 CD2 TYR A 54 -5.273 0.708 -46.560 1.00 0.00 C ATOM 282 CE1 TYR A 54 -5.163 -0.091 -43.908 1.00 0.00 C ATOM 283 CE2 TYR A 54 -4.437 1.364 -45.677 1.00 0.00 C ATOM 284 CZ TYR A 54 -4.381 0.968 -44.356 1.00 0.00 C ATOM 285 OH TYR A 54 -3.548 1.621 -43.476 1.00 0.00 O ATOM 0 H TYR A 54 -6.438 -3.466 -46.675 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.256 -1.609 -45.456 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -6.362 -1.621 -47.802 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.536 -0.329 -47.653 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -6.607 -1.571 -44.449 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -5.317 1.018 -47.594 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -5.118 -0.399 -42.874 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -3.827 2.187 -46.020 1.00 0.00 H new ATOM 0 HH TYR A 54 -3.070 2.335 -43.947 1.00 0.00 H new ATOM 295 N VAL A 55 -8.980 -2.534 -48.545 1.00 0.00 N ATOM 296 CA VAL A 55 -10.036 -2.429 -49.544 1.00 0.00 C ATOM 297 C VAL A 55 -10.826 -3.727 -49.651 1.00 0.00 C ATOM 298 O VAL A 55 -11.741 -3.843 -50.465 1.00 0.00 O ATOM 299 CB VAL A 55 -9.437 -2.080 -50.920 1.00 0.00 C ATOM 300 CG1 VAL A 55 -8.642 -0.786 -50.843 1.00 0.00 C ATOM 301 CG2 VAL A 55 -8.558 -3.224 -51.406 1.00 0.00 C ATOM 0 H VAL A 55 -8.087 -2.867 -48.909 1.00 0.00 H new ATOM 0 HA VAL A 55 -10.713 -1.635 -49.228 1.00 0.00 H new ATOM 0 HB VAL A 55 -10.249 -1.935 -51.633 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -8.226 -0.555 -51.824 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -9.297 0.025 -50.527 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -7.831 -0.899 -50.123 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.137 -2.971 -52.379 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -7.750 -3.390 -50.693 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -9.156 -4.131 -51.494 1.00 0.00 H new ATOM 311 N ASN A 56 -10.464 -4.702 -48.824 1.00 0.00 N ATOM 312 CA ASN A 56 -11.170 -5.978 -48.789 1.00 0.00 C ATOM 313 C ASN A 56 -10.914 -6.783 -50.056 1.00 0.00 C ATOM 314 O ASN A 56 -11.735 -6.795 -50.973 1.00 0.00 O ATOM 315 CB ASN A 56 -12.658 -5.759 -48.587 1.00 0.00 C ATOM 316 CG ASN A 56 -13.369 -7.005 -48.138 1.00 0.00 C ATOM 317 OD1 ASN A 56 -12.787 -7.855 -47.454 1.00 0.00 O ATOM 318 ND2 ASN A 56 -14.617 -7.132 -48.510 1.00 0.00 N ATOM 0 H ASN A 56 -9.685 -4.633 -48.169 1.00 0.00 H new ATOM 0 HA ASN A 56 -10.786 -6.551 -47.945 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -12.809 -4.972 -47.848 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -13.100 -5.409 -49.520 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -15.149 -7.958 -48.236 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -15.057 -6.405 -49.074 1.00 0.00 H new ATOM 325 N VAL A 57 -9.770 -7.457 -50.102 1.00 0.00 N ATOM 326 CA VAL A 57 -9.317 -8.118 -51.320 1.00 0.00 C ATOM 327 C VAL A 57 -8.338 -9.241 -51.006 1.00 0.00 C ATOM 328 O VAL A 57 -7.615 -9.188 -50.012 1.00 0.00 O ATOM 329 CB VAL A 57 -8.642 -7.101 -52.261 1.00 0.00 C ATOM 330 CG1 VAL A 57 -7.353 -6.579 -51.644 1.00 0.00 C ATOM 331 CG2 VAL A 57 -8.372 -7.745 -53.612 1.00 0.00 C ATOM 0 H VAL A 57 -9.138 -7.560 -49.308 1.00 0.00 H new ATOM 0 HA VAL A 57 -10.192 -8.545 -51.810 1.00 0.00 H new ATOM 0 HB VAL A 57 -9.313 -6.255 -52.407 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -6.889 -5.862 -52.322 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -7.576 -6.090 -50.695 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -6.669 -7.410 -51.472 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.895 -7.020 -54.272 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.714 -8.604 -53.481 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.313 -8.073 -54.053 1.00 0.00 H new ATOM 341 N SER A 58 -8.319 -10.259 -51.861 1.00 0.00 N ATOM 342 CA SER A 58 -7.432 -11.400 -51.674 1.00 0.00 C ATOM 343 C SER A 58 -6.060 -11.137 -52.284 1.00 0.00 C ATOM 344 O SER A 58 -5.934 -10.381 -53.247 1.00 0.00 O ATOM 345 CB SER A 58 -8.041 -12.642 -52.294 1.00 0.00 C ATOM 346 OG SER A 58 -7.131 -13.709 -52.279 1.00 0.00 O ATOM 0 H SER A 58 -8.909 -10.316 -52.691 1.00 0.00 H new ATOM 0 HA SER A 58 -7.306 -11.556 -50.603 1.00 0.00 H new ATOM 0 HB2 SER A 58 -8.943 -12.921 -51.748 1.00 0.00 H new ATOM 0 HB3 SER A 58 -8.342 -12.430 -53.320 1.00 0.00 H new ATOM 0 HG SER A 58 -7.547 -14.499 -52.682 1.00 0.00 H new ATOM 352 N LEU A 59 -5.036 -11.765 -51.718 1.00 0.00 N ATOM 353 CA LEU A 59 -3.673 -11.608 -52.211 1.00 0.00 C ATOM 354 C LEU A 59 -3.556 -12.061 -53.661 1.00 0.00 C ATOM 355 O LEU A 59 -2.748 -11.531 -54.424 1.00 0.00 O ATOM 356 CB LEU A 59 -2.697 -12.406 -51.338 1.00 0.00 C ATOM 357 CG LEU A 59 -2.565 -11.933 -49.885 1.00 0.00 C ATOM 358 CD1 LEU A 59 -1.663 -12.892 -49.119 1.00 0.00 C ATOM 359 CD2 LEU A 59 -2.005 -10.519 -49.861 1.00 0.00 C ATOM 0 H LEU A 59 -5.124 -12.389 -50.916 1.00 0.00 H new ATOM 0 HA LEU A 59 -3.419 -10.549 -52.160 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.012 -13.450 -51.334 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.712 -12.372 -51.803 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.544 -11.924 -49.405 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.569 -12.556 -48.086 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.096 -13.892 -49.137 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.678 -12.915 -49.584 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.911 -10.182 -48.829 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -1.024 -10.508 -50.337 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.678 -9.852 -50.400 1.00 0.00 H new ATOM 371 N ASP A 60 -4.366 -13.046 -54.035 1.00 0.00 N ATOM 372 CA ASP A 60 -4.361 -13.566 -55.396 1.00 0.00 C ATOM 373 C ASP A 60 -4.884 -12.532 -56.384 1.00 0.00 C ATOM 374 O ASP A 60 -4.652 -12.636 -57.588 1.00 0.00 O ATOM 375 CB ASP A 60 -5.205 -14.840 -55.487 1.00 0.00 C ATOM 376 CG ASP A 60 -4.557 -16.032 -54.794 1.00 0.00 C ATOM 377 OD1 ASP A 60 -3.384 -15.965 -54.515 1.00 0.00 O ATOM 378 OD2 ASP A 60 -5.242 -16.995 -54.550 1.00 0.00 O ATOM 0 H ASP A 60 -5.035 -13.500 -53.413 1.00 0.00 H new ATOM 0 HA ASP A 60 -3.329 -13.800 -55.656 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -6.182 -14.655 -55.042 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -5.374 -15.084 -56.536 1.00 0.00 H new ATOM 383 N ASN A 61 -5.592 -11.533 -55.867 1.00 0.00 N ATOM 384 CA ASN A 61 -6.160 -10.483 -56.704 1.00 0.00 C ATOM 385 C ASN A 61 -5.282 -9.238 -56.697 1.00 0.00 C ATOM 386 O ASN A 61 -5.686 -8.180 -57.179 1.00 0.00 O ATOM 387 CB ASN A 61 -7.570 -10.145 -56.255 1.00 0.00 C ATOM 388 CG ASN A 61 -8.544 -11.258 -56.525 1.00 0.00 C ATOM 389 OD1 ASN A 61 -8.436 -11.963 -57.534 1.00 0.00 O ATOM 390 ND2 ASN A 61 -9.495 -11.427 -55.642 1.00 0.00 N ATOM 0 H ASN A 61 -5.786 -11.429 -54.871 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.203 -10.857 -57.727 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -7.564 -9.923 -55.188 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -7.904 -9.242 -56.767 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -10.187 -12.165 -55.772 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -9.545 -10.820 -54.824 1.00 0.00 H new ATOM 397 N ILE A 62 -4.079 -9.371 -56.147 1.00 0.00 N ATOM 398 CA ILE A 62 -3.121 -8.273 -56.127 1.00 0.00 C ATOM 399 C ILE A 62 -1.878 -8.612 -56.941 1.00 0.00 C ATOM 400 O ILE A 62 -1.170 -9.573 -56.640 1.00 0.00 O ATOM 401 CB ILE A 62 -2.712 -7.928 -54.684 1.00 0.00 C ATOM 402 CG1 ILE A 62 -3.940 -7.537 -53.859 1.00 0.00 C ATOM 403 CG2 ILE A 62 -1.682 -6.808 -54.676 1.00 0.00 C ATOM 404 CD1 ILE A 62 -3.665 -7.403 -52.379 1.00 0.00 C ATOM 0 H ILE A 62 -3.745 -10.230 -55.709 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.609 -7.408 -56.576 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.262 -8.811 -54.231 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -4.331 -6.591 -54.233 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -4.719 -8.285 -54.008 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -1.404 -6.577 -53.648 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.797 -7.123 -55.229 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -2.106 -5.920 -55.146 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -4.583 -7.124 -51.862 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -3.304 -8.354 -51.989 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.910 -6.634 -52.217 1.00 0.00 H new ATOM 416 N ARG A 63 -1.619 -7.818 -57.974 1.00 0.00 N ATOM 417 CA ARG A 63 -0.467 -8.040 -58.841 1.00 0.00 C ATOM 418 C ARG A 63 0.641 -7.035 -58.553 1.00 0.00 C ATOM 419 O ARG A 63 0.445 -5.826 -58.678 1.00 0.00 O ATOM 420 CB ARG A 63 -0.872 -7.938 -60.304 1.00 0.00 C ATOM 421 CG ARG A 63 0.263 -8.134 -61.296 1.00 0.00 C ATOM 422 CD ARG A 63 -0.211 -8.029 -62.700 1.00 0.00 C ATOM 423 NE ARG A 63 0.878 -8.177 -63.653 1.00 0.00 N ATOM 424 CZ ARG A 63 0.738 -8.110 -64.991 1.00 0.00 C ATOM 425 NH1 ARG A 63 -0.447 -7.898 -65.518 1.00 0.00 N ATOM 426 NH2 ARG A 63 1.793 -8.258 -65.774 1.00 0.00 N ATOM 0 H ARG A 63 -2.192 -7.014 -58.232 1.00 0.00 H new ATOM 0 HA ARG A 63 -0.092 -9.043 -58.638 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -1.644 -8.681 -60.505 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -1.320 -6.959 -60.475 1.00 0.00 H new ATOM 0 HG2 ARG A 63 1.037 -7.387 -61.116 1.00 0.00 H new ATOM 0 HG3 ARG A 63 0.720 -9.111 -61.138 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -0.964 -8.795 -62.887 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -0.695 -7.064 -62.849 1.00 0.00 H new ATOM 0 HE ARG A 63 1.813 -8.343 -63.282 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -1.261 -7.784 -64.914 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -0.553 -7.847 -66.531 1.00 0.00 H new ATOM 0 HH21 ARG A 63 2.713 -8.423 -65.365 1.00 0.00 H new ATOM 0 HH22 ARG A 63 1.687 -8.207 -66.787 1.00 0.00 H new ATOM 440 N ILE A 64 1.807 -7.543 -58.166 1.00 0.00 N ATOM 441 CA ILE A 64 2.950 -6.691 -57.859 1.00 0.00 C ATOM 442 C ILE A 64 4.047 -6.845 -58.904 1.00 0.00 C ATOM 443 O ILE A 64 4.482 -7.957 -59.203 1.00 0.00 O ATOM 444 CB ILE A 64 3.518 -7.015 -56.466 1.00 0.00 C ATOM 445 CG1 ILE A 64 2.409 -6.964 -55.412 1.00 0.00 C ATOM 446 CG2 ILE A 64 4.637 -6.048 -56.110 1.00 0.00 C ATOM 447 CD1 ILE A 64 1.753 -5.610 -55.279 1.00 0.00 C ATOM 0 H ILE A 64 1.985 -8.541 -58.058 1.00 0.00 H new ATOM 0 HA ILE A 64 2.598 -5.659 -57.869 1.00 0.00 H new ATOM 0 HB ILE A 64 3.929 -8.024 -56.486 1.00 0.00 H new ATOM 0 HG12 ILE A 64 1.648 -7.702 -55.664 1.00 0.00 H new ATOM 0 HG13 ILE A 64 2.825 -7.252 -54.447 1.00 0.00 H new ATOM 0 HG21 ILE A 64 5.027 -6.291 -55.122 1.00 0.00 H new ATOM 0 HG22 ILE A 64 5.437 -6.130 -56.846 1.00 0.00 H new ATOM 0 HG23 ILE A 64 4.250 -5.029 -56.106 1.00 0.00 H new ATOM 0 HD11 ILE A 64 0.979 -5.655 -54.513 1.00 0.00 H new ATOM 0 HD12 ILE A 64 2.501 -4.870 -54.996 1.00 0.00 H new ATOM 0 HD13 ILE A 64 1.305 -5.327 -56.232 1.00 0.00 H new ATOM 459 N SER A 65 4.491 -5.722 -59.458 1.00 0.00 N ATOM 460 CA SER A 65 5.539 -5.730 -60.471 1.00 0.00 C ATOM 461 C SER A 65 6.450 -4.515 -60.332 1.00 0.00 C ATOM 462 O SER A 65 6.007 -3.439 -59.932 1.00 0.00 O ATOM 463 CB SER A 65 4.927 -5.757 -61.857 1.00 0.00 C ATOM 464 OG SER A 65 5.919 -5.740 -62.846 1.00 0.00 O ATOM 0 H SER A 65 4.141 -4.794 -59.222 1.00 0.00 H new ATOM 0 HA SER A 65 6.140 -6.627 -60.324 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.312 -6.650 -61.969 1.00 0.00 H new ATOM 0 HB3 SER A 65 4.268 -4.898 -61.984 1.00 0.00 H new ATOM 0 HG SER A 65 5.499 -5.760 -63.731 1.00 0.00 H new ATOM 470 N GLN A 66 7.724 -4.696 -60.664 1.00 0.00 N ATOM 471 CA GLN A 66 8.697 -3.614 -60.582 1.00 0.00 C ATOM 472 C GLN A 66 9.554 -3.548 -61.840 1.00 0.00 C ATOM 473 O GLN A 66 10.031 -4.570 -62.332 1.00 0.00 O ATOM 474 CB GLN A 66 9.589 -3.787 -59.350 1.00 0.00 C ATOM 475 CG GLN A 66 10.591 -2.664 -59.144 1.00 0.00 C ATOM 476 CD GLN A 66 11.381 -2.822 -57.859 1.00 0.00 C ATOM 477 OE1 GLN A 66 10.962 -3.528 -56.938 1.00 0.00 O ATOM 478 NE2 GLN A 66 12.532 -2.164 -57.789 1.00 0.00 N ATOM 0 H GLN A 66 8.106 -5.583 -60.993 1.00 0.00 H new ATOM 0 HA GLN A 66 8.146 -2.678 -60.493 1.00 0.00 H new ATOM 0 HB2 GLN A 66 8.957 -3.862 -58.465 1.00 0.00 H new ATOM 0 HB3 GLN A 66 10.129 -4.730 -59.436 1.00 0.00 H new ATOM 0 HG2 GLN A 66 11.279 -2.635 -59.989 1.00 0.00 H new ATOM 0 HG3 GLN A 66 10.065 -1.710 -59.129 1.00 0.00 H new ATOM 0 HE21 GLN A 66 12.841 -1.591 -58.575 1.00 0.00 H new ATOM 0 HE22 GLN A 66 13.108 -2.231 -56.950 1.00 0.00 H new ATOM 487 N GLU A 67 9.746 -2.338 -62.356 1.00 0.00 N ATOM 488 CA GLU A 67 10.450 -2.147 -63.619 1.00 0.00 C ATOM 489 C GLU A 67 11.262 -0.859 -63.607 1.00 0.00 C ATOM 490 O GLU A 67 10.828 0.155 -63.061 1.00 0.00 O ATOM 491 CB GLU A 67 9.458 -2.125 -64.784 1.00 0.00 C ATOM 492 CG GLU A 67 10.106 -2.058 -66.160 1.00 0.00 C ATOM 493 CD GLU A 67 9.108 -2.152 -67.281 1.00 0.00 C ATOM 494 OE1 GLU A 67 7.933 -2.173 -67.005 1.00 0.00 O ATOM 495 OE2 GLU A 67 9.523 -2.203 -68.415 1.00 0.00 O ATOM 0 H GLU A 67 9.424 -1.475 -61.919 1.00 0.00 H new ATOM 0 HA GLU A 67 11.136 -2.984 -63.748 1.00 0.00 H new ATOM 0 HB2 GLU A 67 8.835 -3.018 -64.732 1.00 0.00 H new ATOM 0 HB3 GLU A 67 8.796 -1.267 -64.665 1.00 0.00 H new ATOM 0 HG2 GLU A 67 10.660 -1.123 -66.250 1.00 0.00 H new ATOM 0 HG3 GLU A 67 10.830 -2.868 -66.255 1.00 0.00 H new ATOM 502 N LYS A 68 12.445 -0.906 -64.211 1.00 0.00 N ATOM 503 CA LYS A 68 13.324 0.256 -64.267 1.00 0.00 C ATOM 504 C LYS A 68 12.996 1.137 -65.466 1.00 0.00 C ATOM 505 O LYS A 68 12.949 0.664 -66.602 1.00 0.00 O ATOM 506 CB LYS A 68 14.788 -0.182 -64.321 1.00 0.00 C ATOM 507 CG LYS A 68 15.790 0.944 -64.100 1.00 0.00 C ATOM 508 CD LYS A 68 17.220 0.445 -64.236 1.00 0.00 C ATOM 509 CE LYS A 68 17.540 -0.613 -63.191 1.00 0.00 C ATOM 510 NZ LYS A 68 17.540 -0.052 -61.813 1.00 0.00 N ATOM 0 H LYS A 68 12.817 -1.738 -64.669 1.00 0.00 H new ATOM 0 HA LYS A 68 13.163 0.840 -63.361 1.00 0.00 H new ATOM 0 HB2 LYS A 68 14.952 -0.952 -63.567 1.00 0.00 H new ATOM 0 HB3 LYS A 68 14.982 -0.640 -65.291 1.00 0.00 H new ATOM 0 HG2 LYS A 68 15.610 1.741 -64.822 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.645 1.373 -63.109 1.00 0.00 H new ATOM 0 HD2 LYS A 68 17.369 0.031 -65.233 1.00 0.00 H new ATOM 0 HD3 LYS A 68 17.911 1.282 -64.132 1.00 0.00 H new ATOM 0 HE2 LYS A 68 16.808 -1.419 -63.255 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.515 -1.050 -63.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.118 -0.655 -61.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.937 0.909 -61.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.565 -0.018 -61.452 1.00 0.00 H new ATOM 524 N GLN A 69 12.770 2.420 -65.207 1.00 0.00 N ATOM 525 CA GLN A 69 12.359 3.352 -66.250 1.00 0.00 C ATOM 526 C GLN A 69 12.957 4.735 -66.019 1.00 0.00 C ATOM 527 O GLN A 69 12.773 5.331 -64.958 1.00 0.00 O ATOM 528 CB GLN A 69 10.833 3.446 -66.316 1.00 0.00 C ATOM 529 CG GLN A 69 10.312 4.376 -67.398 1.00 0.00 C ATOM 530 CD GLN A 69 10.533 3.822 -68.793 1.00 0.00 C ATOM 531 OE1 GLN A 69 10.108 2.708 -69.108 1.00 0.00 O ATOM 532 NE2 GLN A 69 11.200 4.599 -69.638 1.00 0.00 N ATOM 0 H GLN A 69 12.865 2.839 -64.282 1.00 0.00 H new ATOM 0 HA GLN A 69 12.732 2.972 -67.201 1.00 0.00 H new ATOM 0 HB2 GLN A 69 10.426 2.449 -66.483 1.00 0.00 H new ATOM 0 HB3 GLN A 69 10.459 3.785 -65.350 1.00 0.00 H new ATOM 0 HG2 GLN A 69 9.247 4.548 -67.243 1.00 0.00 H new ATOM 0 HG3 GLN A 69 10.807 5.343 -67.311 1.00 0.00 H new ATOM 0 HE21 GLN A 69 11.534 5.514 -69.335 1.00 0.00 H new ATOM 0 HE22 GLN A 69 11.379 4.281 -70.591 1.00 0.00 H new ATOM 541 N ASP A 70 13.671 5.240 -67.019 1.00 0.00 N ATOM 542 CA ASP A 70 14.232 6.584 -66.957 1.00 0.00 C ATOM 543 C ASP A 70 15.218 6.717 -65.804 1.00 0.00 C ATOM 544 O ASP A 70 15.349 7.784 -65.205 1.00 0.00 O ATOM 545 CB ASP A 70 13.119 7.624 -66.806 1.00 0.00 C ATOM 546 CG ASP A 70 12.154 7.633 -67.984 1.00 0.00 C ATOM 547 OD1 ASP A 70 12.524 7.164 -69.034 1.00 0.00 O ATOM 548 OD2 ASP A 70 11.056 8.111 -67.822 1.00 0.00 O ATOM 0 H ASP A 70 13.875 4.738 -67.883 1.00 0.00 H new ATOM 0 HA ASP A 70 14.765 6.762 -67.891 1.00 0.00 H new ATOM 0 HB2 ASP A 70 12.564 7.425 -65.889 1.00 0.00 H new ATOM 0 HB3 ASP A 70 13.565 8.613 -66.700 1.00 0.00 H new ATOM 553 N GLY A 71 15.911 5.625 -65.496 1.00 0.00 N ATOM 554 CA GLY A 71 16.996 5.655 -64.522 1.00 0.00 C ATOM 555 C GLY A 71 16.477 5.393 -63.113 1.00 0.00 C ATOM 556 O GLY A 71 17.255 5.292 -62.164 1.00 0.00 O ATOM 0 H GLY A 71 15.740 4.708 -65.908 1.00 0.00 H new ATOM 0 HA2 GLY A 71 17.743 4.906 -64.783 1.00 0.00 H new ATOM 0 HA3 GLY A 71 17.492 6.625 -64.556 1.00 0.00 H new ATOM 560 N MET A 72 15.160 5.285 -62.984 1.00 0.00 N ATOM 561 CA MET A 72 14.532 5.088 -61.683 1.00 0.00 C ATOM 562 C MET A 72 13.730 3.793 -61.648 1.00 0.00 C ATOM 563 O MET A 72 13.311 3.283 -62.687 1.00 0.00 O ATOM 564 CB MET A 72 13.636 6.278 -61.344 1.00 0.00 C ATOM 565 CG MET A 72 14.370 7.606 -61.231 1.00 0.00 C ATOM 566 SD MET A 72 13.248 9.015 -61.127 1.00 0.00 S ATOM 567 CE MET A 72 12.688 9.127 -62.824 1.00 0.00 C ATOM 0 H MET A 72 14.506 5.331 -63.765 1.00 0.00 H new ATOM 0 HA MET A 72 15.321 5.014 -60.934 1.00 0.00 H new ATOM 0 HB2 MET A 72 12.866 6.367 -62.110 1.00 0.00 H new ATOM 0 HB3 MET A 72 13.127 6.077 -60.401 1.00 0.00 H new ATOM 0 HG2 MET A 72 15.009 7.589 -60.348 1.00 0.00 H new ATOM 0 HG3 MET A 72 15.023 7.730 -62.095 1.00 0.00 H new ATOM 0 HE1 MET A 72 12.207 10.092 -62.985 1.00 0.00 H new ATOM 0 HE2 MET A 72 13.541 9.030 -63.496 1.00 0.00 H new ATOM 0 HE3 MET A 72 11.975 8.328 -63.025 1.00 0.00 H new ATOM 577 N ASP A 73 13.520 3.265 -60.447 1.00 0.00 N ATOM 578 CA ASP A 73 12.765 2.029 -60.275 1.00 0.00 C ATOM 579 C ASP A 73 11.312 2.317 -59.922 1.00 0.00 C ATOM 580 O ASP A 73 11.025 3.023 -58.955 1.00 0.00 O ATOM 581 CB ASP A 73 13.398 1.161 -59.185 1.00 0.00 C ATOM 582 CG ASP A 73 14.743 0.579 -59.598 1.00 0.00 C ATOM 583 OD1 ASP A 73 15.037 0.584 -60.770 1.00 0.00 O ATOM 584 OD2 ASP A 73 15.465 0.135 -58.737 1.00 0.00 O ATOM 0 H ASP A 73 13.862 3.674 -59.578 1.00 0.00 H new ATOM 0 HA ASP A 73 12.791 1.491 -61.222 1.00 0.00 H new ATOM 0 HB2 ASP A 73 13.528 1.758 -58.282 1.00 0.00 H new ATOM 0 HB3 ASP A 73 12.717 0.347 -58.934 1.00 0.00 H new ATOM 589 N VAL A 74 10.397 1.766 -60.712 1.00 0.00 N ATOM 590 CA VAL A 74 8.972 2.017 -60.525 1.00 0.00 C ATOM 591 C VAL A 74 8.258 0.775 -60.007 1.00 0.00 C ATOM 592 O VAL A 74 8.320 -0.291 -60.620 1.00 0.00 O ATOM 593 CB VAL A 74 8.328 2.459 -61.853 1.00 0.00 C ATOM 594 CG1 VAL A 74 6.835 2.686 -61.671 1.00 0.00 C ATOM 595 CG2 VAL A 74 9.007 3.720 -62.364 1.00 0.00 C ATOM 0 H VAL A 74 10.617 1.142 -61.489 1.00 0.00 H new ATOM 0 HA VAL A 74 8.870 2.812 -59.787 1.00 0.00 H new ATOM 0 HB VAL A 74 8.462 1.668 -62.591 1.00 0.00 H new ATOM 0 HG11 VAL A 74 6.396 2.998 -62.619 1.00 0.00 H new ATOM 0 HG12 VAL A 74 6.364 1.760 -61.340 1.00 0.00 H new ATOM 0 HG13 VAL A 74 6.674 3.463 -60.924 1.00 0.00 H new ATOM 0 HG21 VAL A 74 8.546 4.026 -63.303 1.00 0.00 H new ATOM 0 HG22 VAL A 74 8.896 4.517 -61.628 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.066 3.522 -62.527 1.00 0.00 H new ATOM 605 N LEU A 75 7.581 0.919 -58.873 1.00 0.00 N ATOM 606 CA LEU A 75 6.784 -0.166 -58.314 1.00 0.00 C ATOM 607 C LEU A 75 5.319 -0.037 -58.712 1.00 0.00 C ATOM 608 O LEU A 75 4.717 1.027 -58.564 1.00 0.00 O ATOM 609 CB LEU A 75 6.905 -0.179 -56.785 1.00 0.00 C ATOM 610 CG LEU A 75 6.077 -1.249 -56.061 1.00 0.00 C ATOM 611 CD1 LEU A 75 6.594 -2.631 -56.432 1.00 0.00 C ATOM 612 CD2 LEU A 75 6.154 -1.021 -54.559 1.00 0.00 C ATOM 0 H LEU A 75 7.568 1.778 -58.323 1.00 0.00 H new ATOM 0 HA LEU A 75 7.168 -1.103 -58.716 1.00 0.00 H new ATOM 0 HB2 LEU A 75 7.954 -0.319 -56.523 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.610 0.800 -56.407 1.00 0.00 H new ATOM 0 HG LEU A 75 5.033 -1.180 -56.366 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.005 -3.390 -55.917 1.00 0.00 H new ATOM 0 HD12 LEU A 75 6.509 -2.774 -57.509 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.639 -2.720 -56.136 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.566 -1.781 -54.045 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.193 -1.085 -54.234 1.00 0.00 H new ATOM 0 HD23 LEU A 75 5.759 -0.034 -54.320 1.00 0.00 H new ATOM 624 N GLU A 76 4.750 -1.126 -59.218 1.00 0.00 N ATOM 625 CA GLU A 76 3.381 -1.112 -59.718 1.00 0.00 C ATOM 626 C GLU A 76 2.506 -2.097 -58.953 1.00 0.00 C ATOM 627 O GLU A 76 2.832 -3.280 -58.846 1.00 0.00 O ATOM 628 CB GLU A 76 3.354 -1.445 -61.211 1.00 0.00 C ATOM 629 CG GLU A 76 1.962 -1.468 -61.826 1.00 0.00 C ATOM 630 CD GLU A 76 1.977 -1.777 -63.297 1.00 0.00 C ATOM 631 OE1 GLU A 76 2.943 -1.449 -63.943 1.00 0.00 O ATOM 632 OE2 GLU A 76 1.021 -2.341 -63.775 1.00 0.00 O ATOM 0 H GLU A 76 5.217 -2.030 -59.293 1.00 0.00 H new ATOM 0 HA GLU A 76 2.982 -0.109 -59.568 1.00 0.00 H new ATOM 0 HB2 GLU A 76 3.961 -0.714 -61.745 1.00 0.00 H new ATOM 0 HB3 GLU A 76 3.821 -2.418 -61.362 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.355 -2.212 -61.310 1.00 0.00 H new ATOM 0 HG3 GLU A 76 1.484 -0.501 -61.668 1.00 0.00 H new ATOM 639 N LEU A 77 1.392 -1.603 -58.422 1.00 0.00 N ATOM 640 CA LEU A 77 0.431 -2.454 -57.730 1.00 0.00 C ATOM 641 C LEU A 77 -0.934 -2.406 -58.406 1.00 0.00 C ATOM 642 O LEU A 77 -1.490 -1.331 -58.628 1.00 0.00 O ATOM 643 CB LEU A 77 0.298 -2.019 -56.265 1.00 0.00 C ATOM 644 CG LEU A 77 1.587 -2.074 -55.435 1.00 0.00 C ATOM 645 CD1 LEU A 77 2.354 -0.769 -55.604 1.00 0.00 C ATOM 646 CD2 LEU A 77 1.241 -2.319 -53.974 1.00 0.00 C ATOM 0 H LEU A 77 1.133 -0.617 -58.458 1.00 0.00 H new ATOM 0 HA LEU A 77 0.800 -3.479 -57.772 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.084 -0.998 -56.241 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.449 -2.650 -55.784 1.00 0.00 H new ATOM 0 HG LEU A 77 2.218 -2.893 -55.780 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.270 -0.807 -55.015 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.604 -0.628 -56.655 1.00 0.00 H new ATOM 0 HD13 LEU A 77 1.737 0.062 -55.263 1.00 0.00 H new ATOM 0 HD21 LEU A 77 2.157 -2.358 -53.385 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.609 -1.509 -53.609 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.709 -3.265 -53.880 1.00 0.00 H new ATOM 658 N ASN A 78 -1.467 -3.578 -58.732 1.00 0.00 N ATOM 659 CA ASN A 78 -2.786 -3.675 -59.348 1.00 0.00 C ATOM 660 C ASN A 78 -3.731 -4.513 -58.498 1.00 0.00 C ATOM 661 O ASN A 78 -3.509 -5.707 -58.299 1.00 0.00 O ATOM 662 CB ASN A 78 -2.679 -4.246 -60.750 1.00 0.00 C ATOM 663 CG ASN A 78 -1.918 -3.347 -61.685 1.00 0.00 C ATOM 664 OD1 ASN A 78 -2.343 -2.220 -61.965 1.00 0.00 O ATOM 665 ND2 ASN A 78 -0.801 -3.823 -62.173 1.00 0.00 N ATOM 0 H ASN A 78 -1.006 -4.475 -58.580 1.00 0.00 H new ATOM 0 HA ASN A 78 -3.200 -2.669 -59.414 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.187 -5.218 -60.706 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -3.680 -4.413 -61.147 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -0.242 -3.258 -62.812 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.489 -4.759 -61.914 1.00 0.00 H new ATOM 672 N ILE A 79 -4.787 -3.880 -57.997 1.00 0.00 N ATOM 673 CA ILE A 79 -5.718 -4.542 -57.091 1.00 0.00 C ATOM 674 C ILE A 79 -7.103 -4.661 -57.715 1.00 0.00 C ATOM 675 O ILE A 79 -7.762 -3.656 -57.981 1.00 0.00 O ATOM 676 CB ILE A 79 -5.819 -3.781 -55.756 1.00 0.00 C ATOM 677 CG1 ILE A 79 -4.438 -3.656 -55.108 1.00 0.00 C ATOM 678 CG2 ILE A 79 -6.789 -4.483 -54.817 1.00 0.00 C ATOM 679 CD1 ILE A 79 -3.697 -2.395 -55.490 1.00 0.00 C ATOM 0 H ILE A 79 -5.019 -2.909 -58.204 1.00 0.00 H new ATOM 0 HA ILE A 79 -5.331 -5.543 -56.902 1.00 0.00 H new ATOM 0 HB ILE A 79 -6.198 -2.779 -55.955 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.551 -3.686 -54.024 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -3.835 -4.520 -55.389 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -6.849 -3.933 -53.878 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -7.776 -4.524 -55.278 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -6.438 -5.496 -54.622 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.728 -2.378 -54.992 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -3.551 -2.372 -56.570 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.278 -1.525 -55.184 1.00 0.00 H new ATOM 691 N THR A 80 -7.538 -5.895 -57.946 1.00 0.00 N ATOM 692 CA THR A 80 -8.862 -6.148 -58.503 1.00 0.00 C ATOM 693 C THR A 80 -9.906 -6.283 -57.402 1.00 0.00 C ATOM 694 O THR A 80 -9.798 -7.151 -56.535 1.00 0.00 O ATOM 695 CB THR A 80 -8.862 -7.417 -59.375 1.00 0.00 C ATOM 696 OG1 THR A 80 -7.945 -7.251 -60.465 1.00 0.00 O ATOM 697 CG2 THR A 80 -10.255 -7.686 -59.925 1.00 0.00 C ATOM 0 H THR A 80 -6.993 -6.736 -57.756 1.00 0.00 H new ATOM 0 HA THR A 80 -9.120 -5.292 -59.126 1.00 0.00 H new ATOM 0 HB THR A 80 -8.556 -8.263 -58.760 1.00 0.00 H new ATOM 0 HG1 THR A 80 -7.945 -8.060 -61.018 1.00 0.00 H new ATOM 0 HG21 THR A 80 -10.236 -8.586 -60.539 1.00 0.00 H new ATOM 0 HG22 THR A 80 -10.952 -7.825 -59.099 1.00 0.00 H new ATOM 0 HG23 THR A 80 -10.576 -6.840 -60.532 1.00 0.00 H new ATOM 705 N LEU A 81 -10.916 -5.421 -57.442 1.00 0.00 N ATOM 706 CA LEU A 81 -11.952 -5.407 -56.416 1.00 0.00 C ATOM 707 C LEU A 81 -13.342 -5.395 -57.037 1.00 0.00 C ATOM 708 O LEU A 81 -14.111 -6.286 -56.803 1.00 0.00 O ATOM 709 CB LEU A 81 -11.780 -4.183 -55.508 1.00 0.00 C ATOM 710 CG LEU A 81 -12.839 -4.013 -54.411 1.00 0.00 C ATOM 711 CD1 LEU A 81 -12.735 -5.166 -53.421 1.00 0.00 C ATOM 712 CD2 LEU A 81 -12.642 -2.675 -53.716 1.00 0.00 C ATOM 0 H LEU A 81 -11.039 -4.722 -58.175 1.00 0.00 H new ATOM 0 HA LEU A 81 -11.849 -6.316 -55.823 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -10.800 -4.240 -55.035 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -11.782 -3.289 -56.131 1.00 0.00 H new ATOM 0 HG LEU A 81 -13.836 -4.027 -54.851 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -13.487 -5.045 -52.642 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -12.900 -6.109 -53.942 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -11.743 -5.170 -52.970 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -13.395 -2.555 -52.937 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -11.648 -2.640 -53.269 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -12.741 -1.869 -54.443 1.00 0.00 H new ATOM 725 N ASP B 38 -16.015 8.040 -50.860 1.00 0.00 N ATOM 726 CA ASP B 38 -15.477 8.516 -49.592 1.00 0.00 C ATOM 727 C ASP B 38 -14.751 7.403 -48.848 1.00 0.00 C ATOM 728 O ASP B 38 -13.934 7.663 -47.965 1.00 0.00 O ATOM 729 CB ASP B 38 -16.595 9.081 -48.712 1.00 0.00 C ATOM 730 CG ASP B 38 -17.240 10.329 -49.301 1.00 0.00 C ATOM 731 OD1 ASP B 38 -16.520 11.191 -49.748 1.00 0.00 O ATOM 732 OD2 ASP B 38 -18.445 10.408 -49.299 1.00 0.00 O ATOM 0 HA ASP B 38 -14.761 9.307 -49.814 1.00 0.00 H new ATOM 0 HB2 ASP B 38 -17.359 8.317 -48.568 1.00 0.00 H new ATOM 0 HB3 ASP B 38 -16.191 9.317 -47.727 1.00 0.00 H new ATOM 737 N TYR B 39 -15.055 6.161 -49.210 1.00 0.00 N ATOM 738 CA TYR B 39 -14.494 5.004 -48.523 1.00 0.00 C ATOM 739 C TYR B 39 -13.124 4.643 -49.083 1.00 0.00 C ATOM 740 O TYR B 39 -12.119 4.690 -48.371 1.00 0.00 O ATOM 741 CB TYR B 39 -15.442 3.807 -48.628 1.00 0.00 C ATOM 742 CG TYR B 39 -14.922 2.556 -47.955 1.00 0.00 C ATOM 743 CD1 TYR B 39 -14.863 2.486 -46.571 1.00 0.00 C ATOM 744 CD2 TYR B 39 -14.504 1.479 -48.721 1.00 0.00 C ATOM 745 CE1 TYR B 39 -14.389 1.344 -45.956 1.00 0.00 C ATOM 746 CE2 TYR B 39 -14.029 0.336 -48.107 1.00 0.00 C ATOM 747 CZ TYR B 39 -13.971 0.267 -46.730 1.00 0.00 C ATOM 748 OH TYR B 39 -13.499 -0.871 -46.117 1.00 0.00 O ATOM 0 H TYR B 39 -15.688 5.930 -49.976 1.00 0.00 H new ATOM 0 HA TYR B 39 -14.372 5.265 -47.472 1.00 0.00 H new ATOM 0 HB2 TYR B 39 -16.401 4.075 -48.185 1.00 0.00 H new ATOM 0 HB3 TYR B 39 -15.626 3.592 -49.681 1.00 0.00 H new ATOM 0 HD1 TYR B 39 -15.188 3.325 -45.974 1.00 0.00 H new ATOM 0 HD2 TYR B 39 -14.550 1.533 -49.799 1.00 0.00 H new ATOM 0 HE1 TYR B 39 -14.343 1.288 -44.878 1.00 0.00 H new ATOM 0 HE2 TYR B 39 -13.703 -0.503 -48.704 1.00 0.00 H new ATOM 0 HH TYR B 39 -13.249 -1.530 -46.798 1.00 0.00 H new ATOM 758 N LEU B 40 -13.088 4.282 -50.361 1.00 0.00 N ATOM 759 CA LEU B 40 -11.859 3.817 -50.992 1.00 0.00 C ATOM 760 C LEU B 40 -10.860 4.955 -51.159 1.00 0.00 C ATOM 761 O LEU B 40 -9.664 4.783 -50.925 1.00 0.00 O ATOM 762 CB LEU B 40 -12.168 3.195 -52.360 1.00 0.00 C ATOM 763 CG LEU B 40 -12.938 1.868 -52.328 1.00 0.00 C ATOM 764 CD1 LEU B 40 -13.295 1.454 -53.749 1.00 0.00 C ATOM 765 CD2 LEU B 40 -12.091 0.805 -51.645 1.00 0.00 C ATOM 0 H LEU B 40 -13.898 4.303 -50.981 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.415 3.062 -50.343 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -12.743 3.914 -52.944 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -11.227 3.036 -52.887 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.862 1.987 -51.762 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -13.842 0.511 -53.727 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.917 2.224 -54.207 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -12.382 1.330 -54.332 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -12.638 -0.137 -51.622 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -11.161 0.671 -52.197 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.866 1.118 -50.626 1.00 0.00 H new ATOM 777 N PRO B 41 -11.359 6.118 -51.564 1.00 0.00 N ATOM 778 CA PRO B 41 -10.521 7.303 -51.707 1.00 0.00 C ATOM 779 C PRO B 41 -9.698 7.549 -50.449 1.00 0.00 C ATOM 780 O PRO B 41 -8.520 7.901 -50.525 1.00 0.00 O ATOM 781 CB PRO B 41 -11.541 8.421 -51.942 1.00 0.00 C ATOM 782 CG PRO B 41 -12.665 7.746 -52.652 1.00 0.00 C ATOM 783 CD PRO B 41 -12.790 6.409 -51.970 1.00 0.00 C ATOM 0 HA PRO B 41 -9.790 7.221 -52.511 1.00 0.00 H new ATOM 0 HB2 PRO B 41 -11.872 8.863 -51.002 1.00 0.00 H new ATOM 0 HB3 PRO B 41 -11.118 9.227 -52.542 1.00 0.00 H new ATOM 0 HG2 PRO B 41 -13.588 8.321 -52.572 1.00 0.00 H new ATOM 0 HG3 PRO B 41 -12.452 7.632 -53.715 1.00 0.00 H new ATOM 0 HD2 PRO B 41 -13.456 6.453 -51.108 1.00 0.00 H new ATOM 0 HD3 PRO B 41 -13.186 5.646 -52.640 1.00 0.00 H new ATOM 791 N THR B 42 -10.323 7.363 -49.292 1.00 0.00 N ATOM 792 CA THR B 42 -9.641 7.534 -48.015 1.00 0.00 C ATOM 793 C THR B 42 -8.576 6.463 -47.813 1.00 0.00 C ATOM 794 O THR B 42 -7.456 6.760 -47.396 1.00 0.00 O ATOM 795 CB THR B 42 -10.639 7.497 -46.843 1.00 0.00 C ATOM 796 OG1 THR B 42 -11.578 8.573 -46.978 1.00 0.00 O ATOM 797 CG2 THR B 42 -9.910 7.630 -45.516 1.00 0.00 C ATOM 0 H THR B 42 -11.303 7.093 -49.212 1.00 0.00 H new ATOM 0 HA THR B 42 -9.158 8.511 -48.035 1.00 0.00 H new ATOM 0 HB THR B 42 -11.164 6.542 -46.863 1.00 0.00 H new ATOM 0 HG1 THR B 42 -12.387 8.247 -47.425 1.00 0.00 H new ATOM 0 HG21 THR B 42 -10.632 7.602 -44.700 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.204 6.807 -45.405 1.00 0.00 H new ATOM 0 HG23 THR B 42 -9.371 8.577 -45.491 1.00 0.00 H new ATOM 805 N LEU B 43 -8.931 5.219 -48.110 1.00 0.00 N ATOM 806 CA LEU B 43 -7.989 4.110 -48.015 1.00 0.00 C ATOM 807 C LEU B 43 -6.821 4.296 -48.975 1.00 0.00 C ATOM 808 O LEU B 43 -5.687 3.927 -48.667 1.00 0.00 O ATOM 809 CB LEU B 43 -8.699 2.784 -48.316 1.00 0.00 C ATOM 810 CG LEU B 43 -9.750 2.344 -47.289 1.00 0.00 C ATOM 811 CD1 LEU B 43 -10.501 1.129 -47.818 1.00 0.00 C ATOM 812 CD2 LEU B 43 -9.067 2.031 -45.966 1.00 0.00 C ATOM 0 H LEU B 43 -9.866 4.952 -48.419 1.00 0.00 H new ATOM 0 HA LEU B 43 -7.599 4.089 -46.998 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.181 2.864 -49.290 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -7.946 2.000 -48.397 1.00 0.00 H new ATOM 0 HG LEU B 43 -10.468 3.147 -47.124 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -11.248 0.817 -47.088 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -10.995 1.386 -48.755 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -9.798 0.314 -47.990 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -9.814 1.718 -45.236 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -8.343 1.229 -46.111 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -8.554 2.921 -45.602 1.00 0.00 H new ATOM 824 N ARG B 44 -7.103 4.871 -50.139 1.00 0.00 N ATOM 825 CA ARG B 44 -6.074 5.118 -51.141 1.00 0.00 C ATOM 826 C ARG B 44 -5.065 6.150 -50.652 1.00 0.00 C ATOM 827 O ARG B 44 -3.864 6.018 -50.886 1.00 0.00 O ATOM 828 CB ARG B 44 -6.698 5.601 -52.442 1.00 0.00 C ATOM 829 CG ARG B 44 -7.397 4.523 -53.255 1.00 0.00 C ATOM 830 CD ARG B 44 -8.451 5.093 -54.132 1.00 0.00 C ATOM 831 NE ARG B 44 -7.927 6.131 -55.005 1.00 0.00 N ATOM 832 CZ ARG B 44 -8.652 6.792 -55.929 1.00 0.00 C ATOM 833 NH1 ARG B 44 -9.926 6.512 -56.088 1.00 0.00 N ATOM 834 NH2 ARG B 44 -8.081 7.722 -56.675 1.00 0.00 N ATOM 0 H ARG B 44 -8.038 5.175 -50.412 1.00 0.00 H new ATOM 0 HA ARG B 44 -5.555 4.175 -51.316 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -7.418 6.387 -52.213 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -5.919 6.051 -53.057 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -6.664 3.994 -53.864 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -7.841 3.790 -52.582 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -8.890 4.299 -54.735 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -9.251 5.505 -53.517 1.00 0.00 H new ATOM 0 HE ARG B 44 -6.941 6.376 -54.912 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -10.366 5.794 -55.512 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -10.475 7.012 -56.787 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -7.092 7.939 -56.551 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -8.629 8.223 -57.374 1.00 0.00 H new ATOM 848 N LYS B 45 -5.561 7.177 -49.971 1.00 0.00 N ATOM 849 CA LYS B 45 -4.696 8.149 -49.313 1.00 0.00 C ATOM 850 C LYS B 45 -3.850 7.490 -48.232 1.00 0.00 C ATOM 851 O LYS B 45 -2.666 7.796 -48.083 1.00 0.00 O ATOM 852 CB LYS B 45 -5.526 9.285 -48.711 1.00 0.00 C ATOM 853 CG LYS B 45 -6.160 10.213 -49.739 1.00 0.00 C ATOM 854 CD LYS B 45 -7.013 11.280 -49.068 1.00 0.00 C ATOM 855 CE LYS B 45 -7.677 12.185 -50.095 1.00 0.00 C ATOM 856 NZ LYS B 45 -8.546 13.209 -49.454 1.00 0.00 N ATOM 0 H LYS B 45 -6.559 7.358 -49.860 1.00 0.00 H new ATOM 0 HA LYS B 45 -4.025 8.562 -50.067 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -6.314 8.855 -48.093 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -4.889 9.874 -48.051 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -5.380 10.689 -50.333 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -6.775 9.632 -50.427 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -7.776 10.804 -48.452 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -6.392 11.878 -48.401 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -6.911 12.681 -50.691 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -8.272 11.581 -50.780 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -8.980 13.805 -50.188 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -9.293 12.737 -48.906 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -7.974 13.802 -48.820 1.00 0.00 H new ATOM 870 N GLU B 46 -4.462 6.583 -47.479 1.00 0.00 N ATOM 871 CA GLU B 46 -3.750 5.831 -46.452 1.00 0.00 C ATOM 872 C GLU B 46 -2.644 4.979 -47.060 1.00 0.00 C ATOM 873 O GLU B 46 -1.565 4.842 -46.484 1.00 0.00 O ATOM 874 CB GLU B 46 -4.718 4.959 -45.666 1.00 0.00 C ATOM 0 H GLU B 46 -5.452 6.350 -47.561 1.00 0.00 H new ATOM 0 HA GLU B 46 -3.288 6.546 -45.771 1.00 0.00 H new ATOM 879 N LEU B 47 -2.919 4.409 -48.228 1.00 0.00 N ATOM 880 CA LEU B 47 -1.935 3.597 -48.935 1.00 0.00 C ATOM 881 C LEU B 47 -0.722 4.427 -49.337 1.00 0.00 C ATOM 882 O LEU B 47 0.415 3.966 -49.248 1.00 0.00 O ATOM 883 CB LEU B 47 -2.565 2.965 -50.182 1.00 0.00 C ATOM 884 CG LEU B 47 -3.581 1.845 -49.919 1.00 0.00 C ATOM 885 CD1 LEU B 47 -4.276 1.474 -51.222 1.00 0.00 C ATOM 886 CD2 LEU B 47 -2.868 0.644 -49.318 1.00 0.00 C ATOM 0 H LEU B 47 -3.816 4.494 -48.706 1.00 0.00 H new ATOM 0 HA LEU B 47 -1.604 2.809 -48.258 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -3.058 3.750 -50.755 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.766 2.567 -50.808 1.00 0.00 H new ATOM 0 HG LEU B 47 -4.337 2.185 -49.211 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -4.998 0.679 -51.036 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -4.793 2.347 -51.620 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -3.536 1.130 -51.944 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -3.589 -0.151 -49.131 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -2.107 0.288 -50.012 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.396 0.933 -48.379 1.00 0.00 H new ATOM 898 N MET B 48 -0.972 5.655 -49.779 1.00 0.00 N ATOM 899 CA MET B 48 0.101 6.571 -50.144 1.00 0.00 C ATOM 900 C MET B 48 0.994 6.877 -48.950 1.00 0.00 C ATOM 901 O MET B 48 2.218 6.934 -49.076 1.00 0.00 O ATOM 902 CB MET B 48 -0.480 7.862 -50.719 1.00 0.00 C ATOM 903 CG MET B 48 -1.159 7.699 -52.072 1.00 0.00 C ATOM 904 SD MET B 48 -1.873 9.239 -52.682 1.00 0.00 S ATOM 905 CE MET B 48 -0.395 10.130 -53.161 1.00 0.00 C ATOM 0 H MET B 48 -1.910 6.039 -49.893 1.00 0.00 H new ATOM 0 HA MET B 48 0.714 6.088 -50.906 1.00 0.00 H new ATOM 0 HB2 MET B 48 -1.202 8.268 -50.011 1.00 0.00 H new ATOM 0 HB3 MET B 48 0.321 8.596 -50.814 1.00 0.00 H new ATOM 0 HG2 MET B 48 -0.433 7.328 -52.796 1.00 0.00 H new ATOM 0 HG3 MET B 48 -1.943 6.946 -51.992 1.00 0.00 H new ATOM 0 HE1 MET B 48 -0.338 11.066 -52.605 1.00 0.00 H new ATOM 0 HE2 MET B 48 0.483 9.523 -52.941 1.00 0.00 H new ATOM 0 HE3 MET B 48 -0.429 10.344 -54.229 1.00 0.00 H new ATOM 915 N GLU B 49 0.377 7.073 -47.790 1.00 0.00 N ATOM 916 CA GLU B 49 1.119 7.233 -46.544 1.00 0.00 C ATOM 917 C GLU B 49 2.017 6.032 -46.280 1.00 0.00 C ATOM 918 O GLU B 49 3.207 6.184 -46.001 1.00 0.00 O ATOM 919 CB GLU B 49 0.156 7.431 -45.372 1.00 0.00 C ATOM 920 CG GLU B 49 0.835 7.557 -44.015 1.00 0.00 C ATOM 921 CD GLU B 49 -0.144 7.674 -42.880 1.00 0.00 C ATOM 922 OE1 GLU B 49 -1.293 7.944 -43.136 1.00 0.00 O ATOM 923 OE2 GLU B 49 0.258 7.492 -41.755 1.00 0.00 O ATOM 0 H GLU B 49 -0.636 7.125 -47.686 1.00 0.00 H new ATOM 0 HA GLU B 49 1.749 8.117 -46.642 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -0.437 8.327 -45.552 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -0.537 6.591 -45.341 1.00 0.00 H new ATOM 0 HG2 GLU B 49 1.472 6.688 -43.851 1.00 0.00 H new ATOM 0 HG3 GLU B 49 1.485 8.432 -44.019 1.00 0.00 H new ATOM 930 N VAL B 50 1.442 4.838 -46.368 1.00 0.00 N ATOM 931 CA VAL B 50 2.187 3.609 -46.128 1.00 0.00 C ATOM 932 C VAL B 50 3.374 3.490 -47.075 1.00 0.00 C ATOM 933 O VAL B 50 4.464 3.084 -46.672 1.00 0.00 O ATOM 934 CB VAL B 50 1.269 2.384 -46.305 1.00 0.00 C ATOM 935 CG1 VAL B 50 2.085 1.099 -46.289 1.00 0.00 C ATOM 936 CG2 VAL B 50 0.213 2.365 -45.210 1.00 0.00 C ATOM 0 H VAL B 50 0.460 4.695 -46.604 1.00 0.00 H new ATOM 0 HA VAL B 50 2.559 3.643 -45.104 1.00 0.00 H new ATOM 0 HB VAL B 50 0.769 2.454 -47.271 1.00 0.00 H new ATOM 0 HG11 VAL B 50 1.420 0.244 -46.415 1.00 0.00 H new ATOM 0 HG12 VAL B 50 2.810 1.118 -47.103 1.00 0.00 H new ATOM 0 HG13 VAL B 50 2.610 1.013 -45.338 1.00 0.00 H new ATOM 0 HG21 VAL B 50 -0.432 1.496 -45.342 1.00 0.00 H new ATOM 0 HG22 VAL B 50 0.700 2.311 -44.236 1.00 0.00 H new ATOM 0 HG23 VAL B 50 -0.386 3.274 -45.267 1.00 0.00 H new ATOM 946 N LEU B 51 3.156 3.847 -48.336 1.00 0.00 N ATOM 947 CA LEU B 51 4.211 3.792 -49.341 1.00 0.00 C ATOM 948 C LEU B 51 5.335 4.767 -49.015 1.00 0.00 C ATOM 949 O LEU B 51 6.513 4.423 -49.098 1.00 0.00 O ATOM 950 CB LEU B 51 3.639 4.108 -50.729 1.00 0.00 C ATOM 951 CG LEU B 51 2.721 3.034 -51.329 1.00 0.00 C ATOM 952 CD1 LEU B 51 1.925 3.633 -52.481 1.00 0.00 C ATOM 953 CD2 LEU B 51 3.558 1.854 -51.798 1.00 0.00 C ATOM 0 H LEU B 51 2.257 4.178 -48.687 1.00 0.00 H new ATOM 0 HA LEU B 51 4.621 2.782 -49.339 1.00 0.00 H new ATOM 0 HB2 LEU B 51 3.083 5.043 -50.668 1.00 0.00 H new ATOM 0 HB3 LEU B 51 4.469 4.275 -51.415 1.00 0.00 H new ATOM 0 HG LEU B 51 2.020 2.679 -50.574 1.00 0.00 H new ATOM 0 HD11 LEU B 51 1.273 2.871 -52.908 1.00 0.00 H new ATOM 0 HD12 LEU B 51 1.321 4.463 -52.113 1.00 0.00 H new ATOM 0 HD13 LEU B 51 2.610 3.995 -53.248 1.00 0.00 H new ATOM 0 HD21 LEU B 51 2.906 1.092 -52.224 1.00 0.00 H new ATOM 0 HD22 LEU B 51 4.267 2.189 -52.555 1.00 0.00 H new ATOM 0 HD23 LEU B 51 4.102 1.434 -50.952 1.00 0.00 H new ATOM 965 N SER B 52 4.962 5.988 -48.643 1.00 0.00 N ATOM 966 CA SER B 52 5.938 7.034 -48.359 1.00 0.00 C ATOM 967 C SER B 52 6.821 6.656 -47.176 1.00 0.00 C ATOM 968 O SER B 52 7.969 7.093 -47.083 1.00 0.00 O ATOM 969 CB SER B 52 5.230 8.344 -48.075 1.00 0.00 C ATOM 970 OG SER B 52 4.537 8.287 -46.859 1.00 0.00 O ATOM 0 H SER B 52 3.990 6.277 -48.531 1.00 0.00 H new ATOM 0 HA SER B 52 6.574 7.149 -49.237 1.00 0.00 H new ATOM 0 HB2 SER B 52 5.957 9.155 -48.046 1.00 0.00 H new ATOM 0 HB3 SER B 52 4.535 8.568 -48.884 1.00 0.00 H new ATOM 0 HG SER B 52 3.957 7.497 -46.850 1.00 0.00 H new ATOM 976 N LYS B 53 6.279 5.844 -46.275 1.00 0.00 N ATOM 977 CA LYS B 53 6.994 5.459 -45.064 1.00 0.00 C ATOM 978 C LYS B 53 7.801 4.185 -45.282 1.00 0.00 C ATOM 979 O LYS B 53 8.858 3.998 -44.679 1.00 0.00 O ATOM 980 CB LYS B 53 6.017 5.270 -43.903 1.00 0.00 C ATOM 981 CG LYS B 53 5.384 6.559 -43.397 1.00 0.00 C ATOM 982 CD LYS B 53 4.367 6.283 -42.299 1.00 0.00 C ATOM 983 CE LYS B 53 3.846 7.575 -41.688 1.00 0.00 C ATOM 984 NZ LYS B 53 2.762 7.326 -40.699 1.00 0.00 N ATOM 0 H LYS B 53 5.347 5.440 -46.361 1.00 0.00 H new ATOM 0 HA LYS B 53 7.687 6.263 -44.816 1.00 0.00 H new ATOM 0 HB2 LYS B 53 5.225 4.590 -44.217 1.00 0.00 H new ATOM 0 HB3 LYS B 53 6.541 4.789 -43.078 1.00 0.00 H new ATOM 0 HG2 LYS B 53 6.161 7.223 -43.018 1.00 0.00 H new ATOM 0 HG3 LYS B 53 4.898 7.077 -44.224 1.00 0.00 H new ATOM 0 HD2 LYS B 53 3.534 5.710 -42.708 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.825 5.670 -41.523 1.00 0.00 H new ATOM 0 HE2 LYS B 53 4.666 8.103 -41.202 1.00 0.00 H new ATOM 0 HE3 LYS B 53 3.473 8.226 -42.479 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 2.746 8.096 -40.000 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 1.846 7.286 -41.190 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 2.935 6.422 -40.215 1.00 0.00 H new ATOM 998 N TYR B 54 7.296 3.312 -46.146 1.00 0.00 N ATOM 999 CA TYR B 54 7.946 2.033 -46.411 1.00 0.00 C ATOM 1000 C TYR B 54 9.189 2.216 -47.272 1.00 0.00 C ATOM 1001 O TYR B 54 10.313 2.071 -46.793 1.00 0.00 O ATOM 1002 CB TYR B 54 6.969 1.067 -47.086 1.00 0.00 C ATOM 1003 CG TYR B 54 6.055 0.348 -46.119 1.00 0.00 C ATOM 1004 CD1 TYR B 54 5.998 0.747 -44.792 1.00 0.00 C ATOM 1005 CD2 TYR B 54 5.273 -0.708 -46.560 1.00 0.00 C ATOM 1006 CE1 TYR B 54 5.163 0.091 -43.908 1.00 0.00 C ATOM 1007 CE2 TYR B 54 4.437 -1.364 -45.677 1.00 0.00 C ATOM 1008 CZ TYR B 54 4.381 -0.968 -44.356 1.00 0.00 C ATOM 1009 OH TYR B 54 3.548 -1.621 -43.476 1.00 0.00 O ATOM 0 H TYR B 54 6.438 3.466 -46.675 1.00 0.00 H new ATOM 0 HA TYR B 54 8.256 1.609 -45.456 1.00 0.00 H new ATOM 0 HB2 TYR B 54 6.362 1.621 -47.802 1.00 0.00 H new ATOM 0 HB3 TYR B 54 7.536 0.329 -47.653 1.00 0.00 H new ATOM 0 HD1 TYR B 54 6.607 1.571 -44.449 1.00 0.00 H new ATOM 0 HD2 TYR B 54 5.317 -1.018 -47.594 1.00 0.00 H new ATOM 0 HE1 TYR B 54 5.118 0.399 -42.874 1.00 0.00 H new ATOM 0 HE2 TYR B 54 3.827 -2.187 -46.020 1.00 0.00 H new ATOM 0 HH TYR B 54 3.070 -2.335 -43.947 1.00 0.00 H new ATOM 1019 N VAL B 55 8.980 2.534 -48.545 1.00 0.00 N ATOM 1020 CA VAL B 55 10.036 2.429 -49.544 1.00 0.00 C ATOM 1021 C VAL B 55 10.826 3.727 -49.651 1.00 0.00 C ATOM 1022 O VAL B 55 11.741 3.843 -50.465 1.00 0.00 O ATOM 1023 CB VAL B 55 9.437 2.080 -50.920 1.00 0.00 C ATOM 1024 CG1 VAL B 55 8.642 0.786 -50.843 1.00 0.00 C ATOM 1025 CG2 VAL B 55 8.558 3.224 -51.406 1.00 0.00 C ATOM 0 H VAL B 55 8.087 2.867 -48.909 1.00 0.00 H new ATOM 0 HA VAL B 55 10.713 1.635 -49.228 1.00 0.00 H new ATOM 0 HB VAL B 55 10.249 1.935 -51.633 1.00 0.00 H new ATOM 0 HG11 VAL B 55 8.226 0.555 -51.824 1.00 0.00 H new ATOM 0 HG12 VAL B 55 9.297 -0.025 -50.527 1.00 0.00 H new ATOM 0 HG13 VAL B 55 7.831 0.899 -50.123 1.00 0.00 H new ATOM 0 HG21 VAL B 55 8.137 2.971 -52.379 1.00 0.00 H new ATOM 0 HG22 VAL B 55 7.750 3.390 -50.693 1.00 0.00 H new ATOM 0 HG23 VAL B 55 9.156 4.131 -51.494 1.00 0.00 H new ATOM 1035 N ASN B 56 10.464 4.702 -48.824 1.00 0.00 N ATOM 1036 CA ASN B 56 11.170 5.978 -48.789 1.00 0.00 C ATOM 1037 C ASN B 56 10.914 6.783 -50.056 1.00 0.00 C ATOM 1038 O ASN B 56 11.735 6.795 -50.973 1.00 0.00 O ATOM 1039 CB ASN B 56 12.658 5.759 -48.587 1.00 0.00 C ATOM 1040 CG ASN B 56 13.369 7.005 -48.138 1.00 0.00 C ATOM 1041 OD1 ASN B 56 12.787 7.855 -47.454 1.00 0.00 O ATOM 1042 ND2 ASN B 56 14.617 7.132 -48.510 1.00 0.00 N ATOM 0 H ASN B 56 9.685 4.633 -48.169 1.00 0.00 H new ATOM 0 HA ASN B 56 10.786 6.551 -47.945 1.00 0.00 H new ATOM 0 HB2 ASN B 56 12.809 4.972 -47.848 1.00 0.00 H new ATOM 0 HB3 ASN B 56 13.100 5.409 -49.520 1.00 0.00 H new ATOM 0 HD21 ASN B 56 15.149 7.958 -48.236 1.00 0.00 H new ATOM 0 HD22 ASN B 56 15.057 6.405 -49.074 1.00 0.00 H new ATOM 1049 N VAL B 57 9.770 7.457 -50.102 1.00 0.00 N ATOM 1050 CA VAL B 57 9.317 8.118 -51.320 1.00 0.00 C ATOM 1051 C VAL B 57 8.338 9.241 -51.006 1.00 0.00 C ATOM 1052 O VAL B 57 7.615 9.188 -50.012 1.00 0.00 O ATOM 1053 CB VAL B 57 8.642 7.101 -52.261 1.00 0.00 C ATOM 1054 CG1 VAL B 57 7.353 6.579 -51.644 1.00 0.00 C ATOM 1055 CG2 VAL B 57 8.372 7.745 -53.612 1.00 0.00 C ATOM 0 H VAL B 57 9.138 7.560 -49.308 1.00 0.00 H new ATOM 0 HA VAL B 57 10.192 8.545 -51.810 1.00 0.00 H new ATOM 0 HB VAL B 57 9.313 6.255 -52.407 1.00 0.00 H new ATOM 0 HG11 VAL B 57 6.889 5.862 -52.322 1.00 0.00 H new ATOM 0 HG12 VAL B 57 7.576 6.090 -50.695 1.00 0.00 H new ATOM 0 HG13 VAL B 57 6.669 7.410 -51.472 1.00 0.00 H new ATOM 0 HG21 VAL B 57 7.895 7.020 -54.272 1.00 0.00 H new ATOM 0 HG22 VAL B 57 7.714 8.604 -53.481 1.00 0.00 H new ATOM 0 HG23 VAL B 57 9.313 8.073 -54.053 1.00 0.00 H new ATOM 1065 N SER B 58 8.319 10.259 -51.861 1.00 0.00 N ATOM 1066 CA SER B 58 7.432 11.400 -51.674 1.00 0.00 C ATOM 1067 C SER B 58 6.060 11.137 -52.284 1.00 0.00 C ATOM 1068 O SER B 58 5.934 10.381 -53.247 1.00 0.00 O ATOM 1069 CB SER B 58 8.041 12.642 -52.294 1.00 0.00 C ATOM 1070 OG SER B 58 7.131 13.709 -52.279 1.00 0.00 O ATOM 0 H SER B 58 8.909 10.316 -52.691 1.00 0.00 H new ATOM 0 HA SER B 58 7.306 11.556 -50.603 1.00 0.00 H new ATOM 0 HB2 SER B 58 8.943 12.921 -51.748 1.00 0.00 H new ATOM 0 HB3 SER B 58 8.342 12.430 -53.320 1.00 0.00 H new ATOM 0 HG SER B 58 7.547 14.499 -52.682 1.00 0.00 H new ATOM 1076 N LEU B 59 5.036 11.765 -51.718 1.00 0.00 N ATOM 1077 CA LEU B 59 3.673 11.608 -52.211 1.00 0.00 C ATOM 1078 C LEU B 59 3.556 12.061 -53.661 1.00 0.00 C ATOM 1079 O LEU B 59 2.748 11.531 -54.424 1.00 0.00 O ATOM 1080 CB LEU B 59 2.697 12.406 -51.338 1.00 0.00 C ATOM 1081 CG LEU B 59 2.565 11.933 -49.885 1.00 0.00 C ATOM 1082 CD1 LEU B 59 1.663 12.892 -49.119 1.00 0.00 C ATOM 1083 CD2 LEU B 59 2.005 10.519 -49.861 1.00 0.00 C ATOM 0 H LEU B 59 5.124 12.389 -50.916 1.00 0.00 H new ATOM 0 HA LEU B 59 3.419 10.549 -52.160 1.00 0.00 H new ATOM 0 HB2 LEU B 59 3.012 13.450 -51.334 1.00 0.00 H new ATOM 0 HB3 LEU B 59 1.712 12.372 -51.803 1.00 0.00 H new ATOM 0 HG LEU B 59 3.544 11.924 -49.405 1.00 0.00 H new ATOM 0 HD11 LEU B 59 1.569 12.556 -48.086 1.00 0.00 H new ATOM 0 HD12 LEU B 59 2.096 13.892 -49.137 1.00 0.00 H new ATOM 0 HD13 LEU B 59 0.678 12.915 -49.584 1.00 0.00 H new ATOM 0 HD21 LEU B 59 1.911 10.182 -48.829 1.00 0.00 H new ATOM 0 HD22 LEU B 59 1.024 10.508 -50.337 1.00 0.00 H new ATOM 0 HD23 LEU B 59 2.678 9.852 -50.400 1.00 0.00 H new ATOM 1095 N ASP B 60 4.366 13.046 -54.035 1.00 0.00 N ATOM 1096 CA ASP B 60 4.361 13.566 -55.396 1.00 0.00 C ATOM 1097 C ASP B 60 4.884 12.532 -56.384 1.00 0.00 C ATOM 1098 O ASP B 60 4.652 12.636 -57.588 1.00 0.00 O ATOM 1099 CB ASP B 60 5.205 14.840 -55.487 1.00 0.00 C ATOM 1100 CG ASP B 60 4.557 16.032 -54.794 1.00 0.00 C ATOM 1101 OD1 ASP B 60 3.384 15.965 -54.515 1.00 0.00 O ATOM 1102 OD2 ASP B 60 5.242 16.995 -54.550 1.00 0.00 O ATOM 0 H ASP B 60 5.035 13.500 -53.413 1.00 0.00 H new ATOM 0 HA ASP B 60 3.329 13.800 -55.656 1.00 0.00 H new ATOM 0 HB2 ASP B 60 6.182 14.655 -55.042 1.00 0.00 H new ATOM 0 HB3 ASP B 60 5.374 15.084 -56.536 1.00 0.00 H new ATOM 1107 N ASN B 61 5.592 11.533 -55.867 1.00 0.00 N ATOM 1108 CA ASN B 61 6.160 10.483 -56.704 1.00 0.00 C ATOM 1109 C ASN B 61 5.282 9.238 -56.697 1.00 0.00 C ATOM 1110 O ASN B 61 5.686 8.180 -57.179 1.00 0.00 O ATOM 1111 CB ASN B 61 7.570 10.145 -56.255 1.00 0.00 C ATOM 1112 CG ASN B 61 8.544 11.258 -56.525 1.00 0.00 C ATOM 1113 OD1 ASN B 61 8.436 11.963 -57.534 1.00 0.00 O ATOM 1114 ND2 ASN B 61 9.495 11.427 -55.642 1.00 0.00 N ATOM 0 H ASN B 61 5.786 11.429 -54.871 1.00 0.00 H new ATOM 0 HA ASN B 61 6.203 10.857 -57.727 1.00 0.00 H new ATOM 0 HB2 ASN B 61 7.564 9.923 -55.188 1.00 0.00 H new ATOM 0 HB3 ASN B 61 7.904 9.242 -56.767 1.00 0.00 H new ATOM 0 HD21 ASN B 61 10.187 12.165 -55.772 1.00 0.00 H new ATOM 0 HD22 ASN B 61 9.545 10.820 -54.824 1.00 0.00 H new ATOM 1121 N ILE B 62 4.079 9.371 -56.147 1.00 0.00 N ATOM 1122 CA ILE B 62 3.121 8.273 -56.127 1.00 0.00 C ATOM 1123 C ILE B 62 1.878 8.612 -56.941 1.00 0.00 C ATOM 1124 O ILE B 62 1.170 9.573 -56.640 1.00 0.00 O ATOM 1125 CB ILE B 62 2.712 7.928 -54.684 1.00 0.00 C ATOM 1126 CG1 ILE B 62 3.940 7.537 -53.859 1.00 0.00 C ATOM 1127 CG2 ILE B 62 1.682 6.808 -54.676 1.00 0.00 C ATOM 1128 CD1 ILE B 62 3.665 7.403 -52.379 1.00 0.00 C ATOM 0 H ILE B 62 3.745 10.230 -55.709 1.00 0.00 H new ATOM 0 HA ILE B 62 3.609 7.408 -56.576 1.00 0.00 H new ATOM 0 HB ILE B 62 2.262 8.811 -54.231 1.00 0.00 H new ATOM 0 HG12 ILE B 62 4.331 6.591 -54.233 1.00 0.00 H new ATOM 0 HG13 ILE B 62 4.719 8.285 -54.008 1.00 0.00 H new ATOM 0 HG21 ILE B 62 1.404 6.577 -53.648 1.00 0.00 H new ATOM 0 HG22 ILE B 62 0.797 7.123 -55.229 1.00 0.00 H new ATOM 0 HG23 ILE B 62 2.106 5.920 -55.146 1.00 0.00 H new ATOM 0 HD11 ILE B 62 4.583 7.124 -51.862 1.00 0.00 H new ATOM 0 HD12 ILE B 62 3.304 8.354 -51.989 1.00 0.00 H new ATOM 0 HD13 ILE B 62 2.910 6.634 -52.217 1.00 0.00 H new ATOM 1140 N ARG B 63 1.619 7.818 -57.974 1.00 0.00 N ATOM 1141 CA ARG B 63 0.467 8.040 -58.841 1.00 0.00 C ATOM 1142 C ARG B 63 -0.641 7.035 -58.553 1.00 0.00 C ATOM 1143 O ARG B 63 -0.445 5.826 -58.678 1.00 0.00 O ATOM 1144 CB ARG B 63 0.872 7.938 -60.304 1.00 0.00 C ATOM 1145 CG ARG B 63 -0.263 8.134 -61.296 1.00 0.00 C ATOM 1146 CD ARG B 63 0.211 8.029 -62.700 1.00 0.00 C ATOM 1147 NE ARG B 63 -0.878 8.177 -63.653 1.00 0.00 N ATOM 1148 CZ ARG B 63 -0.738 8.110 -64.991 1.00 0.00 C ATOM 1149 NH1 ARG B 63 0.447 7.898 -65.518 1.00 0.00 N ATOM 1150 NH2 ARG B 63 -1.793 8.258 -65.774 1.00 0.00 N ATOM 0 H ARG B 63 2.192 7.014 -58.232 1.00 0.00 H new ATOM 0 HA ARG B 63 0.092 9.043 -58.638 1.00 0.00 H new ATOM 0 HB2 ARG B 63 1.644 8.681 -60.505 1.00 0.00 H new ATOM 0 HB3 ARG B 63 1.320 6.959 -60.475 1.00 0.00 H new ATOM 0 HG2 ARG B 63 -1.037 7.387 -61.116 1.00 0.00 H new ATOM 0 HG3 ARG B 63 -0.720 9.111 -61.138 1.00 0.00 H new ATOM 0 HD2 ARG B 63 0.964 8.795 -62.887 1.00 0.00 H new ATOM 0 HD3 ARG B 63 0.695 7.064 -62.849 1.00 0.00 H new ATOM 0 HE ARG B 63 -1.813 8.343 -63.282 1.00 0.00 H new ATOM 0 HH11 ARG B 63 1.261 7.784 -64.914 1.00 0.00 H new ATOM 0 HH12 ARG B 63 0.553 7.847 -66.531 1.00 0.00 H new ATOM 0 HH21 ARG B 63 -2.713 8.423 -65.365 1.00 0.00 H new ATOM 0 HH22 ARG B 63 -1.687 8.207 -66.787 1.00 0.00 H new ATOM 1164 N ILE B 64 -1.807 7.543 -58.166 1.00 0.00 N ATOM 1165 CA ILE B 64 -2.950 6.691 -57.859 1.00 0.00 C ATOM 1166 C ILE B 64 -4.047 6.845 -58.904 1.00 0.00 C ATOM 1167 O ILE B 64 -4.482 7.957 -59.203 1.00 0.00 O ATOM 1168 CB ILE B 64 -3.518 7.015 -56.466 1.00 0.00 C ATOM 1169 CG1 ILE B 64 -2.409 6.964 -55.412 1.00 0.00 C ATOM 1170 CG2 ILE B 64 -4.637 6.048 -56.110 1.00 0.00 C ATOM 1171 CD1 ILE B 64 -1.753 5.610 -55.279 1.00 0.00 C ATOM 0 H ILE B 64 -1.985 8.541 -58.058 1.00 0.00 H new ATOM 0 HA ILE B 64 -2.598 5.659 -57.869 1.00 0.00 H new ATOM 0 HB ILE B 64 -3.929 8.024 -56.486 1.00 0.00 H new ATOM 0 HG12 ILE B 64 -1.648 7.702 -55.664 1.00 0.00 H new ATOM 0 HG13 ILE B 64 -2.825 7.252 -54.447 1.00 0.00 H new ATOM 0 HG21 ILE B 64 -5.027 6.291 -55.122 1.00 0.00 H new ATOM 0 HG22 ILE B 64 -5.437 6.130 -56.846 1.00 0.00 H new ATOM 0 HG23 ILE B 64 -4.250 5.029 -56.106 1.00 0.00 H new ATOM 0 HD11 ILE B 64 -0.979 5.655 -54.513 1.00 0.00 H new ATOM 0 HD12 ILE B 64 -2.501 4.870 -54.996 1.00 0.00 H new ATOM 0 HD13 ILE B 64 -1.305 5.327 -56.232 1.00 0.00 H new ATOM 1183 N SER B 65 -4.491 5.722 -59.458 1.00 0.00 N ATOM 1184 CA SER B 65 -5.539 5.730 -60.471 1.00 0.00 C ATOM 1185 C SER B 65 -6.450 4.515 -60.332 1.00 0.00 C ATOM 1186 O SER B 65 -6.007 3.439 -59.932 1.00 0.00 O ATOM 1187 CB SER B 65 -4.927 5.757 -61.857 1.00 0.00 C ATOM 1188 OG SER B 65 -5.919 5.740 -62.846 1.00 0.00 O ATOM 0 H SER B 65 -4.141 4.794 -59.222 1.00 0.00 H new ATOM 0 HA SER B 65 -6.140 6.627 -60.324 1.00 0.00 H new ATOM 0 HB2 SER B 65 -4.312 6.650 -61.969 1.00 0.00 H new ATOM 0 HB3 SER B 65 -4.268 4.898 -61.984 1.00 0.00 H new ATOM 0 HG SER B 65 -5.499 5.760 -63.731 1.00 0.00 H new ATOM 1194 N GLN B 66 -7.724 4.696 -60.664 1.00 0.00 N ATOM 1195 CA GLN B 66 -8.697 3.614 -60.582 1.00 0.00 C ATOM 1196 C GLN B 66 -9.554 3.548 -61.840 1.00 0.00 C ATOM 1197 O GLN B 66 -10.031 4.570 -62.332 1.00 0.00 O ATOM 1198 CB GLN B 66 -9.589 3.787 -59.350 1.00 0.00 C ATOM 1199 CG GLN B 66 -10.591 2.664 -59.144 1.00 0.00 C ATOM 1200 CD GLN B 66 -11.381 2.822 -57.859 1.00 0.00 C ATOM 1201 OE1 GLN B 66 -10.962 3.528 -56.938 1.00 0.00 O ATOM 1202 NE2 GLN B 66 -12.532 2.164 -57.789 1.00 0.00 N ATOM 0 H GLN B 66 -8.106 5.583 -60.993 1.00 0.00 H new ATOM 0 HA GLN B 66 -8.146 2.678 -60.493 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -8.957 3.862 -58.465 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -10.129 4.730 -59.436 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -11.279 2.635 -59.989 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -10.065 1.710 -59.129 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -12.841 1.591 -58.575 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -13.108 2.231 -56.950 1.00 0.00 H new ATOM 1211 N GLU B 67 -9.746 2.338 -62.356 1.00 0.00 N ATOM 1212 CA GLU B 67 -10.450 2.147 -63.619 1.00 0.00 C ATOM 1213 C GLU B 67 -11.262 0.859 -63.607 1.00 0.00 C ATOM 1214 O GLU B 67 -10.828 -0.155 -63.061 1.00 0.00 O ATOM 1215 CB GLU B 67 -9.458 2.125 -64.784 1.00 0.00 C ATOM 1216 CG GLU B 67 -10.106 2.058 -66.160 1.00 0.00 C ATOM 1217 CD GLU B 67 -9.108 2.152 -67.281 1.00 0.00 C ATOM 1218 OE1 GLU B 67 -7.933 2.173 -67.005 1.00 0.00 O ATOM 1219 OE2 GLU B 67 -9.523 2.203 -68.415 1.00 0.00 O ATOM 0 H GLU B 67 -9.424 1.475 -61.919 1.00 0.00 H new ATOM 0 HA GLU B 67 -11.136 2.984 -63.748 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -8.835 3.018 -64.732 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -8.796 1.267 -64.665 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -10.660 1.123 -66.250 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -10.830 2.868 -66.255 1.00 0.00 H new ATOM 1226 N LYS B 68 -12.445 0.906 -64.211 1.00 0.00 N ATOM 1227 CA LYS B 68 -13.324 -0.256 -64.267 1.00 0.00 C ATOM 1228 C LYS B 68 -12.996 -1.137 -65.466 1.00 0.00 C ATOM 1229 O LYS B 68 -12.949 -0.664 -66.602 1.00 0.00 O ATOM 1230 CB LYS B 68 -14.788 0.182 -64.321 1.00 0.00 C ATOM 1231 CG LYS B 68 -15.790 -0.944 -64.100 1.00 0.00 C ATOM 1232 CD LYS B 68 -17.220 -0.445 -64.236 1.00 0.00 C ATOM 1233 CE LYS B 68 -17.540 0.613 -63.191 1.00 0.00 C ATOM 1234 NZ LYS B 68 -17.540 0.052 -61.813 1.00 0.00 N ATOM 0 H LYS B 68 -12.817 1.738 -64.669 1.00 0.00 H new ATOM 0 HA LYS B 68 -13.163 -0.840 -63.361 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -14.952 0.952 -63.567 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -14.982 0.640 -65.291 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -15.610 -1.741 -64.822 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -15.645 -1.373 -63.109 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -17.369 -0.031 -65.233 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -17.911 -1.282 -64.132 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -16.808 1.419 -63.255 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -18.515 1.050 -63.405 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -17.925 0.756 -61.151 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -18.128 -0.805 -61.787 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -16.567 -0.188 -61.536 1.00 0.00 H new ATOM 1248 N GLN B 69 -12.770 -2.420 -65.207 1.00 0.00 N ATOM 1249 CA GLN B 69 -12.359 -3.352 -66.250 1.00 0.00 C ATOM 1250 C GLN B 69 -12.957 -4.735 -66.019 1.00 0.00 C ATOM 1251 O GLN B 69 -12.773 -5.331 -64.958 1.00 0.00 O ATOM 1252 CB GLN B 69 -10.833 -3.446 -66.316 1.00 0.00 C ATOM 1253 CG GLN B 69 -10.312 -4.376 -67.398 1.00 0.00 C ATOM 1254 CD GLN B 69 -10.533 -3.822 -68.793 1.00 0.00 C ATOM 1255 OE1 GLN B 69 -10.108 -2.708 -69.108 1.00 0.00 O ATOM 1256 NE2 GLN B 69 -11.200 -4.599 -69.638 1.00 0.00 N ATOM 0 H GLN B 69 -12.865 -2.839 -64.282 1.00 0.00 H new ATOM 0 HA GLN B 69 -12.732 -2.972 -67.201 1.00 0.00 H new ATOM 0 HB2 GLN B 69 -10.426 -2.449 -66.483 1.00 0.00 H new ATOM 0 HB3 GLN B 69 -10.459 -3.785 -65.350 1.00 0.00 H new ATOM 0 HG2 GLN B 69 -9.247 -4.548 -67.243 1.00 0.00 H new ATOM 0 HG3 GLN B 69 -10.807 -5.343 -67.311 1.00 0.00 H new ATOM 0 HE21 GLN B 69 -11.534 -5.514 -69.335 1.00 0.00 H new ATOM 0 HE22 GLN B 69 -11.379 -4.281 -70.591 1.00 0.00 H new ATOM 1265 N ASP B 70 -13.671 -5.240 -67.019 1.00 0.00 N ATOM 1266 CA ASP B 70 -14.232 -6.584 -66.957 1.00 0.00 C ATOM 1267 C ASP B 70 -15.218 -6.717 -65.804 1.00 0.00 C ATOM 1268 O ASP B 70 -15.349 -7.784 -65.205 1.00 0.00 O ATOM 1269 CB ASP B 70 -13.119 -7.624 -66.806 1.00 0.00 C ATOM 1270 CG ASP B 70 -12.154 -7.633 -67.984 1.00 0.00 C ATOM 1271 OD1 ASP B 70 -12.524 -7.164 -69.034 1.00 0.00 O ATOM 1272 OD2 ASP B 70 -11.056 -8.111 -67.822 1.00 0.00 O ATOM 0 H ASP B 70 -13.875 -4.738 -67.883 1.00 0.00 H new ATOM 0 HA ASP B 70 -14.765 -6.762 -67.891 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -12.564 -7.425 -65.889 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -13.565 -8.613 -66.700 1.00 0.00 H new ATOM 1277 N GLY B 71 -15.911 -5.625 -65.496 1.00 0.00 N ATOM 1278 CA GLY B 71 -16.996 -5.655 -64.522 1.00 0.00 C ATOM 1279 C GLY B 71 -16.477 -5.393 -63.113 1.00 0.00 C ATOM 1280 O GLY B 71 -17.255 -5.292 -62.164 1.00 0.00 O ATOM 0 H GLY B 71 -15.740 -4.708 -65.908 1.00 0.00 H new ATOM 0 HA2 GLY B 71 -17.743 -4.906 -64.783 1.00 0.00 H new ATOM 0 HA3 GLY B 71 -17.492 -6.625 -64.556 1.00 0.00 H new ATOM 1284 N MET B 72 -15.160 -5.285 -62.984 1.00 0.00 N ATOM 1285 CA MET B 72 -14.532 -5.088 -61.683 1.00 0.00 C ATOM 1286 C MET B 72 -13.730 -3.793 -61.648 1.00 0.00 C ATOM 1287 O MET B 72 -13.311 -3.283 -62.687 1.00 0.00 O ATOM 1288 CB MET B 72 -13.636 -6.278 -61.344 1.00 0.00 C ATOM 1289 CG MET B 72 -14.370 -7.606 -61.231 1.00 0.00 C ATOM 1290 SD MET B 72 -13.248 -9.015 -61.127 1.00 0.00 S ATOM 1291 CE MET B 72 -12.688 -9.127 -62.824 1.00 0.00 C ATOM 0 H MET B 72 -14.506 -5.331 -63.765 1.00 0.00 H new ATOM 0 HA MET B 72 -15.321 -5.014 -60.934 1.00 0.00 H new ATOM 0 HB2 MET B 72 -12.866 -6.367 -62.110 1.00 0.00 H new ATOM 0 HB3 MET B 72 -13.127 -6.077 -60.401 1.00 0.00 H new ATOM 0 HG2 MET B 72 -15.009 -7.589 -60.348 1.00 0.00 H new ATOM 0 HG3 MET B 72 -15.023 -7.730 -62.095 1.00 0.00 H new ATOM 0 HE1 MET B 72 -12.207 -10.092 -62.985 1.00 0.00 H new ATOM 0 HE2 MET B 72 -13.541 -9.030 -63.496 1.00 0.00 H new ATOM 0 HE3 MET B 72 -11.975 -8.328 -63.025 1.00 0.00 H new ATOM 1301 N ASP B 73 -13.520 -3.265 -60.447 1.00 0.00 N ATOM 1302 CA ASP B 73 -12.765 -2.029 -60.275 1.00 0.00 C ATOM 1303 C ASP B 73 -11.312 -2.317 -59.922 1.00 0.00 C ATOM 1304 O ASP B 73 -11.025 -3.023 -58.955 1.00 0.00 O ATOM 1305 CB ASP B 73 -13.398 -1.161 -59.185 1.00 0.00 C ATOM 1306 CG ASP B 73 -14.743 -0.579 -59.598 1.00 0.00 C ATOM 1307 OD1 ASP B 73 -15.037 -0.584 -60.770 1.00 0.00 O ATOM 1308 OD2 ASP B 73 -15.465 -0.135 -58.737 1.00 0.00 O ATOM 0 H ASP B 73 -13.862 -3.674 -59.578 1.00 0.00 H new ATOM 0 HA ASP B 73 -12.791 -1.491 -61.222 1.00 0.00 H new ATOM 0 HB2 ASP B 73 -13.528 -1.758 -58.282 1.00 0.00 H new ATOM 0 HB3 ASP B 73 -12.717 -0.347 -58.934 1.00 0.00 H new ATOM 1313 N VAL B 74 -10.397 -1.766 -60.712 1.00 0.00 N ATOM 1314 CA VAL B 74 -8.972 -2.017 -60.525 1.00 0.00 C ATOM 1315 C VAL B 74 -8.258 -0.775 -60.007 1.00 0.00 C ATOM 1316 O VAL B 74 -8.320 0.291 -60.620 1.00 0.00 O ATOM 1317 CB VAL B 74 -8.328 -2.459 -61.853 1.00 0.00 C ATOM 1318 CG1 VAL B 74 -6.835 -2.686 -61.671 1.00 0.00 C ATOM 1319 CG2 VAL B 74 -9.007 -3.720 -62.364 1.00 0.00 C ATOM 0 H VAL B 74 -10.617 -1.142 -61.489 1.00 0.00 H new ATOM 0 HA VAL B 74 -8.870 -2.812 -59.787 1.00 0.00 H new ATOM 0 HB VAL B 74 -8.462 -1.668 -62.591 1.00 0.00 H new ATOM 0 HG11 VAL B 74 -6.396 -2.998 -62.619 1.00 0.00 H new ATOM 0 HG12 VAL B 74 -6.364 -1.760 -61.340 1.00 0.00 H new ATOM 0 HG13 VAL B 74 -6.674 -3.463 -60.924 1.00 0.00 H new ATOM 0 HG21 VAL B 74 -8.546 -4.026 -63.303 1.00 0.00 H new ATOM 0 HG22 VAL B 74 -8.896 -4.517 -61.628 1.00 0.00 H new ATOM 0 HG23 VAL B 74 -10.066 -3.522 -62.527 1.00 0.00 H new ATOM 1329 N LEU B 75 -7.581 -0.919 -58.873 1.00 0.00 N ATOM 1330 CA LEU B 75 -6.784 0.166 -58.314 1.00 0.00 C ATOM 1331 C LEU B 75 -5.319 0.037 -58.712 1.00 0.00 C ATOM 1332 O LEU B 75 -4.717 -1.027 -58.564 1.00 0.00 O ATOM 1333 CB LEU B 75 -6.905 0.179 -56.785 1.00 0.00 C ATOM 1334 CG LEU B 75 -6.077 1.249 -56.061 1.00 0.00 C ATOM 1335 CD1 LEU B 75 -6.594 2.631 -56.432 1.00 0.00 C ATOM 1336 CD2 LEU B 75 -6.154 1.021 -54.559 1.00 0.00 C ATOM 0 H LEU B 75 -7.568 -1.778 -58.323 1.00 0.00 H new ATOM 0 HA LEU B 75 -7.168 1.103 -58.716 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -7.954 0.319 -56.523 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -6.610 -0.800 -56.407 1.00 0.00 H new ATOM 0 HG LEU B 75 -5.033 1.180 -56.366 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -6.005 3.390 -55.917 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -6.509 2.774 -57.509 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -7.639 2.720 -56.136 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -5.566 1.781 -54.045 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -7.193 1.085 -54.234 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -5.759 0.034 -54.320 1.00 0.00 H new ATOM 1348 N GLU B 76 -4.750 1.126 -59.218 1.00 0.00 N ATOM 1349 CA GLU B 76 -3.381 1.112 -59.718 1.00 0.00 C ATOM 1350 C GLU B 76 -2.506 2.097 -58.953 1.00 0.00 C ATOM 1351 O GLU B 76 -2.832 3.280 -58.846 1.00 0.00 O ATOM 1352 CB GLU B 76 -3.354 1.445 -61.211 1.00 0.00 C ATOM 1353 CG GLU B 76 -1.962 1.468 -61.826 1.00 0.00 C ATOM 1354 CD GLU B 76 -1.977 1.777 -63.297 1.00 0.00 C ATOM 1355 OE1 GLU B 76 -2.943 1.449 -63.943 1.00 0.00 O ATOM 1356 OE2 GLU B 76 -1.021 2.341 -63.775 1.00 0.00 O ATOM 0 H GLU B 76 -5.217 2.030 -59.293 1.00 0.00 H new ATOM 0 HA GLU B 76 -2.982 0.109 -59.568 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -3.961 0.714 -61.745 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -3.821 2.418 -61.362 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -1.355 2.212 -61.310 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -1.484 0.501 -61.668 1.00 0.00 H new ATOM 1363 N LEU B 77 -1.392 1.603 -58.422 1.00 0.00 N ATOM 1364 CA LEU B 77 -0.431 2.454 -57.730 1.00 0.00 C ATOM 1365 C LEU B 77 0.934 2.406 -58.406 1.00 0.00 C ATOM 1366 O LEU B 77 1.490 1.331 -58.628 1.00 0.00 O ATOM 1367 CB LEU B 77 -0.298 2.019 -56.265 1.00 0.00 C ATOM 1368 CG LEU B 77 -1.587 2.074 -55.435 1.00 0.00 C ATOM 1369 CD1 LEU B 77 -2.354 0.769 -55.604 1.00 0.00 C ATOM 1370 CD2 LEU B 77 -1.241 2.319 -53.974 1.00 0.00 C ATOM 0 H LEU B 77 -1.133 0.617 -58.458 1.00 0.00 H new ATOM 0 HA LEU B 77 -0.800 3.479 -57.772 1.00 0.00 H new ATOM 0 HB2 LEU B 77 0.084 0.998 -56.241 1.00 0.00 H new ATOM 0 HB3 LEU B 77 0.449 2.650 -55.784 1.00 0.00 H new ATOM 0 HG LEU B 77 -2.218 2.893 -55.780 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -3.270 0.807 -55.015 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -2.604 0.628 -56.655 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -1.737 -0.062 -55.263 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -2.157 2.358 -53.385 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -0.609 1.509 -53.609 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -0.709 3.265 -53.880 1.00 0.00 H new ATOM 1382 N ASN B 78 1.467 3.578 -58.732 1.00 0.00 N ATOM 1383 CA ASN B 78 2.786 3.675 -59.348 1.00 0.00 C ATOM 1384 C ASN B 78 3.731 4.513 -58.498 1.00 0.00 C ATOM 1385 O ASN B 78 3.509 5.707 -58.299 1.00 0.00 O ATOM 1386 CB ASN B 78 2.679 4.246 -60.750 1.00 0.00 C ATOM 1387 CG ASN B 78 1.918 3.347 -61.685 1.00 0.00 C ATOM 1388 OD1 ASN B 78 2.343 2.220 -61.965 1.00 0.00 O ATOM 1389 ND2 ASN B 78 0.801 3.823 -62.173 1.00 0.00 N ATOM 0 H ASN B 78 1.006 4.475 -58.580 1.00 0.00 H new ATOM 0 HA ASN B 78 3.200 2.669 -59.414 1.00 0.00 H new ATOM 0 HB2 ASN B 78 2.187 5.218 -60.706 1.00 0.00 H new ATOM 0 HB3 ASN B 78 3.680 4.413 -61.147 1.00 0.00 H new ATOM 0 HD21 ASN B 78 0.242 3.258 -62.812 1.00 0.00 H new ATOM 0 HD22 ASN B 78 0.489 4.759 -61.914 1.00 0.00 H new ATOM 1396 N ILE B 79 4.787 3.880 -57.997 1.00 0.00 N ATOM 1397 CA ILE B 79 5.718 4.542 -57.091 1.00 0.00 C ATOM 1398 C ILE B 79 7.103 4.661 -57.715 1.00 0.00 C ATOM 1399 O ILE B 79 7.762 3.656 -57.981 1.00 0.00 O ATOM 1400 CB ILE B 79 5.819 3.781 -55.756 1.00 0.00 C ATOM 1401 CG1 ILE B 79 4.438 3.656 -55.108 1.00 0.00 C ATOM 1402 CG2 ILE B 79 6.789 4.483 -54.817 1.00 0.00 C ATOM 1403 CD1 ILE B 79 3.697 2.395 -55.490 1.00 0.00 C ATOM 0 H ILE B 79 5.019 2.909 -58.204 1.00 0.00 H new ATOM 0 HA ILE B 79 5.331 5.543 -56.902 1.00 0.00 H new ATOM 0 HB ILE B 79 6.198 2.779 -55.955 1.00 0.00 H new ATOM 0 HG12 ILE B 79 4.551 3.686 -54.024 1.00 0.00 H new ATOM 0 HG13 ILE B 79 3.835 4.520 -55.389 1.00 0.00 H new ATOM 0 HG21 ILE B 79 6.849 3.933 -53.878 1.00 0.00 H new ATOM 0 HG22 ILE B 79 7.776 4.524 -55.278 1.00 0.00 H new ATOM 0 HG23 ILE B 79 6.438 5.496 -54.622 1.00 0.00 H new ATOM 0 HD11 ILE B 79 2.728 2.378 -54.992 1.00 0.00 H new ATOM 0 HD12 ILE B 79 3.551 2.372 -56.570 1.00 0.00 H new ATOM 0 HD13 ILE B 79 4.278 1.525 -55.184 1.00 0.00 H new ATOM 1415 N THR B 80 7.538 5.895 -57.946 1.00 0.00 N ATOM 1416 CA THR B 80 8.862 6.148 -58.503 1.00 0.00 C ATOM 1417 C THR B 80 9.906 6.283 -57.402 1.00 0.00 C ATOM 1418 O THR B 80 9.798 7.151 -56.535 1.00 0.00 O ATOM 1419 CB THR B 80 8.862 7.417 -59.375 1.00 0.00 C ATOM 1420 OG1 THR B 80 7.945 7.251 -60.465 1.00 0.00 O ATOM 1421 CG2 THR B 80 10.255 7.686 -59.925 1.00 0.00 C ATOM 0 H THR B 80 6.993 6.736 -57.756 1.00 0.00 H new ATOM 0 HA THR B 80 9.120 5.292 -59.126 1.00 0.00 H new ATOM 0 HB THR B 80 8.556 8.263 -58.760 1.00 0.00 H new ATOM 0 HG1 THR B 80 7.945 8.060 -61.018 1.00 0.00 H new ATOM 0 HG21 THR B 80 10.236 8.586 -60.539 1.00 0.00 H new ATOM 0 HG22 THR B 80 10.952 7.825 -59.099 1.00 0.00 H new ATOM 0 HG23 THR B 80 10.576 6.840 -60.532 1.00 0.00 H new ATOM 1429 N LEU B 81 10.916 5.421 -57.442 1.00 0.00 N ATOM 1430 CA LEU B 81 11.952 5.407 -56.416 1.00 0.00 C ATOM 1431 C LEU B 81 13.342 5.395 -57.037 1.00 0.00 C ATOM 1432 O LEU B 81 14.111 6.286 -56.803 1.00 0.00 O ATOM 1433 CB LEU B 81 11.780 4.183 -55.508 1.00 0.00 C ATOM 1434 CG LEU B 81 12.839 4.013 -54.411 1.00 0.00 C ATOM 1435 CD1 LEU B 81 12.735 5.166 -53.421 1.00 0.00 C ATOM 1436 CD2 LEU B 81 12.642 2.675 -53.716 1.00 0.00 C ATOM 0 H LEU B 81 11.039 4.722 -58.175 1.00 0.00 H new ATOM 0 HA LEU B 81 11.849 6.316 -55.823 1.00 0.00 H new ATOM 0 HB2 LEU B 81 10.800 4.240 -55.035 1.00 0.00 H new ATOM 0 HB3 LEU B 81 11.782 3.289 -56.131 1.00 0.00 H new ATOM 0 HG LEU B 81 13.836 4.027 -54.851 1.00 0.00 H new ATOM 0 HD11 LEU B 81 13.487 5.045 -52.642 1.00 0.00 H new ATOM 0 HD12 LEU B 81 12.900 6.109 -53.942 1.00 0.00 H new ATOM 0 HD13 LEU B 81 11.743 5.170 -52.970 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.395 2.555 -52.937 1.00 0.00 H new ATOM 0 HD22 LEU B 81 11.648 2.640 -53.269 1.00 0.00 H new ATOM 0 HD23 LEU B 81 12.741 1.869 -54.443 1.00 0.00 H new