USER MOD reduce.3.24.130724 H: found=0, std=0, add=974, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 974 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 31 SER OG : rot -146:sc= 0.0496 USER MOD Set 1.2: B 31 SER OG : rot 63:sc= 0.0516 USER MOD Set 2.1: A 21 CYS SG : rot -41:sc= -5.27! USER MOD Set 2.2: B 21 CYS SG : rot -35:sc= -5.56! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -0.331 X(o=-0.33,f=-0.023) USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 47:sc= 0.0903 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -10.4! C(o=-10!,f=-30!) USER MOD Single : A 27 GLN : amide:sc= -0.212 K(o=-0.21,f=-1.5!) USER MOD Single : A 32 GLN : amide:sc= -0.123 K(o=-0.12,f=-0.88) USER MOD Single : A 37 TYR OH : rot -119:sc= -1.88! USER MOD Single : A 38 CYS SG : rot -7:sc= -14.7! USER MOD Single : A 40 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.355) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -2.14! C(o=-2.1!,f=-6.3!) USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.0482 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -2.67 K(o=-2.7,f=-6!) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= -2.34! K(o=-2.3!,f=-1.2) USER MOD Single : A 58 ASN : amide:sc= -3.27! C(o=-3.3!,f=-7!) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 GLN : amide:sc= 0 X(o=0,f=-0.052) USER MOD Single : B 6 TYR OH : rot 180:sc= 0 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 LYS NZ :NH3+ -127:sc= -0.0228 (180deg=-0.286) USER MOD Single : B 15 THR OG1 : rot 52:sc= 0.176 USER MOD Single : B 16 SER OG : rot 180:sc= 0 USER MOD Single : B 23 ASN : amide:sc= -11.1! C(o=-11!,f=-29!) USER MOD Single : B 27 GLN : amide:sc= -0.313 K(o=-0.31,f=-1.6!) USER MOD Single : B 32 GLN : amide:sc=-0.00923 X(o=-0.0092,f=-0.19) USER MOD Single : B 37 TYR OH : rot -129:sc= -1.94! USER MOD Single : B 38 CYS SG : rot -4:sc= -15.7! USER MOD Single : B 40 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.166) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 ASN : amide:sc= -2.52! C(o=-2.5!,f=-13!) USER MOD Single : B 48 THR OG1 : rot 180:sc= 0 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 53 THR OG1 : rot 180:sc= 0 USER MOD Single : B 56 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : B 58 ASN : amide:sc= -0.554 K(o=-0.55,f=-3.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.856 30.106 -0.233 1.00 0.00 N ATOM 2 CA MET A 1 -16.065 29.279 -0.513 1.00 0.00 C ATOM 3 C MET A 1 -15.658 27.834 -0.815 1.00 0.00 C ATOM 4 O MET A 1 -15.245 27.510 -1.910 1.00 0.00 O ATOM 5 CB MET A 1 -16.711 29.922 -1.741 1.00 0.00 C ATOM 6 CG MET A 1 -18.010 29.190 -2.079 1.00 0.00 C ATOM 7 SD MET A 1 -18.768 29.956 -3.534 1.00 0.00 S ATOM 8 CE MET A 1 -20.423 30.172 -2.838 1.00 0.00 C ATOM 0 H1 MET A 1 -15.144 31.084 -0.029 1.00 0.00 H new ATOM 0 H2 MET A 1 -14.351 29.716 0.588 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.228 30.095 -1.062 1.00 0.00 H new ATOM 0 HA MET A 1 -16.748 29.246 0.336 1.00 0.00 H new ATOM 0 HB2 MET A 1 -16.915 30.975 -1.548 1.00 0.00 H new ATOM 0 HB3 MET A 1 -16.027 29.880 -2.588 1.00 0.00 H new ATOM 0 HG2 MET A 1 -17.807 28.137 -2.272 1.00 0.00 H new ATOM 0 HG3 MET A 1 -18.696 29.233 -1.233 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.072 30.638 -3.580 1.00 0.00 H new ATOM 0 HE2 MET A 1 -20.830 29.200 -2.559 1.00 0.00 H new ATOM 0 HE3 MET A 1 -20.366 30.808 -1.955 1.00 0.00 H new ATOM 20 N GLY A 2 -15.772 26.963 0.151 1.00 0.00 N ATOM 21 CA GLY A 2 -15.393 25.541 -0.079 1.00 0.00 C ATOM 22 C GLY A 2 -16.362 24.629 0.676 1.00 0.00 C ATOM 23 O GLY A 2 -16.759 24.928 1.784 1.00 0.00 O ATOM 0 H GLY A 2 -16.111 27.176 1.089 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -15.418 25.314 -1.145 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -14.372 25.366 0.260 1.00 0.00 H new ATOM 27 N PRO A 3 -16.710 23.541 0.046 1.00 0.00 N ATOM 28 CA PRO A 3 -17.643 22.569 0.666 1.00 0.00 C ATOM 29 C PRO A 3 -16.900 21.748 1.718 1.00 0.00 C ATOM 30 O PRO A 3 -17.455 21.340 2.719 1.00 0.00 O ATOM 31 CB PRO A 3 -18.052 21.677 -0.500 1.00 0.00 C ATOM 32 CG PRO A 3 -16.918 21.766 -1.471 1.00 0.00 C ATOM 33 CD PRO A 3 -16.273 23.118 -1.288 1.00 0.00 C ATOM 0 HA PRO A 3 -18.493 23.038 1.162 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -18.213 20.649 -0.174 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -18.985 22.018 -0.950 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -16.196 20.969 -1.292 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -17.278 21.647 -2.493 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -15.187 23.054 -1.351 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -16.596 23.821 -2.056 1.00 0.00 H new ATOM 41 N LEU A 4 -15.644 21.500 1.480 1.00 0.00 N ATOM 42 CA LEU A 4 -14.835 20.698 2.435 1.00 0.00 C ATOM 43 C LEU A 4 -13.354 21.017 2.240 1.00 0.00 C ATOM 44 O LEU A 4 -12.509 20.144 2.283 1.00 0.00 O ATOM 45 CB LEU A 4 -15.116 19.248 2.045 1.00 0.00 C ATOM 46 CG LEU A 4 -15.205 18.385 3.301 1.00 0.00 C ATOM 47 CD1 LEU A 4 -13.920 18.543 4.116 1.00 0.00 C ATOM 48 CD2 LEU A 4 -16.402 18.834 4.142 1.00 0.00 C ATOM 0 H LEU A 4 -15.138 21.823 0.655 1.00 0.00 H new ATOM 0 HA LEU A 4 -15.080 20.902 3.477 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -16.048 19.187 1.483 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -14.326 18.877 1.393 1.00 0.00 H new ATOM 0 HG LEU A 4 -15.331 17.340 3.019 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -13.981 17.928 5.014 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -13.067 18.226 3.516 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -13.795 19.588 4.400 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -16.467 18.219 5.039 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -16.275 19.879 4.426 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -17.317 18.725 3.560 1.00 0.00 H new ATOM 60 N GLN A 5 -13.032 22.259 1.998 1.00 0.00 N ATOM 61 CA GLN A 5 -11.605 22.626 1.767 1.00 0.00 C ATOM 62 C GLN A 5 -11.147 22.048 0.422 1.00 0.00 C ATOM 63 O GLN A 5 -9.991 22.131 0.057 1.00 0.00 O ATOM 64 CB GLN A 5 -10.830 21.991 2.925 1.00 0.00 C ATOM 65 CG GLN A 5 -9.626 22.867 3.276 1.00 0.00 C ATOM 66 CD GLN A 5 -9.461 22.928 4.796 1.00 0.00 C ATOM 67 OE1 GLN A 5 -9.098 23.953 5.338 1.00 0.00 O ATOM 68 NE2 GLN A 5 -9.714 21.866 5.512 1.00 0.00 N ATOM 0 H GLN A 5 -13.694 23.034 1.950 1.00 0.00 H new ATOM 0 HA GLN A 5 -11.447 23.704 1.731 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -11.479 21.882 3.794 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -10.497 20.991 2.648 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -8.723 22.462 2.818 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -9.765 23.871 2.875 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -10.019 21.005 5.057 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -9.607 21.897 6.526 1.00 0.00 H new ATOM 77 N TYR A 6 -12.061 21.465 -0.316 1.00 0.00 N ATOM 78 CA TYR A 6 -11.724 20.869 -1.642 1.00 0.00 C ATOM 79 C TYR A 6 -10.329 20.235 -1.634 1.00 0.00 C ATOM 80 O TYR A 6 -9.784 19.914 -0.597 1.00 0.00 O ATOM 81 CB TYR A 6 -11.781 22.036 -2.630 1.00 0.00 C ATOM 82 CG TYR A 6 -12.458 21.582 -3.901 1.00 0.00 C ATOM 83 CD1 TYR A 6 -13.840 21.360 -3.917 1.00 0.00 C ATOM 84 CD2 TYR A 6 -11.703 21.376 -5.061 1.00 0.00 C ATOM 85 CE1 TYR A 6 -14.467 20.935 -5.095 1.00 0.00 C ATOM 86 CE2 TYR A 6 -12.328 20.950 -6.238 1.00 0.00 C ATOM 87 CZ TYR A 6 -13.711 20.731 -6.256 1.00 0.00 C ATOM 88 OH TYR A 6 -14.328 20.311 -7.416 1.00 0.00 O ATOM 0 H TYR A 6 -13.041 21.377 -0.049 1.00 0.00 H new ATOM 0 HA TYR A 6 -12.416 20.069 -1.907 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -12.327 22.872 -2.192 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -10.774 22.392 -2.848 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -14.423 21.516 -3.021 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -10.637 21.546 -5.048 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -15.533 20.765 -5.108 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -11.744 20.790 -7.132 1.00 0.00 H new ATOM 0 HH TYR A 6 -13.660 20.219 -8.127 1.00 0.00 H new ATOM 98 N LYS A 7 -9.757 20.047 -2.793 1.00 0.00 N ATOM 99 CA LYS A 7 -8.403 19.426 -2.873 1.00 0.00 C ATOM 100 C LYS A 7 -8.348 18.160 -2.015 1.00 0.00 C ATOM 101 O LYS A 7 -7.440 17.971 -1.229 1.00 0.00 O ATOM 102 CB LYS A 7 -7.448 20.490 -2.334 1.00 0.00 C ATOM 103 CG LYS A 7 -7.742 21.830 -3.013 1.00 0.00 C ATOM 104 CD LYS A 7 -6.566 22.783 -2.797 1.00 0.00 C ATOM 105 CE LYS A 7 -6.588 23.877 -3.867 1.00 0.00 C ATOM 106 NZ LYS A 7 -5.309 24.616 -3.685 1.00 0.00 N ATOM 0 H LYS A 7 -10.171 20.298 -3.691 1.00 0.00 H new ATOM 0 HA LYS A 7 -8.144 19.126 -3.888 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.563 20.584 -1.254 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -6.415 20.195 -2.520 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -7.910 21.680 -4.079 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -8.655 22.264 -2.604 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -6.625 23.230 -1.805 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -5.626 22.233 -2.844 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -6.659 23.450 -4.867 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -7.447 24.536 -3.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -5.249 25.384 -4.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -5.273 25.017 -2.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -4.510 23.964 -3.818 1.00 0.00 H new ATOM 120 N ASP A 8 -9.312 17.292 -2.158 1.00 0.00 N ATOM 121 CA ASP A 8 -9.312 16.039 -1.347 1.00 0.00 C ATOM 122 C ASP A 8 -8.888 14.846 -2.209 1.00 0.00 C ATOM 123 O ASP A 8 -9.612 14.408 -3.081 1.00 0.00 O ATOM 124 CB ASP A 8 -10.757 15.872 -0.874 1.00 0.00 C ATOM 125 CG ASP A 8 -10.764 15.429 0.589 1.00 0.00 C ATOM 126 OD1 ASP A 8 -9.704 15.089 1.090 1.00 0.00 O ATOM 127 OD2 ASP A 8 -11.829 15.435 1.185 1.00 0.00 O ATOM 0 H ASP A 8 -10.098 17.395 -2.799 1.00 0.00 H new ATOM 0 HA ASP A 8 -8.613 16.090 -0.513 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -11.298 16.812 -0.983 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -11.270 15.135 -1.491 1.00 0.00 H new ATOM 132 N LEU A 9 -7.719 14.318 -1.968 1.00 0.00 N ATOM 133 CA LEU A 9 -7.245 13.152 -2.769 1.00 0.00 C ATOM 134 C LEU A 9 -6.068 12.475 -2.061 1.00 0.00 C ATOM 135 O LEU A 9 -5.294 13.115 -1.376 1.00 0.00 O ATOM 136 CB LEU A 9 -6.798 13.746 -4.105 1.00 0.00 C ATOM 137 CG LEU A 9 -5.847 14.915 -3.848 1.00 0.00 C ATOM 138 CD1 LEU A 9 -4.497 14.634 -4.510 1.00 0.00 C ATOM 139 CD2 LEU A 9 -6.446 16.196 -4.434 1.00 0.00 C ATOM 0 H LEU A 9 -7.071 14.643 -1.251 1.00 0.00 H new ATOM 0 HA LEU A 9 -8.018 12.395 -2.899 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -6.302 12.984 -4.706 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -7.664 14.086 -4.673 1.00 0.00 H new ATOM 0 HG LEU A 9 -5.704 15.037 -2.774 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -3.821 15.469 -4.326 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -4.070 13.722 -4.093 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -4.637 14.511 -5.584 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -5.769 17.031 -4.252 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -6.589 16.073 -5.508 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -7.407 16.398 -3.961 1.00 0.00 H new ATOM 151 N LYS A 10 -5.926 11.188 -2.219 1.00 0.00 N ATOM 152 CA LYS A 10 -4.797 10.479 -1.551 1.00 0.00 C ATOM 153 C LYS A 10 -4.929 10.596 -0.030 1.00 0.00 C ATOM 154 O LYS A 10 -6.019 10.671 0.495 1.00 0.00 O ATOM 155 CB LYS A 10 -3.539 11.197 -2.039 1.00 0.00 C ATOM 156 CG LYS A 10 -2.455 10.169 -2.371 1.00 0.00 C ATOM 157 CD LYS A 10 -1.304 10.861 -3.104 1.00 0.00 C ATOM 158 CE LYS A 10 0.010 10.150 -2.775 1.00 0.00 C ATOM 159 NZ LYS A 10 1.025 10.794 -3.655 1.00 0.00 N ATOM 0 H LYS A 10 -6.540 10.598 -2.780 1.00 0.00 H new ATOM 0 HA LYS A 10 -4.776 9.415 -1.786 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -3.769 11.795 -2.921 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -3.180 11.884 -1.273 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -2.089 9.702 -1.457 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -2.870 9.374 -2.991 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -1.480 10.843 -4.179 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -1.247 11.908 -2.808 1.00 0.00 H new ATOM 0 HE2 LYS A 10 0.269 10.266 -1.723 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -0.060 9.080 -2.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 1.955 10.360 -3.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 0.755 10.662 -4.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 1.074 11.811 -3.442 1.00 0.00 H new ATOM 173 N ILE A 11 -3.817 10.617 0.667 1.00 0.00 N ATOM 174 CA ILE A 11 -3.828 10.730 2.167 1.00 0.00 C ATOM 175 C ILE A 11 -5.110 10.191 2.776 1.00 0.00 C ATOM 176 O ILE A 11 -5.647 10.765 3.702 1.00 0.00 O ATOM 177 CB ILE A 11 -3.718 12.215 2.490 1.00 0.00 C ATOM 178 CG1 ILE A 11 -4.482 13.050 1.459 1.00 0.00 C ATOM 179 CG2 ILE A 11 -2.253 12.607 2.496 1.00 0.00 C ATOM 180 CD1 ILE A 11 -4.881 14.385 2.088 1.00 0.00 C ATOM 0 H ILE A 11 -2.886 10.560 0.255 1.00 0.00 H new ATOM 0 HA ILE A 11 -3.006 10.145 2.580 1.00 0.00 H new ATOM 0 HB ILE A 11 -4.157 12.405 3.470 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -3.861 13.220 0.579 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.369 12.513 1.124 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -2.161 13.668 2.726 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -1.724 12.025 3.251 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -1.820 12.410 1.516 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.425 14.983 1.357 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -5.517 14.203 2.954 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -3.986 14.922 2.401 1.00 0.00 H new ATOM 192 N ASP A 12 -5.613 9.104 2.290 1.00 0.00 N ATOM 193 CA ASP A 12 -6.857 8.584 2.892 1.00 0.00 C ATOM 194 C ASP A 12 -6.800 7.057 2.993 1.00 0.00 C ATOM 195 O ASP A 12 -6.698 6.496 4.066 1.00 0.00 O ATOM 196 CB ASP A 12 -7.976 9.031 1.952 1.00 0.00 C ATOM 197 CG ASP A 12 -9.278 9.198 2.739 1.00 0.00 C ATOM 198 OD1 ASP A 12 -9.360 10.135 3.517 1.00 0.00 O ATOM 199 OD2 ASP A 12 -10.170 8.387 2.551 1.00 0.00 O ATOM 0 H ASP A 12 -5.227 8.561 1.517 1.00 0.00 H new ATOM 0 HA ASP A 12 -7.013 8.957 3.904 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -7.707 9.972 1.473 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -8.112 8.297 1.158 1.00 0.00 H new ATOM 204 N ILE A 13 -6.858 6.384 1.877 1.00 0.00 N ATOM 205 CA ILE A 13 -6.798 4.894 1.893 1.00 0.00 C ATOM 206 C ILE A 13 -5.511 4.424 1.202 1.00 0.00 C ATOM 207 O ILE A 13 -4.484 5.066 1.286 1.00 0.00 O ATOM 208 CB ILE A 13 -8.033 4.439 1.110 1.00 0.00 C ATOM 209 CG1 ILE A 13 -7.978 5.016 -0.307 1.00 0.00 C ATOM 210 CG2 ILE A 13 -9.297 4.936 1.813 1.00 0.00 C ATOM 211 CD1 ILE A 13 -8.979 4.277 -1.198 1.00 0.00 C ATOM 0 H ILE A 13 -6.945 6.803 0.951 1.00 0.00 H new ATOM 0 HA ILE A 13 -6.790 4.483 2.903 1.00 0.00 H new ATOM 0 HB ILE A 13 -8.050 3.350 1.061 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -8.210 6.081 -0.287 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -6.971 4.917 -0.713 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -10.175 4.612 1.255 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -9.337 4.526 2.822 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -9.281 6.025 1.864 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -8.940 4.688 -2.207 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -8.726 3.217 -1.228 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -9.984 4.399 -0.795 1.00 0.00 H new ATOM 223 N LYS A 14 -5.558 3.314 0.513 1.00 0.00 N ATOM 224 CA LYS A 14 -4.337 2.814 -0.190 1.00 0.00 C ATOM 225 C LYS A 14 -3.295 2.314 0.817 1.00 0.00 C ATOM 226 O LYS A 14 -2.129 2.646 0.734 1.00 0.00 O ATOM 227 CB LYS A 14 -3.800 4.018 -0.964 1.00 0.00 C ATOM 228 CG LYS A 14 -3.074 3.535 -2.222 1.00 0.00 C ATOM 229 CD LYS A 14 -4.033 3.569 -3.414 1.00 0.00 C ATOM 230 CE LYS A 14 -4.326 2.140 -3.877 1.00 0.00 C ATOM 231 NZ LYS A 14 -4.766 2.277 -5.294 1.00 0.00 N ATOM 0 H LYS A 14 -6.388 2.731 0.406 1.00 0.00 H new ATOM 0 HA LYS A 14 -4.563 1.973 -0.846 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -4.619 4.683 -1.237 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -3.119 4.593 -0.336 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -2.209 4.168 -2.420 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -2.700 2.522 -2.072 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -4.960 4.069 -3.134 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -3.595 4.144 -4.230 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -3.440 1.510 -3.798 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -5.101 1.678 -3.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -4.985 1.337 -5.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -5.615 2.876 -5.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -4.005 2.713 -5.853 1.00 0.00 H new ATOM 245 N THR A 15 -3.704 1.510 1.759 1.00 0.00 N ATOM 246 CA THR A 15 -2.737 0.977 2.764 1.00 0.00 C ATOM 247 C THR A 15 -2.696 -0.553 2.681 1.00 0.00 C ATOM 248 O THR A 15 -3.656 -1.217 3.014 1.00 0.00 O ATOM 249 CB THR A 15 -3.281 1.431 4.116 1.00 0.00 C ATOM 250 OG1 THR A 15 -4.698 1.331 4.117 1.00 0.00 O ATOM 251 CG2 THR A 15 -2.866 2.880 4.370 1.00 0.00 C ATOM 0 H THR A 15 -4.668 1.198 1.878 1.00 0.00 H new ATOM 0 HA THR A 15 -1.721 1.335 2.599 1.00 0.00 H new ATOM 0 HB THR A 15 -2.876 0.795 4.904 1.00 0.00 H new ATOM 0 HG1 THR A 15 -4.965 0.459 3.757 1.00 0.00 H new ATOM 0 HG21 THR A 15 -3.254 3.206 5.335 1.00 0.00 H new ATOM 0 HG22 THR A 15 -1.778 2.952 4.373 1.00 0.00 H new ATOM 0 HG23 THR A 15 -3.269 3.517 3.583 1.00 0.00 H new ATOM 259 N SER A 16 -1.601 -1.120 2.230 1.00 0.00 N ATOM 260 CA SER A 16 -1.523 -2.611 2.129 1.00 0.00 C ATOM 261 C SER A 16 -1.676 -3.224 3.557 1.00 0.00 C ATOM 262 O SER A 16 -2.672 -2.918 4.179 1.00 0.00 O ATOM 263 CB SER A 16 -0.198 -2.886 1.410 1.00 0.00 C ATOM 264 OG SER A 16 -0.209 -2.226 0.151 1.00 0.00 O ATOM 0 H SER A 16 -0.765 -0.619 1.930 1.00 0.00 H new ATOM 0 HA SER A 16 -2.321 -3.085 1.557 1.00 0.00 H new ATOM 0 HB2 SER A 16 0.638 -2.532 2.013 1.00 0.00 H new ATOM 0 HB3 SER A 16 -0.060 -3.958 1.272 1.00 0.00 H new ATOM 0 HG SER A 16 0.636 -2.396 -0.315 1.00 0.00 H new ATOM 270 N PRO A 17 -0.786 -4.067 4.104 1.00 0.00 N ATOM 271 CA PRO A 17 0.482 -4.583 3.557 1.00 0.00 C ATOM 272 C PRO A 17 0.348 -6.074 3.253 1.00 0.00 C ATOM 273 O PRO A 17 1.237 -6.839 3.575 1.00 0.00 O ATOM 274 CB PRO A 17 1.390 -4.469 4.781 1.00 0.00 C ATOM 275 CG PRO A 17 0.469 -4.532 5.961 1.00 0.00 C ATOM 276 CD PRO A 17 -0.917 -4.649 5.412 1.00 0.00 C ATOM 0 HA PRO A 17 0.811 -4.071 2.653 1.00 0.00 H new ATOM 0 HB2 PRO A 17 2.119 -5.279 4.807 1.00 0.00 H new ATOM 0 HB3 PRO A 17 1.951 -3.535 4.769 1.00 0.00 H new ATOM 0 HG2 PRO A 17 0.709 -5.386 6.595 1.00 0.00 H new ATOM 0 HG3 PRO A 17 0.568 -3.639 6.578 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -1.247 -5.687 5.363 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -1.642 -4.112 6.024 1.00 0.00 H new ATOM 284 N PRO A 18 -0.760 -6.468 2.694 1.00 0.00 N ATOM 285 CA PRO A 18 -0.965 -7.900 2.431 1.00 0.00 C ATOM 286 C PRO A 18 0.069 -8.460 1.432 1.00 0.00 C ATOM 287 O PRO A 18 0.417 -9.621 1.531 1.00 0.00 O ATOM 288 CB PRO A 18 -2.412 -7.971 1.959 1.00 0.00 C ATOM 289 CG PRO A 18 -2.712 -6.618 1.420 1.00 0.00 C ATOM 290 CD PRO A 18 -1.904 -5.660 2.252 1.00 0.00 C ATOM 0 HA PRO A 18 -0.808 -8.533 3.304 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -2.540 -8.737 1.194 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -3.082 -8.226 2.780 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -2.440 -6.547 0.367 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -3.777 -6.396 1.490 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -1.584 -4.795 1.671 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -2.478 -5.281 3.098 1.00 0.00 H new ATOM 298 N PRO A 19 0.600 -7.636 0.549 1.00 0.00 N ATOM 299 CA PRO A 19 1.656 -8.132 -0.350 1.00 0.00 C ATOM 300 C PRO A 19 2.959 -8.067 0.445 1.00 0.00 C ATOM 301 O PRO A 19 3.783 -7.201 0.248 1.00 0.00 O ATOM 302 CB PRO A 19 1.644 -7.150 -1.515 1.00 0.00 C ATOM 303 CG PRO A 19 1.069 -5.883 -0.964 1.00 0.00 C ATOM 304 CD PRO A 19 0.297 -6.221 0.292 1.00 0.00 C ATOM 0 HA PRO A 19 1.529 -9.151 -0.715 1.00 0.00 H new ATOM 0 HB2 PRO A 19 2.650 -6.988 -1.902 1.00 0.00 H new ATOM 0 HB3 PRO A 19 1.041 -7.528 -2.341 1.00 0.00 H new ATOM 0 HG2 PRO A 19 1.863 -5.170 -0.742 1.00 0.00 H new ATOM 0 HG3 PRO A 19 0.414 -5.412 -1.697 1.00 0.00 H new ATOM 0 HD2 PRO A 19 0.605 -5.592 1.127 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -0.773 -6.064 0.153 1.00 0.00 H new ATOM 312 N GLU A 20 3.087 -8.953 1.398 1.00 0.00 N ATOM 313 CA GLU A 20 4.270 -8.978 2.321 1.00 0.00 C ATOM 314 C GLU A 20 5.627 -9.003 1.605 1.00 0.00 C ATOM 315 O GLU A 20 6.449 -9.847 1.883 1.00 0.00 O ATOM 316 CB GLU A 20 4.098 -10.265 3.138 1.00 0.00 C ATOM 317 CG GLU A 20 3.615 -11.405 2.236 1.00 0.00 C ATOM 318 CD GLU A 20 4.062 -12.743 2.826 1.00 0.00 C ATOM 319 OE1 GLU A 20 5.225 -13.077 2.670 1.00 0.00 O ATOM 320 OE2 GLU A 20 3.235 -13.411 3.425 1.00 0.00 O ATOM 0 H GLU A 20 2.401 -9.684 1.583 1.00 0.00 H new ATOM 0 HA GLU A 20 4.288 -8.066 2.918 1.00 0.00 H new ATOM 0 HB2 GLU A 20 5.045 -10.537 3.605 1.00 0.00 H new ATOM 0 HB3 GLU A 20 3.382 -10.100 3.943 1.00 0.00 H new ATOM 0 HG2 GLU A 20 2.529 -11.379 2.148 1.00 0.00 H new ATOM 0 HG3 GLU A 20 4.020 -11.285 1.231 1.00 0.00 H new ATOM 327 N CYS A 21 5.911 -8.073 0.741 1.00 0.00 N ATOM 328 CA CYS A 21 7.272 -8.087 0.114 1.00 0.00 C ATOM 329 C CYS A 21 8.266 -7.439 1.084 1.00 0.00 C ATOM 330 O CYS A 21 9.425 -7.797 1.125 1.00 0.00 O ATOM 331 CB CYS A 21 7.252 -7.347 -1.247 1.00 0.00 C ATOM 332 SG CYS A 21 5.720 -6.415 -1.519 1.00 0.00 S ATOM 0 H CYS A 21 5.287 -7.323 0.444 1.00 0.00 H new ATOM 0 HA CYS A 21 7.580 -9.114 -0.081 1.00 0.00 H new ATOM 0 HB2 CYS A 21 8.101 -6.665 -1.297 1.00 0.00 H new ATOM 0 HB3 CYS A 21 7.378 -8.072 -2.051 1.00 0.00 H new ATOM 0 HG CYS A 21 4.706 -7.119 -1.111 1.00 0.00 H new ATOM 338 N ILE A 22 7.815 -6.496 1.878 1.00 0.00 N ATOM 339 CA ILE A 22 8.733 -5.839 2.860 1.00 0.00 C ATOM 340 C ILE A 22 8.909 -6.725 4.079 1.00 0.00 C ATOM 341 O ILE A 22 10.003 -7.060 4.465 1.00 0.00 O ATOM 342 CB ILE A 22 8.045 -4.551 3.309 1.00 0.00 C ATOM 343 CG1 ILE A 22 7.710 -3.619 2.137 1.00 0.00 C ATOM 344 CG2 ILE A 22 8.958 -3.817 4.280 1.00 0.00 C ATOM 345 CD1 ILE A 22 8.322 -4.111 0.817 1.00 0.00 C ATOM 0 H ILE A 22 6.854 -6.155 1.888 1.00 0.00 H new ATOM 0 HA ILE A 22 9.707 -5.654 2.407 1.00 0.00 H new ATOM 0 HB ILE A 22 7.104 -4.830 3.783 1.00 0.00 H new ATOM 0 HG12 ILE A 22 6.628 -3.546 2.030 1.00 0.00 H new ATOM 0 HG13 ILE A 22 8.077 -2.616 2.355 1.00 0.00 H new ATOM 0 HG21 ILE A 22 8.476 -2.896 4.607 1.00 0.00 H new ATOM 0 HG22 ILE A 22 9.154 -4.451 5.145 1.00 0.00 H new ATOM 0 HG23 ILE A 22 9.899 -3.578 3.785 1.00 0.00 H new ATOM 0 HD11 ILE A 22 8.059 -3.421 0.015 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.407 -4.159 0.914 1.00 0.00 H new ATOM 0 HD13 ILE A 22 7.935 -5.103 0.584 1.00 0.00 H new ATOM 357 N ASN A 23 7.840 -7.093 4.710 1.00 0.00 N ATOM 358 CA ASN A 23 7.988 -7.952 5.914 1.00 0.00 C ATOM 359 C ASN A 23 8.600 -9.292 5.508 1.00 0.00 C ATOM 360 O ASN A 23 9.601 -9.705 6.051 1.00 0.00 O ATOM 361 CB ASN A 23 6.589 -8.134 6.496 1.00 0.00 C ATOM 362 CG ASN A 23 5.737 -8.966 5.551 1.00 0.00 C ATOM 363 OD1 ASN A 23 5.772 -8.761 4.358 1.00 0.00 O ATOM 364 ND2 ASN A 23 4.974 -9.907 6.037 1.00 0.00 N ATOM 0 H ASN A 23 6.884 -6.844 4.454 1.00 0.00 H new ATOM 0 HA ASN A 23 8.647 -7.504 6.657 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.651 -8.623 7.468 1.00 0.00 H new ATOM 0 HB3 ASN A 23 6.124 -7.161 6.657 1.00 0.00 H new ATOM 0 HD21 ASN A 23 4.403 -10.475 5.411 1.00 0.00 H new ATOM 0 HD22 ASN A 23 4.949 -10.075 7.043 1.00 0.00 H new ATOM 371 N ASP A 24 8.067 -9.951 4.514 1.00 0.00 N ATOM 372 CA ASP A 24 8.694 -11.228 4.092 1.00 0.00 C ATOM 373 C ASP A 24 10.148 -10.931 3.802 1.00 0.00 C ATOM 374 O ASP A 24 11.002 -11.795 3.833 1.00 0.00 O ATOM 375 CB ASP A 24 7.962 -11.654 2.823 1.00 0.00 C ATOM 376 CG ASP A 24 8.317 -13.105 2.492 1.00 0.00 C ATOM 377 OD1 ASP A 24 9.460 -13.476 2.698 1.00 0.00 O ATOM 378 OD2 ASP A 24 7.438 -13.819 2.039 1.00 0.00 O ATOM 0 H ASP A 24 7.241 -9.665 3.988 1.00 0.00 H new ATOM 0 HA ASP A 24 8.634 -12.017 4.842 1.00 0.00 H new ATOM 0 HB2 ASP A 24 6.885 -11.554 2.961 1.00 0.00 H new ATOM 0 HB3 ASP A 24 8.239 -11.002 1.994 1.00 0.00 H new ATOM 383 N LEU A 25 10.430 -9.689 3.537 1.00 0.00 N ATOM 384 CA LEU A 25 11.809 -9.285 3.260 1.00 0.00 C ATOM 385 C LEU A 25 12.523 -8.988 4.553 1.00 0.00 C ATOM 386 O LEU A 25 13.549 -9.546 4.886 1.00 0.00 O ATOM 387 CB LEU A 25 11.689 -7.985 2.455 1.00 0.00 C ATOM 388 CG LEU A 25 12.862 -7.020 2.771 1.00 0.00 C ATOM 389 CD1 LEU A 25 13.845 -6.981 1.616 1.00 0.00 C ATOM 390 CD2 LEU A 25 12.315 -5.619 3.036 1.00 0.00 C ATOM 0 H LEU A 25 9.745 -8.934 3.503 1.00 0.00 H new ATOM 0 HA LEU A 25 12.362 -10.062 2.732 1.00 0.00 H new ATOM 0 HB2 LEU A 25 11.679 -8.214 1.389 1.00 0.00 H new ATOM 0 HB3 LEU A 25 10.742 -7.498 2.685 1.00 0.00 H new ATOM 0 HG LEU A 25 13.384 -7.380 3.658 1.00 0.00 H new ATOM 0 HD11 LEU A 25 14.661 -6.299 1.855 1.00 0.00 H new ATOM 0 HD12 LEU A 25 14.246 -7.980 1.445 1.00 0.00 H new ATOM 0 HD13 LEU A 25 13.336 -6.636 0.716 1.00 0.00 H new ATOM 0 HD21 LEU A 25 13.140 -4.942 3.258 1.00 0.00 H new ATOM 0 HD22 LEU A 25 11.781 -5.264 2.154 1.00 0.00 H new ATOM 0 HD23 LEU A 25 11.632 -5.650 3.885 1.00 0.00 H new ATOM 402 N LEU A 26 12.005 -8.014 5.219 1.00 0.00 N ATOM 403 CA LEU A 26 12.628 -7.519 6.430 1.00 0.00 C ATOM 404 C LEU A 26 12.458 -8.483 7.593 1.00 0.00 C ATOM 405 O LEU A 26 13.074 -8.323 8.628 1.00 0.00 O ATOM 406 CB LEU A 26 11.906 -6.209 6.677 1.00 0.00 C ATOM 407 CG LEU A 26 12.158 -5.784 8.092 1.00 0.00 C ATOM 408 CD1 LEU A 26 13.642 -5.531 8.242 1.00 0.00 C ATOM 409 CD2 LEU A 26 11.380 -4.508 8.398 1.00 0.00 C ATOM 0 H LEU A 26 11.146 -7.532 4.955 1.00 0.00 H new ATOM 0 HA LEU A 26 13.707 -7.401 6.332 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.260 -5.446 5.984 1.00 0.00 H new ATOM 0 HB3 LEU A 26 10.837 -6.328 6.502 1.00 0.00 H new ATOM 0 HG LEU A 26 11.832 -6.559 8.786 1.00 0.00 H new ATOM 0 HD11 LEU A 26 13.856 -5.219 9.264 1.00 0.00 H new ATOM 0 HD12 LEU A 26 14.191 -6.446 8.019 1.00 0.00 H new ATOM 0 HD13 LEU A 26 13.949 -4.746 7.551 1.00 0.00 H new ATOM 0 HD21 LEU A 26 11.568 -4.205 9.428 1.00 0.00 H new ATOM 0 HD22 LEU A 26 11.701 -3.715 7.722 1.00 0.00 H new ATOM 0 HD23 LEU A 26 10.314 -4.690 8.262 1.00 0.00 H new ATOM 421 N GLN A 27 11.671 -9.499 7.437 1.00 0.00 N ATOM 422 CA GLN A 27 11.534 -10.455 8.535 1.00 0.00 C ATOM 423 C GLN A 27 12.869 -11.187 8.666 1.00 0.00 C ATOM 424 O GLN A 27 13.084 -11.963 9.576 1.00 0.00 O ATOM 425 CB GLN A 27 10.424 -11.394 8.088 1.00 0.00 C ATOM 426 CG GLN A 27 9.080 -10.679 8.220 1.00 0.00 C ATOM 427 CD GLN A 27 8.432 -11.003 9.564 1.00 0.00 C ATOM 428 OE1 GLN A 27 8.544 -12.106 10.062 1.00 0.00 O ATOM 429 NE2 GLN A 27 7.750 -10.073 10.172 1.00 0.00 N ATOM 0 H GLN A 27 11.124 -9.701 6.600 1.00 0.00 H new ATOM 0 HA GLN A 27 11.295 -10.009 9.501 1.00 0.00 H new ATOM 0 HB2 GLN A 27 10.586 -11.703 7.055 1.00 0.00 H new ATOM 0 HB3 GLN A 27 10.430 -12.299 8.696 1.00 0.00 H new ATOM 0 HG2 GLN A 27 9.224 -9.602 8.129 1.00 0.00 H new ATOM 0 HG3 GLN A 27 8.419 -10.982 7.408 1.00 0.00 H new ATOM 0 HE21 GLN A 27 7.659 -9.149 9.750 1.00 0.00 H new ATOM 0 HE22 GLN A 27 7.308 -10.269 11.070 1.00 0.00 H new ATOM 438 N ALA A 28 13.771 -10.948 7.734 1.00 0.00 N ATOM 439 CA ALA A 28 15.082 -11.629 7.773 1.00 0.00 C ATOM 440 C ALA A 28 16.256 -10.642 7.883 1.00 0.00 C ATOM 441 O ALA A 28 17.342 -11.040 8.255 1.00 0.00 O ATOM 442 CB ALA A 28 15.166 -12.385 6.451 1.00 0.00 C ATOM 0 H ALA A 28 13.641 -10.306 6.952 1.00 0.00 H new ATOM 0 HA ALA A 28 15.155 -12.275 8.648 1.00 0.00 H new ATOM 0 HB1 ALA A 28 16.114 -12.921 6.398 1.00 0.00 H new ATOM 0 HB2 ALA A 28 14.343 -13.096 6.386 1.00 0.00 H new ATOM 0 HB3 ALA A 28 15.102 -11.679 5.623 1.00 0.00 H new ATOM 448 N VAL A 29 16.103 -9.368 7.566 1.00 0.00 N ATOM 449 CA VAL A 29 17.299 -8.487 7.689 1.00 0.00 C ATOM 450 C VAL A 29 17.183 -7.598 8.912 1.00 0.00 C ATOM 451 O VAL A 29 17.974 -6.700 9.108 1.00 0.00 O ATOM 452 CB VAL A 29 17.386 -7.687 6.373 1.00 0.00 C ATOM 453 CG1 VAL A 29 15.989 -7.385 5.833 1.00 0.00 C ATOM 454 CG2 VAL A 29 18.129 -6.369 6.607 1.00 0.00 C ATOM 0 H VAL A 29 15.242 -8.926 7.244 1.00 0.00 H new ATOM 0 HA VAL A 29 18.215 -9.059 7.833 1.00 0.00 H new ATOM 0 HB VAL A 29 17.928 -8.290 5.644 1.00 0.00 H new ATOM 0 HG11 VAL A 29 16.072 -6.820 4.904 1.00 0.00 H new ATOM 0 HG12 VAL A 29 15.462 -8.320 5.643 1.00 0.00 H new ATOM 0 HG13 VAL A 29 15.434 -6.799 6.566 1.00 0.00 H new ATOM 0 HG21 VAL A 29 18.185 -5.812 5.672 1.00 0.00 H new ATOM 0 HG22 VAL A 29 17.595 -5.777 7.351 1.00 0.00 H new ATOM 0 HG23 VAL A 29 19.137 -6.578 6.966 1.00 0.00 H new ATOM 464 N ASP A 30 16.240 -7.868 9.766 1.00 0.00 N ATOM 465 CA ASP A 30 16.131 -7.046 10.995 1.00 0.00 C ATOM 466 C ASP A 30 16.258 -5.586 10.632 1.00 0.00 C ATOM 467 O ASP A 30 17.350 -5.059 10.541 1.00 0.00 O ATOM 468 CB ASP A 30 17.337 -7.465 11.814 1.00 0.00 C ATOM 469 CG ASP A 30 16.966 -8.634 12.728 1.00 0.00 C ATOM 470 OD1 ASP A 30 16.492 -9.634 12.214 1.00 0.00 O ATOM 471 OD2 ASP A 30 17.162 -8.511 13.925 1.00 0.00 O ATOM 0 H ASP A 30 15.549 -8.612 9.668 1.00 0.00 H new ATOM 0 HA ASP A 30 15.186 -7.181 11.520 1.00 0.00 H new ATOM 0 HB2 ASP A 30 18.154 -7.754 11.153 1.00 0.00 H new ATOM 0 HB3 ASP A 30 17.692 -6.625 12.410 1.00 0.00 H new ATOM 476 N SER A 31 15.190 -4.918 10.378 1.00 0.00 N ATOM 477 CA SER A 31 15.361 -3.526 9.966 1.00 0.00 C ATOM 478 C SER A 31 14.030 -2.788 10.059 1.00 0.00 C ATOM 479 O SER A 31 13.473 -2.358 9.071 1.00 0.00 O ATOM 480 CB SER A 31 15.848 -3.723 8.532 1.00 0.00 C ATOM 481 OG SER A 31 16.908 -2.827 8.266 1.00 0.00 O ATOM 0 H SER A 31 14.232 -5.264 10.436 1.00 0.00 H new ATOM 0 HA SER A 31 16.039 -2.922 10.569 1.00 0.00 H new ATOM 0 HB2 SER A 31 16.182 -4.751 8.388 1.00 0.00 H new ATOM 0 HB3 SER A 31 15.030 -3.553 7.832 1.00 0.00 H new ATOM 0 HG SER A 31 16.866 -2.540 7.330 1.00 0.00 H new ATOM 487 N GLN A 32 13.517 -2.647 11.251 1.00 0.00 N ATOM 488 CA GLN A 32 12.214 -1.957 11.419 1.00 0.00 C ATOM 489 C GLN A 32 12.198 -0.660 10.620 1.00 0.00 C ATOM 490 O GLN A 32 11.157 -0.144 10.296 1.00 0.00 O ATOM 491 CB GLN A 32 12.092 -1.672 12.914 1.00 0.00 C ATOM 492 CG GLN A 32 10.615 -1.644 13.293 1.00 0.00 C ATOM 493 CD GLN A 32 10.394 -2.521 14.517 1.00 0.00 C ATOM 494 OE1 GLN A 32 11.266 -2.654 15.353 1.00 0.00 O ATOM 495 NE2 GLN A 32 9.256 -3.131 14.660 1.00 0.00 N ATOM 0 H GLN A 32 13.947 -2.981 12.114 1.00 0.00 H new ATOM 0 HA GLN A 32 11.382 -2.562 11.058 1.00 0.00 H new ATOM 0 HB2 GLN A 32 12.614 -2.438 13.488 1.00 0.00 H new ATOM 0 HB3 GLN A 32 12.561 -0.718 13.155 1.00 0.00 H new ATOM 0 HG2 GLN A 32 10.301 -0.622 13.502 1.00 0.00 H new ATOM 0 HG3 GLN A 32 10.007 -2.000 12.461 1.00 0.00 H new ATOM 0 HE21 GLN A 32 8.525 -3.018 13.957 1.00 0.00 H new ATOM 0 HE22 GLN A 32 9.093 -3.723 15.475 1.00 0.00 H new ATOM 504 N GLU A 33 13.334 -0.132 10.277 1.00 0.00 N ATOM 505 CA GLU A 33 13.333 1.116 9.474 1.00 0.00 C ATOM 506 C GLU A 33 12.681 0.833 8.120 1.00 0.00 C ATOM 507 O GLU A 33 12.050 1.688 7.533 1.00 0.00 O ATOM 508 CB GLU A 33 14.801 1.491 9.310 1.00 0.00 C ATOM 509 CG GLU A 33 15.518 1.352 10.655 1.00 0.00 C ATOM 510 CD GLU A 33 16.725 2.291 10.692 1.00 0.00 C ATOM 511 OE1 GLU A 33 16.538 3.451 11.022 1.00 0.00 O ATOM 512 OE2 GLU A 33 17.815 1.835 10.390 1.00 0.00 O ATOM 0 H GLU A 33 14.253 -0.505 10.514 1.00 0.00 H new ATOM 0 HA GLU A 33 12.775 1.926 9.943 1.00 0.00 H new ATOM 0 HB2 GLU A 33 15.271 0.846 8.567 1.00 0.00 H new ATOM 0 HB3 GLU A 33 14.887 2.514 8.944 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.834 1.590 11.470 1.00 0.00 H new ATOM 0 HG3 GLU A 33 15.841 0.321 10.801 1.00 0.00 H new ATOM 519 N VAL A 34 12.812 -0.375 7.632 1.00 0.00 N ATOM 520 CA VAL A 34 12.177 -0.720 6.329 1.00 0.00 C ATOM 521 C VAL A 34 10.675 -0.942 6.559 1.00 0.00 C ATOM 522 O VAL A 34 9.849 -0.490 5.792 1.00 0.00 O ATOM 523 CB VAL A 34 12.915 -1.991 5.838 1.00 0.00 C ATOM 524 CG1 VAL A 34 11.925 -3.078 5.416 1.00 0.00 C ATOM 525 CG2 VAL A 34 13.772 -1.628 4.624 1.00 0.00 C ATOM 0 H VAL A 34 13.329 -1.132 8.079 1.00 0.00 H new ATOM 0 HA VAL A 34 12.258 0.062 5.574 1.00 0.00 H new ATOM 0 HB VAL A 34 13.528 -2.368 6.657 1.00 0.00 H new ATOM 0 HG11 VAL A 34 12.473 -3.957 5.076 1.00 0.00 H new ATOM 0 HG12 VAL A 34 11.297 -3.347 6.265 1.00 0.00 H new ATOM 0 HG13 VAL A 34 11.299 -2.705 4.605 1.00 0.00 H new ATOM 0 HG21 VAL A 34 14.296 -2.516 4.270 1.00 0.00 H new ATOM 0 HG22 VAL A 34 13.133 -1.243 3.829 1.00 0.00 H new ATOM 0 HG23 VAL A 34 14.499 -0.866 4.906 1.00 0.00 H new ATOM 535 N ARG A 35 10.312 -1.594 7.631 1.00 0.00 N ATOM 536 CA ARG A 35 8.867 -1.787 7.920 1.00 0.00 C ATOM 537 C ARG A 35 8.312 -0.473 8.453 1.00 0.00 C ATOM 538 O ARG A 35 7.266 -0.008 8.044 1.00 0.00 O ATOM 539 CB ARG A 35 8.831 -2.846 8.998 1.00 0.00 C ATOM 540 CG ARG A 35 8.210 -4.128 8.449 1.00 0.00 C ATOM 541 CD ARG A 35 7.432 -4.808 9.566 1.00 0.00 C ATOM 542 NE ARG A 35 6.687 -5.916 8.902 1.00 0.00 N ATOM 543 CZ ARG A 35 6.195 -6.901 9.607 1.00 0.00 C ATOM 544 NH1 ARG A 35 6.650 -7.151 10.806 1.00 0.00 N ATOM 545 NH2 ARG A 35 5.242 -7.643 9.111 1.00 0.00 N ATOM 0 H ARG A 35 10.952 -1.998 8.314 1.00 0.00 H new ATOM 0 HA ARG A 35 8.281 -2.080 7.049 1.00 0.00 H new ATOM 0 HB2 ARG A 35 9.841 -3.046 9.357 1.00 0.00 H new ATOM 0 HB3 ARG A 35 8.254 -2.489 9.851 1.00 0.00 H new ATOM 0 HG2 ARG A 35 7.549 -3.900 7.612 1.00 0.00 H new ATOM 0 HG3 ARG A 35 8.987 -4.792 8.070 1.00 0.00 H new ATOM 0 HD2 ARG A 35 8.101 -5.190 10.337 1.00 0.00 H new ATOM 0 HD3 ARG A 35 6.750 -4.111 10.053 1.00 0.00 H new ATOM 0 HE ARG A 35 6.560 -5.905 7.890 1.00 0.00 H new ATOM 0 HH11 ARG A 35 7.395 -6.576 11.199 1.00 0.00 H new ATOM 0 HH12 ARG A 35 6.260 -7.922 11.349 1.00 0.00 H new ATOM 0 HH21 ARG A 35 4.883 -7.454 8.175 1.00 0.00 H new ATOM 0 HH22 ARG A 35 4.857 -8.412 9.659 1.00 0.00 H new ATOM 559 N ASP A 36 9.042 0.155 9.339 1.00 0.00 N ATOM 560 CA ASP A 36 8.599 1.465 9.867 1.00 0.00 C ATOM 561 C ASP A 36 8.418 2.370 8.665 1.00 0.00 C ATOM 562 O ASP A 36 7.598 3.264 8.640 1.00 0.00 O ATOM 563 CB ASP A 36 9.746 1.964 10.751 1.00 0.00 C ATOM 564 CG ASP A 36 9.286 3.187 11.548 1.00 0.00 C ATOM 565 OD1 ASP A 36 8.550 3.987 10.995 1.00 0.00 O ATOM 566 OD2 ASP A 36 9.681 3.305 12.696 1.00 0.00 O ATOM 0 H ASP A 36 9.925 -0.189 9.715 1.00 0.00 H new ATOM 0 HA ASP A 36 7.672 1.427 10.439 1.00 0.00 H new ATOM 0 HB2 ASP A 36 10.065 1.174 11.430 1.00 0.00 H new ATOM 0 HB3 ASP A 36 10.607 2.222 10.135 1.00 0.00 H new ATOM 571 N TYR A 37 9.175 2.082 7.649 1.00 0.00 N ATOM 572 CA TYR A 37 9.095 2.823 6.389 1.00 0.00 C ATOM 573 C TYR A 37 7.891 2.291 5.630 1.00 0.00 C ATOM 574 O TYR A 37 7.024 3.023 5.207 1.00 0.00 O ATOM 575 CB TYR A 37 10.401 2.471 5.683 1.00 0.00 C ATOM 576 CG TYR A 37 10.187 2.560 4.202 1.00 0.00 C ATOM 577 CD1 TYR A 37 9.578 1.496 3.540 1.00 0.00 C ATOM 578 CD2 TYR A 37 10.534 3.721 3.507 1.00 0.00 C ATOM 579 CE1 TYR A 37 9.306 1.583 2.184 1.00 0.00 C ATOM 580 CE2 TYR A 37 10.275 3.808 2.139 1.00 0.00 C ATOM 581 CZ TYR A 37 9.657 2.744 1.476 1.00 0.00 C ATOM 582 OH TYR A 37 9.381 2.851 0.128 1.00 0.00 O ATOM 0 H TYR A 37 9.868 1.334 7.652 1.00 0.00 H new ATOM 0 HA TYR A 37 8.978 3.902 6.490 1.00 0.00 H new ATOM 0 HB2 TYR A 37 11.193 3.153 5.992 1.00 0.00 H new ATOM 0 HB3 TYR A 37 10.720 1.466 5.959 1.00 0.00 H new ATOM 0 HD1 TYR A 37 9.317 0.601 4.085 1.00 0.00 H new ATOM 0 HD2 TYR A 37 11.000 4.546 4.025 1.00 0.00 H new ATOM 0 HE1 TYR A 37 8.826 0.761 1.674 1.00 0.00 H new ATOM 0 HE2 TYR A 37 10.552 4.697 1.592 1.00 0.00 H new ATOM 0 HH TYR A 37 10.218 2.962 -0.369 1.00 0.00 H new ATOM 592 N CYS A 38 7.834 1.002 5.489 1.00 0.00 N ATOM 593 CA CYS A 38 6.702 0.366 4.783 1.00 0.00 C ATOM 594 C CYS A 38 5.386 0.871 5.371 1.00 0.00 C ATOM 595 O CYS A 38 4.504 1.307 4.660 1.00 0.00 O ATOM 596 CB CYS A 38 6.916 -1.119 5.046 1.00 0.00 C ATOM 597 SG CYS A 38 5.896 -2.100 3.934 1.00 0.00 S ATOM 0 H CYS A 38 8.538 0.353 5.840 1.00 0.00 H new ATOM 0 HA CYS A 38 6.656 0.586 3.717 1.00 0.00 H new ATOM 0 HB2 CYS A 38 7.967 -1.373 4.906 1.00 0.00 H new ATOM 0 HB3 CYS A 38 6.666 -1.352 6.081 1.00 0.00 H new ATOM 0 HG CYS A 38 5.103 -1.315 3.266 1.00 0.00 H new ATOM 603 N GLU A 39 5.257 0.854 6.666 1.00 0.00 N ATOM 604 CA GLU A 39 4.015 1.377 7.280 1.00 0.00 C ATOM 605 C GLU A 39 4.046 2.899 7.188 1.00 0.00 C ATOM 606 O GLU A 39 3.056 3.565 7.411 1.00 0.00 O ATOM 607 CB GLU A 39 4.071 0.921 8.734 1.00 0.00 C ATOM 608 CG GLU A 39 5.384 1.403 9.342 1.00 0.00 C ATOM 609 CD GLU A 39 5.093 2.429 10.439 1.00 0.00 C ATOM 610 OE1 GLU A 39 4.215 2.171 11.246 1.00 0.00 O ATOM 611 OE2 GLU A 39 5.751 3.457 10.451 1.00 0.00 O ATOM 0 H GLU A 39 5.956 0.502 7.321 1.00 0.00 H new ATOM 0 HA GLU A 39 3.105 1.026 6.794 1.00 0.00 H new ATOM 0 HB2 GLU A 39 3.225 1.325 9.290 1.00 0.00 H new ATOM 0 HB3 GLU A 39 4.002 -0.165 8.793 1.00 0.00 H new ATOM 0 HG2 GLU A 39 5.937 0.559 9.756 1.00 0.00 H new ATOM 0 HG3 GLU A 39 6.012 1.848 8.571 1.00 0.00 H new ATOM 618 N LYS A 40 5.169 3.456 6.799 1.00 0.00 N ATOM 619 CA LYS A 40 5.225 4.922 6.631 1.00 0.00 C ATOM 620 C LYS A 40 4.747 5.175 5.228 1.00 0.00 C ATOM 621 O LYS A 40 4.063 6.130 4.919 1.00 0.00 O ATOM 622 CB LYS A 40 6.690 5.327 6.757 1.00 0.00 C ATOM 623 CG LYS A 40 6.806 6.842 6.621 1.00 0.00 C ATOM 624 CD LYS A 40 8.022 7.309 7.410 1.00 0.00 C ATOM 625 CE LYS A 40 8.824 8.309 6.576 1.00 0.00 C ATOM 626 NZ LYS A 40 7.933 9.493 6.431 1.00 0.00 N ATOM 0 H LYS A 40 6.034 2.956 6.595 1.00 0.00 H new ATOM 0 HA LYS A 40 4.628 5.473 7.358 1.00 0.00 H new ATOM 0 HB2 LYS A 40 7.087 5.005 7.720 1.00 0.00 H new ATOM 0 HB3 LYS A 40 7.283 4.834 5.987 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.906 7.121 5.572 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.904 7.326 6.995 1.00 0.00 H new ATOM 0 HD2 LYS A 40 7.705 7.772 8.345 1.00 0.00 H new ATOM 0 HD3 LYS A 40 8.647 6.456 7.672 1.00 0.00 H new ATOM 0 HE2 LYS A 40 9.758 8.576 7.071 1.00 0.00 H new ATOM 0 HE3 LYS A 40 9.086 7.891 5.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 8.504 10.331 6.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 7.246 9.320 5.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 7.426 9.657 7.324 1.00 0.00 H new ATOM 640 N LYS A 41 5.107 4.258 4.384 1.00 0.00 N ATOM 641 CA LYS A 41 4.705 4.316 2.975 1.00 0.00 C ATOM 642 C LYS A 41 3.213 4.161 2.923 1.00 0.00 C ATOM 643 O LYS A 41 2.472 5.002 2.455 1.00 0.00 O ATOM 644 CB LYS A 41 5.306 3.074 2.358 1.00 0.00 C ATOM 645 CG LYS A 41 6.808 2.985 2.528 1.00 0.00 C ATOM 646 CD LYS A 41 7.412 4.358 2.761 1.00 0.00 C ATOM 647 CE LYS A 41 7.642 5.042 1.417 1.00 0.00 C ATOM 648 NZ LYS A 41 7.939 6.463 1.751 1.00 0.00 N ATOM 0 H LYS A 41 5.680 3.450 4.628 1.00 0.00 H new ATOM 0 HA LYS A 41 5.013 5.237 2.480 1.00 0.00 H new ATOM 0 HB2 LYS A 41 4.844 2.194 2.807 1.00 0.00 H new ATOM 0 HB3 LYS A 41 5.066 3.053 1.295 1.00 0.00 H new ATOM 0 HG2 LYS A 41 7.044 2.333 3.369 1.00 0.00 H new ATOM 0 HG3 LYS A 41 7.252 2.535 1.640 1.00 0.00 H new ATOM 0 HD2 LYS A 41 6.747 4.960 3.380 1.00 0.00 H new ATOM 0 HD3 LYS A 41 8.354 4.267 3.302 1.00 0.00 H new ATOM 0 HE2 LYS A 41 8.470 4.582 0.877 1.00 0.00 H new ATOM 0 HE3 LYS A 41 6.762 4.963 0.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 8.109 6.997 0.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 7.131 6.877 2.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 8.785 6.508 2.354 1.00 0.00 H new ATOM 662 N GLY A 42 2.787 3.056 3.454 1.00 0.00 N ATOM 663 CA GLY A 42 1.351 2.764 3.516 1.00 0.00 C ATOM 664 C GLY A 42 1.031 1.303 3.200 1.00 0.00 C ATOM 665 O GLY A 42 0.192 0.999 2.382 1.00 0.00 O ATOM 0 H GLY A 42 3.390 2.336 3.852 1.00 0.00 H new ATOM 0 HA2 GLY A 42 0.978 3.006 4.511 1.00 0.00 H new ATOM 0 HA3 GLY A 42 0.823 3.408 2.812 1.00 0.00 H new ATOM 669 N TRP A 43 1.645 0.400 3.904 1.00 0.00 N ATOM 670 CA TRP A 43 1.314 -1.042 3.722 1.00 0.00 C ATOM 671 C TRP A 43 0.926 -1.482 5.074 1.00 0.00 C ATOM 672 O TRP A 43 -0.097 -2.084 5.330 1.00 0.00 O ATOM 673 CB TRP A 43 2.536 -1.878 3.361 1.00 0.00 C ATOM 674 CG TRP A 43 3.490 -1.192 2.461 1.00 0.00 C ATOM 675 CD1 TRP A 43 3.720 0.122 2.453 1.00 0.00 C ATOM 676 CD2 TRP A 43 4.413 -1.762 1.478 1.00 0.00 C ATOM 677 NE1 TRP A 43 4.670 0.396 1.554 1.00 0.00 N ATOM 678 CE2 TRP A 43 5.153 -0.703 0.936 1.00 0.00 C ATOM 679 CE3 TRP A 43 4.687 -3.057 1.014 1.00 0.00 C ATOM 680 CZ2 TRP A 43 6.131 -0.883 -0.015 1.00 0.00 C ATOM 681 CZ3 TRP A 43 5.678 -3.260 0.043 1.00 0.00 C ATOM 682 CH2 TRP A 43 6.409 -2.174 -0.470 1.00 0.00 C ATOM 0 H TRP A 43 2.364 0.595 4.600 1.00 0.00 H new ATOM 0 HA TRP A 43 0.569 -1.160 2.935 1.00 0.00 H new ATOM 0 HB2 TRP A 43 3.055 -2.159 4.277 1.00 0.00 H new ATOM 0 HB3 TRP A 43 2.204 -2.802 2.886 1.00 0.00 H new ATOM 0 HD1 TRP A 43 3.218 0.849 3.074 1.00 0.00 H new ATOM 0 HE1 TRP A 43 4.998 1.341 1.355 1.00 0.00 H new ATOM 0 HE3 TRP A 43 4.134 -3.898 1.405 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 6.677 -0.037 -0.405 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 5.881 -4.259 -0.314 1.00 0.00 H new ATOM 0 HH2 TRP A 43 7.179 -2.337 -1.210 1.00 0.00 H new ATOM 693 N ILE A 44 1.783 -1.080 5.949 1.00 0.00 N ATOM 694 CA ILE A 44 1.641 -1.302 7.386 1.00 0.00 C ATOM 695 C ILE A 44 2.178 -2.653 7.795 1.00 0.00 C ATOM 696 O ILE A 44 1.946 -3.125 8.891 1.00 0.00 O ATOM 697 CB ILE A 44 0.171 -1.209 7.707 1.00 0.00 C ATOM 698 CG1 ILE A 44 -0.458 -0.043 6.953 1.00 0.00 C ATOM 699 CG2 ILE A 44 0.034 -0.980 9.209 1.00 0.00 C ATOM 700 CD1 ILE A 44 -1.869 -0.438 6.522 1.00 0.00 C ATOM 0 H ILE A 44 2.632 -0.572 5.700 1.00 0.00 H new ATOM 0 HA ILE A 44 2.214 -0.555 7.935 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.337 -2.126 7.409 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -0.491 0.843 7.588 1.00 0.00 H new ATOM 0 HG13 ILE A 44 0.145 0.212 6.082 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -1.022 -0.908 9.471 1.00 0.00 H new ATOM 0 HG22 ILE A 44 0.486 -1.813 9.747 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.540 -0.054 9.484 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -2.329 0.389 5.981 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -1.820 -1.313 5.874 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -2.466 -0.672 7.403 1.00 0.00 H new ATOM 712 N VAL A 45 2.878 -3.267 6.911 1.00 0.00 N ATOM 713 CA VAL A 45 3.458 -4.609 7.187 1.00 0.00 C ATOM 714 C VAL A 45 3.821 -4.748 8.671 1.00 0.00 C ATOM 715 O VAL A 45 4.875 -4.335 9.102 1.00 0.00 O ATOM 716 CB VAL A 45 4.716 -4.658 6.332 1.00 0.00 C ATOM 717 CG1 VAL A 45 4.346 -4.787 4.851 1.00 0.00 C ATOM 718 CG2 VAL A 45 5.534 -3.383 6.551 1.00 0.00 C ATOM 0 H VAL A 45 3.084 -2.896 5.983 1.00 0.00 H new ATOM 0 HA VAL A 45 2.761 -5.415 6.959 1.00 0.00 H new ATOM 0 HB VAL A 45 5.309 -5.525 6.623 1.00 0.00 H new ATOM 0 HG11 VAL A 45 5.255 -4.821 4.250 1.00 0.00 H new ATOM 0 HG12 VAL A 45 3.775 -5.703 4.697 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.744 -3.929 4.550 1.00 0.00 H new ATOM 0 HG21 VAL A 45 6.435 -3.419 5.938 1.00 0.00 H new ATOM 0 HG22 VAL A 45 4.938 -2.515 6.269 1.00 0.00 H new ATOM 0 HG23 VAL A 45 5.813 -3.306 7.602 1.00 0.00 H new ATOM 728 N ASN A 46 2.953 -5.314 9.463 1.00 0.00 N ATOM 729 CA ASN A 46 3.268 -5.453 10.915 1.00 0.00 C ATOM 730 C ASN A 46 2.618 -6.714 11.492 1.00 0.00 C ATOM 731 O ASN A 46 1.533 -7.099 11.106 1.00 0.00 O ATOM 732 CB ASN A 46 2.685 -4.196 11.564 1.00 0.00 C ATOM 733 CG ASN A 46 2.571 -4.402 13.075 1.00 0.00 C ATOM 734 OD1 ASN A 46 3.309 -5.174 13.653 1.00 0.00 O ATOM 735 ND2 ASN A 46 1.668 -3.738 13.742 1.00 0.00 N ATOM 0 H ASN A 46 2.048 -5.683 9.173 1.00 0.00 H new ATOM 0 HA ASN A 46 4.339 -5.549 11.096 1.00 0.00 H new ATOM 0 HB2 ASN A 46 3.321 -3.337 11.351 1.00 0.00 H new ATOM 0 HB3 ASN A 46 1.704 -3.979 11.142 1.00 0.00 H new ATOM 0 HD21 ASN A 46 1.581 -3.867 14.750 1.00 0.00 H new ATOM 0 HD22 ASN A 46 1.049 -3.090 13.256 1.00 0.00 H new ATOM 742 N ILE A 47 3.278 -7.353 12.419 1.00 0.00 N ATOM 743 CA ILE A 47 2.705 -8.585 13.031 1.00 0.00 C ATOM 744 C ILE A 47 1.533 -8.223 13.942 1.00 0.00 C ATOM 745 O ILE A 47 1.686 -7.508 14.913 1.00 0.00 O ATOM 746 CB ILE A 47 3.847 -9.190 13.848 1.00 0.00 C ATOM 747 CG1 ILE A 47 3.315 -10.370 14.667 1.00 0.00 C ATOM 748 CG2 ILE A 47 4.410 -8.130 14.794 1.00 0.00 C ATOM 749 CD1 ILE A 47 2.747 -11.431 13.723 1.00 0.00 C ATOM 0 H ILE A 47 4.191 -7.074 12.779 1.00 0.00 H new ATOM 0 HA ILE A 47 2.326 -9.280 12.282 1.00 0.00 H new ATOM 0 HB ILE A 47 4.633 -9.536 13.177 1.00 0.00 H new ATOM 0 HG12 ILE A 47 4.115 -10.797 15.272 1.00 0.00 H new ATOM 0 HG13 ILE A 47 2.542 -10.029 15.356 1.00 0.00 H new ATOM 0 HG21 ILE A 47 5.224 -8.559 15.378 1.00 0.00 H new ATOM 0 HG22 ILE A 47 4.784 -7.287 14.214 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.623 -7.787 15.466 1.00 0.00 H new ATOM 0 HD11 ILE A 47 2.368 -12.271 14.305 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.935 -11.000 13.138 1.00 0.00 H new ATOM 0 HD13 ILE A 47 3.532 -11.779 13.052 1.00 0.00 H new ATOM 761 N THR A 48 0.363 -8.714 13.642 1.00 0.00 N ATOM 762 CA THR A 48 -0.818 -8.400 14.495 1.00 0.00 C ATOM 763 C THR A 48 -1.794 -9.580 14.492 1.00 0.00 C ATOM 764 O THR A 48 -1.415 -10.709 14.248 1.00 0.00 O ATOM 765 CB THR A 48 -1.463 -7.164 13.861 1.00 0.00 C ATOM 766 OG1 THR A 48 -0.685 -6.734 12.752 1.00 0.00 O ATOM 767 CG2 THR A 48 -1.541 -6.042 14.897 1.00 0.00 C ATOM 0 H THR A 48 0.173 -9.319 12.843 1.00 0.00 H new ATOM 0 HA THR A 48 -0.539 -8.217 15.533 1.00 0.00 H new ATOM 0 HB THR A 48 -2.468 -7.415 13.520 1.00 0.00 H new ATOM 0 HG1 THR A 48 -1.101 -5.944 12.347 1.00 0.00 H new ATOM 0 HG21 THR A 48 -2.000 -5.162 14.446 1.00 0.00 H new ATOM 0 HG22 THR A 48 -2.142 -6.371 15.745 1.00 0.00 H new ATOM 0 HG23 THR A 48 -0.537 -5.792 15.239 1.00 0.00 H new ATOM 775 N SER A 49 -3.045 -9.331 14.762 1.00 0.00 N ATOM 776 CA SER A 49 -4.037 -10.443 14.773 1.00 0.00 C ATOM 777 C SER A 49 -5.460 -9.886 14.694 1.00 0.00 C ATOM 778 O SER A 49 -6.128 -10.001 13.687 1.00 0.00 O ATOM 779 CB SER A 49 -3.815 -11.154 16.106 1.00 0.00 C ATOM 780 OG SER A 49 -4.852 -12.106 16.309 1.00 0.00 O ATOM 0 H SER A 49 -3.423 -8.408 14.975 1.00 0.00 H new ATOM 0 HA SER A 49 -3.913 -11.115 13.924 1.00 0.00 H new ATOM 0 HB2 SER A 49 -2.844 -11.650 16.110 1.00 0.00 H new ATOM 0 HB3 SER A 49 -3.806 -10.430 16.921 1.00 0.00 H new ATOM 0 HG SER A 49 -4.712 -12.566 17.163 1.00 0.00 H new ATOM 786 N GLN A 50 -5.929 -9.285 15.752 1.00 0.00 N ATOM 787 CA GLN A 50 -7.309 -8.722 15.739 1.00 0.00 C ATOM 788 C GLN A 50 -7.331 -7.367 16.448 1.00 0.00 C ATOM 789 O GLN A 50 -7.224 -7.284 17.656 1.00 0.00 O ATOM 790 CB GLN A 50 -8.157 -9.741 16.499 1.00 0.00 C ATOM 791 CG GLN A 50 -9.639 -9.416 16.312 1.00 0.00 C ATOM 792 CD GLN A 50 -10.237 -8.965 17.647 1.00 0.00 C ATOM 793 OE1 GLN A 50 -10.082 -7.827 18.042 1.00 0.00 O ATOM 794 NE2 GLN A 50 -10.918 -9.818 18.362 1.00 0.00 N ATOM 0 H GLN A 50 -5.417 -9.159 16.625 1.00 0.00 H new ATOM 0 HA GLN A 50 -7.681 -8.557 14.728 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -7.946 -10.747 16.136 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -7.901 -9.724 17.558 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -9.758 -8.631 15.565 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -10.170 -10.293 15.941 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -11.048 -10.773 18.029 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -11.321 -9.529 19.254 1.00 0.00 H new ATOM 803 N VAL A 51 -7.467 -6.303 15.706 1.00 0.00 N ATOM 804 CA VAL A 51 -7.494 -4.954 16.337 1.00 0.00 C ATOM 805 C VAL A 51 -8.795 -4.234 15.981 1.00 0.00 C ATOM 806 O VAL A 51 -8.844 -3.426 15.075 1.00 0.00 O ATOM 807 CB VAL A 51 -6.290 -4.224 15.743 1.00 0.00 C ATOM 808 CG1 VAL A 51 -6.063 -2.913 16.496 1.00 0.00 C ATOM 809 CG2 VAL A 51 -5.053 -5.113 15.878 1.00 0.00 C ATOM 0 H VAL A 51 -7.561 -6.309 14.690 1.00 0.00 H new ATOM 0 HA VAL A 51 -7.447 -4.999 17.425 1.00 0.00 H new ATOM 0 HB VAL A 51 -6.474 -4.005 14.691 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.204 -2.394 16.071 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.948 -2.284 16.406 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -5.874 -3.126 17.548 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -4.189 -4.600 15.457 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -4.871 -5.325 16.931 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -5.217 -6.048 15.342 1.00 0.00 H new ATOM 819 N GLN A 52 -9.851 -4.523 16.689 1.00 0.00 N ATOM 820 CA GLN A 52 -11.153 -3.860 16.394 1.00 0.00 C ATOM 821 C GLN A 52 -11.042 -2.352 16.630 1.00 0.00 C ATOM 822 O GLN A 52 -10.849 -1.899 17.741 1.00 0.00 O ATOM 823 CB GLN A 52 -12.147 -4.487 17.373 1.00 0.00 C ATOM 824 CG GLN A 52 -11.959 -6.005 17.391 1.00 0.00 C ATOM 825 CD GLN A 52 -13.262 -6.687 16.972 1.00 0.00 C ATOM 826 OE1 GLN A 52 -13.563 -6.780 15.798 1.00 0.00 O ATOM 827 NE2 GLN A 52 -14.055 -7.171 17.889 1.00 0.00 N ATOM 0 H GLN A 52 -9.869 -5.190 17.460 1.00 0.00 H new ATOM 0 HA GLN A 52 -11.462 -3.996 15.358 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -11.995 -4.079 18.372 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -13.167 -4.240 17.080 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -11.153 -6.290 16.714 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -11.669 -6.334 18.389 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -13.803 -7.093 18.874 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -14.927 -7.627 17.620 1.00 0.00 H new ATOM 836 N THR A 53 -11.165 -1.571 15.592 1.00 0.00 N ATOM 837 CA THR A 53 -11.066 -0.092 15.756 1.00 0.00 C ATOM 838 C THR A 53 -12.249 0.595 15.092 1.00 0.00 C ATOM 839 O THR A 53 -13.072 -0.030 14.454 1.00 0.00 O ATOM 840 CB THR A 53 -9.755 0.301 15.077 1.00 0.00 C ATOM 841 OG1 THR A 53 -9.786 -0.109 13.718 1.00 0.00 O ATOM 842 CG2 THR A 53 -8.586 -0.379 15.792 1.00 0.00 C ATOM 0 H THR A 53 -11.330 -1.892 14.638 1.00 0.00 H new ATOM 0 HA THR A 53 -11.081 0.207 16.804 1.00 0.00 H new ATOM 0 HB THR A 53 -9.629 1.383 15.126 1.00 0.00 H new ATOM 0 HG1 THR A 53 -8.946 0.144 13.281 1.00 0.00 H new ATOM 0 HG21 THR A 53 -7.651 -0.099 15.308 1.00 0.00 H new ATOM 0 HG22 THR A 53 -8.564 -0.063 16.835 1.00 0.00 H new ATOM 0 HG23 THR A 53 -8.710 -1.461 15.744 1.00 0.00 H new ATOM 850 N GLU A 54 -12.353 1.880 15.263 1.00 0.00 N ATOM 851 CA GLU A 54 -13.500 2.615 14.672 1.00 0.00 C ATOM 852 C GLU A 54 -13.207 4.118 14.657 1.00 0.00 C ATOM 853 O GLU A 54 -13.238 4.776 15.679 1.00 0.00 O ATOM 854 CB GLU A 54 -14.710 2.319 15.583 1.00 0.00 C ATOM 855 CG GLU A 54 -14.331 1.404 16.758 1.00 0.00 C ATOM 856 CD GLU A 54 -15.427 1.460 17.822 1.00 0.00 C ATOM 857 OE1 GLU A 54 -16.412 0.758 17.668 1.00 0.00 O ATOM 858 OE2 GLU A 54 -15.262 2.205 18.775 1.00 0.00 O ATOM 0 H GLU A 54 -11.692 2.454 15.787 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.689 2.305 13.644 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -15.113 3.256 15.968 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -15.500 1.849 14.997 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -14.201 0.380 16.408 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -13.379 1.718 17.185 1.00 0.00 H new ATOM 865 N ARG A 55 -12.918 4.669 13.510 1.00 0.00 N ATOM 866 CA ARG A 55 -12.622 6.128 13.440 1.00 0.00 C ATOM 867 C ARG A 55 -13.869 6.904 13.007 1.00 0.00 C ATOM 868 O ARG A 55 -14.333 7.786 13.703 1.00 0.00 O ATOM 869 CB ARG A 55 -11.518 6.257 12.391 1.00 0.00 C ATOM 870 CG ARG A 55 -10.164 6.387 13.091 1.00 0.00 C ATOM 871 CD ARG A 55 -9.233 7.257 12.243 1.00 0.00 C ATOM 872 NE ARG A 55 -8.184 6.326 11.746 1.00 0.00 N ATOM 873 CZ ARG A 55 -7.378 6.697 10.790 1.00 0.00 C ATOM 874 NH1 ARG A 55 -7.556 7.844 10.189 1.00 0.00 N ATOM 875 NH2 ARG A 55 -6.393 5.921 10.431 1.00 0.00 N ATOM 0 H ARG A 55 -12.874 4.173 12.620 1.00 0.00 H new ATOM 0 HA ARG A 55 -12.318 6.534 14.405 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -11.519 5.385 11.737 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -11.699 7.128 11.761 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -10.294 6.830 14.078 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -9.723 5.401 13.239 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -9.771 7.723 11.417 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -8.798 8.063 12.834 1.00 0.00 H new ATOM 0 HE ARG A 55 -8.095 5.395 12.154 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -8.327 8.451 10.467 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -6.924 8.132 9.442 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -6.254 5.025 10.898 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -5.762 6.210 9.683 1.00 0.00 H new ATOM 889 N ASN A 56 -14.414 6.584 11.866 1.00 0.00 N ATOM 890 CA ASN A 56 -15.630 7.308 11.396 1.00 0.00 C ATOM 891 C ASN A 56 -16.869 6.794 12.135 1.00 0.00 C ATOM 892 O ASN A 56 -17.243 5.644 12.015 1.00 0.00 O ATOM 893 CB ASN A 56 -15.725 6.994 9.902 1.00 0.00 C ATOM 894 CG ASN A 56 -15.391 8.248 9.095 1.00 0.00 C ATOM 895 OD1 ASN A 56 -14.305 8.373 8.564 1.00 0.00 O ATOM 896 ND2 ASN A 56 -16.286 9.191 8.977 1.00 0.00 N ATOM 0 H ASN A 56 -14.072 5.855 11.240 1.00 0.00 H new ATOM 0 HA ASN A 56 -15.572 8.380 11.583 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -15.037 6.189 9.644 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -16.728 6.647 9.656 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -16.073 10.031 8.440 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -17.198 9.087 9.422 1.00 0.00 H new ATOM 903 N ILE A 57 -17.508 7.638 12.898 1.00 0.00 N ATOM 904 CA ILE A 57 -18.721 7.197 13.645 1.00 0.00 C ATOM 905 C ILE A 57 -19.984 7.578 12.868 1.00 0.00 C ATOM 906 O ILE A 57 -20.943 8.073 13.426 1.00 0.00 O ATOM 907 CB ILE A 57 -18.663 7.948 14.976 1.00 0.00 C ATOM 908 CG1 ILE A 57 -17.279 7.764 15.604 1.00 0.00 C ATOM 909 CG2 ILE A 57 -19.730 7.397 15.922 1.00 0.00 C ATOM 910 CD1 ILE A 57 -16.665 9.135 15.898 1.00 0.00 C ATOM 0 H ILE A 57 -17.243 8.613 13.037 1.00 0.00 H new ATOM 0 HA ILE A 57 -18.749 6.117 13.789 1.00 0.00 H new ATOM 0 HB ILE A 57 -18.846 9.008 14.803 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -17.360 7.185 16.524 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -16.634 7.202 14.929 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -19.688 7.933 16.870 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -20.715 7.528 15.475 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -19.549 6.336 16.096 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -15.680 9.004 16.345 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -16.570 9.698 14.969 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -17.307 9.681 16.589 1.00 0.00 H new ATOM 922 N ASN A 58 -19.991 7.350 11.582 1.00 0.00 N ATOM 923 CA ASN A 58 -21.191 7.699 10.770 1.00 0.00 C ATOM 924 C ASN A 58 -20.952 7.355 9.297 1.00 0.00 C ATOM 925 O ASN A 58 -21.738 6.669 8.674 1.00 0.00 O ATOM 926 CB ASN A 58 -21.364 9.208 10.947 1.00 0.00 C ATOM 927 CG ASN A 58 -22.511 9.478 11.922 1.00 0.00 C ATOM 928 OD1 ASN A 58 -23.101 8.558 12.454 1.00 0.00 O ATOM 929 ND2 ASN A 58 -22.856 10.709 12.180 1.00 0.00 N ATOM 0 H ASN A 58 -19.218 6.938 11.060 1.00 0.00 H new ATOM 0 HA ASN A 58 -22.077 7.147 11.085 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -20.441 9.649 11.323 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -21.572 9.676 9.985 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -23.620 10.899 12.828 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -22.361 11.481 11.734 1.00 0.00 H new ATOM 936 N ARG A 59 -19.871 7.824 8.736 1.00 0.00 N ATOM 937 CA ARG A 59 -19.585 7.523 7.304 1.00 0.00 C ATOM 938 C ARG A 59 -19.033 6.102 7.160 1.00 0.00 C ATOM 939 O ARG A 59 -17.999 5.886 6.558 1.00 0.00 O ATOM 940 CB ARG A 59 -18.535 8.552 6.883 1.00 0.00 C ATOM 941 CG ARG A 59 -18.299 8.447 5.375 1.00 0.00 C ATOM 942 CD ARG A 59 -18.237 9.851 4.769 1.00 0.00 C ATOM 943 NE ARG A 59 -18.901 9.724 3.442 1.00 0.00 N ATOM 944 CZ ARG A 59 -18.208 9.893 2.349 1.00 0.00 C ATOM 945 NH1 ARG A 59 -17.605 11.029 2.127 1.00 0.00 N ATOM 946 NH2 ARG A 59 -18.117 8.926 1.478 1.00 0.00 N ATOM 0 H ARG A 59 -19.174 8.402 9.206 1.00 0.00 H new ATOM 0 HA ARG A 59 -20.481 7.579 6.685 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -18.870 9.557 7.141 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -17.603 8.379 7.421 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -17.369 7.913 5.178 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -19.101 7.874 4.910 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -18.750 10.577 5.400 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -17.207 10.191 4.665 1.00 0.00 H new ATOM 0 HE ARG A 59 -19.896 9.505 3.387 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -17.675 11.785 2.808 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -17.064 11.161 1.273 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -18.588 8.038 1.651 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -17.575 9.058 0.624 1.00 0.00 H new ATOM 960 N ALA A 60 -19.714 5.133 7.707 1.00 0.00 N ATOM 961 CA ALA A 60 -19.227 3.729 7.600 1.00 0.00 C ATOM 962 C ALA A 60 -17.846 3.597 8.247 1.00 0.00 C ATOM 963 O ALA A 60 -17.325 2.493 8.268 1.00 0.00 O ATOM 964 CB ALA A 60 -19.145 3.451 6.099 1.00 0.00 C ATOM 965 OXT ALA A 60 -17.331 4.601 8.708 1.00 0.00 O ATOM 0 H ALA A 60 -20.586 5.253 8.223 1.00 0.00 H new ATOM 0 HA ALA A 60 -19.884 3.024 8.109 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -18.793 2.432 5.936 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -20.132 3.569 5.653 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -18.451 4.153 5.636 1.00 0.00 H new TER 971 ALA A 60 ATOM 972 N MET B 1 41.513 -16.085 -8.867 1.00 0.00 N ATOM 973 CA MET B 1 41.882 -16.262 -10.302 1.00 0.00 C ATOM 974 C MET B 1 41.270 -17.553 -10.851 1.00 0.00 C ATOM 975 O MET B 1 40.406 -17.528 -11.705 1.00 0.00 O ATOM 976 CB MET B 1 43.407 -16.346 -10.310 1.00 0.00 C ATOM 977 CG MET B 1 43.935 -15.932 -11.685 1.00 0.00 C ATOM 978 SD MET B 1 45.176 -17.128 -12.237 1.00 0.00 S ATOM 979 CE MET B 1 45.130 -16.709 -13.996 1.00 0.00 C ATOM 0 H1 MET B 1 41.934 -15.205 -8.506 1.00 0.00 H new ATOM 0 H2 MET B 1 40.478 -16.035 -8.778 1.00 0.00 H new ATOM 0 H3 MET B 1 41.869 -16.891 -8.315 1.00 0.00 H new ATOM 0 HA MET B 1 41.515 -15.447 -10.926 1.00 0.00 H new ATOM 0 HB2 MET B 1 43.821 -15.696 -9.539 1.00 0.00 H new ATOM 0 HB3 MET B 1 43.727 -17.362 -10.077 1.00 0.00 H new ATOM 0 HG2 MET B 1 43.116 -15.884 -12.402 1.00 0.00 H new ATOM 0 HG3 MET B 1 44.372 -14.935 -11.634 1.00 0.00 H new ATOM 0 HE1 MET B 1 45.834 -17.339 -14.539 1.00 0.00 H new ATOM 0 HE2 MET B 1 44.124 -16.872 -14.383 1.00 0.00 H new ATOM 0 HE3 MET B 1 45.404 -15.662 -14.128 1.00 0.00 H new ATOM 991 N GLY B 2 41.711 -18.683 -10.370 1.00 0.00 N ATOM 992 CA GLY B 2 41.155 -19.972 -10.869 1.00 0.00 C ATOM 993 C GLY B 2 41.492 -21.092 -9.883 1.00 0.00 C ATOM 994 O GLY B 2 42.118 -22.068 -10.243 1.00 0.00 O ATOM 0 H GLY B 2 42.432 -18.769 -9.653 1.00 0.00 H new ATOM 0 HA2 GLY B 2 40.075 -19.892 -10.988 1.00 0.00 H new ATOM 0 HA3 GLY B 2 41.568 -20.202 -11.851 1.00 0.00 H new ATOM 998 N PRO B 3 41.059 -20.909 -8.665 1.00 0.00 N ATOM 999 CA PRO B 3 41.312 -21.918 -7.605 1.00 0.00 C ATOM 1000 C PRO B 3 40.391 -23.119 -7.814 1.00 0.00 C ATOM 1001 O PRO B 3 40.714 -24.239 -7.471 1.00 0.00 O ATOM 1002 CB PRO B 3 40.926 -21.190 -6.323 1.00 0.00 C ATOM 1003 CG PRO B 3 39.931 -20.162 -6.757 1.00 0.00 C ATOM 1004 CD PRO B 3 40.301 -19.759 -8.162 1.00 0.00 C ATOM 0 HA PRO B 3 42.337 -22.289 -7.596 1.00 0.00 H new ATOM 0 HB2 PRO B 3 40.495 -21.875 -5.593 1.00 0.00 H new ATOM 0 HB3 PRO B 3 41.794 -20.728 -5.853 1.00 0.00 H new ATOM 0 HG2 PRO B 3 38.919 -20.566 -6.725 1.00 0.00 H new ATOM 0 HG3 PRO B 3 39.951 -19.300 -6.090 1.00 0.00 H new ATOM 0 HD2 PRO B 3 39.417 -19.566 -8.769 1.00 0.00 H new ATOM 0 HD3 PRO B 3 40.900 -18.849 -8.173 1.00 0.00 H new ATOM 1012 N LEU B 4 39.234 -22.874 -8.360 1.00 0.00 N ATOM 1013 CA LEU B 4 38.256 -23.970 -8.587 1.00 0.00 C ATOM 1014 C LEU B 4 37.150 -23.485 -9.522 1.00 0.00 C ATOM 1015 O LEU B 4 35.980 -23.589 -9.213 1.00 0.00 O ATOM 1016 CB LEU B 4 37.683 -24.253 -7.201 1.00 0.00 C ATOM 1017 CG LEU B 4 37.641 -25.762 -6.957 1.00 0.00 C ATOM 1018 CD1 LEU B 4 36.945 -26.449 -8.133 1.00 0.00 C ATOM 1019 CD2 LEU B 4 39.070 -26.296 -6.829 1.00 0.00 C ATOM 0 H LEU B 4 38.922 -21.951 -8.662 1.00 0.00 H new ATOM 0 HA LEU B 4 38.704 -24.853 -9.043 1.00 0.00 H new ATOM 0 HB2 LEU B 4 38.294 -23.769 -6.439 1.00 0.00 H new ATOM 0 HB3 LEU B 4 36.680 -23.834 -7.119 1.00 0.00 H new ATOM 0 HG LEU B 4 37.091 -25.967 -6.039 1.00 0.00 H new ATOM 0 HD11 LEU B 4 36.915 -27.525 -7.960 1.00 0.00 H new ATOM 0 HD12 LEU B 4 35.928 -26.068 -8.227 1.00 0.00 H new ATOM 0 HD13 LEU B 4 37.495 -26.245 -9.051 1.00 0.00 H new ATOM 0 HD21 LEU B 4 39.042 -27.372 -6.655 1.00 0.00 H new ATOM 0 HD22 LEU B 4 39.619 -26.091 -7.748 1.00 0.00 H new ATOM 0 HD23 LEU B 4 39.568 -25.806 -5.992 1.00 0.00 H new ATOM 1031 N GLN B 5 37.504 -22.929 -10.647 1.00 0.00 N ATOM 1032 CA GLN B 5 36.453 -22.417 -11.567 1.00 0.00 C ATOM 1033 C GLN B 5 35.466 -21.580 -10.756 1.00 0.00 C ATOM 1034 O GLN B 5 34.310 -21.441 -11.106 1.00 0.00 O ATOM 1035 CB GLN B 5 35.772 -23.663 -12.137 1.00 0.00 C ATOM 1036 CG GLN B 5 35.815 -23.618 -13.666 1.00 0.00 C ATOM 1037 CD GLN B 5 36.229 -24.987 -14.208 1.00 0.00 C ATOM 1038 OE1 GLN B 5 37.336 -25.435 -13.979 1.00 0.00 O ATOM 1039 NE2 GLN B 5 35.382 -25.678 -14.921 1.00 0.00 N ATOM 0 H GLN B 5 38.465 -22.808 -10.966 1.00 0.00 H new ATOM 0 HA GLN B 5 36.849 -21.789 -12.366 1.00 0.00 H new ATOM 0 HB2 GLN B 5 36.273 -24.561 -11.775 1.00 0.00 H new ATOM 0 HB3 GLN B 5 34.739 -23.714 -11.794 1.00 0.00 H new ATOM 0 HG2 GLN B 5 34.837 -23.340 -14.059 1.00 0.00 H new ATOM 0 HG3 GLN B 5 36.520 -22.856 -13.998 1.00 0.00 H new ATOM 0 HE21 GLN B 5 34.453 -25.304 -15.114 1.00 0.00 H new ATOM 0 HE22 GLN B 5 35.649 -26.593 -15.285 1.00 0.00 H new ATOM 1048 N TYR B 6 35.927 -21.034 -9.661 1.00 0.00 N ATOM 1049 CA TYR B 6 35.043 -20.209 -8.789 1.00 0.00 C ATOM 1050 C TYR B 6 34.088 -19.361 -9.633 1.00 0.00 C ATOM 1051 O TYR B 6 34.507 -18.558 -10.444 1.00 0.00 O ATOM 1052 CB TYR B 6 36.001 -19.313 -8.004 1.00 0.00 C ATOM 1053 CG TYR B 6 35.418 -19.026 -6.643 1.00 0.00 C ATOM 1054 CD1 TYR B 6 34.259 -18.249 -6.528 1.00 0.00 C ATOM 1055 CD2 TYR B 6 36.034 -19.538 -5.494 1.00 0.00 C ATOM 1056 CE1 TYR B 6 33.716 -17.983 -5.266 1.00 0.00 C ATOM 1057 CE2 TYR B 6 35.492 -19.271 -4.231 1.00 0.00 C ATOM 1058 CZ TYR B 6 34.333 -18.495 -4.117 1.00 0.00 C ATOM 1059 OH TYR B 6 33.797 -18.231 -2.871 1.00 0.00 O ATOM 0 H TYR B 6 36.888 -21.126 -9.332 1.00 0.00 H new ATOM 0 HA TYR B 6 34.420 -20.822 -8.138 1.00 0.00 H new ATOM 0 HB2 TYR B 6 36.970 -19.801 -7.901 1.00 0.00 H new ATOM 0 HB3 TYR B 6 36.169 -18.381 -8.544 1.00 0.00 H new ATOM 0 HD1 TYR B 6 33.784 -17.855 -7.414 1.00 0.00 H new ATOM 0 HD2 TYR B 6 36.927 -20.139 -5.582 1.00 0.00 H new ATOM 0 HE1 TYR B 6 32.822 -17.384 -5.178 1.00 0.00 H new ATOM 0 HE2 TYR B 6 35.968 -19.664 -3.345 1.00 0.00 H new ATOM 0 HH TYR B 6 34.345 -18.660 -2.181 1.00 0.00 H new ATOM 1069 N LYS B 7 32.805 -19.528 -9.448 1.00 0.00 N ATOM 1070 CA LYS B 7 31.823 -18.728 -10.238 1.00 0.00 C ATOM 1071 C LYS B 7 30.409 -19.287 -10.050 1.00 0.00 C ATOM 1072 O LYS B 7 29.630 -19.356 -10.980 1.00 0.00 O ATOM 1073 CB LYS B 7 32.266 -18.873 -11.695 1.00 0.00 C ATOM 1074 CG LYS B 7 32.852 -17.547 -12.183 1.00 0.00 C ATOM 1075 CD LYS B 7 32.178 -17.142 -13.496 1.00 0.00 C ATOM 1076 CE LYS B 7 33.139 -17.389 -14.660 1.00 0.00 C ATOM 1077 NZ LYS B 7 32.483 -16.758 -15.839 1.00 0.00 N ATOM 0 H LYS B 7 32.394 -20.184 -8.784 1.00 0.00 H new ATOM 0 HA LYS B 7 31.797 -17.685 -9.923 1.00 0.00 H new ATOM 0 HB2 LYS B 7 33.009 -19.666 -11.783 1.00 0.00 H new ATOM 0 HB3 LYS B 7 31.418 -19.159 -12.317 1.00 0.00 H new ATOM 0 HG2 LYS B 7 32.702 -16.772 -11.431 1.00 0.00 H new ATOM 0 HG3 LYS B 7 33.928 -17.645 -12.329 1.00 0.00 H new ATOM 0 HD2 LYS B 7 31.262 -17.715 -13.639 1.00 0.00 H new ATOM 0 HD3 LYS B 7 31.894 -16.090 -13.462 1.00 0.00 H new ATOM 0 HE2 LYS B 7 34.116 -16.945 -14.467 1.00 0.00 H new ATOM 0 HE3 LYS B 7 33.299 -18.455 -14.821 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 33.082 -16.885 -16.679 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 31.558 -17.205 -16.002 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 32.350 -15.742 -15.660 1.00 0.00 H new ATOM 1091 N ASP B 8 30.071 -19.682 -8.854 1.00 0.00 N ATOM 1092 CA ASP B 8 28.707 -20.232 -8.606 1.00 0.00 C ATOM 1093 C ASP B 8 27.958 -19.338 -7.615 1.00 0.00 C ATOM 1094 O ASP B 8 28.350 -19.197 -6.473 1.00 0.00 O ATOM 1095 CB ASP B 8 28.937 -21.622 -8.012 1.00 0.00 C ATOM 1096 CG ASP B 8 29.236 -22.614 -9.137 1.00 0.00 C ATOM 1097 OD1 ASP B 8 29.766 -22.189 -10.151 1.00 0.00 O ATOM 1098 OD2 ASP B 8 28.931 -23.784 -8.968 1.00 0.00 O ATOM 0 H ASP B 8 30.680 -19.648 -8.037 1.00 0.00 H new ATOM 0 HA ASP B 8 28.106 -20.278 -9.514 1.00 0.00 H new ATOM 0 HB2 ASP B 8 29.767 -21.595 -7.306 1.00 0.00 H new ATOM 0 HB3 ASP B 8 28.056 -21.942 -7.455 1.00 0.00 H new ATOM 1103 N LEU B 9 26.890 -18.723 -8.043 1.00 0.00 N ATOM 1104 CA LEU B 9 26.129 -17.831 -7.123 1.00 0.00 C ATOM 1105 C LEU B 9 24.898 -18.551 -6.567 1.00 0.00 C ATOM 1106 O LEU B 9 24.700 -19.729 -6.790 1.00 0.00 O ATOM 1107 CB LEU B 9 25.713 -16.641 -7.987 1.00 0.00 C ATOM 1108 CG LEU B 9 26.965 -15.941 -8.521 1.00 0.00 C ATOM 1109 CD1 LEU B 9 26.557 -14.774 -9.421 1.00 0.00 C ATOM 1110 CD2 LEU B 9 27.791 -15.413 -7.345 1.00 0.00 C ATOM 0 H LEU B 9 26.512 -18.799 -8.987 1.00 0.00 H new ATOM 0 HA LEU B 9 26.724 -17.526 -6.262 1.00 0.00 H new ATOM 0 HB2 LEU B 9 25.090 -16.979 -8.815 1.00 0.00 H new ATOM 0 HB3 LEU B 9 25.114 -15.943 -7.401 1.00 0.00 H new ATOM 0 HG LEU B 9 27.559 -16.650 -9.097 1.00 0.00 H new ATOM 0 HD11 LEU B 9 27.450 -14.277 -9.800 1.00 0.00 H new ATOM 0 HD12 LEU B 9 25.968 -15.149 -10.258 1.00 0.00 H new ATOM 0 HD13 LEU B 9 25.962 -14.063 -8.848 1.00 0.00 H new ATOM 0 HD21 LEU B 9 28.684 -14.914 -7.722 1.00 0.00 H new ATOM 0 HD22 LEU B 9 27.194 -14.704 -6.770 1.00 0.00 H new ATOM 0 HD23 LEU B 9 28.084 -16.244 -6.704 1.00 0.00 H new ATOM 1122 N LYS B 10 24.074 -17.848 -5.841 1.00 0.00 N ATOM 1123 CA LYS B 10 22.856 -18.482 -5.262 1.00 0.00 C ATOM 1124 C LYS B 10 21.595 -17.813 -5.815 1.00 0.00 C ATOM 1125 O LYS B 10 20.723 -17.399 -5.076 1.00 0.00 O ATOM 1126 CB LYS B 10 22.968 -18.245 -3.758 1.00 0.00 C ATOM 1127 CG LYS B 10 22.742 -16.761 -3.466 1.00 0.00 C ATOM 1128 CD LYS B 10 23.545 -16.354 -2.230 1.00 0.00 C ATOM 1129 CE LYS B 10 24.950 -15.919 -2.652 1.00 0.00 C ATOM 1130 NZ LYS B 10 25.868 -16.622 -1.714 1.00 0.00 N ATOM 0 H LYS B 10 24.192 -16.859 -5.623 1.00 0.00 H new ATOM 0 HA LYS B 10 22.786 -19.542 -5.507 1.00 0.00 H new ATOM 0 HB2 LYS B 10 22.232 -18.849 -3.227 1.00 0.00 H new ATOM 0 HB3 LYS B 10 23.951 -18.553 -3.401 1.00 0.00 H new ATOM 0 HG2 LYS B 10 23.046 -16.161 -4.324 1.00 0.00 H new ATOM 0 HG3 LYS B 10 21.681 -16.569 -3.303 1.00 0.00 H new ATOM 0 HD2 LYS B 10 23.042 -15.539 -1.709 1.00 0.00 H new ATOM 0 HD3 LYS B 10 23.606 -17.189 -1.532 1.00 0.00 H new ATOM 0 HE2 LYS B 10 25.155 -16.195 -3.686 1.00 0.00 H new ATOM 0 HE3 LYS B 10 25.066 -14.837 -2.582 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 26.852 -16.374 -1.940 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 25.654 -16.334 -0.738 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 25.740 -17.650 -1.808 1.00 0.00 H new ATOM 1144 N ILE B 11 21.493 -17.704 -7.110 1.00 0.00 N ATOM 1145 CA ILE B 11 20.292 -17.061 -7.712 1.00 0.00 C ATOM 1146 C ILE B 11 19.752 -17.926 -8.853 1.00 0.00 C ATOM 1147 O ILE B 11 19.514 -19.106 -8.691 1.00 0.00 O ATOM 1148 CB ILE B 11 20.790 -15.715 -8.240 1.00 0.00 C ATOM 1149 CG1 ILE B 11 22.072 -15.926 -9.048 1.00 0.00 C ATOM 1150 CG2 ILE B 11 21.070 -14.786 -7.075 1.00 0.00 C ATOM 1151 CD1 ILE B 11 22.110 -14.937 -10.215 1.00 0.00 C ATOM 0 H ILE B 11 22.190 -18.033 -7.778 1.00 0.00 H new ATOM 0 HA ILE B 11 19.479 -16.939 -6.996 1.00 0.00 H new ATOM 0 HB ILE B 11 20.028 -15.272 -8.881 1.00 0.00 H new ATOM 0 HG12 ILE B 11 22.944 -15.785 -8.409 1.00 0.00 H new ATOM 0 HG13 ILE B 11 22.114 -16.949 -9.423 1.00 0.00 H new ATOM 0 HG21 ILE B 11 21.425 -13.827 -7.452 1.00 0.00 H new ATOM 0 HG22 ILE B 11 20.155 -14.635 -6.502 1.00 0.00 H new ATOM 0 HG23 ILE B 11 21.832 -15.228 -6.432 1.00 0.00 H new ATOM 0 HD11 ILE B 11 23.024 -15.088 -10.790 1.00 0.00 H new ATOM 0 HD12 ILE B 11 21.245 -15.100 -10.858 1.00 0.00 H new ATOM 0 HD13 ILE B 11 22.088 -13.918 -9.829 1.00 0.00 H new ATOM 1163 N ASP B 12 19.561 -17.350 -10.007 1.00 0.00 N ATOM 1164 CA ASP B 12 19.047 -18.122 -11.158 1.00 0.00 C ATOM 1165 C ASP B 12 17.633 -18.638 -10.873 1.00 0.00 C ATOM 1166 O ASP B 12 16.670 -18.199 -11.469 1.00 0.00 O ATOM 1167 CB ASP B 12 20.026 -19.283 -11.332 1.00 0.00 C ATOM 1168 CG ASP B 12 20.387 -19.429 -12.812 1.00 0.00 C ATOM 1169 OD1 ASP B 12 19.484 -19.660 -13.601 1.00 0.00 O ATOM 1170 OD2 ASP B 12 21.558 -19.308 -13.132 1.00 0.00 O ATOM 0 H ASP B 12 19.743 -16.365 -10.198 1.00 0.00 H new ATOM 0 HA ASP B 12 18.978 -17.514 -12.060 1.00 0.00 H new ATOM 0 HB2 ASP B 12 20.926 -19.105 -10.743 1.00 0.00 H new ATOM 0 HB3 ASP B 12 19.581 -20.207 -10.963 1.00 0.00 H new ATOM 1175 N ILE B 13 17.504 -19.573 -9.972 1.00 0.00 N ATOM 1176 CA ILE B 13 16.156 -20.126 -9.650 1.00 0.00 C ATOM 1177 C ILE B 13 15.210 -19.011 -9.188 1.00 0.00 C ATOM 1178 O ILE B 13 15.421 -18.387 -8.168 1.00 0.00 O ATOM 1179 CB ILE B 13 16.398 -21.125 -8.520 1.00 0.00 C ATOM 1180 CG1 ILE B 13 17.015 -20.399 -7.323 1.00 0.00 C ATOM 1181 CG2 ILE B 13 17.352 -22.222 -8.999 1.00 0.00 C ATOM 1182 CD1 ILE B 13 15.926 -20.102 -6.291 1.00 0.00 C ATOM 0 H ILE B 13 18.276 -19.979 -9.443 1.00 0.00 H new ATOM 0 HA ILE B 13 15.688 -20.592 -10.517 1.00 0.00 H new ATOM 0 HB ILE B 13 15.450 -21.575 -8.225 1.00 0.00 H new ATOM 0 HG12 ILE B 13 17.797 -21.012 -6.876 1.00 0.00 H new ATOM 0 HG13 ILE B 13 17.485 -19.471 -7.649 1.00 0.00 H new ATOM 0 HG21 ILE B 13 17.523 -22.934 -8.191 1.00 0.00 H new ATOM 0 HG22 ILE B 13 16.912 -22.740 -9.852 1.00 0.00 H new ATOM 0 HG23 ILE B 13 18.301 -21.775 -9.296 1.00 0.00 H new ATOM 0 HD11 ILE B 13 16.365 -19.585 -5.438 1.00 0.00 H new ATOM 0 HD12 ILE B 13 15.159 -19.472 -6.742 1.00 0.00 H new ATOM 0 HD13 ILE B 13 15.477 -21.037 -5.957 1.00 0.00 H new ATOM 1194 N LYS B 14 14.165 -18.767 -9.933 1.00 0.00 N ATOM 1195 CA LYS B 14 13.193 -17.702 -9.545 1.00 0.00 C ATOM 1196 C LYS B 14 13.925 -16.455 -9.039 1.00 0.00 C ATOM 1197 O LYS B 14 14.298 -16.367 -7.887 1.00 0.00 O ATOM 1198 CB LYS B 14 12.355 -18.320 -8.427 1.00 0.00 C ATOM 1199 CG LYS B 14 10.871 -18.225 -8.788 1.00 0.00 C ATOM 1200 CD LYS B 14 10.408 -19.553 -9.390 1.00 0.00 C ATOM 1201 CE LYS B 14 9.045 -19.929 -8.806 1.00 0.00 C ATOM 1202 NZ LYS B 14 9.338 -20.393 -7.421 1.00 0.00 N ATOM 0 H LYS B 14 13.941 -19.261 -10.797 1.00 0.00 H new ATOM 0 HA LYS B 14 12.582 -17.382 -10.389 1.00 0.00 H new ATOM 0 HB2 LYS B 14 12.638 -19.362 -8.280 1.00 0.00 H new ATOM 0 HB3 LYS B 14 12.545 -17.802 -7.487 1.00 0.00 H new ATOM 0 HG2 LYS B 14 10.284 -17.991 -7.900 1.00 0.00 H new ATOM 0 HG3 LYS B 14 10.710 -17.415 -9.499 1.00 0.00 H new ATOM 0 HD2 LYS B 14 10.340 -19.469 -10.475 1.00 0.00 H new ATOM 0 HD3 LYS B 14 11.136 -20.335 -9.176 1.00 0.00 H new ATOM 0 HE2 LYS B 14 8.368 -19.075 -8.802 1.00 0.00 H new ATOM 0 HE3 LYS B 14 8.566 -20.713 -9.393 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 8.921 -21.334 -7.275 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 10.367 -20.446 -7.283 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 8.931 -19.724 -6.737 1.00 0.00 H new ATOM 1216 N THR B 15 14.127 -15.488 -9.893 1.00 0.00 N ATOM 1217 CA THR B 15 14.830 -14.246 -9.461 1.00 0.00 C ATOM 1218 C THR B 15 14.117 -13.008 -10.020 1.00 0.00 C ATOM 1219 O THR B 15 14.172 -12.740 -11.202 1.00 0.00 O ATOM 1220 CB THR B 15 16.237 -14.363 -10.043 1.00 0.00 C ATOM 1221 OG1 THR B 15 16.165 -14.834 -11.381 1.00 0.00 O ATOM 1222 CG2 THR B 15 17.057 -15.336 -9.193 1.00 0.00 C ATOM 0 H THR B 15 13.836 -15.504 -10.870 1.00 0.00 H new ATOM 0 HA THR B 15 14.846 -14.139 -8.376 1.00 0.00 H new ATOM 0 HB THR B 15 16.716 -13.384 -10.037 1.00 0.00 H new ATOM 0 HG1 THR B 15 15.533 -14.283 -11.888 1.00 0.00 H new ATOM 0 HG21 THR B 15 18.062 -15.422 -9.606 1.00 0.00 H new ATOM 0 HG22 THR B 15 17.115 -14.965 -8.170 1.00 0.00 H new ATOM 0 HG23 THR B 15 16.578 -16.315 -9.197 1.00 0.00 H new ATOM 1230 N SER B 16 13.446 -12.252 -9.182 1.00 0.00 N ATOM 1231 CA SER B 16 12.738 -11.032 -9.682 1.00 0.00 C ATOM 1232 C SER B 16 13.790 -10.050 -10.290 1.00 0.00 C ATOM 1233 O SER B 16 14.484 -10.478 -11.189 1.00 0.00 O ATOM 1234 CB SER B 16 11.950 -10.518 -8.475 1.00 0.00 C ATOM 1235 OG SER B 16 11.060 -11.536 -8.038 1.00 0.00 O ATOM 0 H SER B 16 13.359 -12.426 -8.181 1.00 0.00 H new ATOM 0 HA SER B 16 12.035 -11.198 -10.498 1.00 0.00 H new ATOM 0 HB2 SER B 16 12.631 -10.242 -7.670 1.00 0.00 H new ATOM 0 HB3 SER B 16 11.393 -9.620 -8.743 1.00 0.00 H new ATOM 0 HG SER B 16 10.552 -11.216 -7.264 1.00 0.00 H new ATOM 1241 N PRO B 17 13.949 -8.780 -9.878 1.00 0.00 N ATOM 1242 CA PRO B 17 13.240 -8.033 -8.823 1.00 0.00 C ATOM 1243 C PRO B 17 12.366 -6.953 -9.450 1.00 0.00 C ATOM 1244 O PRO B 17 12.343 -5.838 -8.967 1.00 0.00 O ATOM 1245 CB PRO B 17 14.399 -7.305 -8.151 1.00 0.00 C ATOM 1246 CG PRO B 17 15.455 -7.191 -9.208 1.00 0.00 C ATOM 1247 CD PRO B 17 14.914 -7.866 -10.428 1.00 0.00 C ATOM 0 HA PRO B 17 12.620 -8.664 -8.186 1.00 0.00 H new ATOM 0 HB2 PRO B 17 14.092 -6.322 -7.793 1.00 0.00 H new ATOM 0 HB3 PRO B 17 14.765 -7.860 -7.287 1.00 0.00 H new ATOM 0 HG2 PRO B 17 15.686 -6.146 -9.414 1.00 0.00 H new ATOM 0 HG3 PRO B 17 16.382 -7.664 -8.882 1.00 0.00 H new ATOM 0 HD2 PRO B 17 14.454 -7.155 -11.114 1.00 0.00 H new ATOM 0 HD3 PRO B 17 15.694 -8.386 -10.983 1.00 0.00 H new ATOM 1255 N PRO B 18 11.713 -7.272 -10.526 1.00 0.00 N ATOM 1256 CA PRO B 18 10.905 -6.250 -11.203 1.00 0.00 C ATOM 1257 C PRO B 18 9.770 -5.720 -10.304 1.00 0.00 C ATOM 1258 O PRO B 18 9.401 -4.570 -10.435 1.00 0.00 O ATOM 1259 CB PRO B 18 10.441 -6.948 -12.475 1.00 0.00 C ATOM 1260 CG PRO B 18 10.486 -8.401 -12.157 1.00 0.00 C ATOM 1261 CD PRO B 18 11.643 -8.569 -11.211 1.00 0.00 C ATOM 0 HA PRO B 18 11.456 -5.339 -11.438 1.00 0.00 H new ATOM 0 HB2 PRO B 18 9.434 -6.636 -12.751 1.00 0.00 H new ATOM 0 HB3 PRO B 18 11.091 -6.708 -13.316 1.00 0.00 H new ATOM 0 HG2 PRO B 18 9.554 -8.732 -11.699 1.00 0.00 H new ATOM 0 HG3 PRO B 18 10.627 -8.996 -13.059 1.00 0.00 H new ATOM 0 HD2 PRO B 18 11.473 -9.385 -10.509 1.00 0.00 H new ATOM 0 HD3 PRO B 18 12.568 -8.793 -11.743 1.00 0.00 H new ATOM 1269 N PRO B 19 9.289 -6.513 -9.366 1.00 0.00 N ATOM 1270 CA PRO B 19 8.270 -5.991 -8.440 1.00 0.00 C ATOM 1271 C PRO B 19 9.025 -5.230 -7.348 1.00 0.00 C ATOM 1272 O PRO B 19 9.189 -5.699 -6.242 1.00 0.00 O ATOM 1273 CB PRO B 19 7.586 -7.241 -7.899 1.00 0.00 C ATOM 1274 CG PRO B 19 8.592 -8.341 -8.039 1.00 0.00 C ATOM 1275 CD PRO B 19 9.615 -7.917 -9.069 1.00 0.00 C ATOM 0 HA PRO B 19 7.535 -5.316 -8.878 1.00 0.00 H new ATOM 0 HB2 PRO B 19 7.293 -7.108 -6.858 1.00 0.00 H new ATOM 0 HB3 PRO B 19 6.679 -7.466 -8.460 1.00 0.00 H new ATOM 0 HG2 PRO B 19 9.075 -8.538 -7.082 1.00 0.00 H new ATOM 0 HG3 PRO B 19 8.104 -9.266 -8.346 1.00 0.00 H new ATOM 0 HD2 PRO B 19 10.629 -8.014 -8.682 1.00 0.00 H new ATOM 0 HD3 PRO B 19 9.554 -8.535 -9.965 1.00 0.00 H new ATOM 1283 N GLU B 20 9.545 -4.083 -7.709 1.00 0.00 N ATOM 1284 CA GLU B 20 10.377 -3.253 -6.778 1.00 0.00 C ATOM 1285 C GLU B 20 9.696 -2.937 -5.441 1.00 0.00 C ATOM 1286 O GLU B 20 9.606 -1.792 -5.055 1.00 0.00 O ATOM 1287 CB GLU B 20 10.626 -1.948 -7.541 1.00 0.00 C ATOM 1288 CG GLU B 20 9.336 -1.492 -8.228 1.00 0.00 C ATOM 1289 CD GLU B 20 9.365 0.026 -8.406 1.00 0.00 C ATOM 1290 OE1 GLU B 20 9.940 0.477 -9.383 1.00 0.00 O ATOM 1291 OE2 GLU B 20 8.814 0.713 -7.561 1.00 0.00 O ATOM 0 H GLU B 20 9.425 -3.675 -8.636 1.00 0.00 H new ATOM 0 HA GLU B 20 11.282 -3.799 -6.511 1.00 0.00 H new ATOM 0 HB2 GLU B 20 10.975 -1.176 -6.855 1.00 0.00 H new ATOM 0 HB3 GLU B 20 11.411 -2.094 -8.283 1.00 0.00 H new ATOM 0 HG2 GLU B 20 9.234 -1.981 -9.197 1.00 0.00 H new ATOM 0 HG3 GLU B 20 8.471 -1.783 -7.632 1.00 0.00 H new ATOM 1298 N CYS B 21 9.270 -3.915 -4.698 1.00 0.00 N ATOM 1299 CA CYS B 21 8.676 -3.577 -3.368 1.00 0.00 C ATOM 1300 C CYS B 21 9.812 -3.361 -2.365 1.00 0.00 C ATOM 1301 O CYS B 21 9.696 -2.584 -1.439 1.00 0.00 O ATOM 1302 CB CYS B 21 7.715 -4.700 -2.899 1.00 0.00 C ATOM 1303 SG CYS B 21 7.836 -6.200 -3.916 1.00 0.00 S ATOM 0 H CYS B 21 9.302 -4.906 -4.938 1.00 0.00 H new ATOM 0 HA CYS B 21 8.088 -2.662 -3.445 1.00 0.00 H new ATOM 0 HB2 CYS B 21 7.936 -4.951 -1.862 1.00 0.00 H new ATOM 0 HB3 CYS B 21 6.690 -4.330 -2.926 1.00 0.00 H new ATOM 0 HG CYS B 21 8.062 -5.869 -5.153 1.00 0.00 H new ATOM 1309 N ILE B 22 10.922 -4.034 -2.554 1.00 0.00 N ATOM 1310 CA ILE B 22 12.077 -3.852 -1.619 1.00 0.00 C ATOM 1311 C ILE B 22 12.836 -2.588 -1.973 1.00 0.00 C ATOM 1312 O ILE B 22 13.032 -1.720 -1.161 1.00 0.00 O ATOM 1313 CB ILE B 22 13.013 -5.042 -1.837 1.00 0.00 C ATOM 1314 CG1 ILE B 22 12.316 -6.393 -1.615 1.00 0.00 C ATOM 1315 CG2 ILE B 22 14.186 -4.929 -0.873 1.00 0.00 C ATOM 1316 CD1 ILE B 22 10.897 -6.223 -1.049 1.00 0.00 C ATOM 0 H ILE B 22 11.078 -4.699 -3.312 1.00 0.00 H new ATOM 0 HA ILE B 22 11.726 -3.784 -0.589 1.00 0.00 H new ATOM 0 HB ILE B 22 13.346 -5.011 -2.875 1.00 0.00 H new ATOM 0 HG12 ILE B 22 12.267 -6.935 -2.559 1.00 0.00 H new ATOM 0 HG13 ILE B 22 12.909 -6.999 -0.930 1.00 0.00 H new ATOM 0 HG21 ILE B 22 14.860 -5.773 -1.020 1.00 0.00 H new ATOM 0 HG22 ILE B 22 14.723 -3.999 -1.060 1.00 0.00 H new ATOM 0 HG23 ILE B 22 13.816 -4.934 0.152 1.00 0.00 H new ATOM 0 HD11 ILE B 22 10.442 -7.203 -0.908 1.00 0.00 H new ATOM 0 HD12 ILE B 22 10.947 -5.705 -0.091 1.00 0.00 H new ATOM 0 HD13 ILE B 22 10.295 -5.640 -1.746 1.00 0.00 H new ATOM 1328 N ASN B 23 13.292 -2.484 -3.180 1.00 0.00 N ATOM 1329 CA ASN B 23 14.051 -1.260 -3.544 1.00 0.00 C ATOM 1330 C ASN B 23 13.138 -0.042 -3.415 1.00 0.00 C ATOM 1331 O ASN B 23 13.458 0.903 -2.730 1.00 0.00 O ATOM 1332 CB ASN B 23 14.529 -1.454 -4.982 1.00 0.00 C ATOM 1333 CG ASN B 23 13.344 -1.492 -5.934 1.00 0.00 C ATOM 1334 OD1 ASN B 23 12.370 -2.162 -5.673 1.00 0.00 O ATOM 1335 ND2 ASN B 23 13.388 -0.789 -7.035 1.00 0.00 N ATOM 0 H ASN B 23 13.178 -3.176 -3.921 1.00 0.00 H new ATOM 0 HA ASN B 23 14.905 -1.095 -2.887 1.00 0.00 H new ATOM 0 HB2 ASN B 23 15.202 -0.643 -5.261 1.00 0.00 H new ATOM 0 HB3 ASN B 23 15.097 -2.381 -5.061 1.00 0.00 H new ATOM 0 HD21 ASN B 23 12.598 -0.803 -7.681 1.00 0.00 H new ATOM 0 HD22 ASN B 23 14.212 -0.227 -7.249 1.00 0.00 H new ATOM 1342 N ASP B 24 11.972 -0.065 -4.001 1.00 0.00 N ATOM 1343 CA ASP B 24 11.071 1.101 -3.835 1.00 0.00 C ATOM 1344 C ASP B 24 10.909 1.336 -2.349 1.00 0.00 C ATOM 1345 O ASP B 24 10.590 2.416 -1.895 1.00 0.00 O ATOM 1346 CB ASP B 24 9.744 0.697 -4.470 1.00 0.00 C ATOM 1347 CG ASP B 24 8.870 1.939 -4.657 1.00 0.00 C ATOM 1348 OD1 ASP B 24 8.625 2.620 -3.674 1.00 0.00 O ATOM 1349 OD2 ASP B 24 8.463 2.189 -5.779 1.00 0.00 O ATOM 0 H ASP B 24 11.613 -0.827 -4.576 1.00 0.00 H new ATOM 0 HA ASP B 24 11.447 2.014 -4.297 1.00 0.00 H new ATOM 0 HB2 ASP B 24 9.920 0.215 -5.432 1.00 0.00 H new ATOM 0 HB3 ASP B 24 9.232 -0.029 -3.838 1.00 0.00 H new ATOM 1354 N LEU B 25 11.154 0.310 -1.586 1.00 0.00 N ATOM 1355 CA LEU B 25 11.051 0.428 -0.129 1.00 0.00 C ATOM 1356 C LEU B 25 12.355 0.928 0.435 1.00 0.00 C ATOM 1357 O LEU B 25 12.446 1.943 1.098 1.00 0.00 O ATOM 1358 CB LEU B 25 10.818 -1.003 0.368 1.00 0.00 C ATOM 1359 CG LEU B 25 11.473 -1.225 1.759 1.00 0.00 C ATOM 1360 CD1 LEU B 25 10.414 -1.277 2.842 1.00 0.00 C ATOM 1361 CD2 LEU B 25 12.272 -2.526 1.755 1.00 0.00 C ATOM 0 H LEU B 25 11.424 -0.613 -1.926 1.00 0.00 H new ATOM 0 HA LEU B 25 10.260 1.116 0.169 1.00 0.00 H new ATOM 0 HB2 LEU B 25 9.748 -1.200 0.431 1.00 0.00 H new ATOM 0 HB3 LEU B 25 11.231 -1.712 -0.349 1.00 0.00 H new ATOM 0 HG LEU B 25 12.143 -0.390 1.965 1.00 0.00 H new ATOM 0 HD11 LEU B 25 10.891 -1.433 3.810 1.00 0.00 H new ATOM 0 HD12 LEU B 25 9.862 -0.337 2.857 1.00 0.00 H new ATOM 0 HD13 LEU B 25 9.727 -2.098 2.640 1.00 0.00 H new ATOM 0 HD21 LEU B 25 12.729 -2.676 2.733 1.00 0.00 H new ATOM 0 HD22 LEU B 25 11.607 -3.361 1.534 1.00 0.00 H new ATOM 0 HD23 LEU B 25 13.052 -2.472 0.995 1.00 0.00 H new ATOM 1373 N LEU B 26 13.342 0.126 0.239 1.00 0.00 N ATOM 1374 CA LEU B 26 14.650 0.387 0.803 1.00 0.00 C ATOM 1375 C LEU B 26 15.337 1.560 0.120 1.00 0.00 C ATOM 1376 O LEU B 26 16.345 2.051 0.587 1.00 0.00 O ATOM 1377 CB LEU B 26 15.386 -0.916 0.563 1.00 0.00 C ATOM 1378 CG LEU B 26 16.858 -0.670 0.699 1.00 0.00 C ATOM 1379 CD1 LEU B 26 17.120 -0.197 2.111 1.00 0.00 C ATOM 1380 CD2 LEU B 26 17.629 -1.961 0.430 1.00 0.00 C ATOM 0 H LEU B 26 13.282 -0.730 -0.312 1.00 0.00 H new ATOM 0 HA LEU B 26 14.614 0.671 1.855 1.00 0.00 H new ATOM 0 HB2 LEU B 26 15.061 -1.671 1.280 1.00 0.00 H new ATOM 0 HB3 LEU B 26 15.158 -1.301 -0.431 1.00 0.00 H new ATOM 0 HG LEU B 26 17.186 0.081 -0.020 1.00 0.00 H new ATOM 0 HD11 LEU B 26 18.186 -0.009 2.240 1.00 0.00 H new ATOM 0 HD12 LEU B 26 16.565 0.723 2.296 1.00 0.00 H new ATOM 0 HD13 LEU B 26 16.798 -0.963 2.817 1.00 0.00 H new ATOM 0 HD21 LEU B 26 18.698 -1.774 0.531 1.00 0.00 H new ATOM 0 HD22 LEU B 26 17.325 -2.723 1.148 1.00 0.00 H new ATOM 0 HD23 LEU B 26 17.415 -2.309 -0.581 1.00 0.00 H new ATOM 1392 N GLN B 27 14.795 2.043 -0.955 1.00 0.00 N ATOM 1393 CA GLN B 27 15.419 3.198 -1.605 1.00 0.00 C ATOM 1394 C GLN B 27 15.223 4.404 -0.688 1.00 0.00 C ATOM 1395 O GLN B 27 15.730 5.480 -0.935 1.00 0.00 O ATOM 1396 CB GLN B 27 14.654 3.362 -2.907 1.00 0.00 C ATOM 1397 CG GLN B 27 15.091 2.274 -3.885 1.00 0.00 C ATOM 1398 CD GLN B 27 16.170 2.803 -4.824 1.00 0.00 C ATOM 1399 OE1 GLN B 27 16.172 3.964 -5.180 1.00 0.00 O ATOM 1400 NE2 GLN B 27 17.096 1.985 -5.240 1.00 0.00 N ATOM 0 H GLN B 27 13.952 1.685 -1.403 1.00 0.00 H new ATOM 0 HA GLN B 27 16.487 3.088 -1.794 1.00 0.00 H new ATOM 0 HB2 GLN B 27 13.582 3.294 -2.724 1.00 0.00 H new ATOM 0 HB3 GLN B 27 14.843 4.348 -3.332 1.00 0.00 H new ATOM 0 HG2 GLN B 27 15.470 1.413 -3.335 1.00 0.00 H new ATOM 0 HG3 GLN B 27 14.233 1.931 -4.464 1.00 0.00 H new ATOM 0 HE21 GLN B 27 17.089 1.011 -4.938 1.00 0.00 H new ATOM 0 HE22 GLN B 27 17.827 2.319 -5.868 1.00 0.00 H new ATOM 1409 N ALA B 28 14.463 4.226 0.374 1.00 0.00 N ATOM 1410 CA ALA B 28 14.208 5.349 1.299 1.00 0.00 C ATOM 1411 C ALA B 28 14.732 5.067 2.716 1.00 0.00 C ATOM 1412 O ALA B 28 14.940 5.992 3.475 1.00 0.00 O ATOM 1413 CB ALA B 28 12.688 5.495 1.326 1.00 0.00 C ATOM 0 H ALA B 28 14.015 3.345 0.627 1.00 0.00 H new ATOM 0 HA ALA B 28 14.720 6.251 0.966 1.00 0.00 H new ATOM 0 HB1 ALA B 28 12.413 6.312 1.993 1.00 0.00 H new ATOM 0 HB2 ALA B 28 12.325 5.710 0.321 1.00 0.00 H new ATOM 0 HB3 ALA B 28 12.240 4.568 1.683 1.00 0.00 H new ATOM 1419 N VAL B 29 14.943 3.828 3.120 1.00 0.00 N ATOM 1420 CA VAL B 29 15.433 3.640 4.515 1.00 0.00 C ATOM 1421 C VAL B 29 16.909 3.290 4.528 1.00 0.00 C ATOM 1422 O VAL B 29 17.462 2.964 5.557 1.00 0.00 O ATOM 1423 CB VAL B 29 14.548 2.540 5.137 1.00 0.00 C ATOM 1424 CG1 VAL B 29 14.127 1.518 4.085 1.00 0.00 C ATOM 1425 CG2 VAL B 29 15.300 1.814 6.254 1.00 0.00 C ATOM 0 H VAL B 29 14.803 2.982 2.568 1.00 0.00 H new ATOM 0 HA VAL B 29 15.354 4.555 5.102 1.00 0.00 H new ATOM 0 HB VAL B 29 13.661 3.025 5.544 1.00 0.00 H new ATOM 0 HG11 VAL B 29 13.504 0.753 4.549 1.00 0.00 H new ATOM 0 HG12 VAL B 29 13.562 2.018 3.298 1.00 0.00 H new ATOM 0 HG13 VAL B 29 15.014 1.052 3.655 1.00 0.00 H new ATOM 0 HG21 VAL B 29 14.660 1.042 6.681 1.00 0.00 H new ATOM 0 HG22 VAL B 29 16.201 1.355 5.847 1.00 0.00 H new ATOM 0 HG23 VAL B 29 15.575 2.527 7.031 1.00 0.00 H new ATOM 1435 N ASP B 30 17.572 3.407 3.416 1.00 0.00 N ATOM 1436 CA ASP B 30 19.024 3.116 3.423 1.00 0.00 C ATOM 1437 C ASP B 30 19.260 1.804 4.131 1.00 0.00 C ATOM 1438 O ASP B 30 19.366 1.762 5.342 1.00 0.00 O ATOM 1439 CB ASP B 30 19.611 4.243 4.254 1.00 0.00 C ATOM 1440 CG ASP B 30 20.019 5.408 3.350 1.00 0.00 C ATOM 1441 OD1 ASP B 30 19.163 5.910 2.640 1.00 0.00 O ATOM 1442 OD2 ASP B 30 21.180 5.780 3.385 1.00 0.00 O ATOM 0 H ASP B 30 17.178 3.687 2.518 1.00 0.00 H new ATOM 0 HA ASP B 30 19.456 3.047 2.425 1.00 0.00 H new ATOM 0 HB2 ASP B 30 18.880 4.582 4.989 1.00 0.00 H new ATOM 0 HB3 ASP B 30 20.477 3.883 4.809 1.00 0.00 H new ATOM 1447 N SER B 31 19.300 0.720 3.438 1.00 0.00 N ATOM 1448 CA SER B 31 19.464 -0.530 4.181 1.00 0.00 C ATOM 1449 C SER B 31 19.865 -1.661 3.235 1.00 0.00 C ATOM 1450 O SER B 31 19.136 -2.611 3.033 1.00 0.00 O ATOM 1451 CB SER B 31 18.059 -0.683 4.758 1.00 0.00 C ATOM 1452 OG SER B 31 18.142 -1.107 6.103 1.00 0.00 O ATOM 0 H SER B 31 19.229 0.645 2.423 1.00 0.00 H new ATOM 0 HA SER B 31 20.245 -0.544 4.941 1.00 0.00 H new ATOM 0 HB2 SER B 31 17.525 0.265 4.698 1.00 0.00 H new ATOM 0 HB3 SER B 31 17.491 -1.406 4.173 1.00 0.00 H new ATOM 0 HG SER B 31 18.591 -0.418 6.636 1.00 0.00 H new ATOM 1458 N GLN B 32 21.027 -1.552 2.651 1.00 0.00 N ATOM 1459 CA GLN B 32 21.490 -2.597 1.702 1.00 0.00 C ATOM 1460 C GLN B 32 21.294 -3.987 2.300 1.00 0.00 C ATOM 1461 O GLN B 32 21.233 -4.962 1.593 1.00 0.00 O ATOM 1462 CB GLN B 32 22.973 -2.309 1.483 1.00 0.00 C ATOM 1463 CG GLN B 32 23.379 -2.805 0.097 1.00 0.00 C ATOM 1464 CD GLN B 32 24.230 -1.743 -0.591 1.00 0.00 C ATOM 1465 OE1 GLN B 32 25.106 -1.160 0.016 1.00 0.00 O ATOM 1466 NE2 GLN B 32 24.006 -1.466 -1.842 1.00 0.00 N ATOM 0 H GLN B 32 21.677 -0.779 2.793 1.00 0.00 H new ATOM 0 HA GLN B 32 20.930 -2.577 0.767 1.00 0.00 H new ATOM 0 HB2 GLN B 32 23.165 -1.240 1.571 1.00 0.00 H new ATOM 0 HB3 GLN B 32 23.569 -2.804 2.249 1.00 0.00 H new ATOM 0 HG2 GLN B 32 23.938 -3.737 0.181 1.00 0.00 H new ATOM 0 HG3 GLN B 32 22.492 -3.019 -0.499 1.00 0.00 H new ATOM 0 HE21 GLN B 32 23.270 -1.957 -2.349 1.00 0.00 H new ATOM 0 HE22 GLN B 32 24.567 -0.758 -2.316 1.00 0.00 H new ATOM 1475 N GLU B 33 21.167 -4.095 3.590 1.00 0.00 N ATOM 1476 CA GLU B 33 20.947 -5.441 4.175 1.00 0.00 C ATOM 1477 C GLU B 33 19.598 -5.959 3.694 1.00 0.00 C ATOM 1478 O GLU B 33 19.378 -7.146 3.561 1.00 0.00 O ATOM 1479 CB GLU B 33 20.939 -5.234 5.687 1.00 0.00 C ATOM 1480 CG GLU B 33 22.103 -4.324 6.086 1.00 0.00 C ATOM 1481 CD GLU B 33 22.597 -4.706 7.482 1.00 0.00 C ATOM 1482 OE1 GLU B 33 23.039 -5.831 7.646 1.00 0.00 O ATOM 1483 OE2 GLU B 33 22.525 -3.866 8.365 1.00 0.00 O ATOM 0 H GLU B 33 21.205 -3.323 4.255 1.00 0.00 H new ATOM 0 HA GLU B 33 21.711 -6.163 3.886 1.00 0.00 H new ATOM 0 HB2 GLU B 33 19.994 -4.790 5.999 1.00 0.00 H new ATOM 0 HB3 GLU B 33 21.023 -6.194 6.196 1.00 0.00 H new ATOM 0 HG2 GLU B 33 22.914 -4.417 5.364 1.00 0.00 H new ATOM 0 HG3 GLU B 33 21.784 -3.282 6.075 1.00 0.00 H new ATOM 1490 N VAL B 34 18.696 -5.059 3.417 1.00 0.00 N ATOM 1491 CA VAL B 34 17.356 -5.465 2.925 1.00 0.00 C ATOM 1492 C VAL B 34 17.462 -5.811 1.436 1.00 0.00 C ATOM 1493 O VAL B 34 16.918 -6.797 0.979 1.00 0.00 O ATOM 1494 CB VAL B 34 16.464 -4.241 3.203 1.00 0.00 C ATOM 1495 CG1 VAL B 34 15.501 -3.994 2.040 1.00 0.00 C ATOM 1496 CG2 VAL B 34 15.660 -4.499 4.479 1.00 0.00 C ATOM 0 H VAL B 34 18.834 -4.053 3.512 1.00 0.00 H new ATOM 0 HA VAL B 34 16.943 -6.351 3.408 1.00 0.00 H new ATOM 0 HB VAL B 34 17.096 -3.361 3.320 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.881 -3.125 2.259 1.00 0.00 H new ATOM 0 HG12 VAL B 34 16.070 -3.813 1.128 1.00 0.00 H new ATOM 0 HG13 VAL B 34 14.864 -4.868 1.903 1.00 0.00 H new ATOM 0 HG21 VAL B 34 15.023 -3.639 4.688 1.00 0.00 H new ATOM 0 HG22 VAL B 34 15.040 -5.386 4.345 1.00 0.00 H new ATOM 0 HG23 VAL B 34 16.343 -4.656 5.314 1.00 0.00 H new ATOM 1506 N ARG B 35 18.196 -5.037 0.686 1.00 0.00 N ATOM 1507 CA ARG B 35 18.376 -5.358 -0.754 1.00 0.00 C ATOM 1508 C ARG B 35 19.381 -6.497 -0.855 1.00 0.00 C ATOM 1509 O ARG B 35 19.186 -7.457 -1.573 1.00 0.00 O ATOM 1510 CB ARG B 35 18.949 -4.099 -1.361 1.00 0.00 C ATOM 1511 CG ARG B 35 17.933 -3.469 -2.311 1.00 0.00 C ATOM 1512 CD ARG B 35 18.685 -2.833 -3.471 1.00 0.00 C ATOM 1513 NE ARG B 35 17.632 -2.478 -4.467 1.00 0.00 N ATOM 1514 CZ ARG B 35 17.829 -1.517 -5.337 1.00 0.00 C ATOM 1515 NH1 ARG B 35 18.827 -0.684 -5.199 1.00 0.00 N ATOM 1516 NH2 ARG B 35 17.019 -1.389 -6.354 1.00 0.00 N ATOM 0 H ARG B 35 18.678 -4.198 1.009 1.00 0.00 H new ATOM 0 HA ARG B 35 17.456 -5.660 -1.255 1.00 0.00 H new ATOM 0 HB2 ARG B 35 19.210 -3.392 -0.574 1.00 0.00 H new ATOM 0 HB3 ARG B 35 19.868 -4.330 -1.899 1.00 0.00 H new ATOM 0 HG2 ARG B 35 17.239 -4.225 -2.679 1.00 0.00 H new ATOM 0 HG3 ARG B 35 17.340 -2.719 -1.788 1.00 0.00 H new ATOM 0 HD2 ARG B 35 19.236 -1.950 -3.147 1.00 0.00 H new ATOM 0 HD3 ARG B 35 19.413 -3.524 -3.896 1.00 0.00 H new ATOM 0 HE ARG B 35 16.749 -2.989 -4.471 1.00 0.00 H new ATOM 0 HH11 ARG B 35 19.464 -0.777 -4.407 1.00 0.00 H new ATOM 0 HH12 ARG B 35 18.969 0.059 -5.883 1.00 0.00 H new ATOM 0 HH21 ARG B 35 16.238 -2.035 -6.468 1.00 0.00 H new ATOM 0 HH22 ARG B 35 17.168 -0.643 -7.034 1.00 0.00 H new ATOM 1530 N ASP B 36 20.441 -6.412 -0.091 1.00 0.00 N ATOM 1531 CA ASP B 36 21.435 -7.508 -0.091 1.00 0.00 C ATOM 1532 C ASP B 36 20.677 -8.767 0.270 1.00 0.00 C ATOM 1533 O ASP B 36 20.997 -9.862 -0.141 1.00 0.00 O ATOM 1534 CB ASP B 36 22.447 -7.153 1.003 1.00 0.00 C ATOM 1535 CG ASP B 36 23.659 -8.079 0.897 1.00 0.00 C ATOM 1536 OD1 ASP B 36 23.464 -9.245 0.596 1.00 0.00 O ATOM 1537 OD2 ASP B 36 24.762 -7.606 1.119 1.00 0.00 O ATOM 0 H ASP B 36 20.654 -5.630 0.528 1.00 0.00 H new ATOM 0 HA ASP B 36 21.947 -7.648 -1.043 1.00 0.00 H new ATOM 0 HB2 ASP B 36 22.760 -6.114 0.900 1.00 0.00 H new ATOM 0 HB3 ASP B 36 21.986 -7.251 1.986 1.00 0.00 H new ATOM 1542 N TYR B 37 19.625 -8.575 1.011 1.00 0.00 N ATOM 1543 CA TYR B 37 18.750 -9.677 1.409 1.00 0.00 C ATOM 1544 C TYR B 37 17.858 -9.993 0.216 1.00 0.00 C ATOM 1545 O TYR B 37 17.769 -11.111 -0.240 1.00 0.00 O ATOM 1546 CB TYR B 37 17.946 -9.103 2.572 1.00 0.00 C ATOM 1547 CG TYR B 37 16.625 -9.805 2.632 1.00 0.00 C ATOM 1548 CD1 TYR B 37 15.608 -9.397 1.773 1.00 0.00 C ATOM 1549 CD2 TYR B 37 16.441 -10.898 3.481 1.00 0.00 C ATOM 1550 CE1 TYR B 37 14.404 -10.080 1.748 1.00 0.00 C ATOM 1551 CE2 TYR B 37 15.222 -11.580 3.473 1.00 0.00 C ATOM 1552 CZ TYR B 37 14.205 -11.178 2.602 1.00 0.00 C ATOM 1553 OH TYR B 37 13.014 -11.879 2.572 1.00 0.00 O ATOM 0 H TYR B 37 19.337 -7.662 1.363 1.00 0.00 H new ATOM 0 HA TYR B 37 19.262 -10.594 1.701 1.00 0.00 H new ATOM 0 HB2 TYR B 37 18.488 -9.236 3.508 1.00 0.00 H new ATOM 0 HB3 TYR B 37 17.799 -8.031 2.438 1.00 0.00 H new ATOM 0 HD1 TYR B 37 15.759 -8.546 1.125 1.00 0.00 H new ATOM 0 HD2 TYR B 37 17.236 -11.214 4.140 1.00 0.00 H new ATOM 0 HE1 TYR B 37 13.620 -9.770 1.074 1.00 0.00 H new ATOM 0 HE2 TYR B 37 15.065 -12.416 4.138 1.00 0.00 H new ATOM 0 HH TYR B 37 12.657 -11.957 3.481 1.00 0.00 H new ATOM 1563 N CYS B 38 17.219 -8.986 -0.300 1.00 0.00 N ATOM 1564 CA CYS B 38 16.331 -9.169 -1.469 1.00 0.00 C ATOM 1565 C CYS B 38 17.079 -9.923 -2.568 1.00 0.00 C ATOM 1566 O CYS B 38 16.598 -10.904 -3.096 1.00 0.00 O ATOM 1567 CB CYS B 38 15.991 -7.740 -1.881 1.00 0.00 C ATOM 1568 SG CYS B 38 14.597 -7.730 -3.024 1.00 0.00 S ATOM 0 H CYS B 38 17.277 -8.029 0.047 1.00 0.00 H new ATOM 0 HA CYS B 38 15.435 -9.755 -1.263 1.00 0.00 H new ATOM 0 HB2 CYS B 38 15.750 -7.148 -0.998 1.00 0.00 H new ATOM 0 HB3 CYS B 38 16.858 -7.274 -2.350 1.00 0.00 H new ATOM 0 HG CYS B 38 14.251 -8.953 -3.297 1.00 0.00 H new ATOM 1574 N GLU B 39 18.267 -9.502 -2.894 1.00 0.00 N ATOM 1575 CA GLU B 39 19.044 -10.235 -3.921 1.00 0.00 C ATOM 1576 C GLU B 39 19.554 -11.527 -3.298 1.00 0.00 C ATOM 1577 O GLU B 39 20.030 -12.412 -3.982 1.00 0.00 O ATOM 1578 CB GLU B 39 20.207 -9.314 -4.270 1.00 0.00 C ATOM 1579 CG GLU B 39 20.965 -8.991 -2.984 1.00 0.00 C ATOM 1580 CD GLU B 39 22.336 -9.671 -3.010 1.00 0.00 C ATOM 1581 OE1 GLU B 39 22.936 -9.710 -4.073 1.00 0.00 O ATOM 1582 OE2 GLU B 39 22.763 -10.140 -1.968 1.00 0.00 O ATOM 0 H GLU B 39 18.730 -8.686 -2.494 1.00 0.00 H new ATOM 0 HA GLU B 39 18.462 -10.489 -4.807 1.00 0.00 H new ATOM 0 HB2 GLU B 39 20.869 -9.794 -4.991 1.00 0.00 H new ATOM 0 HB3 GLU B 39 19.840 -8.399 -4.735 1.00 0.00 H new ATOM 0 HG2 GLU B 39 21.085 -7.912 -2.882 1.00 0.00 H new ATOM 0 HG3 GLU B 39 20.396 -9.332 -2.119 1.00 0.00 H new ATOM 1589 N LYS B 40 19.408 -11.671 -2.004 1.00 0.00 N ATOM 1590 CA LYS B 40 19.832 -12.933 -1.371 1.00 0.00 C ATOM 1591 C LYS B 40 18.643 -13.849 -1.491 1.00 0.00 C ATOM 1592 O LYS B 40 18.744 -15.046 -1.676 1.00 0.00 O ATOM 1593 CB LYS B 40 20.100 -12.624 0.098 1.00 0.00 C ATOM 1594 CG LYS B 40 20.527 -13.904 0.809 1.00 0.00 C ATOM 1595 CD LYS B 40 21.368 -13.530 2.022 1.00 0.00 C ATOM 1596 CE LYS B 40 20.968 -14.404 3.211 1.00 0.00 C ATOM 1597 NZ LYS B 40 21.454 -15.768 2.865 1.00 0.00 N ATOM 0 H LYS B 40 19.017 -10.971 -1.374 1.00 0.00 H new ATOM 0 HA LYS B 40 20.721 -13.377 -1.819 1.00 0.00 H new ATOM 0 HB2 LYS B 40 20.879 -11.867 0.187 1.00 0.00 H new ATOM 0 HB3 LYS B 40 19.204 -12.215 0.566 1.00 0.00 H new ATOM 0 HG2 LYS B 40 19.651 -14.475 1.118 1.00 0.00 H new ATOM 0 HG3 LYS B 40 21.100 -14.539 0.133 1.00 0.00 H new ATOM 0 HD2 LYS B 40 22.426 -13.664 1.799 1.00 0.00 H new ATOM 0 HD3 LYS B 40 21.224 -12.478 2.266 1.00 0.00 H new ATOM 0 HE2 LYS B 40 21.422 -14.046 4.135 1.00 0.00 H new ATOM 0 HE3 LYS B 40 19.889 -14.396 3.362 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 21.451 -16.364 3.717 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 20.830 -16.187 2.147 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 22.422 -15.707 2.489 1.00 0.00 H new ATOM 1611 N LYS B 41 17.504 -13.237 -1.407 1.00 0.00 N ATOM 1612 CA LYS B 41 16.235 -13.961 -1.533 1.00 0.00 C ATOM 1613 C LYS B 41 16.125 -14.455 -2.944 1.00 0.00 C ATOM 1614 O LYS B 41 16.031 -15.631 -3.233 1.00 0.00 O ATOM 1615 CB LYS B 41 15.176 -12.900 -1.351 1.00 0.00 C ATOM 1616 CG LYS B 41 15.301 -12.149 -0.046 1.00 0.00 C ATOM 1617 CD LYS B 41 16.052 -12.973 0.986 1.00 0.00 C ATOM 1618 CE LYS B 41 15.085 -13.952 1.643 1.00 0.00 C ATOM 1619 NZ LYS B 41 15.949 -14.935 2.355 1.00 0.00 N ATOM 0 H LYS B 41 17.405 -12.234 -1.251 1.00 0.00 H new ATOM 0 HA LYS B 41 16.148 -14.790 -0.830 1.00 0.00 H new ATOM 0 HB2 LYS B 41 15.236 -12.191 -2.177 1.00 0.00 H new ATOM 0 HB3 LYS B 41 14.192 -13.366 -1.401 1.00 0.00 H new ATOM 0 HG2 LYS B 41 15.822 -11.206 -0.213 1.00 0.00 H new ATOM 0 HG3 LYS B 41 14.309 -11.902 0.332 1.00 0.00 H new ATOM 0 HD2 LYS B 41 16.871 -13.514 0.512 1.00 0.00 H new ATOM 0 HD3 LYS B 41 16.495 -12.320 1.738 1.00 0.00 H new ATOM 0 HE2 LYS B 41 14.417 -13.441 2.336 1.00 0.00 H new ATOM 0 HE3 LYS B 41 14.458 -14.445 0.900 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 15.352 -15.641 2.831 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 16.569 -15.412 1.670 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 16.530 -14.439 3.061 1.00 0.00 H new ATOM 1633 N GLY B 42 16.173 -13.509 -3.829 1.00 0.00 N ATOM 1634 CA GLY B 42 16.112 -13.823 -5.257 1.00 0.00 C ATOM 1635 C GLY B 42 15.236 -12.845 -6.037 1.00 0.00 C ATOM 1636 O GLY B 42 14.338 -13.227 -6.757 1.00 0.00 O ATOM 0 H GLY B 42 16.253 -12.516 -3.610 1.00 0.00 H new ATOM 0 HA2 GLY B 42 17.120 -13.812 -5.671 1.00 0.00 H new ATOM 0 HA3 GLY B 42 15.726 -14.834 -5.387 1.00 0.00 H new ATOM 1640 N TRP B 43 15.545 -11.588 -5.952 1.00 0.00 N ATOM 1641 CA TRP B 43 14.805 -10.578 -6.760 1.00 0.00 C ATOM 1642 C TRP B 43 15.869 -9.868 -7.491 1.00 0.00 C ATOM 1643 O TRP B 43 15.869 -9.683 -8.690 1.00 0.00 O ATOM 1644 CB TRP B 43 14.142 -9.513 -5.896 1.00 0.00 C ATOM 1645 CG TRP B 43 13.592 -10.023 -4.621 1.00 0.00 C ATOM 1646 CD1 TRP B 43 14.110 -11.026 -3.913 1.00 0.00 C ATOM 1647 CD2 TRP B 43 12.462 -9.526 -3.837 1.00 0.00 C ATOM 1648 NE1 TRP B 43 13.389 -11.194 -2.798 1.00 0.00 N ATOM 1649 CE2 TRP B 43 12.381 -10.305 -2.676 1.00 0.00 C ATOM 1650 CE3 TRP B 43 11.515 -8.502 -4.005 1.00 0.00 C ATOM 1651 CZ2 TRP B 43 11.433 -10.100 -1.702 1.00 0.00 C ATOM 1652 CZ3 TRP B 43 10.541 -8.279 -3.024 1.00 0.00 C ATOM 1653 CH2 TRP B 43 10.500 -9.075 -1.865 1.00 0.00 C ATOM 0 H TRP B 43 16.281 -11.210 -5.356 1.00 0.00 H new ATOM 0 HA TRP B 43 14.039 -11.070 -7.359 1.00 0.00 H new ATOM 0 HB2 TRP B 43 14.871 -8.732 -5.678 1.00 0.00 H new ATOM 0 HB3 TRP B 43 13.337 -9.048 -6.466 1.00 0.00 H new ATOM 0 HD1 TRP B 43 14.974 -11.610 -4.194 1.00 0.00 H new ATOM 0 HE1 TRP B 43 13.582 -11.921 -2.109 1.00 0.00 H new ATOM 0 HE3 TRP B 43 11.538 -7.886 -4.892 1.00 0.00 H new ATOM 0 HZ2 TRP B 43 11.410 -10.725 -0.821 1.00 0.00 H new ATOM 0 HZ3 TRP B 43 9.816 -7.490 -3.158 1.00 0.00 H new ATOM 0 HH2 TRP B 43 9.752 -8.894 -1.107 1.00 0.00 H new ATOM 1664 N ILE B 44 16.816 -9.518 -6.690 1.00 0.00 N ATOM 1665 CA ILE B 44 18.036 -8.837 -7.123 1.00 0.00 C ATOM 1666 C ILE B 44 17.827 -7.344 -7.213 1.00 0.00 C ATOM 1667 O ILE B 44 18.624 -6.623 -7.781 1.00 0.00 O ATOM 1668 CB ILE B 44 18.396 -9.388 -8.481 1.00 0.00 C ATOM 1669 CG1 ILE B 44 18.216 -10.901 -8.495 1.00 0.00 C ATOM 1670 CG2 ILE B 44 19.858 -9.042 -8.754 1.00 0.00 C ATOM 1671 CD1 ILE B 44 17.679 -11.323 -9.863 1.00 0.00 C ATOM 0 H ILE B 44 16.784 -9.692 -5.685 1.00 0.00 H new ATOM 0 HA ILE B 44 18.834 -9.009 -6.401 1.00 0.00 H new ATOM 0 HB ILE B 44 17.750 -8.957 -9.246 1.00 0.00 H new ATOM 0 HG12 ILE B 44 19.166 -11.396 -8.294 1.00 0.00 H new ATOM 0 HG13 ILE B 44 17.526 -11.206 -7.709 1.00 0.00 H new ATOM 0 HG21 ILE B 44 20.147 -9.429 -9.731 1.00 0.00 H new ATOM 0 HG22 ILE B 44 19.984 -7.959 -8.740 1.00 0.00 H new ATOM 0 HG23 ILE B 44 20.488 -9.491 -7.986 1.00 0.00 H new ATOM 0 HD11 ILE B 44 17.546 -12.405 -9.884 1.00 0.00 H new ATOM 0 HD12 ILE B 44 16.721 -10.836 -10.044 1.00 0.00 H new ATOM 0 HD13 ILE B 44 18.387 -11.029 -10.638 1.00 0.00 H new ATOM 1683 N VAL B 45 16.750 -6.898 -6.667 1.00 0.00 N ATOM 1684 CA VAL B 45 16.410 -5.448 -6.691 1.00 0.00 C ATOM 1685 C VAL B 45 17.682 -4.600 -6.706 1.00 0.00 C ATOM 1686 O VAL B 45 18.570 -4.783 -5.897 1.00 0.00 O ATOM 1687 CB VAL B 45 15.640 -5.224 -5.405 1.00 0.00 C ATOM 1688 CG1 VAL B 45 14.276 -5.915 -5.485 1.00 0.00 C ATOM 1689 CG2 VAL B 45 16.450 -5.783 -4.235 1.00 0.00 C ATOM 0 H VAL B 45 16.066 -7.485 -6.190 1.00 0.00 H new ATOM 0 HA VAL B 45 15.838 -5.168 -7.576 1.00 0.00 H new ATOM 0 HB VAL B 45 15.477 -4.157 -5.255 1.00 0.00 H new ATOM 0 HG11 VAL B 45 13.729 -5.749 -4.557 1.00 0.00 H new ATOM 0 HG12 VAL B 45 13.708 -5.503 -6.319 1.00 0.00 H new ATOM 0 HG13 VAL B 45 14.419 -6.985 -5.636 1.00 0.00 H new ATOM 0 HG21 VAL B 45 15.903 -5.626 -3.306 1.00 0.00 H new ATOM 0 HG22 VAL B 45 16.614 -6.850 -4.383 1.00 0.00 H new ATOM 0 HG23 VAL B 45 17.411 -5.272 -4.181 1.00 0.00 H new ATOM 1699 N ASN B 46 17.791 -3.694 -7.631 1.00 0.00 N ATOM 1700 CA ASN B 46 19.024 -2.868 -7.703 1.00 0.00 C ATOM 1701 C ASN B 46 18.758 -1.568 -8.467 1.00 0.00 C ATOM 1702 O ASN B 46 17.814 -1.461 -9.224 1.00 0.00 O ATOM 1703 CB ASN B 46 20.007 -3.758 -8.460 1.00 0.00 C ATOM 1704 CG ASN B 46 21.424 -3.196 -8.347 1.00 0.00 C ATOM 1705 OD1 ASN B 46 21.618 -2.079 -7.908 1.00 0.00 O ATOM 1706 ND2 ASN B 46 22.430 -3.935 -8.729 1.00 0.00 N ATOM 0 H ASN B 46 17.084 -3.489 -8.337 1.00 0.00 H new ATOM 0 HA ASN B 46 19.396 -2.568 -6.723 1.00 0.00 H new ATOM 0 HB2 ASN B 46 19.976 -4.770 -8.057 1.00 0.00 H new ATOM 0 HB3 ASN B 46 19.716 -3.823 -9.509 1.00 0.00 H new ATOM 0 HD21 ASN B 46 23.382 -3.576 -8.660 1.00 0.00 H new ATOM 0 HD22 ASN B 46 22.264 -4.872 -9.097 1.00 0.00 H new ATOM 1713 N ILE B 47 19.585 -0.576 -8.271 1.00 0.00 N ATOM 1714 CA ILE B 47 19.382 0.720 -8.980 1.00 0.00 C ATOM 1715 C ILE B 47 19.194 0.480 -10.481 1.00 0.00 C ATOM 1716 O ILE B 47 20.147 0.363 -11.226 1.00 0.00 O ATOM 1717 CB ILE B 47 20.659 1.517 -8.717 1.00 0.00 C ATOM 1718 CG1 ILE B 47 20.547 2.893 -9.377 1.00 0.00 C ATOM 1719 CG2 ILE B 47 21.859 0.771 -9.302 1.00 0.00 C ATOM 1720 CD1 ILE B 47 19.889 3.874 -8.405 1.00 0.00 C ATOM 0 H ILE B 47 20.393 -0.608 -7.650 1.00 0.00 H new ATOM 0 HA ILE B 47 18.494 1.248 -8.632 1.00 0.00 H new ATOM 0 HB ILE B 47 20.794 1.637 -7.642 1.00 0.00 H new ATOM 0 HG12 ILE B 47 21.536 3.254 -9.660 1.00 0.00 H new ATOM 0 HG13 ILE B 47 19.959 2.822 -10.292 1.00 0.00 H new ATOM 0 HG21 ILE B 47 22.769 1.341 -9.114 1.00 0.00 H new ATOM 0 HG22 ILE B 47 21.941 -0.210 -8.833 1.00 0.00 H new ATOM 0 HG23 ILE B 47 21.723 0.649 -10.377 1.00 0.00 H new ATOM 0 HD11 ILE B 47 19.809 4.854 -8.875 1.00 0.00 H new ATOM 0 HD12 ILE B 47 18.894 3.515 -8.144 1.00 0.00 H new ATOM 0 HD13 ILE B 47 20.495 3.953 -7.502 1.00 0.00 H new ATOM 1732 N THR B 48 17.970 0.406 -10.932 1.00 0.00 N ATOM 1733 CA THR B 48 17.723 0.173 -12.386 1.00 0.00 C ATOM 1734 C THR B 48 18.244 1.353 -13.209 1.00 0.00 C ATOM 1735 O THR B 48 17.545 2.321 -13.438 1.00 0.00 O ATOM 1736 CB THR B 48 16.203 0.058 -12.521 1.00 0.00 C ATOM 1737 OG1 THR B 48 15.746 -1.066 -11.781 1.00 0.00 O ATOM 1738 CG2 THR B 48 15.834 -0.112 -13.996 1.00 0.00 C ATOM 0 H THR B 48 17.132 0.497 -10.358 1.00 0.00 H new ATOM 0 HA THR B 48 18.233 -0.719 -12.750 1.00 0.00 H new ATOM 0 HB THR B 48 15.733 0.961 -12.133 1.00 0.00 H new ATOM 0 HG1 THR B 48 14.772 -1.139 -11.865 1.00 0.00 H new ATOM 0 HG21 THR B 48 14.751 -0.194 -14.093 1.00 0.00 H new ATOM 0 HG22 THR B 48 16.185 0.752 -14.561 1.00 0.00 H new ATOM 0 HG23 THR B 48 16.303 -1.015 -14.387 1.00 0.00 H new ATOM 1746 N SER B 49 19.465 1.280 -13.661 1.00 0.00 N ATOM 1747 CA SER B 49 20.028 2.393 -14.476 1.00 0.00 C ATOM 1748 C SER B 49 20.580 1.848 -15.794 1.00 0.00 C ATOM 1749 O SER B 49 21.228 2.548 -16.546 1.00 0.00 O ATOM 1750 CB SER B 49 21.152 2.977 -13.624 1.00 0.00 C ATOM 1751 OG SER B 49 22.352 2.258 -13.875 1.00 0.00 O ATOM 0 H SER B 49 20.098 0.497 -13.501 1.00 0.00 H new ATOM 0 HA SER B 49 19.279 3.143 -14.729 1.00 0.00 H new ATOM 0 HB2 SER B 49 21.291 4.032 -13.858 1.00 0.00 H new ATOM 0 HB3 SER B 49 20.892 2.916 -12.567 1.00 0.00 H new ATOM 0 HG SER B 49 23.077 2.631 -13.331 1.00 0.00 H new ATOM 1757 N GLN B 50 20.328 0.598 -16.078 1.00 0.00 N ATOM 1758 CA GLN B 50 20.839 0.002 -17.345 1.00 0.00 C ATOM 1759 C GLN B 50 19.705 -0.121 -18.366 1.00 0.00 C ATOM 1760 O GLN B 50 19.569 -1.125 -19.037 1.00 0.00 O ATOM 1761 CB GLN B 50 21.353 -1.383 -16.950 1.00 0.00 C ATOM 1762 CG GLN B 50 22.637 -1.690 -17.721 1.00 0.00 C ATOM 1763 CD GLN B 50 23.826 -1.046 -17.004 1.00 0.00 C ATOM 1764 OE1 GLN B 50 24.228 0.052 -17.337 1.00 0.00 O ATOM 1765 NE2 GLN B 50 24.408 -1.686 -16.027 1.00 0.00 N ATOM 0 H GLN B 50 19.790 -0.036 -15.487 1.00 0.00 H new ATOM 0 HA GLN B 50 21.617 0.612 -17.804 1.00 0.00 H new ATOM 0 HB2 GLN B 50 21.543 -1.420 -15.877 1.00 0.00 H new ATOM 0 HB3 GLN B 50 20.597 -2.138 -17.166 1.00 0.00 H new ATOM 0 HG2 GLN B 50 22.782 -2.768 -17.793 1.00 0.00 H new ATOM 0 HG3 GLN B 50 22.563 -1.309 -18.740 1.00 0.00 H new ATOM 0 HE21 GLN B 50 24.070 -2.607 -15.748 1.00 0.00 H new ATOM 0 HE22 GLN B 50 25.201 -1.265 -15.542 1.00 0.00 H new ATOM 1774 N VAL B 51 18.891 0.891 -18.490 1.00 0.00 N ATOM 1775 CA VAL B 51 17.768 0.825 -19.470 1.00 0.00 C ATOM 1776 C VAL B 51 18.198 1.446 -20.801 1.00 0.00 C ATOM 1777 O VAL B 51 19.321 1.880 -20.960 1.00 0.00 O ATOM 1778 CB VAL B 51 16.636 1.634 -18.837 1.00 0.00 C ATOM 1779 CG1 VAL B 51 15.320 1.321 -19.553 1.00 0.00 C ATOM 1780 CG2 VAL B 51 16.509 1.261 -17.359 1.00 0.00 C ATOM 0 H VAL B 51 18.954 1.759 -17.957 1.00 0.00 H new ATOM 0 HA VAL B 51 17.461 -0.200 -19.681 1.00 0.00 H new ATOM 0 HB VAL B 51 16.856 2.698 -18.929 1.00 0.00 H new ATOM 0 HG11 VAL B 51 14.514 1.898 -19.101 1.00 0.00 H new ATOM 0 HG12 VAL B 51 15.408 1.584 -20.607 1.00 0.00 H new ATOM 0 HG13 VAL B 51 15.100 0.257 -19.462 1.00 0.00 H new ATOM 0 HG21 VAL B 51 15.702 1.837 -16.906 1.00 0.00 H new ATOM 0 HG22 VAL B 51 16.289 0.197 -17.270 1.00 0.00 H new ATOM 0 HG23 VAL B 51 17.445 1.483 -16.846 1.00 0.00 H new ATOM 1790 N GLN B 52 17.315 1.486 -21.761 1.00 0.00 N ATOM 1791 CA GLN B 52 17.676 2.074 -23.084 1.00 0.00 C ATOM 1792 C GLN B 52 17.534 3.598 -23.048 1.00 0.00 C ATOM 1793 O GLN B 52 17.737 4.273 -24.039 1.00 0.00 O ATOM 1794 CB GLN B 52 16.681 1.465 -24.074 1.00 0.00 C ATOM 1795 CG GLN B 52 16.508 -0.027 -23.780 1.00 0.00 C ATOM 1796 CD GLN B 52 16.468 -0.807 -25.096 1.00 0.00 C ATOM 1797 OE1 GLN B 52 17.233 -1.731 -25.292 1.00 0.00 O ATOM 1798 NE2 GLN B 52 15.603 -0.472 -26.014 1.00 0.00 N ATOM 0 H GLN B 52 16.359 1.137 -21.687 1.00 0.00 H new ATOM 0 HA GLN B 52 18.709 1.861 -23.360 1.00 0.00 H new ATOM 0 HB2 GLN B 52 15.720 1.974 -23.998 1.00 0.00 H new ATOM 0 HB3 GLN B 52 17.037 1.605 -25.095 1.00 0.00 H new ATOM 0 HG2 GLN B 52 17.330 -0.383 -23.159 1.00 0.00 H new ATOM 0 HG3 GLN B 52 15.589 -0.193 -23.219 1.00 0.00 H new ATOM 0 HE21 GLN B 52 14.960 0.303 -25.851 1.00 0.00 H new ATOM 0 HE22 GLN B 52 15.569 -0.985 -26.895 1.00 0.00 H new ATOM 1807 N THR B 53 17.188 4.147 -21.916 1.00 0.00 N ATOM 1808 CA THR B 53 17.035 5.627 -21.822 1.00 0.00 C ATOM 1809 C THR B 53 18.359 6.320 -22.161 1.00 0.00 C ATOM 1810 O THR B 53 19.106 6.716 -21.289 1.00 0.00 O ATOM 1811 CB THR B 53 16.649 5.893 -20.367 1.00 0.00 C ATOM 1812 OG1 THR B 53 16.579 7.295 -20.146 1.00 0.00 O ATOM 1813 CG2 THR B 53 17.698 5.280 -19.439 1.00 0.00 C ATOM 0 H THR B 53 17.005 3.636 -21.053 1.00 0.00 H new ATOM 0 HA THR B 53 16.289 6.010 -22.519 1.00 0.00 H new ATOM 0 HB THR B 53 15.678 5.443 -20.160 1.00 0.00 H new ATOM 0 HG1 THR B 53 16.330 7.467 -19.214 1.00 0.00 H new ATOM 0 HG21 THR B 53 17.422 5.470 -18.402 1.00 0.00 H new ATOM 0 HG22 THR B 53 17.750 4.205 -19.609 1.00 0.00 H new ATOM 0 HG23 THR B 53 18.671 5.728 -19.643 1.00 0.00 H new ATOM 1821 N GLU B 54 18.652 6.467 -23.425 1.00 0.00 N ATOM 1822 CA GLU B 54 19.925 7.134 -23.823 1.00 0.00 C ATOM 1823 C GLU B 54 19.743 7.853 -25.162 1.00 0.00 C ATOM 1824 O GLU B 54 20.448 7.594 -26.119 1.00 0.00 O ATOM 1825 CB GLU B 54 20.940 5.998 -23.957 1.00 0.00 C ATOM 1826 CG GLU B 54 22.331 6.581 -24.213 1.00 0.00 C ATOM 1827 CD GLU B 54 22.823 7.308 -22.960 1.00 0.00 C ATOM 1828 OE1 GLU B 54 22.789 6.708 -21.899 1.00 0.00 O ATOM 1829 OE2 GLU B 54 23.224 8.453 -23.083 1.00 0.00 O ATOM 0 H GLU B 54 18.065 6.154 -24.199 1.00 0.00 H new ATOM 0 HA GLU B 54 20.246 7.883 -23.100 1.00 0.00 H new ATOM 0 HB2 GLU B 54 20.949 5.395 -23.049 1.00 0.00 H new ATOM 0 HB3 GLU B 54 20.655 5.337 -24.776 1.00 0.00 H new ATOM 0 HG2 GLU B 54 23.026 5.785 -24.480 1.00 0.00 H new ATOM 0 HG3 GLU B 54 22.297 7.271 -25.056 1.00 0.00 H new ATOM 1836 N ARG B 55 18.803 8.753 -25.239 1.00 0.00 N ATOM 1837 CA ARG B 55 18.573 9.487 -26.516 1.00 0.00 C ATOM 1838 C ARG B 55 19.754 10.414 -26.817 1.00 0.00 C ATOM 1839 O ARG B 55 19.933 10.864 -27.932 1.00 0.00 O ATOM 1840 CB ARG B 55 17.301 10.301 -26.280 1.00 0.00 C ATOM 1841 CG ARG B 55 16.106 9.562 -26.886 1.00 0.00 C ATOM 1842 CD ARG B 55 14.896 10.498 -26.932 1.00 0.00 C ATOM 1843 NE ARG B 55 13.830 9.781 -26.179 1.00 0.00 N ATOM 1844 CZ ARG B 55 12.590 10.174 -26.272 1.00 0.00 C ATOM 1845 NH1 ARG B 55 11.991 10.178 -27.432 1.00 0.00 N ATOM 1846 NH2 ARG B 55 11.946 10.564 -25.205 1.00 0.00 N ATOM 0 H ARG B 55 18.183 9.013 -24.472 1.00 0.00 H new ATOM 0 HA ARG B 55 18.475 8.813 -27.367 1.00 0.00 H new ATOM 0 HB2 ARG B 55 17.146 10.452 -25.212 1.00 0.00 H new ATOM 0 HB3 ARG B 55 17.399 11.289 -26.731 1.00 0.00 H new ATOM 0 HG2 ARG B 55 16.350 9.216 -27.891 1.00 0.00 H new ATOM 0 HG3 ARG B 55 15.873 8.678 -26.293 1.00 0.00 H new ATOM 0 HD2 ARG B 55 15.123 11.461 -26.475 1.00 0.00 H new ATOM 0 HD3 ARG B 55 14.589 10.697 -27.959 1.00 0.00 H new ATOM 0 HE ARG B 55 14.070 8.983 -25.591 1.00 0.00 H new ATOM 0 HH11 ARG B 55 12.493 9.874 -28.266 1.00 0.00 H new ATOM 0 HH12 ARG B 55 11.021 10.485 -27.504 1.00 0.00 H new ATOM 0 HH21 ARG B 55 12.413 10.561 -24.298 1.00 0.00 H new ATOM 0 HH22 ARG B 55 10.976 10.871 -25.278 1.00 0.00 H new ATOM 1860 N ASN B 56 20.559 10.704 -25.834 1.00 0.00 N ATOM 1861 CA ASN B 56 21.725 11.603 -26.067 1.00 0.00 C ATOM 1862 C ASN B 56 23.005 10.778 -26.230 1.00 0.00 C ATOM 1863 O ASN B 56 23.211 9.793 -25.551 1.00 0.00 O ATOM 1864 CB ASN B 56 21.806 12.480 -24.818 1.00 0.00 C ATOM 1865 CG ASN B 56 20.506 13.273 -24.663 1.00 0.00 C ATOM 1866 OD1 ASN B 56 19.825 13.541 -25.633 1.00 0.00 O ATOM 1867 ND2 ASN B 56 20.131 13.664 -23.476 1.00 0.00 N ATOM 0 H ASN B 56 20.461 10.358 -24.879 1.00 0.00 H new ATOM 0 HA ASN B 56 21.614 12.197 -26.974 1.00 0.00 H new ATOM 0 HB2 ASN B 56 21.974 11.861 -23.937 1.00 0.00 H new ATOM 0 HB3 ASN B 56 22.653 13.162 -24.894 1.00 0.00 H new ATOM 0 HD21 ASN B 56 19.267 14.194 -23.363 1.00 0.00 H new ATOM 0 HD22 ASN B 56 20.702 13.440 -22.661 1.00 0.00 H new ATOM 1874 N ILE B 57 23.866 11.177 -27.125 1.00 0.00 N ATOM 1875 CA ILE B 57 25.132 10.419 -27.332 1.00 0.00 C ATOM 1876 C ILE B 57 26.308 11.187 -26.725 1.00 0.00 C ATOM 1877 O ILE B 57 26.211 12.364 -26.439 1.00 0.00 O ATOM 1878 CB ILE B 57 25.284 10.310 -28.848 1.00 0.00 C ATOM 1879 CG1 ILE B 57 25.369 11.713 -29.454 1.00 0.00 C ATOM 1880 CG2 ILE B 57 24.075 9.576 -29.430 1.00 0.00 C ATOM 1881 CD1 ILE B 57 26.244 11.675 -30.708 1.00 0.00 C ATOM 0 H ILE B 57 23.748 11.995 -27.722 1.00 0.00 H new ATOM 0 HA ILE B 57 25.113 9.439 -26.855 1.00 0.00 H new ATOM 0 HB ILE B 57 26.193 9.757 -29.083 1.00 0.00 H new ATOM 0 HG12 ILE B 57 24.371 12.073 -29.705 1.00 0.00 H new ATOM 0 HG13 ILE B 57 25.787 12.410 -28.727 1.00 0.00 H new ATOM 0 HG21 ILE B 57 24.183 9.498 -30.512 1.00 0.00 H new ATOM 0 HG22 ILE B 57 24.013 8.577 -28.998 1.00 0.00 H new ATOM 0 HG23 ILE B 57 23.166 10.129 -29.195 1.00 0.00 H new ATOM 0 HD11 ILE B 57 26.305 12.674 -31.140 1.00 0.00 H new ATOM 0 HD12 ILE B 57 27.244 11.333 -30.443 1.00 0.00 H new ATOM 0 HD13 ILE B 57 25.807 10.991 -31.436 1.00 0.00 H new ATOM 1893 N ASN B 58 27.419 10.533 -26.524 1.00 0.00 N ATOM 1894 CA ASN B 58 28.598 11.231 -25.935 1.00 0.00 C ATOM 1895 C ASN B 58 29.379 11.967 -27.026 1.00 0.00 C ATOM 1896 O ASN B 58 29.663 11.423 -28.074 1.00 0.00 O ATOM 1897 CB ASN B 58 29.449 10.120 -25.321 1.00 0.00 C ATOM 1898 CG ASN B 58 28.632 9.375 -24.264 1.00 0.00 C ATOM 1899 OD1 ASN B 58 27.463 9.649 -24.079 1.00 0.00 O ATOM 1900 ND2 ASN B 58 29.202 8.437 -23.557 1.00 0.00 N ATOM 0 H ASN B 58 27.562 9.547 -26.742 1.00 0.00 H new ATOM 0 HA ASN B 58 28.309 11.978 -25.196 1.00 0.00 H new ATOM 0 HB2 ASN B 58 29.777 9.428 -26.097 1.00 0.00 H new ATOM 0 HB3 ASN B 58 30.347 10.542 -24.870 1.00 0.00 H new ATOM 0 HD21 ASN B 58 28.666 7.934 -22.850 1.00 0.00 H new ATOM 0 HD22 ASN B 58 30.183 8.207 -23.712 1.00 0.00 H new ATOM 1907 N ARG B 59 29.726 13.203 -26.789 1.00 0.00 N ATOM 1908 CA ARG B 59 30.488 13.974 -27.813 1.00 0.00 C ATOM 1909 C ARG B 59 31.990 13.727 -27.651 1.00 0.00 C ATOM 1910 O ARG B 59 32.412 12.686 -27.189 1.00 0.00 O ATOM 1911 CB ARG B 59 30.157 15.441 -27.537 1.00 0.00 C ATOM 1912 CG ARG B 59 30.738 15.849 -26.181 1.00 0.00 C ATOM 1913 CD ARG B 59 29.601 16.248 -25.239 1.00 0.00 C ATOM 1914 NE ARG B 59 30.021 15.756 -23.898 1.00 0.00 N ATOM 1915 CZ ARG B 59 29.151 15.182 -23.112 1.00 0.00 C ATOM 1916 NH1 ARG B 59 27.917 15.608 -23.082 1.00 0.00 N ATOM 1917 NH2 ARG B 59 29.514 14.183 -22.354 1.00 0.00 N ATOM 0 H ARG B 59 29.515 13.712 -25.931 1.00 0.00 H new ATOM 0 HA ARG B 59 30.223 13.681 -28.829 1.00 0.00 H new ATOM 0 HB2 ARG B 59 30.568 16.072 -28.325 1.00 0.00 H new ATOM 0 HB3 ARG B 59 29.077 15.588 -27.541 1.00 0.00 H new ATOM 0 HG2 ARG B 59 31.306 15.023 -25.753 1.00 0.00 H new ATOM 0 HG3 ARG B 59 31.431 16.681 -26.306 1.00 0.00 H new ATOM 0 HD2 ARG B 59 29.453 17.328 -25.235 1.00 0.00 H new ATOM 0 HD3 ARG B 59 28.657 15.798 -25.547 1.00 0.00 H new ATOM 0 HE ARG B 59 30.988 15.867 -23.594 1.00 0.00 H new ATOM 0 HH11 ARG B 59 27.633 16.389 -23.673 1.00 0.00 H new ATOM 0 HH12 ARG B 59 27.237 15.159 -22.468 1.00 0.00 H new ATOM 0 HH21 ARG B 59 30.478 13.850 -22.376 1.00 0.00 H new ATOM 0 HH22 ARG B 59 28.834 13.735 -21.740 1.00 0.00 H new ATOM 1931 N ALA B 60 32.800 14.678 -28.030 1.00 0.00 N ATOM 1932 CA ALA B 60 34.274 14.501 -27.898 1.00 0.00 C ATOM 1933 C ALA B 60 34.994 15.817 -28.201 1.00 0.00 C ATOM 1934 O ALA B 60 34.964 16.694 -27.355 1.00 0.00 O ATOM 1935 CB ALA B 60 34.637 13.439 -28.938 1.00 0.00 C ATOM 1936 OXT ALA B 60 35.564 15.924 -29.275 1.00 0.00 O ATOM 0 H ALA B 60 32.504 15.570 -28.426 1.00 0.00 H new ATOM 0 HA ALA B 60 34.567 14.204 -26.891 1.00 0.00 H new ATOM 0 HB1 ALA B 60 35.710 13.250 -28.906 1.00 0.00 H new ATOM 0 HB2 ALA B 60 34.099 12.517 -28.719 1.00 0.00 H new ATOM 0 HB3 ALA B 60 34.361 13.793 -29.931 1.00 0.00 H new TER 1942 ALA B 60