USER MOD reduce.3.24.130724 H: found=0, std=0, add=1044, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 0 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 51 TYR OH : rot 87:sc= 0.701 USER MOD Set 1.2: B 63 SER OG : rot 85:sc= 1.42 USER MOD Set 2.1: B 11 MET CE :methyl -117:sc= -2.65 (180deg=-7.47!) USER MOD Set 2.2: B 30 MET CE :methyl -149:sc= -3.34 (180deg=-7.21!) USER MOD Set 3.1: A 32 SER OG : rot 51:sc= 1.24 USER MOD Set 3.2: A 36 GLN : amide:sc= 0.963 K(o=2.2,f=-0.88) USER MOD Set 4.1: A 11 MET CE :methyl -109:sc= -1.75 (180deg=-7.33!) USER MOD Set 4.2: A 30 MET CE :methyl -173:sc= -5.35! (180deg=-5.33!) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 ASN : amide:sc= 0.0952 K(o=0.095,f=-2!) USER MOD Single : A 13 MET CE :methyl -179:sc= -0.179 (180deg=-0.186) USER MOD Single : A 18 LYS NZ :NH3+ -150:sc= 0.42 (180deg=0.108) USER MOD Single : A 20 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.0317) USER MOD Single : A 26 ASN : amide:sc= -2.77! C(o=-2.8!,f=-6.5!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0.573 K(o=0.57,f=-4.2!) USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 43 SER OG : rot -159:sc= 0.185 USER MOD Single : A 44 LYS NZ :NH3+ -164:sc= 0.109 (180deg=-0.0661) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot -46:sc= 0.789 USER MOD Single : A 53 ASN : amide:sc= 0.0158 K(o=0.016,f=-4.7!) USER MOD Single : A 62 GLN : amide:sc= 0.0324 X(o=0.032,f=0) USER MOD Single : A 63 SER OG : rot -30:sc= 0.683 USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 HIS : no HD1:sc= -0.0204 K(o=-0.02,f=-3.4!) USER MOD Single : B 8 ASN : amide:sc=-0.000906 X(o=-0.00091,f=-0.38) USER MOD Single : B 13 MET CE :methyl 137:sc= -0.211 (180deg=-0.972) USER MOD Single : B 18 LYS NZ :NH3+ -171:sc= 1.3 (180deg=1.21) USER MOD Single : B 20 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.00283) USER MOD Single : B 26 ASN : amide:sc= 1.13 K(o=1.1,f=-0.14) USER MOD Single : B 29 SER OG : rot 32:sc= 0.535 USER MOD Single : B 31 ASN : amide:sc= 0.529 K(o=0.53,f=-2.6!) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 36 GLN : amide:sc= -0.962 K(o=-0.96,f=-2.2) USER MOD Single : B 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 43 SER OG : rot -109:sc= 0.344 USER MOD Single : B 44 LYS NZ :NH3+ 174:sc= 0.111 (180deg=0.0322) USER MOD Single : B 46 SER OG : rot -154:sc= 1.16 USER MOD Single : B 49 THR OG1 : rot 180:sc= 0 USER MOD Single : B 51 TYR OH : rot 30:sc= -0.593 USER MOD Single : B 53 ASN : amide:sc= -0.726 K(o=-0.73,f=-6.4!) USER MOD Single : B 62 GLN : amide:sc= -1.7! K(o=-1.7!,f=-0.081) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 13.074 -17.199 -6.643 1.00 0.00 N ATOM 2 CA ALA A 1 14.397 -16.608 -6.339 1.00 0.00 C ATOM 3 C ALA A 1 15.621 -17.470 -6.789 1.00 0.00 C ATOM 4 O ALA A 1 15.646 -18.685 -6.599 1.00 0.00 O ATOM 5 CB ALA A 1 14.469 -16.404 -4.821 1.00 0.00 C ATOM 0 H1 ALA A 1 12.324 -16.560 -6.310 1.00 0.00 H new ATOM 0 H2 ALA A 1 12.982 -17.335 -7.670 1.00 0.00 H new ATOM 0 H3 ALA A 1 12.985 -18.117 -6.163 1.00 0.00 H new ATOM 0 HA ALA A 1 14.469 -15.679 -6.904 1.00 0.00 H new ATOM 0 HB1 ALA A 1 15.433 -15.969 -4.558 1.00 0.00 H new ATOM 0 HB2 ALA A 1 13.670 -15.733 -4.506 1.00 0.00 H new ATOM 0 HB3 ALA A 1 14.356 -17.365 -4.319 1.00 0.00 H new ATOM 6 N ARG A 2 16.778 -16.973 -7.246 1.00 0.00 N ATOM 7 CA ARG A 2 17.060 -15.541 -7.588 1.00 0.00 C ATOM 8 C ARG A 2 17.183 -14.590 -6.343 1.00 0.00 C ATOM 9 O ARG A 2 17.522 -14.989 -5.228 1.00 0.00 O ATOM 10 CB ARG A 2 16.206 -15.089 -8.835 1.00 0.00 C ATOM 11 CG ARG A 2 16.963 -14.459 -10.035 1.00 0.00 C ATOM 12 CD ARG A 2 17.570 -13.048 -9.845 1.00 0.00 C ATOM 13 NE ARG A 2 18.875 -13.064 -9.120 1.00 0.00 N ATOM 14 CZ ARG A 2 20.066 -13.305 -9.671 1.00 0.00 C ATOM 15 NH1 ARG A 2 20.250 -13.563 -10.931 1.00 0.00 N ATOM 16 NH2 ARG A 2 21.105 -13.289 -8.910 1.00 0.00 N ATOM 0 H ARG A 2 17.590 -17.571 -7.400 1.00 0.00 H new ATOM 0 HA ARG A 2 18.083 -15.441 -7.949 1.00 0.00 H new ATOM 0 HB2 ARG A 2 15.660 -15.959 -9.201 1.00 0.00 H new ATOM 0 HB3 ARG A 2 15.464 -14.369 -8.491 1.00 0.00 H new ATOM 0 HG2 ARG A 2 17.770 -15.136 -10.314 1.00 0.00 H new ATOM 0 HG3 ARG A 2 16.276 -14.417 -10.880 1.00 0.00 H new ATOM 0 HD2 ARG A 2 17.710 -12.585 -10.822 1.00 0.00 H new ATOM 0 HD3 ARG A 2 16.863 -12.426 -9.295 1.00 0.00 H new ATOM 0 HE ARG A 2 18.854 -12.875 -8.118 1.00 0.00 H new ATOM 0 HH11 ARG A 2 19.453 -13.591 -11.568 1.00 0.00 H new ATOM 0 HH12 ARG A 2 21.191 -13.738 -11.284 1.00 0.00 H new ATOM 0 HH21 ARG A 2 21.004 -13.096 -7.914 1.00 0.00 H new ATOM 0 HH22 ARG A 2 22.028 -13.470 -9.304 1.00 0.00 H new ATOM 17 N ASP A 3 16.906 -13.312 -6.558 1.00 0.00 N ATOM 18 CA ASP A 3 16.706 -12.294 -5.497 1.00 0.00 C ATOM 19 C ASP A 3 15.225 -11.796 -5.582 1.00 0.00 C ATOM 20 O ASP A 3 14.957 -10.623 -5.852 1.00 0.00 O ATOM 21 CB ASP A 3 17.786 -11.201 -5.749 1.00 0.00 C ATOM 22 CG ASP A 3 19.211 -11.592 -5.372 1.00 0.00 C ATOM 23 OD1 ASP A 3 19.835 -12.284 -6.368 1.00 0.00 O ATOM 24 OD2 ASP A 3 19.724 -11.305 -4.297 1.00 0.00 O ATOM 0 H ASP A 3 16.808 -12.928 -7.498 1.00 0.00 H new ATOM 0 HA ASP A 3 16.835 -12.660 -4.478 1.00 0.00 H new ATOM 0 HB2 ASP A 3 17.768 -10.933 -6.805 1.00 0.00 H new ATOM 0 HB3 ASP A 3 17.512 -10.307 -5.189 1.00 0.00 H new ATOM 25 N ASP A 4 14.252 -12.705 -5.366 1.00 0.00 N ATOM 26 CA ASP A 4 12.801 -12.390 -5.441 1.00 0.00 C ATOM 27 C ASP A 4 11.905 -13.460 -4.727 1.00 0.00 C ATOM 28 O ASP A 4 11.304 -14.292 -5.418 1.00 0.00 O ATOM 29 CB ASP A 4 12.357 -12.057 -6.892 1.00 0.00 C ATOM 30 CG ASP A 4 12.653 -13.042 -8.027 1.00 0.00 C ATOM 31 OD1 ASP A 4 11.998 -14.228 -7.887 1.00 0.00 O ATOM 32 OD2 ASP A 4 13.400 -12.774 -8.962 1.00 0.00 O ATOM 0 H ASP A 4 14.445 -13.679 -5.134 1.00 0.00 H new ATOM 0 HA ASP A 4 12.642 -11.477 -4.867 1.00 0.00 H new ATOM 0 HB2 ASP A 4 11.279 -11.898 -6.873 1.00 0.00 H new ATOM 0 HB3 ASP A 4 12.815 -11.105 -7.161 1.00 0.00 H new ATOM 33 N PRO A 5 11.797 -13.523 -3.372 1.00 0.00 N ATOM 34 CA PRO A 5 11.343 -14.753 -2.676 1.00 0.00 C ATOM 35 C PRO A 5 9.851 -14.716 -2.245 1.00 0.00 C ATOM 36 O PRO A 5 9.247 -13.659 -2.027 1.00 0.00 O ATOM 37 CB PRO A 5 12.338 -14.838 -1.494 1.00 0.00 C ATOM 38 CG PRO A 5 13.308 -13.672 -1.693 1.00 0.00 C ATOM 39 CD PRO A 5 12.496 -12.631 -2.430 1.00 0.00 C ATOM 0 HA PRO A 5 11.356 -15.638 -3.312 1.00 0.00 H new ATOM 0 HB2 PRO A 5 11.820 -14.759 -0.538 1.00 0.00 H new ATOM 0 HB3 PRO A 5 12.866 -15.792 -1.493 1.00 0.00 H new ATOM 0 HG2 PRO A 5 13.672 -13.290 -0.739 1.00 0.00 H new ATOM 0 HG3 PRO A 5 14.182 -13.976 -2.269 1.00 0.00 H new ATOM 0 HD2 PRO A 5 11.813 -12.087 -1.777 1.00 0.00 H new ATOM 0 HD3 PRO A 5 13.116 -11.888 -2.932 1.00 0.00 H new ATOM 40 N HIS A 6 9.303 -15.923 -2.111 1.00 0.00 N ATOM 41 CA HIS A 6 7.888 -16.156 -1.750 1.00 0.00 C ATOM 42 C HIS A 6 7.587 -15.928 -0.236 1.00 0.00 C ATOM 43 O HIS A 6 8.222 -16.520 0.644 1.00 0.00 O ATOM 44 CB HIS A 6 7.567 -17.637 -2.120 1.00 0.00 C ATOM 45 CG HIS A 6 7.505 -17.975 -3.608 1.00 0.00 C ATOM 46 ND1 HIS A 6 8.616 -18.237 -4.395 1.00 0.00 N ATOM 47 CD2 HIS A 6 6.330 -18.065 -4.360 1.00 0.00 C ATOM 48 CE1 HIS A 6 7.990 -18.462 -5.595 1.00 0.00 C ATOM 49 NE2 HIS A 6 6.623 -18.382 -5.675 1.00 0.00 N ATOM 0 H HIS A 6 9.830 -16.785 -2.250 1.00 0.00 H new ATOM 0 HA HIS A 6 7.269 -15.440 -2.292 1.00 0.00 H new ATOM 0 HB2 HIS A 6 8.321 -18.274 -1.658 1.00 0.00 H new ATOM 0 HB3 HIS A 6 6.609 -17.900 -1.671 1.00 0.00 H new ATOM 0 HD2 HIS A 6 5.335 -17.909 -3.970 1.00 0.00 H new ATOM 0 HE1 HIS A 6 8.571 -18.701 -6.473 1.00 0.00 H new ATOM 0 HE2 HIS A 6 6.002 -18.517 -6.473 1.00 0.00 H new ATOM 50 N PHE A 7 6.455 -15.288 0.072 1.00 0.00 N ATOM 51 CA PHE A 7 5.415 -16.002 0.851 1.00 0.00 C ATOM 52 C PHE A 7 4.118 -16.165 -0.002 1.00 0.00 C ATOM 53 O PHE A 7 3.904 -15.555 -1.056 1.00 0.00 O ATOM 54 CB PHE A 7 5.273 -15.428 2.288 1.00 0.00 C ATOM 55 CG PHE A 7 4.682 -14.027 2.528 1.00 0.00 C ATOM 56 CD1 PHE A 7 5.459 -12.865 2.390 1.00 0.00 C ATOM 57 CD2 PHE A 7 3.394 -13.915 3.070 1.00 0.00 C ATOM 58 CE1 PHE A 7 4.971 -11.641 2.825 1.00 0.00 C ATOM 59 CE2 PHE A 7 2.915 -12.684 3.480 1.00 0.00 C ATOM 60 CZ PHE A 7 3.712 -11.566 3.394 1.00 0.00 C ATOM 0 H PHE A 7 6.232 -14.327 -0.186 1.00 0.00 H new ATOM 0 HA PHE A 7 5.719 -17.029 1.053 1.00 0.00 H new ATOM 0 HB2 PHE A 7 4.664 -16.133 2.854 1.00 0.00 H new ATOM 0 HB3 PHE A 7 6.267 -15.436 2.734 1.00 0.00 H new ATOM 0 HD1 PHE A 7 6.441 -12.924 1.943 1.00 0.00 H new ATOM 0 HD2 PHE A 7 2.773 -14.793 3.168 1.00 0.00 H new ATOM 0 HE1 PHE A 7 5.572 -10.750 2.720 1.00 0.00 H new ATOM 0 HE2 PHE A 7 1.911 -12.600 3.869 1.00 0.00 H new ATOM 0 HZ PHE A 7 3.352 -10.621 3.774 1.00 0.00 H new ATOM 61 N ASN A 8 3.229 -17.049 0.440 1.00 0.00 N ATOM 62 CA ASN A 8 1.820 -17.033 -0.014 1.00 0.00 C ATOM 63 C ASN A 8 1.021 -15.970 0.810 1.00 0.00 C ATOM 64 O ASN A 8 0.417 -16.303 1.833 1.00 0.00 O ATOM 65 CB ASN A 8 1.267 -18.491 -0.010 1.00 0.00 C ATOM 66 CG ASN A 8 1.375 -19.357 1.260 1.00 0.00 C ATOM 67 OD1 ASN A 8 2.056 -19.062 2.234 1.00 0.00 O ATOM 68 ND2 ASN A 8 0.747 -20.502 1.269 1.00 0.00 N ATOM 0 H ASN A 8 3.446 -17.787 1.109 1.00 0.00 H new ATOM 0 HA ASN A 8 1.713 -16.704 -1.048 1.00 0.00 H new ATOM 0 HB2 ASN A 8 0.211 -18.437 -0.276 1.00 0.00 H new ATOM 0 HB3 ASN A 8 1.771 -19.030 -0.813 1.00 0.00 H new ATOM 0 HD21 ASN A 8 0.831 -21.124 2.073 1.00 0.00 H new ATOM 0 HD22 ASN A 8 0.172 -20.775 0.472 1.00 0.00 H new ATOM 69 N PHE A 9 0.972 -14.693 0.347 1.00 0.00 N ATOM 70 CA PHE A 9 -0.093 -13.762 0.784 1.00 0.00 C ATOM 71 C PHE A 9 -1.479 -14.241 0.260 1.00 0.00 C ATOM 72 O PHE A 9 -1.659 -15.300 -0.332 1.00 0.00 O ATOM 73 CB PHE A 9 0.327 -12.312 0.424 1.00 0.00 C ATOM 74 CG PHE A 9 -0.404 -11.184 1.184 1.00 0.00 C ATOM 75 CD1 PHE A 9 -0.440 -11.166 2.589 1.00 0.00 C ATOM 76 CD2 PHE A 9 -0.748 -10.012 0.501 1.00 0.00 C ATOM 77 CE1 PHE A 9 -0.772 -10.010 3.274 1.00 0.00 C ATOM 78 CE2 PHE A 9 -1.143 -8.874 1.188 1.00 0.00 C ATOM 79 CZ PHE A 9 -1.051 -8.856 2.563 1.00 0.00 C ATOM 0 H PHE A 9 1.641 -14.295 -0.312 1.00 0.00 H new ATOM 0 HA PHE A 9 -0.218 -13.759 1.867 1.00 0.00 H new ATOM 0 HB2 PHE A 9 1.397 -12.210 0.605 1.00 0.00 H new ATOM 0 HB3 PHE A 9 0.169 -12.164 -0.644 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -0.206 -12.065 3.140 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -0.705 -9.994 -0.578 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -0.813 -10.009 4.353 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -1.518 -8.014 0.653 1.00 0.00 H new ATOM 0 HZ PHE A 9 -1.199 -7.927 3.094 1.00 0.00 H new ATOM 80 N ARG A 10 -2.498 -13.626 0.799 1.00 0.00 N ATOM 81 CA ARG A 10 -3.497 -14.350 1.632 1.00 0.00 C ATOM 82 C ARG A 10 -4.202 -13.280 2.479 1.00 0.00 C ATOM 83 O ARG A 10 -3.587 -12.673 3.365 1.00 0.00 O ATOM 84 CB ARG A 10 -2.928 -15.495 2.521 1.00 0.00 C ATOM 85 CG ARG A 10 -3.893 -16.221 3.474 1.00 0.00 C ATOM 86 CD ARG A 10 -5.156 -16.838 2.857 1.00 0.00 C ATOM 87 NE ARG A 10 -5.801 -17.781 3.814 1.00 0.00 N ATOM 88 CZ ARG A 10 -6.722 -17.471 4.718 1.00 0.00 C ATOM 89 NH1 ARG A 10 -7.207 -16.281 4.904 1.00 0.00 N ATOM 90 NH2 ARG A 10 -7.154 -18.423 5.468 1.00 0.00 N ATOM 0 H ARG A 10 -2.682 -12.628 0.693 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.180 -14.879 0.967 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -2.487 -16.242 1.861 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -2.117 -15.080 3.120 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -3.339 -17.015 3.975 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -4.204 -15.514 4.243 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -5.858 -16.049 2.587 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -4.898 -17.364 1.938 1.00 0.00 H new ATOM 0 HE ARG A 10 -5.507 -18.757 3.770 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -6.880 -15.502 4.332 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -7.915 -16.125 5.622 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -6.788 -19.368 5.353 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -7.862 -18.232 6.177 1.00 0.00 H new ATOM 91 N MET A 11 -5.473 -13.025 2.172 1.00 0.00 N ATOM 92 CA MET A 11 -6.157 -11.827 2.752 1.00 0.00 C ATOM 93 C MET A 11 -7.409 -12.207 3.630 1.00 0.00 C ATOM 94 O MET A 11 -7.662 -13.383 3.919 1.00 0.00 O ATOM 95 CB MET A 11 -6.398 -10.809 1.594 1.00 0.00 C ATOM 96 CG MET A 11 -5.188 -10.272 0.767 1.00 0.00 C ATOM 97 SD MET A 11 -4.538 -11.523 -0.370 1.00 0.00 S ATOM 98 CE MET A 11 -3.303 -10.618 -1.335 1.00 0.00 C ATOM 0 H MET A 11 -6.048 -13.595 1.552 1.00 0.00 H new ATOM 0 HA MET A 11 -5.526 -11.327 3.487 1.00 0.00 H new ATOM 0 HB2 MET A 11 -7.091 -11.273 0.892 1.00 0.00 H new ATOM 0 HB3 MET A 11 -6.908 -9.946 2.021 1.00 0.00 H new ATOM 0 HG2 MET A 11 -5.497 -9.393 0.201 1.00 0.00 H new ATOM 0 HG3 MET A 11 -4.397 -9.953 1.446 1.00 0.00 H new ATOM 0 HE1 MET A 11 -3.668 -10.477 -2.352 1.00 0.00 H new ATOM 0 HE2 MET A 11 -3.124 -9.646 -0.876 1.00 0.00 H new ATOM 0 HE3 MET A 11 -2.373 -11.185 -1.359 1.00 0.00 H new ATOM 99 N PRO A 12 -8.266 -11.240 4.033 1.00 0.00 N ATOM 100 CA PRO A 12 -9.737 -11.445 3.886 1.00 0.00 C ATOM 101 C PRO A 12 -10.353 -10.771 2.614 1.00 0.00 C ATOM 102 O PRO A 12 -9.739 -9.954 1.908 1.00 0.00 O ATOM 103 CB PRO A 12 -10.296 -10.967 5.241 1.00 0.00 C ATOM 104 CG PRO A 12 -9.282 -9.948 5.757 1.00 0.00 C ATOM 105 CD PRO A 12 -7.938 -10.473 5.252 1.00 0.00 C ATOM 0 HA PRO A 12 -10.008 -12.483 3.691 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -11.282 -10.517 5.123 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -10.407 -11.799 5.937 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -9.490 -8.949 5.373 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -9.301 -9.882 6.845 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -7.251 -9.655 5.032 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -7.454 -11.104 5.998 1.00 0.00 H new ATOM 106 N MET A 13 -11.558 -11.249 2.250 1.00 0.00 N ATOM 107 CA MET A 13 -12.134 -11.033 0.885 1.00 0.00 C ATOM 108 C MET A 13 -12.337 -9.555 0.414 1.00 0.00 C ATOM 109 O MET A 13 -12.087 -9.273 -0.758 1.00 0.00 O ATOM 110 CB MET A 13 -13.372 -11.958 0.759 1.00 0.00 C ATOM 111 CG MET A 13 -14.138 -11.940 -0.585 1.00 0.00 C ATOM 112 SD MET A 13 -13.088 -11.834 -2.058 1.00 0.00 S ATOM 113 CE MET A 13 -12.199 -13.394 -2.084 1.00 0.00 C ATOM 0 H MET A 13 -12.160 -11.788 2.872 1.00 0.00 H new ATOM 0 HA MET A 13 -11.380 -11.316 0.151 1.00 0.00 H new ATOM 0 HB2 MET A 13 -13.049 -12.981 0.949 1.00 0.00 H new ATOM 0 HB3 MET A 13 -14.073 -11.693 1.550 1.00 0.00 H new ATOM 0 HG2 MET A 13 -14.745 -12.843 -0.653 1.00 0.00 H new ATOM 0 HG3 MET A 13 -14.825 -11.094 -0.584 1.00 0.00 H new ATOM 0 HE1 MET A 13 -11.521 -13.412 -2.938 1.00 0.00 H new ATOM 0 HE2 MET A 13 -11.626 -13.501 -1.163 1.00 0.00 H new ATOM 0 HE3 MET A 13 -12.910 -14.216 -2.167 1.00 0.00 H new ATOM 114 N GLU A 14 -12.667 -8.598 1.298 1.00 0.00 N ATOM 115 CA GLU A 14 -12.570 -7.151 0.956 1.00 0.00 C ATOM 116 C GLU A 14 -11.141 -6.611 0.615 1.00 0.00 C ATOM 117 O GLU A 14 -11.037 -5.867 -0.348 1.00 0.00 O ATOM 118 CB GLU A 14 -13.346 -6.271 1.973 1.00 0.00 C ATOM 119 CG GLU A 14 -12.639 -5.981 3.323 1.00 0.00 C ATOM 120 CD GLU A 14 -13.452 -5.117 4.280 1.00 0.00 C ATOM 121 OE1 GLU A 14 -13.267 -3.782 4.062 1.00 0.00 O ATOM 122 OE2 GLU A 14 -14.183 -5.584 5.147 1.00 0.00 O ATOM 0 H GLU A 14 -13.000 -8.786 2.244 1.00 0.00 H new ATOM 0 HA GLU A 14 -13.073 -7.065 -0.007 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -13.572 -5.318 1.495 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -14.299 -6.755 2.185 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -12.410 -6.928 3.811 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -11.688 -5.487 3.124 1.00 0.00 H new ATOM 123 N VAL A 15 -10.047 -6.960 1.319 1.00 0.00 N ATOM 124 CA VAL A 15 -8.654 -6.565 0.915 1.00 0.00 C ATOM 125 C VAL A 15 -8.252 -7.117 -0.464 1.00 0.00 C ATOM 126 O VAL A 15 -7.722 -6.351 -1.258 1.00 0.00 O ATOM 127 CB VAL A 15 -7.553 -7.022 1.931 1.00 0.00 C ATOM 128 CG1 VAL A 15 -6.412 -6.006 2.001 1.00 0.00 C ATOM 129 CG2 VAL A 15 -7.969 -7.328 3.381 1.00 0.00 C ATOM 0 H VAL A 15 -10.085 -7.515 2.174 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.699 -5.476 0.890 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.265 -7.981 1.501 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.662 -6.349 2.714 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.956 -5.903 1.016 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.803 -5.041 2.323 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -7.093 -7.630 3.955 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -8.407 -6.436 3.830 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.702 -8.134 3.387 1.00 0.00 H new ATOM 130 N ARG A 16 -8.447 -8.413 -0.749 1.00 0.00 N ATOM 131 CA ARG A 16 -8.181 -8.909 -2.110 1.00 0.00 C ATOM 132 C ARG A 16 -9.194 -8.468 -3.193 1.00 0.00 C ATOM 133 O ARG A 16 -8.727 -8.183 -4.280 1.00 0.00 O ATOM 134 CB ARG A 16 -7.910 -10.412 -2.128 1.00 0.00 C ATOM 135 CG ARG A 16 -6.902 -10.794 -3.231 1.00 0.00 C ATOM 136 CD ARG A 16 -7.201 -12.153 -3.842 1.00 0.00 C ATOM 137 NE ARG A 16 -6.158 -12.439 -4.845 1.00 0.00 N ATOM 138 CZ ARG A 16 -6.102 -13.541 -5.587 1.00 0.00 C ATOM 139 NH1 ARG A 16 -6.893 -14.565 -5.447 1.00 0.00 N ATOM 140 NH2 ARG A 16 -5.214 -13.591 -6.514 1.00 0.00 N ATOM 0 H ARG A 16 -8.775 -9.114 -0.085 1.00 0.00 H new ATOM 0 HA ARG A 16 -7.262 -8.403 -2.406 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -7.524 -10.724 -1.158 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -8.845 -10.949 -2.287 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -6.918 -10.035 -4.013 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -5.895 -10.800 -2.813 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -7.211 -12.924 -3.071 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -8.187 -12.154 -4.306 1.00 0.00 H new ATOM 0 HE ARG A 16 -5.427 -11.741 -4.979 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -7.617 -14.556 -4.729 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -6.789 -15.377 -6.056 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -4.584 -12.802 -6.659 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -5.139 -14.419 -7.105 1.00 0.00 H new ATOM 141 N GLU A 17 -10.502 -8.284 -2.965 1.00 0.00 N ATOM 142 CA GLU A 17 -11.321 -7.455 -3.896 1.00 0.00 C ATOM 143 C GLU A 17 -10.839 -5.975 -4.048 1.00 0.00 C ATOM 144 O GLU A 17 -10.774 -5.486 -5.165 1.00 0.00 O ATOM 145 CB GLU A 17 -12.812 -7.473 -3.510 1.00 0.00 C ATOM 146 CG GLU A 17 -13.558 -8.798 -3.787 1.00 0.00 C ATOM 147 CD GLU A 17 -15.044 -8.735 -3.459 1.00 0.00 C ATOM 148 OE1 GLU A 17 -15.756 -8.141 -4.459 1.00 0.00 O ATOM 149 OE2 GLU A 17 -15.531 -9.163 -2.419 1.00 0.00 O ATOM 0 H GLU A 17 -11.013 -8.678 -2.175 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.183 -7.929 -4.868 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.897 -7.245 -2.448 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -13.318 -6.672 -4.049 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -13.436 -9.062 -4.837 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -13.098 -9.595 -3.202 1.00 0.00 H new ATOM 150 N LYS A 18 -10.463 -5.266 -2.979 1.00 0.00 N ATOM 151 CA LYS A 18 -9.838 -3.924 -3.075 1.00 0.00 C ATOM 152 C LYS A 18 -8.443 -3.889 -3.786 1.00 0.00 C ATOM 153 O LYS A 18 -8.287 -3.115 -4.724 1.00 0.00 O ATOM 154 CB LYS A 18 -9.951 -3.231 -1.701 1.00 0.00 C ATOM 155 CG LYS A 18 -11.365 -2.883 -1.157 1.00 0.00 C ATOM 156 CD LYS A 18 -11.425 -2.262 0.264 1.00 0.00 C ATOM 157 CE LYS A 18 -10.602 -2.947 1.369 1.00 0.00 C ATOM 158 NZ LYS A 18 -10.914 -2.344 2.681 1.00 0.00 N ATOM 0 H LYS A 18 -10.579 -5.597 -2.021 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.397 -3.312 -3.783 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -9.462 -3.871 -0.966 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -9.378 -2.305 -1.749 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -11.837 -2.190 -1.853 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -11.965 -3.793 -1.157 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -11.097 -1.225 0.193 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -12.468 -2.246 0.581 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -10.822 -4.014 1.389 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -9.538 -2.845 1.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -10.079 -2.404 3.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -11.177 -1.346 2.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -11.706 -2.856 3.119 1.00 0.00 H new ATOM 159 N LEU A 19 -7.481 -4.746 -3.423 1.00 0.00 N ATOM 160 CA LEU A 19 -6.167 -4.921 -4.103 1.00 0.00 C ATOM 161 C LEU A 19 -6.254 -5.532 -5.547 1.00 0.00 C ATOM 162 O LEU A 19 -5.532 -5.104 -6.446 1.00 0.00 O ATOM 163 CB LEU A 19 -5.299 -5.612 -3.005 1.00 0.00 C ATOM 164 CG LEU A 19 -3.754 -5.542 -3.027 1.00 0.00 C ATOM 165 CD1 LEU A 19 -3.087 -4.161 -2.884 1.00 0.00 C ATOM 166 CD2 LEU A 19 -3.265 -6.475 -1.891 1.00 0.00 C ATOM 0 H LEU A 19 -7.588 -5.365 -2.619 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.675 -3.999 -4.413 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.620 -5.205 -2.046 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.567 -6.668 -3.009 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.455 -5.840 -4.032 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.004 -4.275 -2.918 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.410 -3.515 -3.700 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.375 -3.714 -1.932 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.176 -6.467 -1.857 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.660 -6.125 -0.937 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.615 -7.490 -2.078 1.00 0.00 H new ATOM 167 N LYS A 20 -7.146 -6.510 -5.790 1.00 0.00 N ATOM 168 CA LYS A 20 -7.332 -7.175 -7.089 1.00 0.00 C ATOM 169 C LYS A 20 -8.351 -6.450 -8.024 1.00 0.00 C ATOM 170 O LYS A 20 -8.196 -6.581 -9.230 1.00 0.00 O ATOM 171 CB LYS A 20 -7.708 -8.655 -6.892 1.00 0.00 C ATOM 172 CG LYS A 20 -7.610 -9.544 -8.144 1.00 0.00 C ATOM 173 CD LYS A 20 -7.908 -11.029 -7.884 1.00 0.00 C ATOM 174 CE LYS A 20 -9.207 -11.319 -7.114 1.00 0.00 C ATOM 175 NZ LYS A 20 -9.447 -12.773 -7.075 1.00 0.00 N ATOM 0 H LYS A 20 -7.772 -6.867 -5.069 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.372 -7.119 -7.603 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.062 -9.075 -6.120 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.729 -8.704 -6.514 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -8.305 -9.171 -8.896 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.608 -9.454 -8.563 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.951 -11.546 -8.843 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.074 -11.457 -7.328 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.136 -10.925 -6.100 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -10.046 -10.815 -7.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.443 -12.954 -6.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -9.233 -13.185 -8.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.835 -13.207 -6.355 1.00 0.00 H new ATOM 176 N PHE A 21 -9.349 -5.670 -7.545 1.00 0.00 N ATOM 177 CA PHE A 21 -9.945 -4.567 -8.348 1.00 0.00 C ATOM 178 C PHE A 21 -8.892 -3.499 -8.621 1.00 0.00 C ATOM 179 O PHE A 21 -8.453 -3.567 -9.745 1.00 0.00 O ATOM 180 CB PHE A 21 -11.218 -3.908 -7.760 1.00 0.00 C ATOM 181 CG PHE A 21 -12.472 -4.760 -7.697 1.00 0.00 C ATOM 182 CD1 PHE A 21 -12.785 -5.711 -8.669 1.00 0.00 C ATOM 183 CD2 PHE A 21 -13.312 -4.588 -6.601 1.00 0.00 C ATOM 184 CE1 PHE A 21 -13.874 -6.546 -8.494 1.00 0.00 C ATOM 185 CE2 PHE A 21 -14.408 -5.415 -6.427 1.00 0.00 C ATOM 186 CZ PHE A 21 -14.697 -6.404 -7.373 1.00 0.00 C ATOM 0 H PHE A 21 -9.757 -5.779 -6.617 1.00 0.00 H new ATOM 0 HA PHE A 21 -10.280 -5.046 -9.268 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -10.988 -3.570 -6.750 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -11.442 -3.019 -8.350 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -12.177 -5.795 -9.558 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -13.108 -3.807 -5.884 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -14.089 -7.310 -9.226 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -15.041 -5.297 -5.560 1.00 0.00 H new ATOM 0 HZ PHE A 21 -15.550 -7.053 -7.238 1.00 0.00 H new ATOM 187 N ARG A 22 -8.417 -2.602 -7.738 1.00 0.00 N ATOM 188 CA ARG A 22 -7.175 -1.780 -7.960 1.00 0.00 C ATOM 189 C ARG A 22 -6.236 -2.267 -9.146 1.00 0.00 C ATOM 190 O ARG A 22 -6.300 -1.671 -10.222 1.00 0.00 O ATOM 191 CB ARG A 22 -6.559 -1.599 -6.537 1.00 0.00 C ATOM 192 CG ARG A 22 -5.254 -0.786 -6.397 1.00 0.00 C ATOM 193 CD ARG A 22 -5.353 0.730 -6.223 1.00 0.00 C ATOM 194 NE ARG A 22 -5.265 1.188 -4.817 1.00 0.00 N ATOM 195 CZ ARG A 22 -5.616 2.405 -4.398 1.00 0.00 C ATOM 196 NH1 ARG A 22 -6.186 3.312 -5.135 1.00 0.00 N ATOM 197 NH2 ARG A 22 -5.362 2.721 -3.183 1.00 0.00 N ATOM 0 H ARG A 22 -8.871 -2.414 -6.844 1.00 0.00 H new ATOM 0 HA ARG A 22 -7.390 -0.796 -8.378 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -7.313 -1.127 -5.907 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -6.377 -2.592 -6.126 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -4.707 -1.183 -5.542 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -4.647 -0.979 -7.281 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -4.557 1.203 -6.798 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -6.298 1.072 -6.646 1.00 0.00 H new ATOM 0 HE ARG A 22 -4.913 0.529 -4.123 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -6.397 3.115 -6.113 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -6.422 4.220 -4.735 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -4.904 2.050 -2.567 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -5.618 3.644 -2.832 1.00 0.00 H new ATOM 198 N ALA A 23 -5.718 -3.514 -9.072 1.00 0.00 N ATOM 199 CA ALA A 23 -5.254 -4.320 -10.247 1.00 0.00 C ATOM 200 C ALA A 23 -6.190 -4.505 -11.511 1.00 0.00 C ATOM 201 O ALA A 23 -5.971 -3.839 -12.522 1.00 0.00 O ATOM 202 CB ALA A 23 -4.718 -5.629 -9.628 1.00 0.00 C ATOM 0 H ALA A 23 -5.605 -4.005 -8.185 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.499 -3.738 -10.775 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.355 -6.284 -10.420 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.901 -5.400 -8.944 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -5.519 -6.128 -9.083 1.00 0.00 H new ATOM 203 N GLU A 24 -7.188 -5.403 -11.469 1.00 0.00 N ATOM 204 CA GLU A 24 -8.145 -5.701 -12.589 1.00 0.00 C ATOM 205 C GLU A 24 -9.182 -4.603 -13.015 1.00 0.00 C ATOM 206 O GLU A 24 -9.502 -4.482 -14.198 1.00 0.00 O ATOM 207 CB GLU A 24 -8.908 -7.026 -12.292 1.00 0.00 C ATOM 208 CG GLU A 24 -8.034 -8.289 -12.090 1.00 0.00 C ATOM 209 CD GLU A 24 -8.800 -9.607 -12.140 1.00 0.00 C ATOM 210 OE1 GLU A 24 -9.053 -10.007 -13.415 1.00 0.00 O ATOM 211 OE2 GLU A 24 -9.144 -10.245 -11.152 1.00 0.00 O ATOM 0 H GLU A 24 -7.371 -5.967 -10.639 1.00 0.00 H new ATOM 0 HA GLU A 24 -7.479 -5.762 -13.450 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -9.511 -6.880 -11.396 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -9.598 -7.215 -13.114 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -7.259 -8.305 -12.857 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -7.528 -8.214 -11.127 1.00 0.00 H new ATOM 212 N ALA A 25 -9.691 -3.803 -12.067 1.00 0.00 N ATOM 213 CA ALA A 25 -10.182 -2.422 -12.312 1.00 0.00 C ATOM 214 C ALA A 25 -9.332 -1.549 -13.324 1.00 0.00 C ATOM 215 O ALA A 25 -9.901 -0.892 -14.196 1.00 0.00 O ATOM 216 CB ALA A 25 -10.161 -1.666 -10.964 1.00 0.00 C ATOM 0 H ALA A 25 -9.778 -4.093 -11.093 1.00 0.00 H new ATOM 0 HA ALA A 25 -11.169 -2.546 -12.758 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -10.517 -0.647 -11.113 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.808 -2.176 -10.251 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.143 -1.641 -10.576 1.00 0.00 H new ATOM 217 N ASN A 26 -7.980 -1.521 -13.157 1.00 0.00 N ATOM 218 CA ASN A 26 -7.068 -0.680 -13.980 1.00 0.00 C ATOM 219 C ASN A 26 -6.395 -1.373 -15.227 1.00 0.00 C ATOM 220 O ASN A 26 -6.363 -0.793 -16.314 1.00 0.00 O ATOM 221 CB ASN A 26 -6.102 -0.003 -12.951 1.00 0.00 C ATOM 222 CG ASN A 26 -4.642 -0.448 -12.885 1.00 0.00 C ATOM 223 OD1 ASN A 26 -3.846 -0.247 -13.790 1.00 0.00 O ATOM 224 ND2 ASN A 26 -4.242 -1.053 -11.812 1.00 0.00 N ATOM 0 H ASN A 26 -7.496 -2.077 -12.453 1.00 0.00 H new ATOM 0 HA ASN A 26 -7.634 0.071 -14.531 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -6.108 1.068 -13.153 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -6.531 -0.143 -11.959 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -3.272 -1.356 -11.729 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -4.897 -1.226 -11.050 1.00 0.00 H new ATOM 225 N GLY A 27 -5.748 -2.535 -15.029 1.00 0.00 N ATOM 226 CA GLY A 27 -4.577 -2.954 -15.867 1.00 0.00 C ATOM 227 C GLY A 27 -3.280 -3.504 -15.195 1.00 0.00 C ATOM 228 O GLY A 27 -2.457 -4.074 -15.913 1.00 0.00 O ATOM 0 H GLY A 27 -6.003 -3.206 -14.305 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -4.932 -3.720 -16.556 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.287 -2.093 -16.469 1.00 0.00 H new ATOM 229 N ARG A 28 -3.062 -3.377 -13.870 1.00 0.00 N ATOM 230 CA ARG A 28 -1.918 -4.036 -13.164 1.00 0.00 C ATOM 231 C ARG A 28 -2.461 -5.434 -12.692 1.00 0.00 C ATOM 232 O ARG A 28 -3.666 -5.633 -12.534 1.00 0.00 O ATOM 233 CB ARG A 28 -1.358 -3.045 -12.092 1.00 0.00 C ATOM 234 CG ARG A 28 -0.800 -1.670 -12.568 1.00 0.00 C ATOM 235 CD ARG A 28 -0.025 -0.752 -11.576 1.00 0.00 C ATOM 236 NE ARG A 28 -0.848 -0.107 -10.520 1.00 0.00 N ATOM 237 CZ ARG A 28 -0.449 0.691 -9.545 1.00 0.00 C ATOM 238 NH1 ARG A 28 0.750 1.130 -9.391 1.00 0.00 N ATOM 239 NH2 ARG A 28 -1.333 1.054 -8.690 1.00 0.00 N ATOM 0 H ARG A 28 -3.660 -2.824 -13.256 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.036 -4.253 -13.767 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -2.155 -2.849 -11.374 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -0.561 -3.557 -11.552 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -0.138 -1.865 -13.412 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -1.643 -1.094 -12.950 1.00 0.00 H new ATOM 0 HD2 ARG A 28 0.753 -1.344 -11.094 1.00 0.00 H new ATOM 0 HD3 ARG A 28 0.477 0.029 -12.148 1.00 0.00 H new ATOM 0 HE ARG A 28 -1.848 -0.305 -10.552 1.00 0.00 H new ATOM 0 HH11 ARG A 28 1.479 0.864 -10.053 1.00 0.00 H new ATOM 0 HH12 ARG A 28 0.972 1.744 -8.607 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -2.295 0.727 -8.781 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -1.074 1.670 -7.919 1.00 0.00 H new ATOM 240 N SER A 29 -1.629 -6.469 -12.557 1.00 0.00 N ATOM 241 CA SER A 29 -2.142 -7.867 -12.362 1.00 0.00 C ATOM 242 C SER A 29 -1.555 -8.365 -11.033 1.00 0.00 C ATOM 243 O SER A 29 -0.343 -8.509 -10.980 1.00 0.00 O ATOM 244 CB SER A 29 -1.748 -8.711 -13.595 1.00 0.00 C ATOM 245 OG SER A 29 -2.273 -10.035 -13.480 1.00 0.00 O ATOM 0 H SER A 29 -0.612 -6.390 -12.576 1.00 0.00 H new ATOM 0 HA SER A 29 -3.228 -7.934 -12.293 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.127 -8.240 -14.502 1.00 0.00 H new ATOM 0 HB3 SER A 29 -0.662 -8.750 -13.685 1.00 0.00 H new ATOM 0 HG SER A 29 -2.017 -10.558 -14.268 1.00 0.00 H new ATOM 246 N MET A 30 -2.309 -8.474 -9.925 1.00 0.00 N ATOM 247 CA MET A 30 -1.795 -8.098 -8.574 1.00 0.00 C ATOM 248 C MET A 30 -0.325 -8.417 -8.162 1.00 0.00 C ATOM 249 O MET A 30 0.319 -7.558 -7.594 1.00 0.00 O ATOM 250 CB MET A 30 -2.690 -8.670 -7.474 1.00 0.00 C ATOM 251 CG MET A 30 -3.595 -7.731 -6.712 1.00 0.00 C ATOM 252 SD MET A 30 -3.128 -7.925 -4.997 1.00 0.00 S ATOM 253 CE MET A 30 -4.670 -8.497 -4.384 1.00 0.00 C ATOM 0 H MET A 30 -3.270 -8.815 -9.926 1.00 0.00 H new ATOM 0 HA MET A 30 -1.812 -7.013 -8.677 1.00 0.00 H new ATOM 0 HB2 MET A 30 -3.317 -9.439 -7.925 1.00 0.00 H new ATOM 0 HB3 MET A 30 -2.046 -9.168 -6.750 1.00 0.00 H new ATOM 0 HG2 MET A 30 -3.463 -6.701 -7.043 1.00 0.00 H new ATOM 0 HG3 MET A 30 -4.644 -7.983 -6.866 1.00 0.00 H new ATOM 0 HE1 MET A 30 -4.628 -8.562 -3.297 1.00 0.00 H new ATOM 0 HE2 MET A 30 -5.458 -7.803 -4.676 1.00 0.00 H new ATOM 0 HE3 MET A 30 -4.883 -9.482 -4.798 1.00 0.00 H new ATOM 254 N ASN A 31 0.273 -9.584 -8.387 1.00 0.00 N ATOM 255 CA ASN A 31 1.758 -9.698 -8.257 1.00 0.00 C ATOM 256 C ASN A 31 2.573 -8.517 -8.963 1.00 0.00 C ATOM 257 O ASN A 31 3.277 -7.793 -8.262 1.00 0.00 O ATOM 258 CB ASN A 31 2.157 -11.148 -8.629 1.00 0.00 C ATOM 259 CG ASN A 31 3.594 -11.587 -8.362 1.00 0.00 C ATOM 260 OD1 ASN A 31 4.201 -12.264 -9.180 1.00 0.00 O ATOM 261 ND2 ASN A 31 4.176 -11.270 -7.236 1.00 0.00 N ATOM 0 H ASN A 31 -0.208 -10.444 -8.651 1.00 0.00 H new ATOM 0 HA ASN A 31 2.062 -9.535 -7.223 1.00 0.00 H new ATOM 0 HB2 ASN A 31 1.495 -11.825 -8.089 1.00 0.00 H new ATOM 0 HB3 ASN A 31 1.957 -11.287 -9.692 1.00 0.00 H new ATOM 0 HD21 ASN A 31 5.127 -11.587 -7.047 1.00 0.00 H new ATOM 0 HD22 ASN A 31 3.679 -10.706 -6.546 1.00 0.00 H new ATOM 262 N SER A 32 2.244 -8.155 -10.223 1.00 0.00 N ATOM 263 CA SER A 32 2.269 -6.731 -10.706 1.00 0.00 C ATOM 264 C SER A 32 1.596 -5.638 -9.811 1.00 0.00 C ATOM 265 O SER A 32 2.338 -4.861 -9.211 1.00 0.00 O ATOM 266 CB SER A 32 1.933 -6.662 -12.219 1.00 0.00 C ATOM 267 OG SER A 32 1.802 -5.314 -12.687 1.00 0.00 O ATOM 0 H SER A 32 1.955 -8.824 -10.937 1.00 0.00 H new ATOM 0 HA SER A 32 3.304 -6.413 -10.578 1.00 0.00 H new ATOM 0 HB2 SER A 32 2.716 -7.166 -12.786 1.00 0.00 H new ATOM 0 HB3 SER A 32 1.005 -7.201 -12.408 1.00 0.00 H new ATOM 0 HG SER A 32 2.589 -4.796 -12.418 1.00 0.00 H new ATOM 268 N GLU A 33 0.263 -5.508 -9.689 1.00 0.00 N ATOM 269 CA GLU A 33 -0.311 -4.340 -8.941 1.00 0.00 C ATOM 270 C GLU A 33 -0.028 -4.196 -7.433 1.00 0.00 C ATOM 271 O GLU A 33 0.409 -3.121 -7.025 1.00 0.00 O ATOM 272 CB GLU A 33 -1.835 -4.279 -9.020 1.00 0.00 C ATOM 273 CG GLU A 33 -2.398 -2.862 -8.734 1.00 0.00 C ATOM 274 CD GLU A 33 -2.635 -2.524 -7.267 1.00 0.00 C ATOM 275 OE1 GLU A 33 -3.183 -3.275 -6.465 1.00 0.00 O ATOM 276 OE2 GLU A 33 -2.172 -1.285 -6.962 1.00 0.00 O ATOM 0 H GLU A 33 -0.423 -6.157 -10.074 1.00 0.00 H new ATOM 0 HA GLU A 33 0.220 -3.547 -9.468 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.155 -4.598 -10.012 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.259 -4.984 -8.305 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.708 -2.127 -9.149 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.341 -2.752 -9.269 1.00 0.00 H new ATOM 277 N LEU A 34 -0.345 -5.233 -6.613 1.00 0.00 N ATOM 278 CA LEU A 34 0.164 -5.396 -5.235 1.00 0.00 C ATOM 279 C LEU A 34 1.636 -4.898 -5.223 1.00 0.00 C ATOM 280 O LEU A 34 1.865 -3.945 -4.506 1.00 0.00 O ATOM 281 CB LEU A 34 0.001 -6.881 -4.770 1.00 0.00 C ATOM 282 CG LEU A 34 -0.331 -7.272 -3.300 1.00 0.00 C ATOM 283 CD1 LEU A 34 -0.030 -8.728 -2.913 1.00 0.00 C ATOM 284 CD2 LEU A 34 0.190 -6.449 -2.123 1.00 0.00 C ATOM 0 H LEU A 34 -0.970 -5.986 -6.900 1.00 0.00 H new ATOM 0 HA LEU A 34 -0.405 -4.804 -4.519 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.781 -7.317 -5.391 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.931 -7.390 -5.024 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.392 -7.049 -3.411 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.299 -8.890 -1.869 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -0.610 -9.400 -3.546 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.033 -8.928 -3.049 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.155 -6.891 -1.189 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.280 -6.440 -2.139 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -0.182 -5.427 -2.200 1.00 0.00 H new ATOM 285 N LEU A 35 2.585 -5.355 -6.102 1.00 0.00 N ATOM 286 CA LEU A 35 3.959 -4.799 -6.073 1.00 0.00 C ATOM 287 C LEU A 35 4.083 -3.302 -6.387 1.00 0.00 C ATOM 288 O LEU A 35 4.715 -2.575 -5.633 1.00 0.00 O ATOM 289 CB LEU A 35 4.942 -5.557 -6.994 1.00 0.00 C ATOM 290 CG LEU A 35 5.590 -6.821 -6.421 1.00 0.00 C ATOM 291 CD1 LEU A 35 6.584 -7.327 -7.451 1.00 0.00 C ATOM 292 CD2 LEU A 35 6.310 -6.490 -5.100 1.00 0.00 C ATOM 0 H LEU A 35 2.425 -6.075 -6.806 1.00 0.00 H new ATOM 0 HA LEU A 35 4.227 -4.940 -5.026 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.411 -5.831 -7.906 1.00 0.00 H new ATOM 0 HB3 LEU A 35 5.737 -4.869 -7.283 1.00 0.00 H new ATOM 0 HG LEU A 35 4.838 -7.582 -6.211 1.00 0.00 H new ATOM 0 HD11 LEU A 35 7.067 -8.230 -7.077 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.061 -7.553 -8.380 1.00 0.00 H new ATOM 0 HD13 LEU A 35 7.338 -6.562 -7.636 1.00 0.00 H new ATOM 0 HD21 LEU A 35 6.768 -7.394 -4.699 1.00 0.00 H new ATOM 0 HD22 LEU A 35 7.082 -5.743 -5.284 1.00 0.00 H new ATOM 0 HD23 LEU A 35 5.590 -6.099 -4.381 1.00 0.00 H new ATOM 293 N GLN A 36 3.518 -2.847 -7.497 1.00 0.00 N ATOM 294 CA GLN A 36 3.628 -1.424 -7.904 1.00 0.00 C ATOM 295 C GLN A 36 2.964 -0.423 -6.926 1.00 0.00 C ATOM 296 O GLN A 36 3.571 0.627 -6.688 1.00 0.00 O ATOM 297 CB GLN A 36 3.129 -1.226 -9.354 1.00 0.00 C ATOM 298 CG GLN A 36 4.088 -1.594 -10.507 1.00 0.00 C ATOM 299 CD GLN A 36 4.309 -3.079 -10.768 1.00 0.00 C ATOM 300 OE1 GLN A 36 3.782 -3.687 -11.695 1.00 0.00 O ATOM 301 NE2 GLN A 36 5.081 -3.710 -9.930 1.00 0.00 N ATOM 0 H GLN A 36 2.978 -3.427 -8.139 1.00 0.00 H new ATOM 0 HA GLN A 36 4.691 -1.186 -7.863 1.00 0.00 H new ATOM 0 HB2 GLN A 36 2.218 -1.812 -9.477 1.00 0.00 H new ATOM 0 HB3 GLN A 36 2.852 -0.178 -9.472 1.00 0.00 H new ATOM 0 HG2 GLN A 36 3.708 -1.141 -11.423 1.00 0.00 H new ATOM 0 HG3 GLN A 36 5.056 -1.137 -10.303 1.00 0.00 H new ATOM 0 HE21 GLN A 36 5.519 -3.204 -9.160 1.00 0.00 H new ATOM 0 HE22 GLN A 36 5.248 -4.710 -10.044 1.00 0.00 H new ATOM 302 N ILE A 37 1.820 -0.752 -6.286 1.00 0.00 N ATOM 303 CA ILE A 37 1.425 -0.023 -5.066 1.00 0.00 C ATOM 304 C ILE A 37 2.274 -0.370 -3.815 1.00 0.00 C ATOM 305 O ILE A 37 2.521 0.578 -3.141 1.00 0.00 O ATOM 306 CB ILE A 37 -0.104 -0.106 -4.771 1.00 0.00 C ATOM 307 CG1 ILE A 37 -0.586 1.031 -3.834 1.00 0.00 C ATOM 308 CG2 ILE A 37 -0.474 -1.475 -4.164 1.00 0.00 C ATOM 309 CD1 ILE A 37 -2.099 1.272 -3.820 1.00 0.00 C ATOM 0 H ILE A 37 1.178 -1.488 -6.580 1.00 0.00 H new ATOM 0 HA ILE A 37 1.649 1.019 -5.294 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.612 0.013 -5.728 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.262 0.804 -2.818 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -0.090 1.956 -4.128 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.546 -1.508 -3.967 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.209 -2.267 -4.864 1.00 0.00 H new ATOM 0 HG23 ILE A 37 0.071 -1.619 -3.231 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -2.331 2.087 -3.134 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.435 1.535 -4.823 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.609 0.366 -3.493 1.00 0.00 H new ATOM 310 N VAL A 38 2.660 -1.585 -3.429 1.00 0.00 N ATOM 311 CA VAL A 38 3.442 -1.927 -2.181 1.00 0.00 C ATOM 312 C VAL A 38 4.881 -1.348 -2.163 1.00 0.00 C ATOM 313 O VAL A 38 5.288 -0.722 -1.182 1.00 0.00 O ATOM 314 CB VAL A 38 3.605 -3.478 -2.134 1.00 0.00 C ATOM 315 CG1 VAL A 38 4.739 -4.214 -1.381 1.00 0.00 C ATOM 316 CG2 VAL A 38 2.306 -4.163 -1.745 1.00 0.00 C ATOM 0 H VAL A 38 2.441 -2.413 -3.982 1.00 0.00 H new ATOM 0 HA VAL A 38 2.890 -1.504 -1.341 1.00 0.00 H new ATOM 0 HB VAL A 38 3.934 -3.576 -3.168 1.00 0.00 H new ATOM 0 HG11 VAL A 38 4.621 -5.290 -1.508 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.704 -3.904 -1.783 1.00 0.00 H new ATOM 0 HG13 VAL A 38 4.692 -3.966 -0.321 1.00 0.00 H new ATOM 0 HG21 VAL A 38 2.456 -5.242 -1.722 1.00 0.00 H new ATOM 0 HG22 VAL A 38 1.995 -3.819 -0.759 1.00 0.00 H new ATOM 0 HG23 VAL A 38 1.534 -3.920 -2.475 1.00 0.00 H new ATOM 317 N GLN A 39 5.651 -1.572 -3.267 1.00 0.00 N ATOM 318 CA GLN A 39 6.819 -0.741 -3.618 1.00 0.00 C ATOM 319 C GLN A 39 6.435 0.737 -3.489 1.00 0.00 C ATOM 320 O GLN A 39 6.973 1.314 -2.553 1.00 0.00 O ATOM 321 CB GLN A 39 7.311 -1.032 -5.064 1.00 0.00 C ATOM 322 CG GLN A 39 8.007 -2.377 -5.332 1.00 0.00 C ATOM 323 CD GLN A 39 8.404 -2.607 -6.790 1.00 0.00 C ATOM 324 OE1 GLN A 39 7.930 -3.508 -7.470 1.00 0.00 O ATOM 325 NE2 GLN A 39 9.296 -1.813 -7.323 1.00 0.00 N ATOM 0 H GLN A 39 5.474 -2.329 -3.927 1.00 0.00 H new ATOM 0 HA GLN A 39 7.634 -0.982 -2.935 1.00 0.00 H new ATOM 0 HB2 GLN A 39 6.451 -0.962 -5.730 1.00 0.00 H new ATOM 0 HB3 GLN A 39 8.000 -0.237 -5.349 1.00 0.00 H new ATOM 0 HG2 GLN A 39 8.901 -2.439 -4.711 1.00 0.00 H new ATOM 0 HG3 GLN A 39 7.344 -3.183 -5.018 1.00 0.00 H new ATOM 0 HE21 GLN A 39 9.701 -1.057 -6.771 1.00 0.00 H new ATOM 0 HE22 GLN A 39 9.587 -1.949 -8.291 1.00 0.00 H new ATOM 326 N ASP A 40 5.400 1.274 -4.195 1.00 0.00 N ATOM 327 CA ASP A 40 4.795 2.574 -3.770 1.00 0.00 C ATOM 328 C ASP A 40 4.671 2.867 -2.247 1.00 0.00 C ATOM 329 O ASP A 40 5.204 3.852 -1.727 1.00 0.00 O ATOM 330 CB ASP A 40 3.627 3.130 -4.625 1.00 0.00 C ATOM 331 CG ASP A 40 3.472 4.643 -4.475 1.00 0.00 C ATOM 332 OD1 ASP A 40 4.400 5.329 -5.202 1.00 0.00 O ATOM 333 OD2 ASP A 40 2.652 5.162 -3.727 1.00 0.00 O ATOM 0 H ASP A 40 4.981 0.852 -5.024 1.00 0.00 H new ATOM 0 HA ASP A 40 5.636 3.207 -4.051 1.00 0.00 H new ATOM 0 HB2 ASP A 40 3.798 2.886 -5.673 1.00 0.00 H new ATOM 0 HB3 ASP A 40 2.699 2.640 -4.331 1.00 0.00 H new ATOM 334 N ALA A 41 3.999 1.945 -1.582 1.00 0.00 N ATOM 335 CA ALA A 41 3.204 2.236 -0.394 1.00 0.00 C ATOM 336 C ALA A 41 3.927 2.281 0.969 1.00 0.00 C ATOM 337 O ALA A 41 3.489 2.969 1.893 1.00 0.00 O ATOM 338 CB ALA A 41 1.962 1.330 -0.505 1.00 0.00 C ATOM 0 H ALA A 41 3.987 0.961 -1.851 1.00 0.00 H new ATOM 0 HA ALA A 41 2.916 3.287 -0.389 1.00 0.00 H new ATOM 0 HB1 ALA A 41 1.314 1.493 0.356 1.00 0.00 H new ATOM 0 HB2 ALA A 41 1.418 1.569 -1.419 1.00 0.00 H new ATOM 0 HB3 ALA A 41 2.274 0.286 -0.531 1.00 0.00 H new ATOM 339 N LEU A 42 5.099 1.662 1.044 1.00 0.00 N ATOM 340 CA LEU A 42 6.178 2.159 1.935 1.00 0.00 C ATOM 341 C LEU A 42 7.272 3.063 1.315 1.00 0.00 C ATOM 342 O LEU A 42 7.674 4.036 1.966 1.00 0.00 O ATOM 343 CB LEU A 42 6.717 1.026 2.847 1.00 0.00 C ATOM 344 CG LEU A 42 7.272 -0.242 2.148 1.00 0.00 C ATOM 345 CD1 LEU A 42 8.287 -0.921 3.055 1.00 0.00 C ATOM 346 CD2 LEU A 42 6.197 -1.296 1.831 1.00 0.00 C ATOM 0 H LEU A 42 5.339 0.825 0.513 1.00 0.00 H new ATOM 0 HA LEU A 42 5.678 2.895 2.565 1.00 0.00 H new ATOM 0 HB2 LEU A 42 7.508 1.442 3.471 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.913 0.719 3.515 1.00 0.00 H new ATOM 0 HG LEU A 42 7.706 0.107 1.211 1.00 0.00 H new ATOM 0 HD11 LEU A 42 8.676 -1.812 2.563 1.00 0.00 H new ATOM 0 HD12 LEU A 42 9.107 -0.233 3.262 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.806 -1.205 3.991 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.661 -2.153 1.343 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.720 -1.619 2.756 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.447 -0.863 1.169 1.00 0.00 H new ATOM 347 N SER A 43 7.801 2.765 0.123 1.00 0.00 N ATOM 348 CA SER A 43 8.926 3.554 -0.436 1.00 0.00 C ATOM 349 C SER A 43 9.126 3.105 -1.891 1.00 0.00 C ATOM 350 O SER A 43 10.027 2.300 -2.153 1.00 0.00 O ATOM 351 CB SER A 43 10.227 3.401 0.416 1.00 0.00 C ATOM 352 OG SER A 43 11.378 3.902 -0.273 1.00 0.00 O ATOM 0 H SER A 43 7.482 1.999 -0.471 1.00 0.00 H new ATOM 0 HA SER A 43 8.690 4.618 -0.407 1.00 0.00 H new ATOM 0 HB2 SER A 43 10.108 3.934 1.359 1.00 0.00 H new ATOM 0 HB3 SER A 43 10.379 2.350 0.661 1.00 0.00 H new ATOM 0 HG SER A 43 12.188 3.506 0.112 1.00 0.00 H new ATOM 353 N LYS A 44 8.340 3.646 -2.842 1.00 0.00 N ATOM 354 CA LYS A 44 8.646 3.335 -4.309 1.00 0.00 C ATOM 355 C LYS A 44 10.146 3.209 -4.864 1.00 0.00 C ATOM 356 O LYS A 44 10.367 2.274 -5.645 1.00 0.00 O ATOM 357 CB LYS A 44 7.786 4.163 -5.309 1.00 0.00 C ATOM 358 CG LYS A 44 7.089 3.488 -6.522 1.00 0.00 C ATOM 359 CD LYS A 44 7.931 2.627 -7.480 1.00 0.00 C ATOM 360 CE LYS A 44 7.089 2.142 -8.672 1.00 0.00 C ATOM 361 NZ LYS A 44 7.891 1.259 -9.536 1.00 0.00 N ATOM 0 H LYS A 44 7.541 4.258 -2.674 1.00 0.00 H new ATOM 0 HA LYS A 44 8.354 2.286 -4.262 1.00 0.00 H new ATOM 0 HB2 LYS A 44 7.006 4.655 -4.727 1.00 0.00 H new ATOM 0 HB3 LYS A 44 8.429 4.948 -5.708 1.00 0.00 H new ATOM 0 HG2 LYS A 44 6.287 2.860 -6.134 1.00 0.00 H new ATOM 0 HG3 LYS A 44 6.620 4.275 -7.112 1.00 0.00 H new ATOM 0 HD2 LYS A 44 8.781 3.205 -7.842 1.00 0.00 H new ATOM 0 HD3 LYS A 44 8.335 1.769 -6.943 1.00 0.00 H new ATOM 0 HE2 LYS A 44 6.209 1.609 -8.312 1.00 0.00 H new ATOM 0 HE3 LYS A 44 6.731 2.997 -9.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 7.422 1.156 -10.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 8.836 1.671 -9.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 7.982 0.325 -9.088 1.00 0.00 H new ATOM 362 N PRO A 45 11.190 4.049 -4.563 1.00 0.00 N ATOM 363 CA PRO A 45 12.424 4.120 -5.397 1.00 0.00 C ATOM 364 C PRO A 45 13.348 2.871 -5.564 1.00 0.00 C ATOM 365 O PRO A 45 13.448 1.987 -4.716 1.00 0.00 O ATOM 366 CB PRO A 45 13.151 5.384 -4.889 1.00 0.00 C ATOM 367 CG PRO A 45 12.485 5.745 -3.563 1.00 0.00 C ATOM 368 CD PRO A 45 11.056 5.235 -3.709 1.00 0.00 C ATOM 0 HA PRO A 45 12.111 4.158 -6.440 1.00 0.00 H new ATOM 0 HB2 PRO A 45 14.216 5.194 -4.752 1.00 0.00 H new ATOM 0 HB3 PRO A 45 13.062 6.200 -5.606 1.00 0.00 H new ATOM 0 HG2 PRO A 45 12.992 5.273 -2.722 1.00 0.00 H new ATOM 0 HG3 PRO A 45 12.508 6.820 -3.386 1.00 0.00 H new ATOM 0 HD2 PRO A 45 10.621 4.984 -2.742 1.00 0.00 H new ATOM 0 HD3 PRO A 45 10.409 5.984 -4.165 1.00 0.00 H new ATOM 369 N SER A 46 13.907 2.625 -6.754 1.00 0.00 N ATOM 370 CA SER A 46 14.367 3.714 -7.681 1.00 0.00 C ATOM 371 C SER A 46 13.351 4.324 -8.712 1.00 0.00 C ATOM 372 O SER A 46 13.459 5.541 -8.885 1.00 0.00 O ATOM 373 CB SER A 46 15.610 3.289 -8.479 1.00 0.00 C ATOM 374 OG SER A 46 16.652 2.795 -7.636 1.00 0.00 O ATOM 0 H SER A 46 14.061 1.684 -7.116 1.00 0.00 H new ATOM 0 HA SER A 46 14.554 4.508 -6.958 1.00 0.00 H new ATOM 0 HB2 SER A 46 15.332 2.519 -9.198 1.00 0.00 H new ATOM 0 HB3 SER A 46 15.981 4.140 -9.051 1.00 0.00 H new ATOM 0 HG SER A 46 17.421 2.535 -8.185 1.00 0.00 H new ATOM 375 N PRO A 47 12.427 3.618 -9.445 1.00 0.00 N ATOM 376 CA PRO A 47 11.658 4.250 -10.554 1.00 0.00 C ATOM 377 C PRO A 47 10.646 5.350 -10.147 1.00 0.00 C ATOM 378 O PRO A 47 9.613 5.055 -9.548 1.00 0.00 O ATOM 379 CB PRO A 47 11.043 3.044 -11.296 1.00 0.00 C ATOM 380 CG PRO A 47 11.897 1.844 -10.889 1.00 0.00 C ATOM 381 CD PRO A 47 12.312 2.145 -9.450 1.00 0.00 C ATOM 0 HA PRO A 47 12.307 4.850 -11.192 1.00 0.00 H new ATOM 0 HB2 PRO A 47 10.000 2.899 -11.014 1.00 0.00 H new ATOM 0 HB3 PRO A 47 11.064 3.194 -12.375 1.00 0.00 H new ATOM 0 HG2 PRO A 47 11.332 0.914 -10.954 1.00 0.00 H new ATOM 0 HG3 PRO A 47 12.765 1.735 -11.539 1.00 0.00 H new ATOM 0 HD2 PRO A 47 11.570 1.795 -8.733 1.00 0.00 H new ATOM 0 HD3 PRO A 47 13.256 1.665 -9.192 1.00 0.00 H new ATOM 382 N VAL A 48 10.950 6.646 -10.203 1.00 0.00 N ATOM 383 CA VAL A 48 11.899 7.325 -11.160 1.00 0.00 C ATOM 384 C VAL A 48 12.308 8.700 -10.523 1.00 0.00 C ATOM 385 O VAL A 48 13.436 8.910 -10.077 1.00 0.00 O ATOM 386 CB VAL A 48 11.413 7.454 -12.657 1.00 0.00 C ATOM 387 CG1 VAL A 48 11.606 6.163 -13.471 1.00 0.00 C ATOM 388 CG2 VAL A 48 9.956 7.940 -12.868 1.00 0.00 C ATOM 0 H VAL A 48 10.530 7.312 -9.555 1.00 0.00 H new ATOM 0 HA VAL A 48 12.765 6.674 -11.278 1.00 0.00 H new ATOM 0 HB VAL A 48 12.070 8.242 -13.024 1.00 0.00 H new ATOM 0 HG11 VAL A 48 11.252 6.319 -14.490 1.00 0.00 H new ATOM 0 HG12 VAL A 48 12.664 5.900 -13.490 1.00 0.00 H new ATOM 0 HG13 VAL A 48 11.039 5.354 -13.010 1.00 0.00 H new ATOM 0 HG21 VAL A 48 9.739 7.988 -13.935 1.00 0.00 H new ATOM 0 HG22 VAL A 48 9.267 7.244 -12.389 1.00 0.00 H new ATOM 0 HG23 VAL A 48 9.835 8.930 -12.428 1.00 0.00 H new ATOM 389 N THR A 49 11.333 9.601 -10.404 1.00 0.00 N ATOM 390 CA THR A 49 11.341 10.819 -9.533 1.00 0.00 C ATOM 391 C THR A 49 11.257 10.624 -7.970 1.00 0.00 C ATOM 392 O THR A 49 10.566 11.353 -7.245 1.00 0.00 O ATOM 393 CB THR A 49 10.101 11.614 -10.074 1.00 0.00 C ATOM 394 OG1 THR A 49 9.986 12.866 -9.409 1.00 0.00 O ATOM 395 CG2 THR A 49 8.755 10.867 -9.880 1.00 0.00 C ATOM 0 H THR A 49 10.464 9.514 -10.931 1.00 0.00 H new ATOM 0 HA THR A 49 12.311 11.311 -9.607 1.00 0.00 H new ATOM 0 HB THR A 49 10.281 11.737 -11.142 1.00 0.00 H new ATOM 0 HG1 THR A 49 10.100 12.736 -8.444 1.00 0.00 H new ATOM 0 HG21 THR A 49 7.941 11.474 -10.277 1.00 0.00 H new ATOM 0 HG22 THR A 49 8.788 9.915 -10.409 1.00 0.00 H new ATOM 0 HG23 THR A 49 8.589 10.687 -8.818 1.00 0.00 H new ATOM 396 N GLY A 50 11.943 9.608 -7.467 1.00 0.00 N ATOM 397 CA GLY A 50 11.468 8.858 -6.272 1.00 0.00 C ATOM 398 C GLY A 50 10.737 7.562 -6.699 1.00 0.00 C ATOM 399 O GLY A 50 11.360 6.694 -7.297 1.00 0.00 O ATOM 0 H GLY A 50 12.826 9.272 -7.851 1.00 0.00 H new ATOM 0 HA2 GLY A 50 12.314 8.611 -5.631 1.00 0.00 H new ATOM 0 HA3 GLY A 50 10.796 9.485 -5.686 1.00 0.00 H new ATOM 400 N TYR A 51 9.459 7.259 -6.509 1.00 0.00 N ATOM 401 CA TYR A 51 8.448 8.066 -5.770 1.00 0.00 C ATOM 402 C TYR A 51 8.446 7.724 -4.226 1.00 0.00 C ATOM 403 O TYR A 51 7.968 6.658 -3.847 1.00 0.00 O ATOM 404 CB TYR A 51 7.075 7.705 -6.432 1.00 0.00 C ATOM 405 CG TYR A 51 6.720 8.254 -7.827 1.00 0.00 C ATOM 406 CD1 TYR A 51 7.056 7.552 -8.989 1.00 0.00 C ATOM 407 CD2 TYR A 51 5.886 9.368 -7.930 1.00 0.00 C ATOM 408 CE1 TYR A 51 6.543 7.950 -10.225 1.00 0.00 C ATOM 409 CE2 TYR A 51 5.381 9.769 -9.164 1.00 0.00 C ATOM 410 CZ TYR A 51 5.700 9.052 -10.308 1.00 0.00 C ATOM 411 OH TYR A 51 5.151 9.416 -11.506 1.00 0.00 O ATOM 0 H TYR A 51 9.059 6.397 -6.881 1.00 0.00 H new ATOM 0 HA TYR A 51 8.663 9.133 -5.832 1.00 0.00 H new ATOM 0 HB2 TYR A 51 7.019 6.618 -6.489 1.00 0.00 H new ATOM 0 HB3 TYR A 51 6.291 8.029 -5.748 1.00 0.00 H new ATOM 0 HD1 TYR A 51 7.715 6.698 -8.930 1.00 0.00 H new ATOM 0 HD2 TYR A 51 5.629 9.926 -7.042 1.00 0.00 H new ATOM 0 HE1 TYR A 51 6.802 7.401 -11.118 1.00 0.00 H new ATOM 0 HE2 TYR A 51 4.742 10.637 -9.230 1.00 0.00 H new ATOM 0 HH TYR A 51 4.315 8.924 -11.646 1.00 0.00 H new ATOM 412 N ARG A 52 8.972 8.554 -3.303 1.00 0.00 N ATOM 413 CA ARG A 52 9.043 8.181 -1.842 1.00 0.00 C ATOM 414 C ARG A 52 7.681 8.421 -1.074 1.00 0.00 C ATOM 415 O ARG A 52 6.654 7.908 -1.496 1.00 0.00 O ATOM 416 CB ARG A 52 10.383 8.794 -1.324 1.00 0.00 C ATOM 417 CG ARG A 52 10.809 8.573 0.152 1.00 0.00 C ATOM 418 CD ARG A 52 10.755 7.133 0.689 1.00 0.00 C ATOM 419 NE ARG A 52 11.115 7.187 2.132 1.00 0.00 N ATOM 420 CZ ARG A 52 11.937 6.354 2.766 1.00 0.00 C ATOM 421 NH1 ARG A 52 12.508 5.321 2.227 1.00 0.00 N ATOM 422 NH2 ARG A 52 12.181 6.589 4.007 1.00 0.00 N ATOM 0 H ARG A 52 9.352 9.475 -3.520 1.00 0.00 H new ATOM 0 HA ARG A 52 9.111 7.112 -1.638 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.183 8.408 -1.955 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.335 9.870 -1.492 1.00 0.00 H new ATOM 0 HG2 ARG A 52 11.829 8.939 0.268 1.00 0.00 H new ATOM 0 HG3 ARG A 52 10.174 9.194 0.784 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.759 6.710 0.557 1.00 0.00 H new ATOM 0 HD3 ARG A 52 11.448 6.493 0.143 1.00 0.00 H new ATOM 0 HE ARG A 52 10.693 7.932 2.687 1.00 0.00 H new ATOM 0 HH11 ARG A 52 12.338 5.098 1.246 1.00 0.00 H new ATOM 0 HH12 ARG A 52 13.126 4.732 2.784 1.00 0.00 H new ATOM 0 HH21 ARG A 52 11.750 7.390 4.469 1.00 0.00 H new ATOM 0 HH22 ARG A 52 12.806 5.975 4.529 1.00 0.00 H new ATOM 423 N ASN A 53 7.639 9.078 0.092 1.00 0.00 N ATOM 424 CA ASN A 53 6.688 10.205 0.414 1.00 0.00 C ATOM 425 C ASN A 53 5.190 9.906 0.660 1.00 0.00 C ATOM 426 O ASN A 53 4.488 9.507 -0.257 1.00 0.00 O ATOM 427 CB ASN A 53 6.944 11.495 -0.456 1.00 0.00 C ATOM 428 CG ASN A 53 8.419 11.917 -0.528 1.00 0.00 C ATOM 429 OD1 ASN A 53 9.001 12.209 -1.560 1.00 0.00 O ATOM 430 ND2 ASN A 53 9.089 11.765 0.585 1.00 0.00 N ATOM 0 H ASN A 53 8.266 8.855 0.865 1.00 0.00 H new ATOM 0 HA ASN A 53 6.986 10.412 1.442 1.00 0.00 H new ATOM 0 HB2 ASN A 53 6.578 11.317 -1.467 1.00 0.00 H new ATOM 0 HB3 ASN A 53 6.360 12.319 -0.046 1.00 0.00 H new ATOM 0 HD21 ASN A 53 10.101 11.891 0.592 1.00 0.00 H new ATOM 0 HD22 ASN A 53 8.599 11.521 1.446 1.00 0.00 H new ATOM 431 N ASP A 54 4.703 10.057 1.915 1.00 0.00 N ATOM 432 CA ASP A 54 3.306 9.686 2.354 1.00 0.00 C ATOM 433 C ASP A 54 2.617 8.318 1.993 1.00 0.00 C ATOM 434 O ASP A 54 1.734 7.763 2.631 1.00 0.00 O ATOM 435 CB ASP A 54 2.606 10.859 3.102 1.00 0.00 C ATOM 436 CG ASP A 54 1.276 11.482 2.668 1.00 0.00 C ATOM 437 OD1 ASP A 54 0.802 11.433 1.543 1.00 0.00 O ATOM 438 OD2 ASP A 54 0.659 12.096 3.709 1.00 0.00 O ATOM 0 H ASP A 54 5.265 10.444 2.673 1.00 0.00 H new ATOM 0 HA ASP A 54 3.015 8.682 2.662 1.00 0.00 H new ATOM 0 HB2 ASP A 54 2.463 10.522 4.129 1.00 0.00 H new ATOM 0 HB3 ASP A 54 3.328 11.675 3.132 1.00 0.00 H new ATOM 439 N ALA A 55 3.420 7.502 1.373 1.00 0.00 N ATOM 440 CA ALA A 55 4.191 6.472 2.103 1.00 0.00 C ATOM 441 C ALA A 55 4.312 6.408 3.689 1.00 0.00 C ATOM 442 O ALA A 55 3.663 5.622 4.388 1.00 0.00 O ATOM 443 CB ALA A 55 5.534 6.872 1.410 1.00 0.00 C ATOM 0 H ALA A 55 3.575 7.510 0.365 1.00 0.00 H new ATOM 0 HA ALA A 55 3.741 5.481 2.038 1.00 0.00 H new ATOM 0 HB1 ALA A 55 6.338 6.235 1.780 1.00 0.00 H new ATOM 0 HB2 ALA A 55 5.438 6.746 0.331 1.00 0.00 H new ATOM 0 HB3 ALA A 55 5.763 7.914 1.635 1.00 0.00 H new ATOM 444 N GLU A 56 5.064 7.371 4.242 1.00 0.00 N ATOM 445 CA GLU A 56 4.949 7.868 5.638 1.00 0.00 C ATOM 446 C GLU A 56 3.526 8.355 6.169 1.00 0.00 C ATOM 447 O GLU A 56 3.371 8.656 7.351 1.00 0.00 O ATOM 448 CB GLU A 56 6.036 8.976 5.754 1.00 0.00 C ATOM 449 CG GLU A 56 7.538 8.568 5.678 1.00 0.00 C ATOM 450 CD GLU A 56 8.146 8.384 4.285 1.00 0.00 C ATOM 451 OE1 GLU A 56 7.771 8.993 3.286 1.00 0.00 O ATOM 452 OE2 GLU A 56 9.163 7.481 4.291 1.00 0.00 O ATOM 0 H GLU A 56 5.798 7.848 3.718 1.00 0.00 H new ATOM 0 HA GLU A 56 5.094 7.016 6.302 1.00 0.00 H new ATOM 0 HB2 GLU A 56 5.851 9.703 4.963 1.00 0.00 H new ATOM 0 HB3 GLU A 56 5.882 9.491 6.702 1.00 0.00 H new ATOM 0 HG2 GLU A 56 8.120 9.325 6.203 1.00 0.00 H new ATOM 0 HG3 GLU A 56 7.662 7.634 6.226 1.00 0.00 H new ATOM 453 N ARG A 57 2.474 8.322 5.349 1.00 0.00 N ATOM 454 CA ARG A 57 1.042 8.401 5.776 1.00 0.00 C ATOM 455 C ARG A 57 0.416 7.030 6.104 1.00 0.00 C ATOM 456 O ARG A 57 -0.353 6.932 7.046 1.00 0.00 O ATOM 457 CB ARG A 57 0.162 8.908 4.620 1.00 0.00 C ATOM 458 CG ARG A 57 -1.090 9.747 4.897 1.00 0.00 C ATOM 459 CD ARG A 57 -1.721 9.926 3.512 1.00 0.00 C ATOM 460 NE ARG A 57 -2.751 10.989 3.530 1.00 0.00 N ATOM 461 CZ ARG A 57 -3.582 11.263 2.535 1.00 0.00 C ATOM 462 NH1 ARG A 57 -3.604 10.632 1.398 1.00 0.00 N ATOM 463 NH2 ARG A 57 -4.418 12.220 2.720 1.00 0.00 N ATOM 0 H ARG A 57 2.578 8.238 4.338 1.00 0.00 H new ATOM 0 HA ARG A 57 1.064 9.051 6.651 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.803 9.496 3.964 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.157 8.033 4.053 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.768 9.240 5.583 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -0.837 10.706 5.349 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.948 10.177 2.786 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -2.169 8.986 3.189 1.00 0.00 H new ATOM 0 HE ARG A 57 -2.827 11.555 4.375 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -2.950 9.868 1.226 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.275 10.901 0.678 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.421 12.731 3.603 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -5.079 12.469 1.984 1.00 0.00 H new ATOM 464 N LEU A 58 0.686 5.989 5.297 1.00 0.00 N ATOM 465 CA LEU A 58 0.279 4.595 5.625 1.00 0.00 C ATOM 466 C LEU A 58 0.940 4.084 6.964 1.00 0.00 C ATOM 467 O LEU A 58 0.252 3.660 7.909 1.00 0.00 O ATOM 468 CB LEU A 58 0.600 3.777 4.343 1.00 0.00 C ATOM 469 CG LEU A 58 -0.353 3.925 3.117 1.00 0.00 C ATOM 470 CD1 LEU A 58 -0.721 5.339 2.639 1.00 0.00 C ATOM 471 CD2 LEU A 58 0.294 3.235 1.921 1.00 0.00 C ATOM 0 H LEU A 58 1.184 6.078 4.411 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.781 4.493 5.857 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.605 4.047 4.018 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.627 2.723 4.619 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.284 3.489 3.479 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.389 5.270 1.780 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -1.220 5.877 3.445 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.185 5.873 2.352 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.357 3.327 1.052 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.254 3.704 1.706 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.448 2.180 2.149 1.00 0.00 H new ATOM 472 N ALA A 59 2.257 4.356 7.111 1.00 0.00 N ATOM 473 CA ALA A 59 2.869 4.646 8.432 1.00 0.00 C ATOM 474 C ALA A 59 2.060 5.457 9.473 1.00 0.00 C ATOM 475 O ALA A 59 1.730 4.874 10.501 1.00 0.00 O ATOM 476 CB ALA A 59 4.147 5.453 8.125 1.00 0.00 C ATOM 0 H ALA A 59 2.917 4.381 6.334 1.00 0.00 H new ATOM 0 HA ALA A 59 2.990 3.673 8.908 1.00 0.00 H new ATOM 0 HB1 ALA A 59 4.652 5.703 9.058 1.00 0.00 H new ATOM 0 HB2 ALA A 59 4.812 4.857 7.500 1.00 0.00 H new ATOM 0 HB3 ALA A 59 3.881 6.370 7.600 1.00 0.00 H new ATOM 477 N ASP A 60 1.737 6.747 9.259 1.00 0.00 N ATOM 478 CA ASP A 60 1.001 7.515 10.296 1.00 0.00 C ATOM 479 C ASP A 60 -0.533 7.268 10.402 1.00 0.00 C ATOM 480 O ASP A 60 -1.176 7.817 11.297 1.00 0.00 O ATOM 481 CB ASP A 60 1.332 8.999 10.081 1.00 0.00 C ATOM 482 CG ASP A 60 2.656 9.445 10.701 1.00 0.00 C ATOM 483 OD1 ASP A 60 3.750 8.952 10.446 1.00 0.00 O ATOM 484 OD2 ASP A 60 2.480 10.481 11.559 1.00 0.00 O ATOM 0 H ASP A 60 1.961 7.269 8.412 1.00 0.00 H new ATOM 0 HA ASP A 60 1.345 7.150 11.263 1.00 0.00 H new ATOM 0 HB2 ASP A 60 1.359 9.202 9.010 1.00 0.00 H new ATOM 0 HB3 ASP A 60 0.527 9.603 10.499 1.00 0.00 H new ATOM 485 N GLU A 61 -1.089 6.370 9.590 1.00 0.00 N ATOM 486 CA GLU A 61 -2.392 5.734 9.853 1.00 0.00 C ATOM 487 C GLU A 61 -2.225 4.677 10.974 1.00 0.00 C ATOM 488 O GLU A 61 -2.718 4.950 12.080 1.00 0.00 O ATOM 489 CB GLU A 61 -3.026 5.262 8.511 1.00 0.00 C ATOM 490 CG GLU A 61 -4.536 4.911 8.598 1.00 0.00 C ATOM 491 CD GLU A 61 -5.132 4.291 7.330 1.00 0.00 C ATOM 492 OE1 GLU A 61 -4.981 3.111 7.033 1.00 0.00 O ATOM 493 OE2 GLU A 61 -5.868 5.170 6.589 1.00 0.00 O ATOM 0 H GLU A 61 -0.650 6.057 8.724 1.00 0.00 H new ATOM 0 HA GLU A 61 -3.129 6.431 10.252 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -2.891 6.045 7.765 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -2.483 4.386 8.156 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -4.685 4.219 9.427 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -5.091 5.818 8.836 1.00 0.00 H new ATOM 494 N GLN A 62 -1.464 3.556 10.823 1.00 0.00 N ATOM 495 CA GLN A 62 -1.306 2.664 11.980 1.00 0.00 C ATOM 496 C GLN A 62 -0.431 3.313 13.077 1.00 0.00 C ATOM 497 O GLN A 62 -0.920 3.511 14.179 1.00 0.00 O ATOM 498 CB GLN A 62 -0.815 1.298 11.494 1.00 0.00 C ATOM 499 CG GLN A 62 -0.506 0.286 12.626 1.00 0.00 C ATOM 500 CD GLN A 62 -1.664 -0.159 13.531 1.00 0.00 C ATOM 501 OE1 GLN A 62 -2.078 -1.311 13.532 1.00 0.00 O ATOM 502 NE2 GLN A 62 -2.195 0.711 14.361 1.00 0.00 N ATOM 0 H GLN A 62 -0.985 3.271 9.969 1.00 0.00 H new ATOM 0 HA GLN A 62 -2.267 2.498 12.467 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -1.570 0.868 10.836 1.00 0.00 H new ATOM 0 HB3 GLN A 62 0.085 1.441 10.896 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -0.078 -0.606 12.169 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.266 0.721 13.261 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -1.861 1.675 14.372 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -2.941 0.422 14.994 1.00 0.00 H new ATOM 503 N SER A 63 0.818 3.639 12.775 1.00 0.00 N ATOM 504 CA SER A 63 1.707 4.404 13.656 1.00 0.00 C ATOM 505 C SER A 63 1.599 5.965 13.592 1.00 0.00 C ATOM 506 O SER A 63 2.600 6.666 13.738 1.00 0.00 O ATOM 507 CB SER A 63 3.071 3.688 13.453 1.00 0.00 C ATOM 508 OG SER A 63 4.112 4.374 14.149 1.00 0.00 O ATOM 0 H SER A 63 1.257 3.376 11.893 1.00 0.00 H new ATOM 0 HA SER A 63 1.430 4.384 14.710 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.004 2.660 13.810 1.00 0.00 H new ATOM 0 HB3 SER A 63 3.308 3.641 12.390 1.00 0.00 H new ATOM 0 HG SER A 63 3.904 5.331 14.189 1.00 0.00 H new ATOM 509 N GLU A 64 0.379 6.545 13.587 1.00 0.00 N ATOM 510 CA GLU A 64 -0.105 7.333 14.759 1.00 0.00 C ATOM 511 C GLU A 64 -0.967 6.494 15.757 1.00 0.00 C ATOM 512 O GLU A 64 -0.687 6.523 16.959 1.00 0.00 O ATOM 513 CB GLU A 64 -0.884 8.592 14.295 1.00 0.00 C ATOM 514 CG GLU A 64 0.015 9.723 13.739 1.00 0.00 C ATOM 515 CD GLU A 64 -0.745 10.850 13.060 1.00 0.00 C ATOM 516 OE1 GLU A 64 -1.384 10.417 11.938 1.00 0.00 O ATOM 517 OE2 GLU A 64 -0.774 12.004 13.472 1.00 0.00 O ATOM 0 H GLU A 64 -0.279 6.490 12.810 1.00 0.00 H new ATOM 0 HA GLU A 64 0.787 7.643 15.304 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -1.600 8.300 13.526 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -1.460 8.980 15.135 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.603 10.139 14.557 1.00 0.00 H new ATOM 0 HG3 GLU A 64 0.719 9.294 13.026 1.00 0.00 H new ATOM 518 N LEU A 65 -2.020 5.788 15.300 1.00 0.00 N ATOM 519 CA LEU A 65 -3.086 5.243 16.200 1.00 0.00 C ATOM 520 C LEU A 65 -2.673 4.082 17.183 1.00 0.00 C ATOM 521 O LEU A 65 -3.318 3.901 18.217 1.00 0.00 O ATOM 522 CB LEU A 65 -4.318 4.892 15.310 1.00 0.00 C ATOM 523 CG LEU A 65 -4.787 5.973 14.292 1.00 0.00 C ATOM 524 CD1 LEU A 65 -5.832 5.432 13.310 1.00 0.00 C ATOM 525 CD2 LEU A 65 -5.272 7.280 14.938 1.00 0.00 C ATOM 0 H LEU A 65 -2.166 5.575 14.313 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.327 6.027 16.918 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -4.087 3.982 14.756 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -5.156 4.660 15.968 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.887 6.227 13.732 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.127 6.223 12.621 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -5.407 4.601 12.748 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.706 5.087 13.862 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.580 7.978 14.160 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -6.118 7.070 15.593 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -4.463 7.720 15.520 1.00 0.00 H new ATOM 526 N VAL A 66 -1.557 3.381 16.903 1.00 0.00 N ATOM 527 CA VAL A 66 -0.759 2.560 17.887 1.00 0.00 C ATOM 528 C VAL A 66 -0.684 3.080 19.377 1.00 0.00 C ATOM 529 O VAL A 66 -0.918 2.309 20.311 1.00 0.00 O ATOM 530 CB VAL A 66 0.686 2.204 17.342 1.00 0.00 C ATOM 531 CG1 VAL A 66 0.742 1.423 16.006 1.00 0.00 C ATOM 532 CG2 VAL A 66 1.660 3.405 17.221 1.00 0.00 C ATOM 0 H VAL A 66 -1.159 3.357 15.964 1.00 0.00 H new ATOM 0 HA VAL A 66 -1.361 1.654 17.960 1.00 0.00 H new ATOM 0 HB VAL A 66 1.018 1.542 18.141 1.00 0.00 H new ATOM 0 HG11 VAL A 66 1.782 1.238 15.736 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.222 0.472 16.118 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.262 2.009 15.222 1.00 0.00 H new ATOM 0 HG21 VAL A 66 2.620 3.058 16.840 1.00 0.00 H new ATOM 0 HG22 VAL A 66 1.244 4.144 16.536 1.00 0.00 H new ATOM 0 HG23 VAL A 66 1.802 3.859 18.202 1.00 0.00 H new TER 533 VAL A 66 ATOM 534 N ALA B 1 -13.177 -21.813 6.449 1.00 0.00 N ATOM 535 CA ALA B 1 -13.128 -21.448 5.015 1.00 0.00 C ATOM 536 C ALA B 1 -12.192 -20.240 4.709 1.00 0.00 C ATOM 537 O ALA B 1 -12.248 -19.190 5.359 1.00 0.00 O ATOM 538 CB ALA B 1 -14.571 -21.166 4.565 1.00 0.00 C ATOM 0 H1 ALA B 1 -13.817 -22.622 6.580 1.00 0.00 H new ATOM 0 H2 ALA B 1 -12.223 -22.070 6.775 1.00 0.00 H new ATOM 0 H3 ALA B 1 -13.525 -21.004 7.002 1.00 0.00 H new ATOM 0 HA ALA B 1 -12.696 -22.278 4.456 1.00 0.00 H new ATOM 0 HB1 ALA B 1 -14.576 -20.893 3.510 1.00 0.00 H new ATOM 0 HB2 ALA B 1 -15.179 -22.059 4.712 1.00 0.00 H new ATOM 0 HB3 ALA B 1 -14.982 -20.346 5.154 1.00 0.00 H new ATOM 539 N ARG B 2 -11.376 -20.360 3.649 1.00 0.00 N ATOM 540 CA ARG B 2 -10.558 -19.227 3.134 1.00 0.00 C ATOM 541 C ARG B 2 -11.386 -18.259 2.221 1.00 0.00 C ATOM 542 O ARG B 2 -11.447 -18.400 0.998 1.00 0.00 O ATOM 543 CB ARG B 2 -9.234 -19.766 2.525 1.00 0.00 C ATOM 544 CG ARG B 2 -9.300 -20.667 1.264 1.00 0.00 C ATOM 545 CD ARG B 2 -7.918 -21.177 0.817 1.00 0.00 C ATOM 546 NE ARG B 2 -8.082 -21.815 -0.514 1.00 0.00 N ATOM 547 CZ ARG B 2 -7.141 -21.954 -1.437 1.00 0.00 C ATOM 548 NH1 ARG B 2 -5.909 -21.562 -1.308 1.00 0.00 N ATOM 549 NH2 ARG B 2 -7.482 -22.518 -2.540 1.00 0.00 N ATOM 0 H ARG B 2 -11.259 -21.227 3.125 1.00 0.00 H new ATOM 0 HA ARG B 2 -10.261 -18.582 3.961 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -8.609 -18.906 2.283 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -8.718 -20.327 3.304 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -9.948 -21.520 1.467 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -9.756 -20.107 0.448 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -7.206 -20.354 0.761 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -7.523 -21.892 1.538 1.00 0.00 H new ATOM 0 HE ARG B 2 -9.007 -22.181 -0.739 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -5.606 -21.109 -0.446 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -5.245 -21.707 -2.069 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -8.442 -22.836 -2.675 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -6.793 -22.648 -3.281 1.00 0.00 H new ATOM 550 N ASP B 3 -12.042 -17.249 2.820 1.00 0.00 N ATOM 551 CA ASP B 3 -12.503 -16.047 2.073 1.00 0.00 C ATOM 552 C ASP B 3 -11.754 -14.813 2.683 1.00 0.00 C ATOM 553 O ASP B 3 -12.276 -14.093 3.533 1.00 0.00 O ATOM 554 CB ASP B 3 -14.050 -15.948 2.130 1.00 0.00 C ATOM 555 CG ASP B 3 -14.807 -16.914 1.223 1.00 0.00 C ATOM 556 OD1 ASP B 3 -14.653 -18.211 1.609 1.00 0.00 O ATOM 557 OD2 ASP B 3 -15.478 -16.548 0.265 1.00 0.00 O ATOM 0 H ASP B 3 -12.268 -17.233 3.815 1.00 0.00 H new ATOM 0 HA ASP B 3 -12.263 -16.097 1.011 1.00 0.00 H new ATOM 0 HB2 ASP B 3 -14.369 -16.118 3.158 1.00 0.00 H new ATOM 0 HB3 ASP B 3 -14.341 -14.930 1.870 1.00 0.00 H new ATOM 558 N ASP B 4 -10.465 -14.572 2.427 1.00 0.00 N ATOM 559 CA ASP B 4 -9.860 -14.702 1.092 1.00 0.00 C ATOM 560 C ASP B 4 -8.998 -15.998 0.983 1.00 0.00 C ATOM 561 O ASP B 4 -8.378 -16.415 1.963 1.00 0.00 O ATOM 562 CB ASP B 4 -8.946 -13.486 0.845 1.00 0.00 C ATOM 563 CG ASP B 4 -8.412 -13.305 -0.556 1.00 0.00 C ATOM 564 OD1 ASP B 4 -9.129 -13.220 -1.542 1.00 0.00 O ATOM 565 OD2 ASP B 4 -7.056 -13.228 -0.590 1.00 0.00 O ATOM 0 H ASP B 4 -9.803 -14.278 3.145 1.00 0.00 H new ATOM 0 HA ASP B 4 -10.660 -14.753 0.354 1.00 0.00 H new ATOM 0 HB2 ASP B 4 -9.498 -12.586 1.116 1.00 0.00 H new ATOM 0 HB3 ASP B 4 -8.097 -13.556 1.525 1.00 0.00 H new ATOM 566 N PRO B 5 -8.852 -16.561 -0.231 1.00 0.00 N ATOM 567 CA PRO B 5 -7.735 -17.474 -0.560 1.00 0.00 C ATOM 568 C PRO B 5 -6.297 -16.839 -0.531 1.00 0.00 C ATOM 569 O PRO B 5 -6.057 -15.702 -0.082 1.00 0.00 O ATOM 570 CB PRO B 5 -8.223 -18.009 -1.934 1.00 0.00 C ATOM 571 CG PRO B 5 -9.709 -17.651 -2.018 1.00 0.00 C ATOM 572 CD PRO B 5 -9.816 -16.348 -1.316 1.00 0.00 C ATOM 0 HA PRO B 5 -7.557 -18.253 0.181 1.00 0.00 H new ATOM 0 HB2 PRO B 5 -7.664 -17.553 -2.752 1.00 0.00 H new ATOM 0 HB3 PRO B 5 -8.076 -19.086 -2.009 1.00 0.00 H new ATOM 0 HG2 PRO B 5 -10.041 -17.573 -3.053 1.00 0.00 H new ATOM 0 HG3 PRO B 5 -10.328 -18.411 -1.541 1.00 0.00 H new ATOM 0 HD2 PRO B 5 -9.545 -15.507 -1.955 1.00 0.00 H new ATOM 0 HD3 PRO B 5 -10.823 -16.156 -0.946 1.00 0.00 H new ATOM 573 N HIS B 6 -5.349 -17.662 -0.994 1.00 0.00 N ATOM 574 CA HIS B 6 -3.915 -17.302 -1.118 1.00 0.00 C ATOM 575 C HIS B 6 -3.570 -16.815 -2.582 1.00 0.00 C ATOM 576 O HIS B 6 -4.037 -17.413 -3.559 1.00 0.00 O ATOM 577 CB HIS B 6 -3.065 -18.580 -0.830 1.00 0.00 C ATOM 578 CG HIS B 6 -3.128 -19.194 0.569 1.00 0.00 C ATOM 579 ND1 HIS B 6 -4.095 -20.109 0.958 1.00 0.00 N ATOM 580 CD2 HIS B 6 -2.243 -18.935 1.626 1.00 0.00 C ATOM 581 CE1 HIS B 6 -3.722 -20.286 2.266 1.00 0.00 C ATOM 582 NE2 HIS B 6 -2.601 -19.665 2.745 1.00 0.00 N ATOM 0 H HIS B 6 -5.551 -18.614 -1.300 1.00 0.00 H new ATOM 0 HA HIS B 6 -3.697 -16.498 -0.415 1.00 0.00 H new ATOM 0 HB2 HIS B 6 -3.366 -19.347 -1.543 1.00 0.00 H new ATOM 0 HB3 HIS B 6 -2.023 -18.340 -1.041 1.00 0.00 H new ATOM 0 HD2 HIS B 6 -1.401 -18.261 1.574 1.00 0.00 H new ATOM 0 HE1 HIS B 6 -4.312 -20.914 2.917 1.00 0.00 H new ATOM 0 HE2 HIS B 6 -2.158 -19.723 3.662 1.00 0.00 H new ATOM 583 N PHE B 7 -2.649 -15.851 -2.780 1.00 0.00 N ATOM 584 CA PHE B 7 -1.732 -15.875 -3.961 1.00 0.00 C ATOM 585 C PHE B 7 -0.219 -15.706 -3.563 1.00 0.00 C ATOM 586 O PHE B 7 0.146 -15.225 -2.484 1.00 0.00 O ATOM 587 CB PHE B 7 -2.252 -14.934 -5.091 1.00 0.00 C ATOM 588 CG PHE B 7 -1.830 -13.455 -5.073 1.00 0.00 C ATOM 589 CD1 PHE B 7 -0.608 -13.069 -5.645 1.00 0.00 C ATOM 590 CD2 PHE B 7 -2.654 -12.469 -4.515 1.00 0.00 C ATOM 591 CE1 PHE B 7 -0.215 -11.745 -5.619 1.00 0.00 C ATOM 592 CE2 PHE B 7 -2.279 -11.135 -4.562 1.00 0.00 C ATOM 593 CZ PHE B 7 -1.070 -10.781 -5.142 1.00 0.00 C ATOM 0 H PHE B 7 -2.513 -15.056 -2.156 1.00 0.00 H new ATOM 0 HA PHE B 7 -1.752 -16.873 -4.398 1.00 0.00 H new ATOM 0 HB2 PHE B 7 -1.935 -15.356 -6.045 1.00 0.00 H new ATOM 0 HB3 PHE B 7 -3.341 -14.967 -5.074 1.00 0.00 H new ATOM 0 HD1 PHE B 7 0.028 -13.810 -6.107 1.00 0.00 H new ATOM 0 HD2 PHE B 7 -3.586 -12.749 -4.046 1.00 0.00 H new ATOM 0 HE1 PHE B 7 0.766 -11.467 -5.974 1.00 0.00 H new ATOM 0 HE2 PHE B 7 -2.926 -10.375 -4.149 1.00 0.00 H new ATOM 0 HZ PHE B 7 -0.798 -9.739 -5.219 1.00 0.00 H new ATOM 594 N ASN B 8 0.689 -16.071 -4.479 1.00 0.00 N ATOM 595 CA ASN B 8 2.146 -15.805 -4.325 1.00 0.00 C ATOM 596 C ASN B 8 2.548 -14.286 -4.298 1.00 0.00 C ATOM 597 O ASN B 8 2.660 -13.626 -5.334 1.00 0.00 O ATOM 598 CB ASN B 8 2.915 -16.619 -5.409 1.00 0.00 C ATOM 599 CG ASN B 8 2.607 -16.336 -6.888 1.00 0.00 C ATOM 600 OD1 ASN B 8 1.599 -16.780 -7.423 1.00 0.00 O ATOM 601 ND2 ASN B 8 3.438 -15.612 -7.594 1.00 0.00 N ATOM 0 H ASN B 8 0.448 -16.555 -5.344 1.00 0.00 H new ATOM 0 HA ASN B 8 2.438 -16.143 -3.331 1.00 0.00 H new ATOM 0 HB2 ASN B 8 3.981 -16.454 -5.254 1.00 0.00 H new ATOM 0 HB3 ASN B 8 2.726 -17.677 -5.227 1.00 0.00 H new ATOM 0 HD21 ASN B 8 3.242 -15.424 -8.577 1.00 0.00 H new ATOM 0 HD22 ASN B 8 4.281 -15.236 -7.161 1.00 0.00 H new ATOM 602 N PHE B 9 2.848 -13.755 -3.108 1.00 0.00 N ATOM 603 CA PHE B 9 3.612 -12.516 -2.943 1.00 0.00 C ATOM 604 C PHE B 9 4.801 -12.807 -2.010 1.00 0.00 C ATOM 605 O PHE B 9 4.666 -12.810 -0.790 1.00 0.00 O ATOM 606 CB PHE B 9 2.597 -11.453 -2.459 1.00 0.00 C ATOM 607 CG PHE B 9 2.989 -10.076 -2.945 1.00 0.00 C ATOM 608 CD1 PHE B 9 2.915 -9.780 -4.314 1.00 0.00 C ATOM 609 CD2 PHE B 9 3.202 -9.036 -2.037 1.00 0.00 C ATOM 610 CE1 PHE B 9 3.074 -8.482 -4.748 1.00 0.00 C ATOM 611 CE2 PHE B 9 3.431 -7.753 -2.480 1.00 0.00 C ATOM 612 CZ PHE B 9 3.260 -7.479 -3.815 1.00 0.00 C ATOM 0 H PHE B 9 2.564 -14.178 -2.224 1.00 0.00 H new ATOM 0 HA PHE B 9 4.068 -12.124 -3.852 1.00 0.00 H new ATOM 0 HB2 PHE B 9 1.601 -11.702 -2.824 1.00 0.00 H new ATOM 0 HB3 PHE B 9 2.549 -11.459 -1.370 1.00 0.00 H new ATOM 0 HD1 PHE B 9 2.733 -10.570 -5.028 1.00 0.00 H new ATOM 0 HD2 PHE B 9 3.187 -9.241 -0.977 1.00 0.00 H new ATOM 0 HE1 PHE B 9 3.054 -8.251 -5.803 1.00 0.00 H new ATOM 0 HE2 PHE B 9 3.738 -6.979 -1.793 1.00 0.00 H new ATOM 0 HZ PHE B 9 3.271 -6.451 -4.145 1.00 0.00 H new ATOM 613 N ARG B 10 6.060 -12.920 -2.416 1.00 0.00 N ATOM 614 CA ARG B 10 6.598 -13.054 -3.800 1.00 0.00 C ATOM 615 C ARG B 10 6.993 -11.651 -4.342 1.00 0.00 C ATOM 616 O ARG B 10 6.180 -10.921 -4.914 1.00 0.00 O ATOM 617 CB ARG B 10 5.931 -14.003 -4.821 1.00 0.00 C ATOM 618 CG ARG B 10 6.931 -14.792 -5.704 1.00 0.00 C ATOM 619 CD ARG B 10 7.934 -14.001 -6.562 1.00 0.00 C ATOM 620 NE ARG B 10 7.248 -13.239 -7.637 1.00 0.00 N ATOM 621 CZ ARG B 10 7.852 -12.611 -8.639 1.00 0.00 C ATOM 622 NH1 ARG B 10 9.138 -12.597 -8.826 1.00 0.00 N ATOM 623 NH2 ARG B 10 7.117 -11.989 -9.489 1.00 0.00 N ATOM 0 H ARG B 10 6.817 -12.922 -1.733 1.00 0.00 H new ATOM 0 HA ARG B 10 7.483 -13.676 -3.667 1.00 0.00 H new ATOM 0 HB2 ARG B 10 5.301 -14.712 -4.283 1.00 0.00 H new ATOM 0 HB3 ARG B 10 5.275 -13.420 -5.467 1.00 0.00 H new ATOM 0 HG2 ARG B 10 7.502 -15.452 -5.050 1.00 0.00 H new ATOM 0 HG3 ARG B 10 6.352 -15.429 -6.373 1.00 0.00 H new ATOM 0 HD2 ARG B 10 8.494 -13.314 -5.928 1.00 0.00 H new ATOM 0 HD3 ARG B 10 8.656 -14.687 -7.005 1.00 0.00 H new ATOM 0 HE ARG B 10 6.230 -13.195 -7.603 1.00 0.00 H new ATOM 0 HH11 ARG B 10 9.753 -13.091 -8.179 1.00 0.00 H new ATOM 0 HH12 ARG B 10 9.532 -12.092 -9.620 1.00 0.00 H new ATOM 0 HH21 ARG B 10 6.103 -11.988 -9.382 1.00 0.00 H new ATOM 0 HH22 ARG B 10 7.548 -11.496 -10.271 1.00 0.00 H new ATOM 624 N MET B 11 8.237 -11.257 -4.045 1.00 0.00 N ATOM 625 CA MET B 11 8.643 -9.831 -4.065 1.00 0.00 C ATOM 626 C MET B 11 10.152 -9.704 -4.463 1.00 0.00 C ATOM 627 O MET B 11 10.978 -10.254 -3.726 1.00 0.00 O ATOM 628 CB MET B 11 8.418 -9.271 -2.630 1.00 0.00 C ATOM 629 CG MET B 11 7.035 -8.699 -2.295 1.00 0.00 C ATOM 630 SD MET B 11 6.940 -8.514 -0.512 1.00 0.00 S ATOM 631 CE MET B 11 5.637 -9.681 -0.102 1.00 0.00 C ATOM 0 H MET B 11 8.986 -11.899 -3.787 1.00 0.00 H new ATOM 0 HA MET B 11 8.058 -9.272 -4.796 1.00 0.00 H new ATOM 0 HB2 MET B 11 8.630 -10.071 -1.921 1.00 0.00 H new ATOM 0 HB3 MET B 11 9.156 -8.487 -2.457 1.00 0.00 H new ATOM 0 HG2 MET B 11 6.889 -7.738 -2.788 1.00 0.00 H new ATOM 0 HG3 MET B 11 6.249 -9.364 -2.653 1.00 0.00 H new ATOM 0 HE1 MET B 11 4.792 -9.145 0.330 1.00 0.00 H new ATOM 0 HE2 MET B 11 5.315 -10.199 -1.005 1.00 0.00 H new ATOM 0 HE3 MET B 11 6.013 -10.408 0.618 1.00 0.00 H new ATOM 632 N PRO B 12 10.593 -8.951 -5.521 1.00 0.00 N ATOM 633 CA PRO B 12 12.013 -8.520 -5.690 1.00 0.00 C ATOM 634 C PRO B 12 12.764 -8.051 -4.411 1.00 0.00 C ATOM 635 O PRO B 12 12.158 -7.474 -3.500 1.00 0.00 O ATOM 636 CB PRO B 12 11.905 -7.436 -6.779 1.00 0.00 C ATOM 637 CG PRO B 12 10.672 -7.831 -7.592 1.00 0.00 C ATOM 638 CD PRO B 12 9.706 -8.393 -6.551 1.00 0.00 C ATOM 0 HA PRO B 12 12.647 -9.365 -5.959 1.00 0.00 H new ATOM 0 HB2 PRO B 12 11.791 -6.444 -6.342 1.00 0.00 H new ATOM 0 HB3 PRO B 12 12.799 -7.409 -7.402 1.00 0.00 H new ATOM 0 HG2 PRO B 12 10.245 -6.973 -8.111 1.00 0.00 H new ATOM 0 HG3 PRO B 12 10.916 -8.574 -8.352 1.00 0.00 H new ATOM 0 HD2 PRO B 12 9.059 -7.616 -6.144 1.00 0.00 H new ATOM 0 HD3 PRO B 12 9.057 -9.158 -6.978 1.00 0.00 H new ATOM 639 N MET B 13 14.062 -8.373 -4.306 1.00 0.00 N ATOM 640 CA MET B 13 14.761 -8.361 -2.987 1.00 0.00 C ATOM 641 C MET B 13 14.749 -7.038 -2.148 1.00 0.00 C ATOM 642 O MET B 13 14.635 -7.115 -0.923 1.00 0.00 O ATOM 643 CB MET B 13 16.158 -8.985 -3.201 1.00 0.00 C ATOM 644 CG MET B 13 17.095 -9.120 -1.982 1.00 0.00 C ATOM 645 SD MET B 13 16.307 -9.672 -0.445 1.00 0.00 S ATOM 646 CE MET B 13 15.345 -11.132 -0.876 1.00 0.00 C ATOM 0 H MET B 13 14.650 -8.642 -5.095 1.00 0.00 H new ATOM 0 HA MET B 13 14.162 -8.966 -2.306 1.00 0.00 H new ATOM 0 HB2 MET B 13 16.016 -9.980 -3.623 1.00 0.00 H new ATOM 0 HB3 MET B 13 16.676 -8.390 -3.954 1.00 0.00 H new ATOM 0 HG2 MET B 13 17.890 -9.822 -2.234 1.00 0.00 H new ATOM 0 HG3 MET B 13 17.567 -8.154 -1.801 1.00 0.00 H new ATOM 0 HE1 MET B 13 15.480 -11.896 -0.110 1.00 0.00 H new ATOM 0 HE2 MET B 13 14.290 -10.866 -0.941 1.00 0.00 H new ATOM 0 HE3 MET B 13 15.682 -11.519 -1.838 1.00 0.00 H new ATOM 647 N GLU B 14 14.744 -5.846 -2.776 1.00 0.00 N ATOM 648 CA GLU B 14 14.348 -4.596 -2.069 1.00 0.00 C ATOM 649 C GLU B 14 12.893 -4.567 -1.498 1.00 0.00 C ATOM 650 O GLU B 14 12.760 -4.291 -0.318 1.00 0.00 O ATOM 651 CB GLU B 14 14.752 -3.316 -2.860 1.00 0.00 C ATOM 652 CG GLU B 14 13.873 -2.917 -4.079 1.00 0.00 C ATOM 653 CD GLU B 14 14.165 -1.551 -4.704 1.00 0.00 C ATOM 654 OE1 GLU B 14 13.903 -0.523 -3.848 1.00 0.00 O ATOM 655 OE2 GLU B 14 14.545 -1.397 -5.860 1.00 0.00 O ATOM 0 H GLU B 14 15.003 -5.715 -3.754 1.00 0.00 H new ATOM 0 HA GLU B 14 14.947 -4.598 -1.158 1.00 0.00 H new ATOM 0 HB2 GLU B 14 14.760 -2.478 -2.163 1.00 0.00 H new ATOM 0 HB3 GLU B 14 15.775 -3.447 -3.212 1.00 0.00 H new ATOM 0 HG2 GLU B 14 13.990 -3.679 -4.850 1.00 0.00 H new ATOM 0 HG3 GLU B 14 12.828 -2.936 -3.769 1.00 0.00 H new ATOM 656 N VAL B 15 11.812 -4.875 -2.236 1.00 0.00 N ATOM 657 CA VAL B 15 10.412 -4.896 -1.686 1.00 0.00 C ATOM 658 C VAL B 15 10.219 -5.862 -0.506 1.00 0.00 C ATOM 659 O VAL B 15 9.564 -5.486 0.457 1.00 0.00 O ATOM 660 CB VAL B 15 9.326 -5.262 -2.762 1.00 0.00 C ATOM 661 CG1 VAL B 15 8.036 -4.469 -2.492 1.00 0.00 C ATOM 662 CG2 VAL B 15 9.722 -5.146 -4.255 1.00 0.00 C ATOM 0 H VAL B 15 11.865 -5.117 -3.225 1.00 0.00 H new ATOM 0 HA VAL B 15 10.274 -3.870 -1.344 1.00 0.00 H new ATOM 0 HB VAL B 15 9.186 -6.334 -2.627 1.00 0.00 H new ATOM 0 HG11 VAL B 15 7.287 -4.727 -3.241 1.00 0.00 H new ATOM 0 HG12 VAL B 15 7.658 -4.716 -1.500 1.00 0.00 H new ATOM 0 HG13 VAL B 15 8.248 -3.401 -2.543 1.00 0.00 H new ATOM 0 HG21 VAL B 15 8.875 -5.430 -4.879 1.00 0.00 H new ATOM 0 HG22 VAL B 15 10.008 -4.118 -4.477 1.00 0.00 H new ATOM 0 HG23 VAL B 15 10.562 -5.809 -4.461 1.00 0.00 H new ATOM 663 N ARG B 16 10.729 -7.095 -0.580 1.00 0.00 N ATOM 664 CA ARG B 16 10.680 -7.989 0.581 1.00 0.00 C ATOM 665 C ARG B 16 11.678 -7.681 1.718 1.00 0.00 C ATOM 666 O ARG B 16 11.253 -7.820 2.852 1.00 0.00 O ATOM 667 CB ARG B 16 10.698 -9.465 0.167 1.00 0.00 C ATOM 668 CG ARG B 16 9.643 -10.238 0.996 1.00 0.00 C ATOM 669 CD ARG B 16 10.124 -11.643 1.237 1.00 0.00 C ATOM 670 NE ARG B 16 9.163 -12.385 2.083 1.00 0.00 N ATOM 671 CZ ARG B 16 9.308 -13.661 2.427 1.00 0.00 C ATOM 672 NH1 ARG B 16 10.226 -14.449 1.953 1.00 0.00 N ATOM 673 NH2 ARG B 16 8.497 -14.147 3.292 1.00 0.00 N ATOM 0 H ARG B 16 11.171 -7.490 -1.410 1.00 0.00 H new ATOM 0 HA ARG B 16 9.713 -7.774 1.036 1.00 0.00 H new ATOM 0 HB2 ARG B 16 10.482 -9.559 -0.897 1.00 0.00 H new ATOM 0 HB3 ARG B 16 11.689 -9.889 0.330 1.00 0.00 H new ATOM 0 HG2 ARG B 16 9.471 -9.733 1.947 1.00 0.00 H new ATOM 0 HG3 ARG B 16 8.690 -10.254 0.467 1.00 0.00 H new ATOM 0 HD2 ARG B 16 10.251 -12.158 0.285 1.00 0.00 H new ATOM 0 HD3 ARG B 16 11.101 -11.621 1.720 1.00 0.00 H new ATOM 0 HE ARG B 16 8.340 -11.888 2.423 1.00 0.00 H new ATOM 0 HH11 ARG B 16 10.897 -14.098 1.270 1.00 0.00 H new ATOM 0 HH12 ARG B 16 10.276 -15.419 2.264 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.768 -13.558 3.695 1.00 0.00 H new ATOM 0 HH22 ARG B 16 8.581 -15.123 3.578 1.00 0.00 H new ATOM 674 N GLU B 17 12.913 -7.194 1.526 1.00 0.00 N ATOM 675 CA GLU B 17 13.632 -6.552 2.671 1.00 0.00 C ATOM 676 C GLU B 17 12.941 -5.255 3.212 1.00 0.00 C ATOM 677 O GLU B 17 12.869 -5.079 4.421 1.00 0.00 O ATOM 678 CB GLU B 17 15.095 -6.245 2.308 1.00 0.00 C ATOM 679 CG GLU B 17 16.035 -7.470 2.243 1.00 0.00 C ATOM 680 CD GLU B 17 17.469 -7.111 1.868 1.00 0.00 C ATOM 681 OE1 GLU B 17 17.877 -7.023 0.715 1.00 0.00 O ATOM 682 OE2 GLU B 17 18.251 -6.895 2.959 1.00 0.00 O ATOM 0 H GLU B 17 13.425 -7.221 0.644 1.00 0.00 H new ATOM 0 HA GLU B 17 13.596 -7.287 3.475 1.00 0.00 H new ATOM 0 HB2 GLU B 17 15.113 -5.743 1.341 1.00 0.00 H new ATOM 0 HB3 GLU B 17 15.493 -5.542 3.040 1.00 0.00 H new ATOM 0 HG2 GLU B 17 16.035 -7.971 3.211 1.00 0.00 H new ATOM 0 HG3 GLU B 17 15.644 -8.181 1.516 1.00 0.00 H new ATOM 683 N LYS B 18 12.385 -4.377 2.368 1.00 0.00 N ATOM 684 CA LYS B 18 11.535 -3.252 2.810 1.00 0.00 C ATOM 685 C LYS B 18 10.229 -3.689 3.559 1.00 0.00 C ATOM 686 O LYS B 18 10.082 -3.344 4.728 1.00 0.00 O ATOM 687 CB LYS B 18 11.331 -2.281 1.629 1.00 0.00 C ATOM 688 CG LYS B 18 12.522 -1.508 0.999 1.00 0.00 C ATOM 689 CD LYS B 18 12.144 -0.582 -0.193 1.00 0.00 C ATOM 690 CE LYS B 18 11.311 -1.224 -1.318 1.00 0.00 C ATOM 691 NZ LYS B 18 11.152 -0.331 -2.479 1.00 0.00 N ATOM 0 H LYS B 18 12.509 -4.422 1.357 1.00 0.00 H new ATOM 0 HA LYS B 18 12.056 -2.703 3.594 1.00 0.00 H new ATOM 0 HB2 LYS B 18 10.864 -2.852 0.827 1.00 0.00 H new ATOM 0 HB3 LYS B 18 10.605 -1.535 1.954 1.00 0.00 H new ATOM 0 HG2 LYS B 18 12.995 -0.904 1.774 1.00 0.00 H new ATOM 0 HG3 LYS B 18 13.265 -2.229 0.659 1.00 0.00 H new ATOM 0 HD2 LYS B 18 11.590 0.271 0.199 1.00 0.00 H new ATOM 0 HD3 LYS B 18 13.064 -0.192 -0.628 1.00 0.00 H new ATOM 0 HE2 LYS B 18 11.790 -2.150 -1.638 1.00 0.00 H new ATOM 0 HE3 LYS B 18 10.328 -1.491 -0.931 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 10.463 -0.742 -3.141 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 10.813 0.598 -2.158 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 12.068 -0.218 -2.958 1.00 0.00 H new ATOM 692 N LEU B 19 9.314 -4.453 2.942 1.00 0.00 N ATOM 693 CA LEU B 19 8.092 -5.005 3.588 1.00 0.00 C ATOM 694 C LEU B 19 8.351 -5.965 4.793 1.00 0.00 C ATOM 695 O LEU B 19 7.624 -5.901 5.785 1.00 0.00 O ATOM 696 CB LEU B 19 7.228 -5.542 2.414 1.00 0.00 C ATOM 697 CG LEU B 19 5.704 -5.727 2.598 1.00 0.00 C ATOM 698 CD1 LEU B 19 4.848 -4.489 2.893 1.00 0.00 C ATOM 699 CD2 LEU B 19 5.217 -6.337 1.276 1.00 0.00 C ATOM 0 H LEU B 19 9.396 -4.715 1.960 1.00 0.00 H new ATOM 0 HA LEU B 19 7.534 -4.242 4.130 1.00 0.00 H new ATOM 0 HB2 LEU B 19 7.373 -4.868 1.570 1.00 0.00 H new ATOM 0 HB3 LEU B 19 7.639 -6.509 2.124 1.00 0.00 H new ATOM 0 HG LEU B 19 5.578 -6.331 3.497 1.00 0.00 H new ATOM 0 HD11 LEU B 19 3.804 -4.785 2.995 1.00 0.00 H new ATOM 0 HD12 LEU B 19 5.186 -4.025 3.820 1.00 0.00 H new ATOM 0 HD13 LEU B 19 4.945 -3.776 2.074 1.00 0.00 H new ATOM 0 HD21 LEU B 19 4.140 -6.500 1.325 1.00 0.00 H new ATOM 0 HD22 LEU B 19 5.444 -5.656 0.456 1.00 0.00 H new ATOM 0 HD23 LEU B 19 5.721 -7.289 1.107 1.00 0.00 H new ATOM 700 N LYS B 20 9.393 -6.815 4.736 1.00 0.00 N ATOM 701 CA LYS B 20 9.749 -7.768 5.798 1.00 0.00 C ATOM 702 C LYS B 20 10.650 -7.168 6.922 1.00 0.00 C ATOM 703 O LYS B 20 10.500 -7.608 8.056 1.00 0.00 O ATOM 704 CB LYS B 20 10.378 -9.047 5.215 1.00 0.00 C ATOM 705 CG LYS B 20 10.299 -10.301 6.104 1.00 0.00 C ATOM 706 CD LYS B 20 10.813 -11.596 5.439 1.00 0.00 C ATOM 707 CE LYS B 20 12.077 -11.450 4.576 1.00 0.00 C ATOM 708 NZ LYS B 20 12.519 -12.772 4.096 1.00 0.00 N ATOM 0 H LYS B 20 10.022 -6.858 3.934 1.00 0.00 H new ATOM 0 HA LYS B 20 8.806 -8.024 6.280 1.00 0.00 H new ATOM 0 HB2 LYS B 20 9.891 -9.268 4.265 1.00 0.00 H new ATOM 0 HB3 LYS B 20 11.427 -8.846 4.996 1.00 0.00 H new ATOM 0 HG2 LYS B 20 10.874 -10.122 7.013 1.00 0.00 H new ATOM 0 HG3 LYS B 20 9.263 -10.451 6.407 1.00 0.00 H new ATOM 0 HD2 LYS B 20 11.013 -12.329 6.221 1.00 0.00 H new ATOM 0 HD3 LYS B 20 10.016 -12.003 4.817 1.00 0.00 H new ATOM 0 HE2 LYS B 20 11.874 -10.796 3.728 1.00 0.00 H new ATOM 0 HE3 LYS B 20 12.871 -10.981 5.157 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 13.493 -12.703 3.737 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 12.487 -13.455 4.880 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 11.890 -13.092 3.332 1.00 0.00 H new ATOM 709 N PHE B 21 11.544 -6.174 6.678 1.00 0.00 N ATOM 710 CA PHE B 21 12.038 -5.275 7.760 1.00 0.00 C ATOM 711 C PHE B 21 10.887 -4.442 8.298 1.00 0.00 C ATOM 712 O PHE B 21 10.443 -4.861 9.338 1.00 0.00 O ATOM 713 CB PHE B 21 13.211 -4.336 7.380 1.00 0.00 C ATOM 714 CG PHE B 21 14.543 -4.971 7.056 1.00 0.00 C ATOM 715 CD1 PHE B 21 14.960 -6.185 7.601 1.00 0.00 C ATOM 716 CD2 PHE B 21 15.340 -4.318 6.121 1.00 0.00 C ATOM 717 CE1 PHE B 21 16.111 -6.791 7.134 1.00 0.00 C ATOM 718 CE2 PHE B 21 16.496 -4.917 5.657 1.00 0.00 C ATOM 719 CZ PHE B 21 16.889 -6.164 6.154 1.00 0.00 C ATOM 0 H PHE B 21 11.934 -5.975 5.757 1.00 0.00 H new ATOM 0 HA PHE B 21 12.444 -5.949 8.514 1.00 0.00 H new ATOM 0 HB2 PHE B 21 12.902 -3.746 6.517 1.00 0.00 H new ATOM 0 HB3 PHE B 21 13.363 -3.639 8.204 1.00 0.00 H new ATOM 0 HD1 PHE B 21 14.384 -6.651 8.387 1.00 0.00 H new ATOM 0 HD2 PHE B 21 15.055 -3.342 5.757 1.00 0.00 H new ATOM 0 HE1 PHE B 21 16.411 -7.751 7.527 1.00 0.00 H new ATOM 0 HE2 PHE B 21 17.097 -4.421 4.909 1.00 0.00 H new ATOM 0 HZ PHE B 21 17.786 -6.639 5.784 1.00 0.00 H new ATOM 720 N ARG B 22 10.350 -3.372 7.701 1.00 0.00 N ATOM 721 CA ARG B 22 9.095 -2.695 8.167 1.00 0.00 C ATOM 722 C ARG B 22 8.138 -3.549 9.099 1.00 0.00 C ATOM 723 O ARG B 22 8.082 -3.247 10.288 1.00 0.00 O ATOM 724 CB ARG B 22 8.532 -2.019 6.890 1.00 0.00 C ATOM 725 CG ARG B 22 7.594 -0.817 7.094 1.00 0.00 C ATOM 726 CD ARG B 22 6.200 -1.207 7.587 1.00 0.00 C ATOM 727 NE ARG B 22 5.177 -0.263 7.091 1.00 0.00 N ATOM 728 CZ ARG B 22 4.906 0.943 7.570 1.00 0.00 C ATOM 729 NH1 ARG B 22 5.519 1.495 8.574 1.00 0.00 N ATOM 730 NH2 ARG B 22 3.972 1.596 6.984 1.00 0.00 N ATOM 0 H ARG B 22 10.762 -2.936 6.876 1.00 0.00 H new ATOM 0 HA ARG B 22 9.275 -1.930 8.922 1.00 0.00 H new ATOM 0 HB2 ARG B 22 9.374 -1.692 6.280 1.00 0.00 H new ATOM 0 HB3 ARG B 22 7.996 -2.774 6.315 1.00 0.00 H new ATOM 0 HG2 ARG B 22 8.046 -0.132 7.811 1.00 0.00 H new ATOM 0 HG3 ARG B 22 7.499 -0.276 6.152 1.00 0.00 H new ATOM 0 HD2 ARG B 22 5.961 -2.216 7.251 1.00 0.00 H new ATOM 0 HD3 ARG B 22 6.187 -1.222 8.677 1.00 0.00 H new ATOM 0 HE ARG B 22 4.620 -0.573 6.295 1.00 0.00 H new ATOM 0 HH11 ARG B 22 6.268 0.994 9.052 1.00 0.00 H new ATOM 0 HH12 ARG B 22 5.251 2.429 8.884 1.00 0.00 H new ATOM 0 HH21 ARG B 22 3.480 1.182 6.192 1.00 0.00 H new ATOM 0 HH22 ARG B 22 3.720 2.529 7.310 1.00 0.00 H new ATOM 731 N ALA B 23 7.732 -4.768 8.676 1.00 0.00 N ATOM 732 CA ALA B 23 7.310 -5.876 9.589 1.00 0.00 C ATOM 733 C ALA B 23 8.271 -6.300 10.779 1.00 0.00 C ATOM 734 O ALA B 23 8.039 -5.898 11.919 1.00 0.00 O ATOM 735 CB ALA B 23 6.921 -7.037 8.647 1.00 0.00 C ATOM 0 H ALA B 23 7.685 -5.020 7.689 1.00 0.00 H new ATOM 0 HA ALA B 23 6.483 -5.514 10.200 1.00 0.00 H new ATOM 0 HB1 ALA B 23 6.598 -7.893 9.239 1.00 0.00 H new ATOM 0 HB2 ALA B 23 6.108 -6.719 7.995 1.00 0.00 H new ATOM 0 HB3 ALA B 23 7.783 -7.319 8.042 1.00 0.00 H new ATOM 736 N GLU B 24 9.315 -7.111 10.529 1.00 0.00 N ATOM 737 CA GLU B 24 10.298 -7.601 11.552 1.00 0.00 C ATOM 738 C GLU B 24 11.242 -6.564 12.265 1.00 0.00 C ATOM 739 O GLU B 24 11.542 -6.713 13.450 1.00 0.00 O ATOM 740 CB GLU B 24 11.140 -8.756 10.931 1.00 0.00 C ATOM 741 CG GLU B 24 10.397 -9.999 10.354 1.00 0.00 C ATOM 742 CD GLU B 24 9.414 -10.737 11.264 1.00 0.00 C ATOM 743 OE1 GLU B 24 9.929 -10.995 12.496 1.00 0.00 O ATOM 744 OE2 GLU B 24 8.291 -11.082 10.910 1.00 0.00 O ATOM 0 H GLU B 24 9.516 -7.461 9.592 1.00 0.00 H new ATOM 0 HA GLU B 24 9.660 -7.922 12.376 1.00 0.00 H new ATOM 0 HB2 GLU B 24 11.744 -8.331 10.129 1.00 0.00 H new ATOM 0 HB3 GLU B 24 11.830 -9.110 11.697 1.00 0.00 H new ATOM 0 HG2 GLU B 24 9.853 -9.679 9.465 1.00 0.00 H new ATOM 0 HG3 GLU B 24 11.150 -10.715 10.026 1.00 0.00 H new ATOM 745 N ALA B 25 11.690 -5.518 11.556 1.00 0.00 N ATOM 746 CA ALA B 25 12.085 -4.206 12.132 1.00 0.00 C ATOM 747 C ALA B 25 11.182 -3.658 13.318 1.00 0.00 C ATOM 748 O ALA B 25 11.712 -3.220 14.340 1.00 0.00 O ATOM 749 CB ALA B 25 12.003 -3.141 11.016 1.00 0.00 C ATOM 0 H ALA B 25 11.793 -5.552 10.542 1.00 0.00 H new ATOM 0 HA ALA B 25 13.081 -4.376 12.540 1.00 0.00 H new ATOM 0 HB1 ALA B 25 12.289 -2.169 11.419 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.679 -3.411 10.205 1.00 0.00 H new ATOM 0 HB3 ALA B 25 10.983 -3.090 10.636 1.00 0.00 H new ATOM 750 N ASN B 26 9.831 -3.632 13.133 1.00 0.00 N ATOM 751 CA ASN B 26 8.872 -3.027 14.106 1.00 0.00 C ATOM 752 C ASN B 26 8.200 -4.010 15.138 1.00 0.00 C ATOM 753 O ASN B 26 8.082 -3.677 16.319 1.00 0.00 O ATOM 754 CB ASN B 26 7.900 -2.139 13.253 1.00 0.00 C ATOM 755 CG ASN B 26 6.421 -2.499 13.121 1.00 0.00 C ATOM 756 OD1 ASN B 26 5.573 -2.111 13.914 1.00 0.00 O ATOM 757 ND2 ASN B 26 6.073 -3.188 12.078 1.00 0.00 N ATOM 0 H ASN B 26 9.377 -4.028 12.310 1.00 0.00 H new ATOM 0 HA ASN B 26 9.411 -2.410 14.826 1.00 0.00 H new ATOM 0 HB2 ASN B 26 7.948 -1.129 13.661 1.00 0.00 H new ATOM 0 HB3 ASN B 26 8.310 -2.095 12.244 1.00 0.00 H new ATOM 0 HD21 ASN B 26 5.090 -3.408 11.917 1.00 0.00 H new ATOM 0 HD22 ASN B 26 6.782 -3.510 11.419 1.00 0.00 H new ATOM 758 N GLY B 27 7.685 -5.159 14.673 1.00 0.00 N ATOM 759 CA GLY B 27 6.684 -5.983 15.424 1.00 0.00 C ATOM 760 C GLY B 27 5.369 -6.414 14.707 1.00 0.00 C ATOM 761 O GLY B 27 4.446 -6.873 15.381 1.00 0.00 O ATOM 0 H GLY B 27 7.941 -5.555 13.769 1.00 0.00 H new ATOM 0 HA2 GLY B 27 7.189 -6.889 15.758 1.00 0.00 H new ATOM 0 HA3 GLY B 27 6.404 -5.426 16.318 1.00 0.00 H new ATOM 762 N ARG B 28 5.265 -6.316 13.374 1.00 0.00 N ATOM 763 CA ARG B 28 4.161 -6.915 12.569 1.00 0.00 C ATOM 764 C ARG B 28 4.847 -8.046 11.729 1.00 0.00 C ATOM 765 O ARG B 28 6.046 -8.012 11.453 1.00 0.00 O ATOM 766 CB ARG B 28 3.448 -5.748 11.827 1.00 0.00 C ATOM 767 CG ARG B 28 2.796 -4.646 12.721 1.00 0.00 C ATOM 768 CD ARG B 28 1.966 -3.550 12.012 1.00 0.00 C ATOM 769 NE ARG B 28 2.728 -2.692 11.074 1.00 0.00 N ATOM 770 CZ ARG B 28 3.142 -1.452 11.311 1.00 0.00 C ATOM 771 NH1 ARG B 28 3.053 -0.848 12.458 1.00 0.00 N ATOM 772 NH2 ARG B 28 3.670 -0.813 10.335 1.00 0.00 N ATOM 0 H ARG B 28 5.948 -5.815 12.806 1.00 0.00 H new ATOM 0 HA ARG B 28 3.346 -7.402 13.105 1.00 0.00 H new ATOM 0 HB2 ARG B 28 4.173 -5.268 11.170 1.00 0.00 H new ATOM 0 HB3 ARG B 28 2.672 -6.173 11.190 1.00 0.00 H new ATOM 0 HG2 ARG B 28 2.150 -5.140 13.447 1.00 0.00 H new ATOM 0 HG3 ARG B 28 3.591 -4.155 13.283 1.00 0.00 H new ATOM 0 HD2 ARG B 28 1.154 -4.028 11.464 1.00 0.00 H new ATOM 0 HD3 ARG B 28 1.508 -2.915 12.771 1.00 0.00 H new ATOM 0 HE ARG B 28 2.955 -3.090 10.163 1.00 0.00 H new ATOM 0 HH11 ARG B 28 2.641 -1.329 13.257 1.00 0.00 H new ATOM 0 HH12 ARG B 28 3.395 0.108 12.559 1.00 0.00 H new ATOM 0 HH21 ARG B 28 3.758 -1.259 9.422 1.00 0.00 H new ATOM 0 HH22 ARG B 28 4.002 0.142 10.471 1.00 0.00 H new ATOM 773 N SER B 29 4.157 -9.136 11.393 1.00 0.00 N ATOM 774 CA SER B 29 4.838 -10.351 10.829 1.00 0.00 C ATOM 775 C SER B 29 4.259 -10.538 9.421 1.00 0.00 C ATOM 776 O SER B 29 3.059 -10.767 9.363 1.00 0.00 O ATOM 777 CB SER B 29 4.630 -11.562 11.773 1.00 0.00 C ATOM 778 OG SER B 29 3.261 -11.966 11.869 1.00 0.00 O ATOM 0 H SER B 29 3.146 -9.225 11.491 1.00 0.00 H new ATOM 0 HA SER B 29 5.920 -10.245 10.754 1.00 0.00 H new ATOM 0 HB2 SER B 29 5.227 -12.401 11.416 1.00 0.00 H new ATOM 0 HB3 SER B 29 4.999 -11.309 12.767 1.00 0.00 H new ATOM 0 HG SER B 29 2.807 -11.787 11.019 1.00 0.00 H new ATOM 779 N MET B 30 4.973 -10.315 8.304 1.00 0.00 N ATOM 780 CA MET B 30 4.365 -9.658 7.102 1.00 0.00 C ATOM 781 C MET B 30 2.928 -10.078 6.662 1.00 0.00 C ATOM 782 O MET B 30 2.143 -9.192 6.405 1.00 0.00 O ATOM 783 CB MET B 30 5.206 -9.813 5.833 1.00 0.00 C ATOM 784 CG MET B 30 6.561 -9.177 5.740 1.00 0.00 C ATOM 785 SD MET B 30 7.459 -10.059 4.450 1.00 0.00 S ATOM 786 CE MET B 30 7.269 -8.873 3.124 1.00 0.00 C ATOM 0 H MET B 30 5.955 -10.569 8.195 1.00 0.00 H new ATOM 0 HA MET B 30 4.322 -8.641 7.491 1.00 0.00 H new ATOM 0 HB2 MET B 30 5.339 -10.881 5.663 1.00 0.00 H new ATOM 0 HB3 MET B 30 4.612 -9.429 5.004 1.00 0.00 H new ATOM 0 HG2 MET B 30 6.476 -8.118 5.497 1.00 0.00 H new ATOM 0 HG3 MET B 30 7.086 -9.244 6.693 1.00 0.00 H new ATOM 0 HE1 MET B 30 7.241 -9.397 2.169 1.00 0.00 H new ATOM 0 HE2 MET B 30 6.341 -8.319 3.262 1.00 0.00 H new ATOM 0 HE3 MET B 30 8.110 -8.180 3.133 1.00 0.00 H new ATOM 787 N ASN B 31 2.460 -11.329 6.617 1.00 0.00 N ATOM 788 CA ASN B 31 0.982 -11.572 6.494 1.00 0.00 C ATOM 789 C ASN B 31 0.062 -10.722 7.477 1.00 0.00 C ATOM 790 O ASN B 31 -0.852 -10.060 6.994 1.00 0.00 O ATOM 791 CB ASN B 31 0.680 -13.093 6.462 1.00 0.00 C ATOM 792 CG ASN B 31 -0.388 -13.507 5.451 1.00 0.00 C ATOM 793 OD1 ASN B 31 -0.147 -14.299 4.553 1.00 0.00 O ATOM 794 ND2 ASN B 31 -1.556 -12.928 5.493 1.00 0.00 N ATOM 0 H ASN B 31 3.037 -12.169 6.660 1.00 0.00 H new ATOM 0 HA ASN B 31 0.682 -11.166 5.528 1.00 0.00 H new ATOM 0 HB2 ASN B 31 1.602 -13.629 6.237 1.00 0.00 H new ATOM 0 HB3 ASN B 31 0.363 -13.408 7.456 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -2.256 -13.139 4.781 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -1.770 -12.265 6.238 1.00 0.00 H new ATOM 795 N SER B 32 0.439 -10.575 8.762 1.00 0.00 N ATOM 796 CA SER B 32 0.205 -9.331 9.565 1.00 0.00 C ATOM 797 C SER B 32 0.696 -7.953 8.996 1.00 0.00 C ATOM 798 O SER B 32 -0.182 -7.148 8.687 1.00 0.00 O ATOM 799 CB SER B 32 0.576 -9.614 11.043 1.00 0.00 C ATOM 800 OG SER B 32 0.489 -8.445 11.864 1.00 0.00 O ATOM 0 H SER B 32 0.916 -11.309 9.285 1.00 0.00 H new ATOM 0 HA SER B 32 -0.863 -9.128 9.481 1.00 0.00 H new ATOM 0 HB2 SER B 32 -0.087 -10.383 11.440 1.00 0.00 H new ATOM 0 HB3 SER B 32 1.590 -10.012 11.090 1.00 0.00 H new ATOM 0 HG SER B 32 0.730 -8.674 12.786 1.00 0.00 H new ATOM 801 N GLU B 33 1.997 -7.614 8.847 1.00 0.00 N ATOM 802 CA GLU B 33 2.376 -6.248 8.319 1.00 0.00 C ATOM 803 C GLU B 33 1.916 -5.895 6.882 1.00 0.00 C ATOM 804 O GLU B 33 1.234 -4.896 6.708 1.00 0.00 O ATOM 805 CB GLU B 33 3.880 -5.980 8.293 1.00 0.00 C ATOM 806 CG GLU B 33 4.317 -4.488 8.402 1.00 0.00 C ATOM 807 CD GLU B 33 3.648 -3.412 7.555 1.00 0.00 C ATOM 808 OE1 GLU B 33 4.041 -3.458 6.254 1.00 0.00 O ATOM 809 OE2 GLU B 33 2.847 -2.598 7.993 1.00 0.00 O ATOM 0 H GLU B 33 2.784 -8.224 9.069 1.00 0.00 H new ATOM 0 HA GLU B 33 1.842 -5.637 9.047 1.00 0.00 H new ATOM 0 HB2 GLU B 33 4.340 -6.532 9.112 1.00 0.00 H new ATOM 0 HB3 GLU B 33 4.284 -6.388 7.367 1.00 0.00 H new ATOM 0 HG2 GLU B 33 4.196 -4.195 9.445 1.00 0.00 H new ATOM 0 HG3 GLU B 33 5.384 -4.451 8.182 1.00 0.00 H new ATOM 810 N LEU B 34 2.336 -6.666 5.855 1.00 0.00 N ATOM 811 CA LEU B 34 1.747 -6.672 4.504 1.00 0.00 C ATOM 812 C LEU B 34 0.221 -6.440 4.602 1.00 0.00 C ATOM 813 O LEU B 34 -0.182 -5.401 4.112 1.00 0.00 O ATOM 814 CB LEU B 34 2.107 -7.995 3.770 1.00 0.00 C ATOM 815 CG LEU B 34 2.509 -8.001 2.278 1.00 0.00 C ATOM 816 CD1 LEU B 34 2.301 -9.357 1.595 1.00 0.00 C ATOM 817 CD2 LEU B 34 1.851 -6.969 1.336 1.00 0.00 C ATOM 0 H LEU B 34 3.115 -7.318 5.949 1.00 0.00 H new ATOM 0 HA LEU B 34 2.163 -5.858 3.910 1.00 0.00 H new ATOM 0 HB2 LEU B 34 2.928 -8.452 4.322 1.00 0.00 H new ATOM 0 HB3 LEU B 34 1.248 -8.658 3.870 1.00 0.00 H new ATOM 0 HG LEU B 34 3.558 -7.729 2.393 1.00 0.00 H new ATOM 0 HD11 LEU B 34 2.604 -9.288 0.550 1.00 0.00 H new ATOM 0 HD12 LEU B 34 2.903 -10.114 2.098 1.00 0.00 H new ATOM 0 HD13 LEU B 34 1.248 -9.635 1.650 1.00 0.00 H new ATOM 0 HD21 LEU B 34 2.236 -7.101 0.325 1.00 0.00 H new ATOM 0 HD22 LEU B 34 0.771 -7.115 1.334 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.081 -5.961 1.683 1.00 0.00 H new ATOM 818 N LEU B 35 -0.611 -7.239 5.336 1.00 0.00 N ATOM 819 CA LEU B 35 -2.055 -6.901 5.425 1.00 0.00 C ATOM 820 C LEU B 35 -2.394 -5.553 6.063 1.00 0.00 C ATOM 821 O LEU B 35 -3.191 -4.803 5.515 1.00 0.00 O ATOM 822 CB LEU B 35 -2.926 -7.962 6.135 1.00 0.00 C ATOM 823 CG LEU B 35 -3.500 -9.077 5.256 1.00 0.00 C ATOM 824 CD1 LEU B 35 -4.490 -9.831 6.137 1.00 0.00 C ATOM 825 CD2 LEU B 35 -4.247 -8.461 4.044 1.00 0.00 C ATOM 0 H LEU B 35 -0.323 -8.074 5.846 1.00 0.00 H new ATOM 0 HA LEU B 35 -2.298 -6.859 4.363 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -2.329 -8.422 6.922 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -3.756 -7.451 6.622 1.00 0.00 H new ATOM 0 HG LEU B 35 -2.717 -9.730 4.872 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -4.938 -10.645 5.567 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -3.969 -10.239 7.003 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -5.272 -9.149 6.472 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -4.653 -9.259 3.423 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -5.061 -7.830 4.401 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -3.553 -7.861 3.456 1.00 0.00 H new ATOM 826 N GLN B 36 -1.816 -5.286 7.220 1.00 0.00 N ATOM 827 CA GLN B 36 -1.940 -3.988 7.888 1.00 0.00 C ATOM 828 C GLN B 36 -1.512 -2.764 6.995 1.00 0.00 C ATOM 829 O GLN B 36 -2.354 -1.888 6.813 1.00 0.00 O ATOM 830 CB GLN B 36 -1.228 -4.187 9.260 1.00 0.00 C ATOM 831 CG GLN B 36 -1.620 -3.179 10.365 1.00 0.00 C ATOM 832 CD GLN B 36 -1.506 -1.723 9.962 1.00 0.00 C ATOM 833 OE1 GLN B 36 -2.504 -1.023 9.851 1.00 0.00 O ATOM 834 NE2 GLN B 36 -0.330 -1.277 9.596 1.00 0.00 N ATOM 0 H GLN B 36 -1.245 -5.960 7.730 1.00 0.00 H new ATOM 0 HA GLN B 36 -2.972 -3.688 8.069 1.00 0.00 H new ATOM 0 HB2 GLN B 36 -1.442 -5.194 9.618 1.00 0.00 H new ATOM 0 HB3 GLN B 36 -0.151 -4.127 9.103 1.00 0.00 H new ATOM 0 HG2 GLN B 36 -2.647 -3.378 10.672 1.00 0.00 H new ATOM 0 HG3 GLN B 36 -0.988 -3.351 11.236 1.00 0.00 H new ATOM 0 HE21 GLN B 36 0.494 -1.871 9.694 1.00 0.00 H new ATOM 0 HE22 GLN B 36 -0.238 -0.336 9.213 1.00 0.00 H new ATOM 835 N ILE B 37 -0.316 -2.703 6.371 1.00 0.00 N ATOM 836 CA ILE B 37 -0.023 -1.661 5.338 1.00 0.00 C ATOM 837 C ILE B 37 -0.878 -1.730 4.039 1.00 0.00 C ATOM 838 O ILE B 37 -0.929 -0.727 3.371 1.00 0.00 O ATOM 839 CB ILE B 37 1.496 -1.579 4.949 1.00 0.00 C ATOM 840 CG1 ILE B 37 1.904 -0.143 4.498 1.00 0.00 C ATOM 841 CG2 ILE B 37 1.854 -2.652 3.884 1.00 0.00 C ATOM 842 CD1 ILE B 37 3.341 0.042 3.997 1.00 0.00 C ATOM 0 H ILE B 37 0.455 -3.345 6.553 1.00 0.00 H new ATOM 0 HA ILE B 37 -0.318 -0.749 5.857 1.00 0.00 H new ATOM 0 HB ILE B 37 2.080 -1.798 5.843 1.00 0.00 H new ATOM 0 HG12 ILE B 37 1.225 0.170 3.705 1.00 0.00 H new ATOM 0 HG13 ILE B 37 1.747 0.534 5.338 1.00 0.00 H new ATOM 0 HG21 ILE B 37 2.911 -2.575 3.631 1.00 0.00 H new ATOM 0 HG22 ILE B 37 1.648 -3.645 4.284 1.00 0.00 H new ATOM 0 HG23 ILE B 37 1.254 -2.490 2.989 1.00 0.00 H new ATOM 0 HD11 ILE B 37 3.497 1.083 3.715 1.00 0.00 H new ATOM 0 HD12 ILE B 37 4.040 -0.228 4.789 1.00 0.00 H new ATOM 0 HD13 ILE B 37 3.510 -0.598 3.131 1.00 0.00 H new ATOM 843 N VAL B 38 -1.338 -2.887 3.572 1.00 0.00 N ATOM 844 CA VAL B 38 -2.157 -3.081 2.343 1.00 0.00 C ATOM 845 C VAL B 38 -3.637 -2.592 2.569 1.00 0.00 C ATOM 846 O VAL B 38 -4.203 -1.870 1.756 1.00 0.00 O ATOM 847 CB VAL B 38 -2.104 -4.601 2.031 1.00 0.00 C ATOM 848 CG1 VAL B 38 -3.192 -5.284 1.209 1.00 0.00 C ATOM 849 CG2 VAL B 38 -0.767 -5.018 1.408 1.00 0.00 C ATOM 0 H VAL B 38 -1.150 -3.767 4.051 1.00 0.00 H new ATOM 0 HA VAL B 38 -1.770 -2.496 1.509 1.00 0.00 H new ATOM 0 HB VAL B 38 -2.274 -4.955 3.048 1.00 0.00 H new ATOM 0 HG11 VAL B 38 -2.961 -6.345 1.110 1.00 0.00 H new ATOM 0 HG12 VAL B 38 -4.153 -5.167 1.709 1.00 0.00 H new ATOM 0 HG13 VAL B 38 -3.240 -4.829 0.220 1.00 0.00 H new ATOM 0 HG21 VAL B 38 -0.777 -6.089 1.208 1.00 0.00 H new ATOM 0 HG22 VAL B 38 -0.616 -4.476 0.475 1.00 0.00 H new ATOM 0 HG23 VAL B 38 0.044 -4.786 2.098 1.00 0.00 H new ATOM 850 N GLN B 39 -4.255 -2.985 3.702 1.00 0.00 N ATOM 851 CA GLN B 39 -5.380 -2.258 4.342 1.00 0.00 C ATOM 852 C GLN B 39 -5.099 -0.732 4.593 1.00 0.00 C ATOM 853 O GLN B 39 -5.934 0.085 4.203 1.00 0.00 O ATOM 854 CB GLN B 39 -5.721 -3.067 5.633 1.00 0.00 C ATOM 855 CG GLN B 39 -6.358 -4.470 5.400 1.00 0.00 C ATOM 856 CD GLN B 39 -6.684 -5.307 6.638 1.00 0.00 C ATOM 857 OE1 GLN B 39 -7.795 -5.783 6.827 1.00 0.00 O ATOM 858 NE2 GLN B 39 -5.730 -5.562 7.494 1.00 0.00 N ATOM 0 H GLN B 39 -3.985 -3.828 4.208 1.00 0.00 H new ATOM 0 HA GLN B 39 -6.241 -2.214 3.676 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -4.807 -3.195 6.212 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -6.404 -2.474 6.242 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -7.279 -4.332 4.834 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -5.681 -5.048 4.771 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -4.798 -5.172 7.350 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -5.917 -6.151 8.306 1.00 0.00 H new ATOM 859 N ASP B 40 -3.899 -0.328 5.081 1.00 0.00 N ATOM 860 CA ASP B 40 -3.369 1.053 4.862 1.00 0.00 C ATOM 861 C ASP B 40 -3.302 1.557 3.379 1.00 0.00 C ATOM 862 O ASP B 40 -3.631 2.707 3.098 1.00 0.00 O ATOM 863 CB ASP B 40 -2.094 1.475 5.640 1.00 0.00 C ATOM 864 CG ASP B 40 -1.939 1.209 7.138 1.00 0.00 C ATOM 865 OD1 ASP B 40 -3.061 1.476 7.863 1.00 0.00 O ATOM 866 OD2 ASP B 40 -0.872 0.855 7.629 1.00 0.00 O ATOM 0 H ASP B 40 -3.280 -0.929 5.625 1.00 0.00 H new ATOM 0 HA ASP B 40 -4.190 1.585 5.342 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -1.250 0.995 5.145 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -1.978 2.549 5.497 1.00 0.00 H new ATOM 867 N ALA B 41 -2.874 0.704 2.448 1.00 0.00 N ATOM 868 CA ALA B 41 -2.582 1.063 1.040 1.00 0.00 C ATOM 869 C ALA B 41 -3.831 1.404 0.166 1.00 0.00 C ATOM 870 O ALA B 41 -3.819 2.333 -0.641 1.00 0.00 O ATOM 871 CB ALA B 41 -1.653 -0.042 0.492 1.00 0.00 C ATOM 0 H ALA B 41 -2.713 -0.283 2.647 1.00 0.00 H new ATOM 0 HA ALA B 41 -2.069 2.024 0.994 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -1.405 0.173 -0.547 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -0.738 -0.075 1.084 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -2.159 -1.006 0.552 1.00 0.00 H new ATOM 872 N LEU B 42 -4.903 0.651 0.404 1.00 0.00 N ATOM 873 CA LEU B 42 -6.251 0.847 -0.196 1.00 0.00 C ATOM 874 C LEU B 42 -7.153 1.871 0.570 1.00 0.00 C ATOM 875 O LEU B 42 -7.896 2.618 -0.070 1.00 0.00 O ATOM 876 CB LEU B 42 -6.938 -0.545 -0.333 1.00 0.00 C ATOM 877 CG LEU B 42 -6.074 -1.708 -0.894 1.00 0.00 C ATOM 878 CD1 LEU B 42 -6.528 -3.080 -0.394 1.00 0.00 C ATOM 879 CD2 LEU B 42 -5.945 -1.612 -2.415 1.00 0.00 C ATOM 0 H LEU B 42 -4.871 -0.145 1.041 1.00 0.00 H new ATOM 0 HA LEU B 42 -6.115 1.299 -1.178 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -7.305 -0.840 0.650 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -7.810 -0.430 -0.977 1.00 0.00 H new ATOM 0 HG LEU B 42 -5.067 -1.596 -0.493 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -5.887 -3.853 -0.819 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -6.461 -3.111 0.694 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -7.560 -3.255 -0.699 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -5.335 -2.438 -2.781 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -6.935 -1.663 -2.868 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -5.472 -0.667 -2.681 1.00 0.00 H new ATOM 880 N SER B 43 -7.081 1.934 1.918 1.00 0.00 N ATOM 881 CA SER B 43 -7.640 3.083 2.697 1.00 0.00 C ATOM 882 C SER B 43 -6.988 4.473 2.373 1.00 0.00 C ATOM 883 O SER B 43 -7.685 5.379 1.910 1.00 0.00 O ATOM 884 CB SER B 43 -7.578 2.719 4.204 1.00 0.00 C ATOM 885 OG SER B 43 -8.094 3.766 5.031 1.00 0.00 O ATOM 0 H SER B 43 -6.647 1.213 2.494 1.00 0.00 H new ATOM 0 HA SER B 43 -8.676 3.229 2.392 1.00 0.00 H new ATOM 0 HB2 SER B 43 -8.146 1.805 4.380 1.00 0.00 H new ATOM 0 HB3 SER B 43 -6.545 2.511 4.484 1.00 0.00 H new ATOM 0 HG SER B 43 -7.357 4.193 5.516 1.00 0.00 H new ATOM 886 N LYS B 44 -5.673 4.617 2.619 1.00 0.00 N ATOM 887 CA LYS B 44 -4.864 5.851 2.380 1.00 0.00 C ATOM 888 C LYS B 44 -4.640 6.796 3.629 1.00 0.00 C ATOM 889 O LYS B 44 -3.498 6.835 4.103 1.00 0.00 O ATOM 890 CB LYS B 44 -5.055 6.566 1.005 1.00 0.00 C ATOM 891 CG LYS B 44 -4.846 5.678 -0.249 1.00 0.00 C ATOM 892 CD LYS B 44 -5.318 6.334 -1.570 1.00 0.00 C ATOM 893 CE LYS B 44 -6.765 6.019 -2.002 1.00 0.00 C ATOM 894 NZ LYS B 44 -7.774 6.607 -1.101 1.00 0.00 N ATOM 0 H LYS B 44 -5.114 3.856 3.004 1.00 0.00 H new ATOM 0 HA LYS B 44 -3.873 5.415 2.249 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -6.062 6.982 0.969 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -4.361 7.405 0.953 1.00 0.00 H new ATOM 0 HG2 LYS B 44 -3.788 5.432 -0.335 1.00 0.00 H new ATOM 0 HG3 LYS B 44 -5.381 4.739 -0.110 1.00 0.00 H new ATOM 0 HD2 LYS B 44 -5.216 7.415 -1.472 1.00 0.00 H new ATOM 0 HD3 LYS B 44 -4.645 6.021 -2.369 1.00 0.00 H new ATOM 0 HE2 LYS B 44 -6.926 6.393 -3.013 1.00 0.00 H new ATOM 0 HE3 LYS B 44 -6.902 4.938 -2.036 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 -8.724 6.450 -1.494 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 -7.708 6.158 -0.165 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 -7.603 7.628 -1.007 1.00 0.00 H new ATOM 895 N PRO B 45 -5.596 7.591 4.199 1.00 0.00 N ATOM 896 CA PRO B 45 -5.253 8.705 5.122 1.00 0.00 C ATOM 897 C PRO B 45 -5.141 8.352 6.641 1.00 0.00 C ATOM 898 O PRO B 45 -6.002 7.710 7.251 1.00 0.00 O ATOM 899 CB PRO B 45 -6.400 9.694 4.830 1.00 0.00 C ATOM 900 CG PRO B 45 -7.607 8.811 4.508 1.00 0.00 C ATOM 901 CD PRO B 45 -6.999 7.625 3.759 1.00 0.00 C ATOM 0 HA PRO B 45 -4.245 9.078 4.942 1.00 0.00 H new ATOM 0 HB2 PRO B 45 -6.597 10.335 5.689 1.00 0.00 H new ATOM 0 HB3 PRO B 45 -6.154 10.348 3.994 1.00 0.00 H new ATOM 0 HG2 PRO B 45 -8.122 8.491 5.414 1.00 0.00 H new ATOM 0 HG3 PRO B 45 -8.338 9.339 3.896 1.00 0.00 H new ATOM 0 HD2 PRO B 45 -7.514 6.696 4.003 1.00 0.00 H new ATOM 0 HD3 PRO B 45 -7.073 7.757 2.680 1.00 0.00 H new ATOM 902 N SER B 46 -4.142 8.929 7.304 1.00 0.00 N ATOM 903 CA SER B 46 -4.447 9.916 8.378 1.00 0.00 C ATOM 904 C SER B 46 -4.652 11.362 7.769 1.00 0.00 C ATOM 905 O SER B 46 -4.008 11.658 6.754 1.00 0.00 O ATOM 906 CB SER B 46 -3.281 9.870 9.384 1.00 0.00 C ATOM 907 OG SER B 46 -3.568 10.699 10.512 1.00 0.00 O ATOM 0 H SER B 46 -3.151 8.753 7.140 1.00 0.00 H new ATOM 0 HA SER B 46 -5.379 9.668 8.885 1.00 0.00 H new ATOM 0 HB2 SER B 46 -3.114 8.844 9.711 1.00 0.00 H new ATOM 0 HB3 SER B 46 -2.362 10.205 8.902 1.00 0.00 H new ATOM 0 HG SER B 46 -2.729 11.002 10.917 1.00 0.00 H new ATOM 908 N PRO B 47 -5.507 12.296 8.292 1.00 0.00 N ATOM 909 CA PRO B 47 -5.688 13.652 7.681 1.00 0.00 C ATOM 910 C PRO B 47 -4.505 14.664 7.903 1.00 0.00 C ATOM 911 O PRO B 47 -4.598 15.654 8.634 1.00 0.00 O ATOM 912 CB PRO B 47 -7.045 14.059 8.292 1.00 0.00 C ATOM 913 CG PRO B 47 -7.076 13.386 9.667 1.00 0.00 C ATOM 914 CD PRO B 47 -6.396 12.036 9.441 1.00 0.00 C ATOM 0 HA PRO B 47 -5.681 13.649 6.591 1.00 0.00 H new ATOM 0 HB2 PRO B 47 -7.129 15.142 8.380 1.00 0.00 H new ATOM 0 HB3 PRO B 47 -7.875 13.724 7.670 1.00 0.00 H new ATOM 0 HG2 PRO B 47 -6.546 13.979 10.412 1.00 0.00 H new ATOM 0 HG3 PRO B 47 -8.098 13.262 10.026 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -5.836 11.715 10.319 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -7.120 11.252 9.221 1.00 0.00 H new ATOM 915 N VAL B 48 -3.385 14.389 7.223 1.00 0.00 N ATOM 916 CA VAL B 48 -2.077 15.071 7.446 1.00 0.00 C ATOM 917 C VAL B 48 -1.139 14.734 6.239 1.00 0.00 C ATOM 918 O VAL B 48 -0.835 13.571 5.961 1.00 0.00 O ATOM 919 CB VAL B 48 -1.442 14.776 8.855 1.00 0.00 C ATOM 920 CG1 VAL B 48 -1.143 13.291 9.167 1.00 0.00 C ATOM 921 CG2 VAL B 48 -0.170 15.604 9.145 1.00 0.00 C ATOM 0 H VAL B 48 -3.347 13.680 6.491 1.00 0.00 H new ATOM 0 HA VAL B 48 -2.235 16.149 7.477 1.00 0.00 H new ATOM 0 HB VAL B 48 -2.248 15.087 9.520 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -0.708 13.209 10.163 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -2.069 12.717 9.127 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -0.441 12.899 8.431 1.00 0.00 H new ATOM 0 HG21 VAL B 48 0.213 15.349 10.133 1.00 0.00 H new ATOM 0 HG22 VAL B 48 0.588 15.382 8.394 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -0.412 16.666 9.113 1.00 0.00 H new ATOM 922 N THR B 49 -0.684 15.765 5.510 1.00 0.00 N ATOM 923 CA THR B 49 0.210 15.580 4.314 1.00 0.00 C ATOM 924 C THR B 49 1.496 16.473 4.362 1.00 0.00 C ATOM 925 O THR B 49 1.816 17.217 3.430 1.00 0.00 O ATOM 926 CB THR B 49 -0.597 15.694 2.976 1.00 0.00 C ATOM 927 OG1 THR B 49 -1.245 16.954 2.867 1.00 0.00 O ATOM 928 CG2 THR B 49 -1.685 14.629 2.758 1.00 0.00 C ATOM 0 H THR B 49 -0.909 16.739 5.712 1.00 0.00 H new ATOM 0 HA THR B 49 0.594 14.560 4.352 1.00 0.00 H new ATOM 0 HB THR B 49 0.174 15.549 2.220 1.00 0.00 H new ATOM 0 HG1 THR B 49 -1.739 16.996 2.022 1.00 0.00 H new ATOM 0 HG21 THR B 49 -2.179 14.804 1.802 1.00 0.00 H new ATOM 0 HG22 THR B 49 -1.229 13.639 2.755 1.00 0.00 H new ATOM 0 HG23 THR B 49 -2.419 14.689 3.562 1.00 0.00 H new ATOM 929 N GLY B 50 2.293 16.327 5.436 1.00 0.00 N ATOM 930 CA GLY B 50 3.627 16.997 5.554 1.00 0.00 C ATOM 931 C GLY B 50 4.886 16.156 5.233 1.00 0.00 C ATOM 932 O GLY B 50 5.923 16.348 5.869 1.00 0.00 O ATOM 0 H GLY B 50 2.047 15.753 6.242 1.00 0.00 H new ATOM 0 HA2 GLY B 50 3.626 17.864 4.894 1.00 0.00 H new ATOM 0 HA3 GLY B 50 3.725 17.372 6.573 1.00 0.00 H new ATOM 933 N TYR B 51 4.818 15.254 4.244 1.00 0.00 N ATOM 934 CA TYR B 51 5.913 14.279 3.942 1.00 0.00 C ATOM 935 C TYR B 51 6.274 14.097 2.410 1.00 0.00 C ATOM 936 O TYR B 51 6.972 13.144 2.076 1.00 0.00 O ATOM 937 CB TYR B 51 5.733 12.893 4.695 1.00 0.00 C ATOM 938 CG TYR B 51 4.731 12.624 5.861 1.00 0.00 C ATOM 939 CD1 TYR B 51 3.359 12.782 5.626 1.00 0.00 C ATOM 940 CD2 TYR B 51 5.128 11.984 7.049 1.00 0.00 C ATOM 941 CE1 TYR B 51 2.414 12.337 6.536 1.00 0.00 C ATOM 942 CE2 TYR B 51 4.174 11.560 7.979 1.00 0.00 C ATOM 943 CZ TYR B 51 2.824 11.797 7.735 1.00 0.00 C ATOM 944 OH TYR B 51 1.861 11.511 8.650 1.00 0.00 O ATOM 0 H TYR B 51 4.012 15.167 3.625 1.00 0.00 H new ATOM 0 HA TYR B 51 6.797 14.761 4.359 1.00 0.00 H new ATOM 0 HB2 TYR B 51 5.494 12.163 3.922 1.00 0.00 H new ATOM 0 HB3 TYR B 51 6.718 12.635 5.083 1.00 0.00 H new ATOM 0 HD1 TYR B 51 3.031 13.261 4.715 1.00 0.00 H new ATOM 0 HD2 TYR B 51 6.177 11.819 7.244 1.00 0.00 H new ATOM 0 HE1 TYR B 51 1.361 12.413 6.307 1.00 0.00 H new ATOM 0 HE2 TYR B 51 4.482 11.052 8.881 1.00 0.00 H new ATOM 0 HH TYR B 51 1.027 11.285 8.187 1.00 0.00 H new ATOM 945 N ARG B 52 5.813 14.994 1.509 1.00 0.00 N ATOM 946 CA ARG B 52 6.200 15.138 0.055 1.00 0.00 C ATOM 947 C ARG B 52 5.383 14.655 -1.259 1.00 0.00 C ATOM 948 O ARG B 52 5.607 15.301 -2.279 1.00 0.00 O ATOM 949 CB ARG B 52 7.753 15.242 -0.147 1.00 0.00 C ATOM 950 CG ARG B 52 8.446 16.587 0.207 1.00 0.00 C ATOM 951 CD ARG B 52 8.490 16.911 1.711 1.00 0.00 C ATOM 952 NE ARG B 52 9.258 18.161 1.927 1.00 0.00 N ATOM 953 CZ ARG B 52 9.394 18.788 3.088 1.00 0.00 C ATOM 954 NH1 ARG B 52 8.863 18.391 4.208 1.00 0.00 N ATOM 955 NH2 ARG B 52 10.099 19.862 3.099 1.00 0.00 N ATOM 0 H ARG B 52 5.116 15.688 1.778 1.00 0.00 H new ATOM 0 HA ARG B 52 5.575 16.029 -0.007 1.00 0.00 H new ATOM 0 HB2 ARG B 52 8.221 14.458 0.449 1.00 0.00 H new ATOM 0 HB3 ARG B 52 7.970 15.020 -1.192 1.00 0.00 H new ATOM 0 HG2 ARG B 52 9.466 16.567 -0.176 1.00 0.00 H new ATOM 0 HG3 ARG B 52 7.927 17.394 -0.310 1.00 0.00 H new ATOM 0 HD2 ARG B 52 7.478 17.022 2.099 1.00 0.00 H new ATOM 0 HD3 ARG B 52 8.952 16.089 2.257 1.00 0.00 H new ATOM 0 HE ARG B 52 9.720 18.573 1.116 1.00 0.00 H new ATOM 0 HH11 ARG B 52 8.297 17.543 4.232 1.00 0.00 H new ATOM 0 HH12 ARG B 52 9.013 18.928 5.062 1.00 0.00 H new ATOM 0 HH21 ARG B 52 10.527 20.200 2.237 1.00 0.00 H new ATOM 0 HH22 ARG B 52 10.230 20.377 3.970 1.00 0.00 H new ATOM 956 N ASN B 53 4.426 13.739 -1.593 1.00 0.00 N ATOM 957 CA ASN B 53 3.861 12.567 -0.840 1.00 0.00 C ATOM 958 C ASN B 53 2.805 11.599 -1.498 1.00 0.00 C ATOM 959 O ASN B 53 2.767 11.618 -2.712 1.00 0.00 O ATOM 960 CB ASN B 53 3.687 12.766 0.664 1.00 0.00 C ATOM 961 CG ASN B 53 2.912 13.991 1.224 1.00 0.00 C ATOM 962 OD1 ASN B 53 2.698 14.121 2.419 1.00 0.00 O ATOM 963 ND2 ASN B 53 2.560 14.976 0.433 1.00 0.00 N ATOM 0 H ASN B 53 3.976 13.810 -2.505 1.00 0.00 H new ATOM 0 HA ASN B 53 4.736 11.933 -0.983 1.00 0.00 H new ATOM 0 HB2 ASN B 53 3.195 11.873 1.050 1.00 0.00 H new ATOM 0 HB3 ASN B 53 4.686 12.793 1.100 1.00 0.00 H new ATOM 0 HD21 ASN B 53 2.124 15.812 0.822 1.00 0.00 H new ATOM 0 HD22 ASN B 53 2.722 14.906 -0.572 1.00 0.00 H new ATOM 964 N ASP B 54 1.965 10.746 -0.833 1.00 0.00 N ATOM 965 CA ASP B 54 0.908 9.925 -1.523 1.00 0.00 C ATOM 966 C ASP B 54 -0.260 10.694 -2.215 1.00 0.00 C ATOM 967 O ASP B 54 -1.108 10.138 -2.904 1.00 0.00 O ATOM 968 CB ASP B 54 0.512 8.567 -0.912 1.00 0.00 C ATOM 969 CG ASP B 54 -0.660 8.522 0.064 1.00 0.00 C ATOM 970 OD1 ASP B 54 -1.853 8.807 -0.538 1.00 0.00 O ATOM 971 OD2 ASP B 54 -0.549 8.231 1.241 1.00 0.00 O ATOM 0 H ASP B 54 1.997 10.607 0.177 1.00 0.00 H new ATOM 0 HA ASP B 54 1.527 9.605 -2.361 1.00 0.00 H new ATOM 0 HB2 ASP B 54 0.286 7.887 -1.733 1.00 0.00 H new ATOM 0 HB3 ASP B 54 1.386 8.167 -0.399 1.00 0.00 H new ATOM 972 N ALA B 55 -0.282 11.996 -2.057 1.00 0.00 N ATOM 973 CA ALA B 55 0.028 12.924 -3.140 1.00 0.00 C ATOM 974 C ALA B 55 0.430 12.493 -4.591 1.00 0.00 C ATOM 975 O ALA B 55 -0.160 11.635 -5.241 1.00 0.00 O ATOM 976 CB ALA B 55 0.988 13.936 -2.346 1.00 0.00 C ATOM 0 H ALA B 55 -0.515 12.452 -1.175 1.00 0.00 H new ATOM 0 HA ALA B 55 -0.885 13.323 -3.581 1.00 0.00 H new ATOM 0 HB1 ALA B 55 1.327 14.722 -3.021 1.00 0.00 H new ATOM 0 HB2 ALA B 55 0.440 14.382 -1.516 1.00 0.00 H new ATOM 0 HB3 ALA B 55 1.851 13.392 -1.960 1.00 0.00 H new ATOM 977 N GLU B 56 1.504 13.113 -5.017 1.00 0.00 N ATOM 978 CA GLU B 56 2.436 12.629 -6.062 1.00 0.00 C ATOM 979 C GLU B 56 2.802 11.090 -6.131 1.00 0.00 C ATOM 980 O GLU B 56 3.181 10.543 -7.159 1.00 0.00 O ATOM 981 CB GLU B 56 3.633 13.563 -5.701 1.00 0.00 C ATOM 982 CG GLU B 56 4.829 13.529 -6.651 1.00 0.00 C ATOM 983 CD GLU B 56 4.612 14.076 -8.060 1.00 0.00 C ATOM 984 OE1 GLU B 56 3.947 13.506 -8.917 1.00 0.00 O ATOM 985 OE2 GLU B 56 5.244 15.262 -8.261 1.00 0.00 O ATOM 0 H GLU B 56 1.785 14.017 -4.638 1.00 0.00 H new ATOM 0 HA GLU B 56 2.020 12.682 -7.068 1.00 0.00 H new ATOM 0 HB2 GLU B 56 3.265 14.588 -5.652 1.00 0.00 H new ATOM 0 HB3 GLU B 56 3.982 13.301 -4.702 1.00 0.00 H new ATOM 0 HG2 GLU B 56 5.642 14.090 -6.191 1.00 0.00 H new ATOM 0 HG3 GLU B 56 5.164 12.495 -6.737 1.00 0.00 H new ATOM 986 N ARG B 57 2.714 10.379 -5.021 1.00 0.00 N ATOM 987 CA ARG B 57 3.076 8.958 -4.879 1.00 0.00 C ATOM 988 C ARG B 57 1.812 8.058 -5.071 1.00 0.00 C ATOM 989 O ARG B 57 1.936 7.030 -5.736 1.00 0.00 O ATOM 990 CB ARG B 57 3.914 8.831 -3.573 1.00 0.00 C ATOM 991 CG ARG B 57 5.312 9.520 -3.514 1.00 0.00 C ATOM 992 CD ARG B 57 5.586 10.901 -4.142 1.00 0.00 C ATOM 993 NE ARG B 57 7.004 11.301 -3.947 1.00 0.00 N ATOM 994 CZ ARG B 57 7.888 11.642 -4.875 1.00 0.00 C ATOM 995 NH1 ARG B 57 7.667 11.648 -6.148 1.00 0.00 N ATOM 996 NH2 ARG B 57 9.065 11.967 -4.478 1.00 0.00 N ATOM 0 H ARG B 57 2.374 10.784 -4.148 1.00 0.00 H new ATOM 0 HA ARG B 57 3.728 8.570 -5.662 1.00 0.00 H new ATOM 0 HB2 ARG B 57 3.314 9.229 -2.755 1.00 0.00 H new ATOM 0 HB3 ARG B 57 4.060 7.769 -3.375 1.00 0.00 H new ATOM 0 HG2 ARG B 57 5.575 9.600 -2.459 1.00 0.00 H new ATOM 0 HG3 ARG B 57 6.020 8.826 -3.967 1.00 0.00 H new ATOM 0 HD2 ARG B 57 5.355 10.873 -5.207 1.00 0.00 H new ATOM 0 HD3 ARG B 57 4.929 11.646 -3.693 1.00 0.00 H new ATOM 0 HE ARG B 57 7.338 11.315 -2.983 1.00 0.00 H new ATOM 0 HH11 ARG B 57 6.752 11.375 -6.508 1.00 0.00 H new ATOM 0 HH12 ARG B 57 8.407 11.925 -6.793 1.00 0.00 H new ATOM 0 HH21 ARG B 57 9.289 11.956 -3.483 1.00 0.00 H new ATOM 0 HH22 ARG B 57 9.776 12.236 -5.158 1.00 0.00 H new ATOM 997 N LEU B 58 0.557 8.446 -4.722 1.00 0.00 N ATOM 998 CA LEU B 58 -0.620 7.780 -5.380 1.00 0.00 C ATOM 999 C LEU B 58 -1.129 8.452 -6.731 1.00 0.00 C ATOM 1000 O LEU B 58 -1.834 7.848 -7.550 1.00 0.00 O ATOM 1001 CB LEU B 58 -1.510 7.171 -4.259 1.00 0.00 C ATOM 1002 CG LEU B 58 -0.823 5.982 -3.468 1.00 0.00 C ATOM 1003 CD1 LEU B 58 -1.598 5.552 -2.216 1.00 0.00 C ATOM 1004 CD2 LEU B 58 -0.509 4.707 -4.265 1.00 0.00 C ATOM 0 H LEU B 58 0.331 9.167 -4.036 1.00 0.00 H new ATOM 0 HA LEU B 58 -0.413 6.885 -5.966 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -1.777 7.958 -3.553 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -2.439 6.811 -4.701 1.00 0.00 H new ATOM 0 HG LEU B 58 0.127 6.448 -3.207 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -1.070 4.735 -1.724 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -1.679 6.396 -1.531 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -2.596 5.220 -2.502 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -0.042 3.973 -3.608 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -1.433 4.295 -4.671 1.00 0.00 H new ATOM 0 HD23 LEU B 58 0.171 4.947 -5.083 1.00 0.00 H new ATOM 1005 N ALA B 59 -0.467 9.538 -7.166 1.00 0.00 N ATOM 1006 CA ALA B 59 -0.034 9.692 -8.578 1.00 0.00 C ATOM 1007 C ALA B 59 0.866 8.579 -9.185 1.00 0.00 C ATOM 1008 O ALA B 59 0.597 8.251 -10.336 1.00 0.00 O ATOM 1009 CB ALA B 59 0.680 11.021 -8.775 1.00 0.00 C ATOM 0 H ALA B 59 -0.217 10.324 -6.566 1.00 0.00 H new ATOM 0 HA ALA B 59 -0.979 9.625 -9.117 1.00 0.00 H new ATOM 0 HB1 ALA B 59 0.990 11.117 -9.816 1.00 0.00 H new ATOM 0 HB2 ALA B 59 0.005 11.838 -8.521 1.00 0.00 H new ATOM 0 HB3 ALA B 59 1.557 11.062 -8.130 1.00 0.00 H new ATOM 1010 N ASP B 60 1.858 7.960 -8.498 1.00 0.00 N ATOM 1011 CA ASP B 60 2.352 6.606 -8.943 1.00 0.00 C ATOM 1012 C ASP B 60 1.294 5.459 -9.053 1.00 0.00 C ATOM 1013 O ASP B 60 1.443 4.545 -9.873 1.00 0.00 O ATOM 1014 CB ASP B 60 3.409 6.030 -8.010 1.00 0.00 C ATOM 1015 CG ASP B 60 4.332 4.984 -8.639 1.00 0.00 C ATOM 1016 OD1 ASP B 60 5.035 5.172 -9.624 1.00 0.00 O ATOM 1017 OD2 ASP B 60 4.205 3.777 -8.027 1.00 0.00 O ATOM 0 H ASP B 60 2.321 8.342 -7.673 1.00 0.00 H new ATOM 0 HA ASP B 60 2.720 6.860 -9.937 1.00 0.00 H new ATOM 0 HB2 ASP B 60 4.020 6.849 -7.629 1.00 0.00 H new ATOM 0 HB3 ASP B 60 2.908 5.581 -7.153 1.00 0.00 H new ATOM 1018 N GLU B 61 0.223 5.541 -8.254 1.00 0.00 N ATOM 1019 CA GLU B 61 -1.045 4.865 -8.662 1.00 0.00 C ATOM 1020 C GLU B 61 -1.488 5.308 -10.097 1.00 0.00 C ATOM 1021 O GLU B 61 -1.264 4.508 -11.010 1.00 0.00 O ATOM 1022 CB GLU B 61 -2.062 4.792 -7.475 1.00 0.00 C ATOM 1023 CG GLU B 61 -3.581 5.044 -7.694 1.00 0.00 C ATOM 1024 CD GLU B 61 -4.492 3.915 -8.177 1.00 0.00 C ATOM 1025 OE1 GLU B 61 -3.829 2.789 -8.534 1.00 0.00 O ATOM 1026 OE2 GLU B 61 -5.711 4.020 -8.239 1.00 0.00 O ATOM 0 H GLU B 61 0.190 6.038 -7.364 1.00 0.00 H new ATOM 0 HA GLU B 61 -0.915 3.798 -8.841 1.00 0.00 H new ATOM 0 HB2 GLU B 61 -1.965 3.800 -7.034 1.00 0.00 H new ATOM 0 HB3 GLU B 61 -1.726 5.508 -6.725 1.00 0.00 H new ATOM 0 HG2 GLU B 61 -3.987 5.403 -6.749 1.00 0.00 H new ATOM 0 HG3 GLU B 61 -3.672 5.860 -8.411 1.00 0.00 H new ATOM 1027 N GLN B 62 -1.866 6.573 -10.389 1.00 0.00 N ATOM 1028 CA GLN B 62 -2.385 6.923 -11.718 1.00 0.00 C ATOM 1029 C GLN B 62 -1.354 6.646 -12.869 1.00 0.00 C ATOM 1030 O GLN B 62 -1.655 5.821 -13.718 1.00 0.00 O ATOM 1031 CB GLN B 62 -2.942 8.358 -11.565 1.00 0.00 C ATOM 1032 CG GLN B 62 -3.671 8.913 -12.803 1.00 0.00 C ATOM 1033 CD GLN B 62 -4.857 8.108 -13.357 1.00 0.00 C ATOM 1034 OE1 GLN B 62 -6.014 8.474 -13.204 1.00 0.00 O ATOM 1035 NE2 GLN B 62 -4.621 6.998 -14.016 1.00 0.00 N ATOM 0 H GLN B 62 -1.821 7.351 -9.731 1.00 0.00 H new ATOM 0 HA GLN B 62 -3.198 6.281 -12.056 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -3.630 8.375 -10.720 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -2.117 9.027 -11.319 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -4.029 9.913 -12.560 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -2.938 9.022 -13.602 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -3.661 6.680 -14.152 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -5.397 6.454 -14.392 1.00 0.00 H new ATOM 1036 N SER B 63 -0.135 7.201 -12.812 1.00 0.00 N ATOM 1037 CA SER B 63 1.123 6.622 -13.404 1.00 0.00 C ATOM 1038 C SER B 63 1.236 5.175 -13.991 1.00 0.00 C ATOM 1039 O SER B 63 1.567 4.982 -15.164 1.00 0.00 O ATOM 1040 CB SER B 63 2.153 6.654 -12.295 1.00 0.00 C ATOM 1041 OG SER B 63 2.673 7.958 -12.022 1.00 0.00 O ATOM 0 H SER B 63 0.029 8.092 -12.343 1.00 0.00 H new ATOM 0 HA SER B 63 1.221 7.239 -14.297 1.00 0.00 H new ATOM 0 HB2 SER B 63 1.705 6.255 -11.385 1.00 0.00 H new ATOM 0 HB3 SER B 63 2.978 5.993 -12.560 1.00 0.00 H new ATOM 0 HG SER B 63 2.072 8.428 -11.407 1.00 0.00 H new ATOM 1042 N GLU B 64 1.068 4.183 -13.116 1.00 0.00 N ATOM 1043 CA GLU B 64 1.144 2.760 -13.497 1.00 0.00 C ATOM 1044 C GLU B 64 -0.293 2.166 -13.835 1.00 0.00 C ATOM 1045 O GLU B 64 -0.432 0.994 -14.162 1.00 0.00 O ATOM 1046 CB GLU B 64 2.059 2.241 -12.326 1.00 0.00 C ATOM 1047 CG GLU B 64 3.579 2.573 -12.435 1.00 0.00 C ATOM 1048 CD GLU B 64 4.453 2.048 -11.291 1.00 0.00 C ATOM 1049 OE1 GLU B 64 4.131 2.070 -10.107 1.00 0.00 O ATOM 1050 OE2 GLU B 64 5.651 1.574 -11.727 1.00 0.00 O ATOM 0 H GLU B 64 0.876 4.335 -12.126 1.00 0.00 H new ATOM 0 HA GLU B 64 1.590 2.447 -14.441 1.00 0.00 H new ATOM 0 HB2 GLU B 64 1.685 2.656 -11.390 1.00 0.00 H new ATOM 0 HB3 GLU B 64 1.949 1.158 -12.261 1.00 0.00 H new ATOM 0 HG2 GLU B 64 3.956 2.165 -13.373 1.00 0.00 H new ATOM 0 HG3 GLU B 64 3.694 3.656 -12.489 1.00 0.00 H new ATOM 1051 N LEU B 65 -1.332 3.016 -13.910 1.00 0.00 N ATOM 1052 CA LEU B 65 -2.504 2.940 -14.839 1.00 0.00 C ATOM 1053 C LEU B 65 -2.428 4.029 -16.023 1.00 0.00 C ATOM 1054 O LEU B 65 -3.441 4.415 -16.611 1.00 0.00 O ATOM 1055 CB LEU B 65 -3.827 3.037 -13.968 1.00 0.00 C ATOM 1056 CG LEU B 65 -3.751 3.372 -12.440 1.00 0.00 C ATOM 1057 CD1 LEU B 65 -4.982 3.987 -11.793 1.00 0.00 C ATOM 1058 CD2 LEU B 65 -3.189 2.253 -11.533 1.00 0.00 C ATOM 0 H LEU B 65 -1.392 3.826 -13.293 1.00 0.00 H new ATOM 0 HA LEU B 65 -2.499 1.985 -15.365 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -4.462 3.792 -14.431 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -4.345 2.083 -14.063 1.00 0.00 H new ATOM 0 HG LEU B 65 -3.011 4.170 -12.495 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -4.787 4.165 -10.736 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -5.217 4.932 -12.283 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -5.826 3.305 -11.896 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -3.182 2.593 -10.497 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -3.816 1.366 -11.619 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -2.172 2.010 -11.842 1.00 0.00 H new ATOM 1059 N VAL B 66 -1.222 4.542 -16.357 1.00 0.00 N ATOM 1060 CA VAL B 66 -0.934 5.687 -17.293 1.00 0.00 C ATOM 1061 C VAL B 66 0.187 5.225 -18.298 1.00 0.00 C ATOM 1062 O VAL B 66 0.420 4.038 -18.540 1.00 0.00 O ATOM 1063 CB VAL B 66 -0.618 6.945 -16.362 1.00 0.00 C ATOM 1064 CG1 VAL B 66 0.535 7.962 -16.450 1.00 0.00 C ATOM 1065 CG2 VAL B 66 -1.819 7.756 -15.939 1.00 0.00 C ATOM 0 H VAL B 66 -0.364 4.155 -15.965 1.00 0.00 H new ATOM 0 HA VAL B 66 -1.756 5.991 -17.941 1.00 0.00 H new ATOM 0 HB VAL B 66 -0.172 6.198 -15.706 1.00 0.00 H new ATOM 0 HG11 VAL B 66 0.438 8.692 -15.647 1.00 0.00 H new ATOM 0 HG12 VAL B 66 1.488 7.441 -16.354 1.00 0.00 H new ATOM 0 HG13 VAL B 66 0.497 8.473 -17.412 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -1.495 8.585 -15.310 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -2.324 8.146 -16.823 1.00 0.00 H new ATOM 0 HG23 VAL B 66 -2.506 7.123 -15.378 1.00 0.00 H new TER 1066 VAL B 66