USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1024 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 MET CE :methyl 168:sc= 0 (180deg=-0.166) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.135) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 170:sc= -0.0555 (180deg=-0.114) USER MOD Single : A 23 ASN : amide:sc= -1.13 K(o=-1.1,f=-2.1!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot -173:sc= -2.06 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 4:sc= 0.726 USER MOD Single : A 35 ASN : amide:sc= -0.829 K(o=-0.83,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 TYR OH : rot -6:sc= 0.689 USER MOD Single : A 40 LYS NZ :NH3+ 159:sc= -2.1 (180deg=-2.94!) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -146:sc= 0 (180deg=-1.13) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 74:sc= 0.138 USER MOD Single : A 62 TYR OH : rot -54:sc= -1.29 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -1.9 K(o=-1.9,f=-4.7!) USER MOD Single : A 79 TYR OH : rot 130:sc= 0 USER MOD Single : A 84 MET CE :methyl 177:sc= -2.42! (180deg=-2.61!) USER MOD Single : A 97 ASN : amide:sc= -3.22 K(o=-3.2,f=-5.8!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -7.67 K(o=-7.7,f=-9.7!) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 80:sc= 1.05 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot 180:sc= -0.385 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= 0.969 K(o=0.97,f=-0.0017) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 8 5.165 -4.861 -27.456 1.00 0.00 N ATOM 2 CA LYS A 8 5.670 -4.849 -26.058 1.00 0.00 C ATOM 3 C LYS A 8 4.522 -4.775 -25.057 1.00 0.00 C ATOM 4 O LYS A 8 3.698 -3.861 -25.110 1.00 0.00 O ATOM 5 CB LYS A 8 6.599 -3.646 -25.886 1.00 0.00 C ATOM 6 CG LYS A 8 7.882 -3.748 -26.697 1.00 0.00 C ATOM 7 CD LYS A 8 8.737 -2.501 -26.545 1.00 0.00 C ATOM 8 CE LYS A 8 9.547 -2.224 -27.801 1.00 0.00 C ATOM 9 NZ LYS A 8 10.942 -2.736 -27.686 1.00 0.00 N ATOM 0 HA LYS A 8 6.213 -5.774 -25.866 1.00 0.00 H new ATOM 0 HB2 LYS A 8 6.066 -2.741 -26.177 1.00 0.00 H new ATOM 0 HB3 LYS A 8 6.853 -3.541 -24.831 1.00 0.00 H new ATOM 0 HG2 LYS A 8 8.449 -4.621 -26.374 1.00 0.00 H new ATOM 0 HG3 LYS A 8 7.638 -3.897 -27.749 1.00 0.00 H new ATOM 0 HD2 LYS A 8 8.098 -1.645 -26.327 1.00 0.00 H new ATOM 0 HD3 LYS A 8 9.410 -2.621 -25.696 1.00 0.00 H new ATOM 0 HE2 LYS A 8 9.059 -2.689 -28.658 1.00 0.00 H new ATOM 0 HE3 LYS A 8 9.568 -1.151 -27.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 11.462 -2.528 -28.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 11.416 -2.274 -26.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 10.923 -3.764 -27.531 1.00 0.00 H new ATOM 25 N MET A 9 4.473 -5.742 -24.147 1.00 0.00 N ATOM 26 CA MET A 9 3.425 -5.785 -23.133 1.00 0.00 C ATOM 27 C MET A 9 3.845 -5.022 -21.882 1.00 0.00 C ATOM 28 O MET A 9 5.002 -4.623 -21.744 1.00 0.00 O ATOM 29 CB MET A 9 3.094 -7.236 -22.776 1.00 0.00 C ATOM 30 CG MET A 9 1.608 -7.488 -22.574 1.00 0.00 C ATOM 31 SD MET A 9 1.087 -9.099 -23.193 1.00 0.00 S ATOM 32 CE MET A 9 2.193 -10.182 -22.293 1.00 0.00 C ATOM 0 H MET A 9 5.146 -6.506 -24.091 1.00 0.00 H new ATOM 0 HA MET A 9 2.536 -5.307 -23.543 1.00 0.00 H new ATOM 0 HB2 MET A 9 3.461 -7.889 -23.568 1.00 0.00 H new ATOM 0 HB3 MET A 9 3.628 -7.508 -21.865 1.00 0.00 H new ATOM 0 HG2 MET A 9 1.372 -7.418 -21.512 1.00 0.00 H new ATOM 0 HG3 MET A 9 1.039 -6.708 -23.079 1.00 0.00 H new ATOM 0 HE1 MET A 9 1.859 -11.214 -22.401 1.00 0.00 H new ATOM 0 HE2 MET A 9 3.203 -10.084 -22.692 1.00 0.00 H new ATOM 0 HE3 MET A 9 2.191 -9.909 -21.238 1.00 0.00 H new ATOM 42 N SER A 10 2.898 -4.822 -20.971 1.00 0.00 N ATOM 43 CA SER A 10 3.169 -4.106 -19.730 1.00 0.00 C ATOM 44 C SER A 10 2.794 -4.955 -18.519 1.00 0.00 C ATOM 45 O SER A 10 1.829 -5.719 -18.557 1.00 0.00 O ATOM 46 CB SER A 10 2.399 -2.784 -19.701 1.00 0.00 C ATOM 47 OG SER A 10 3.254 -1.690 -19.990 1.00 0.00 O ATOM 0 H SER A 10 1.936 -5.146 -21.069 1.00 0.00 H new ATOM 0 HA SER A 10 4.238 -3.896 -19.686 1.00 0.00 H new ATOM 0 HB2 SER A 10 1.587 -2.817 -20.427 1.00 0.00 H new ATOM 0 HB3 SER A 10 1.945 -2.645 -18.720 1.00 0.00 H new ATOM 0 HG SER A 10 2.738 -0.857 -19.967 1.00 0.00 H new ATOM 53 N GLU A 11 3.565 -4.816 -17.445 1.00 0.00 N ATOM 54 CA GLU A 11 3.316 -5.570 -16.221 1.00 0.00 C ATOM 55 C GLU A 11 2.735 -4.669 -15.136 1.00 0.00 C ATOM 56 O GLU A 11 3.392 -3.735 -14.675 1.00 0.00 O ATOM 57 CB GLU A 11 4.611 -6.217 -15.726 1.00 0.00 C ATOM 58 CG GLU A 11 5.792 -5.264 -15.693 1.00 0.00 C ATOM 59 CD GLU A 11 7.027 -5.886 -15.071 1.00 0.00 C ATOM 60 OE1 GLU A 11 7.104 -5.935 -13.826 1.00 0.00 O ATOM 61 OE2 GLU A 11 7.917 -6.324 -15.829 1.00 0.00 O ATOM 0 H GLU A 11 4.367 -4.188 -17.397 1.00 0.00 H new ATOM 0 HA GLU A 11 2.590 -6.351 -16.445 1.00 0.00 H new ATOM 0 HB2 GLU A 11 4.448 -6.616 -14.725 1.00 0.00 H new ATOM 0 HB3 GLU A 11 4.854 -7.062 -16.370 1.00 0.00 H new ATOM 0 HG2 GLU A 11 6.024 -4.943 -16.709 1.00 0.00 H new ATOM 0 HG3 GLU A 11 5.518 -4.371 -15.132 1.00 0.00 H new ATOM 68 N LYS A 12 1.502 -4.955 -14.732 1.00 0.00 N ATOM 69 CA LYS A 12 0.835 -4.170 -13.701 1.00 0.00 C ATOM 70 C LYS A 12 -0.251 -4.989 -13.009 1.00 0.00 C ATOM 71 O LYS A 12 -1.111 -5.575 -13.665 1.00 0.00 O ATOM 72 CB LYS A 12 0.227 -2.904 -14.309 1.00 0.00 C ATOM 73 CG LYS A 12 1.052 -1.651 -14.059 1.00 0.00 C ATOM 74 CD LYS A 12 0.376 -0.722 -13.061 1.00 0.00 C ATOM 75 CE LYS A 12 0.356 0.714 -13.560 1.00 0.00 C ATOM 76 NZ LYS A 12 1.728 1.224 -13.840 1.00 0.00 N ATOM 0 H LYS A 12 0.945 -5.725 -15.103 1.00 0.00 H new ATOM 0 HA LYS A 12 1.579 -3.887 -12.957 1.00 0.00 H new ATOM 0 HB2 LYS A 12 0.114 -3.046 -15.384 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -0.773 -2.758 -13.899 1.00 0.00 H new ATOM 0 HG2 LYS A 12 2.037 -1.932 -13.685 1.00 0.00 H new ATOM 0 HG3 LYS A 12 1.207 -1.123 -15.000 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -0.645 -1.060 -12.882 1.00 0.00 H new ATOM 0 HD3 LYS A 12 0.900 -0.769 -12.106 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -0.246 0.775 -14.467 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -0.123 1.350 -12.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 1.714 2.264 -13.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 2.377 0.902 -13.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 2.052 0.862 -14.760 1.00 0.00 H new ATOM 90 N LEU A 13 -0.207 -5.020 -11.680 1.00 0.00 N ATOM 91 CA LEU A 13 -1.190 -5.765 -10.902 1.00 0.00 C ATOM 92 C LEU A 13 -2.513 -5.010 -10.843 1.00 0.00 C ATOM 93 O LEU A 13 -2.536 -3.781 -10.781 1.00 0.00 O ATOM 94 CB LEU A 13 -0.668 -6.018 -9.486 1.00 0.00 C ATOM 95 CG LEU A 13 -1.622 -6.791 -8.573 1.00 0.00 C ATOM 96 CD1 LEU A 13 -1.408 -8.289 -8.727 1.00 0.00 C ATOM 97 CD2 LEU A 13 -1.432 -6.367 -7.124 1.00 0.00 C ATOM 0 H LEU A 13 0.498 -4.539 -11.121 1.00 0.00 H new ATOM 0 HA LEU A 13 -1.358 -6.724 -11.393 1.00 0.00 H new ATOM 0 HB2 LEU A 13 0.271 -6.568 -9.554 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -0.442 -5.058 -9.021 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.646 -6.559 -8.866 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.094 -8.824 -8.071 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.595 -8.579 -9.761 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -0.381 -8.539 -8.460 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -2.118 -6.926 -6.488 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.406 -6.570 -6.817 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.636 -5.301 -7.027 1.00 0.00 H new ATOM 109 N ARG A 14 -3.614 -5.752 -10.865 1.00 0.00 N ATOM 110 CA ARG A 14 -4.940 -5.149 -10.818 1.00 0.00 C ATOM 111 C ARG A 14 -5.213 -4.527 -9.453 1.00 0.00 C ATOM 112 O ARG A 14 -5.524 -5.225 -8.489 1.00 0.00 O ATOM 113 CB ARG A 14 -6.013 -6.189 -11.138 1.00 0.00 C ATOM 114 CG ARG A 14 -5.846 -6.834 -12.505 1.00 0.00 C ATOM 115 CD ARG A 14 -6.853 -6.293 -13.508 1.00 0.00 C ATOM 116 NE ARG A 14 -6.259 -6.090 -14.827 1.00 0.00 N ATOM 117 CZ ARG A 14 -5.565 -5.006 -15.170 1.00 0.00 C ATOM 118 NH1 ARG A 14 -5.373 -4.026 -14.296 1.00 0.00 N ATOM 119 NH2 ARG A 14 -5.060 -4.902 -16.392 1.00 0.00 N ATOM 0 H ARG A 14 -3.615 -6.771 -10.915 1.00 0.00 H new ATOM 0 HA ARG A 14 -4.973 -4.360 -11.569 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -5.994 -6.966 -10.374 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -6.993 -5.715 -11.086 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -4.835 -6.655 -12.871 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -5.966 -7.914 -12.415 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -7.690 -6.986 -13.591 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -7.256 -5.348 -13.143 1.00 0.00 H new ATOM 0 HE ARG A 14 -6.383 -6.822 -15.527 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -5.758 -4.100 -13.354 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -4.840 -3.199 -14.566 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -5.203 -5.652 -17.069 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -4.529 -4.072 -16.655 1.00 0.00 H new ATOM 133 N ILE A 15 -5.092 -3.208 -9.383 1.00 0.00 N ATOM 134 CA ILE A 15 -5.322 -2.479 -8.147 1.00 0.00 C ATOM 135 C ILE A 15 -6.086 -1.186 -8.418 1.00 0.00 C ATOM 136 O ILE A 15 -5.586 -0.289 -9.096 1.00 0.00 O ATOM 137 CB ILE A 15 -3.992 -2.145 -7.449 1.00 0.00 C ATOM 138 CG1 ILE A 15 -3.147 -3.409 -7.297 1.00 0.00 C ATOM 139 CG2 ILE A 15 -4.244 -1.500 -6.094 1.00 0.00 C ATOM 140 CD1 ILE A 15 -1.795 -3.160 -6.670 1.00 0.00 C ATOM 0 H ILE A 15 -4.834 -2.619 -10.175 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.915 -3.119 -7.494 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.444 -1.432 -8.065 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -3.693 -4.130 -6.689 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.005 -3.862 -8.278 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.291 -1.272 -5.617 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.812 -0.580 -6.229 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -4.810 -2.186 -5.464 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.251 -4.101 -6.593 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.230 -2.463 -7.289 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.928 -2.736 -5.675 1.00 0.00 H new ATOM 152 N LYS A 16 -7.302 -1.098 -7.887 1.00 0.00 N ATOM 153 CA LYS A 16 -8.131 0.086 -8.077 1.00 0.00 C ATOM 154 C LYS A 16 -8.693 0.572 -6.747 1.00 0.00 C ATOM 155 O LYS A 16 -9.381 -0.170 -6.045 1.00 0.00 O ATOM 156 CB LYS A 16 -9.274 -0.215 -9.049 1.00 0.00 C ATOM 157 CG LYS A 16 -10.089 -1.442 -8.671 1.00 0.00 C ATOM 158 CD LYS A 16 -10.467 -2.264 -9.895 1.00 0.00 C ATOM 159 CE LYS A 16 -9.752 -3.606 -9.909 1.00 0.00 C ATOM 160 NZ LYS A 16 -10.092 -4.404 -11.119 1.00 0.00 N ATOM 0 H LYS A 16 -7.733 -1.831 -7.323 1.00 0.00 H new ATOM 0 HA LYS A 16 -7.506 0.874 -8.497 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -9.936 0.650 -9.097 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -8.862 -0.357 -10.048 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -9.517 -2.060 -7.980 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -10.993 -1.131 -8.147 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -11.545 -2.425 -9.907 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.217 -1.708 -10.799 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -8.675 -3.444 -9.872 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -10.020 -4.170 -9.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -9.584 -5.311 -11.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -11.117 -4.581 -11.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -9.813 -3.878 -11.972 1.00 0.00 H new ATOM 174 N VAL A 17 -8.393 1.819 -6.404 1.00 0.00 N ATOM 175 CA VAL A 17 -8.868 2.400 -5.155 1.00 0.00 C ATOM 176 C VAL A 17 -9.948 3.443 -5.410 1.00 0.00 C ATOM 177 O VAL A 17 -9.712 4.443 -6.088 1.00 0.00 O ATOM 178 CB VAL A 17 -7.723 3.052 -4.351 1.00 0.00 C ATOM 179 CG1 VAL A 17 -8.013 2.967 -2.863 1.00 0.00 C ATOM 180 CG2 VAL A 17 -6.386 2.399 -4.674 1.00 0.00 C ATOM 0 H VAL A 17 -7.824 2.446 -6.972 1.00 0.00 H new ATOM 0 HA VAL A 17 -9.284 1.579 -4.571 1.00 0.00 H new ATOM 0 HB VAL A 17 -7.660 4.102 -4.637 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -7.198 3.430 -2.306 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -8.945 3.488 -2.644 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.104 1.921 -2.569 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -5.597 2.878 -4.094 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.429 1.339 -4.423 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -6.173 2.512 -5.737 1.00 0.00 H new ATOM 190 N ASP A 18 -11.134 3.204 -4.860 1.00 0.00 N ATOM 191 CA ASP A 18 -12.252 4.124 -5.026 1.00 0.00 C ATOM 192 C ASP A 18 -13.097 4.192 -3.757 1.00 0.00 C ATOM 193 O ASP A 18 -14.281 4.523 -3.807 1.00 0.00 O ATOM 194 CB ASP A 18 -13.121 3.690 -6.208 1.00 0.00 C ATOM 195 CG ASP A 18 -12.711 4.361 -7.505 1.00 0.00 C ATOM 196 OD1 ASP A 18 -12.195 5.498 -7.448 1.00 0.00 O ATOM 197 OD2 ASP A 18 -12.904 3.750 -8.576 1.00 0.00 O ATOM 0 H ASP A 18 -11.345 2.381 -4.296 1.00 0.00 H new ATOM 0 HA ASP A 18 -11.848 5.117 -5.223 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -13.056 2.608 -6.325 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -14.164 3.925 -5.994 1.00 0.00 H new ATOM 202 N ASP A 19 -12.483 3.879 -2.619 1.00 0.00 N ATOM 203 CA ASP A 19 -13.184 3.910 -1.342 1.00 0.00 C ATOM 204 C ASP A 19 -12.296 4.498 -0.251 1.00 0.00 C ATOM 205 O ASP A 19 -11.100 4.215 -0.191 1.00 0.00 O ATOM 206 CB ASP A 19 -13.634 2.502 -0.948 1.00 0.00 C ATOM 207 CG ASP A 19 -15.009 2.492 -0.310 1.00 0.00 C ATOM 208 OD1 ASP A 19 -16.000 2.732 -1.032 1.00 0.00 O ATOM 209 OD2 ASP A 19 -15.096 2.246 0.911 1.00 0.00 O ATOM 0 H ASP A 19 -11.503 3.602 -2.557 1.00 0.00 H new ATOM 0 HA ASP A 19 -14.063 4.545 -1.452 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -13.642 1.865 -1.833 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -12.911 2.073 -0.254 1.00 0.00 H new ATOM 214 N VAL A 20 -12.889 5.318 0.609 1.00 0.00 N ATOM 215 CA VAL A 20 -12.152 5.947 1.697 1.00 0.00 C ATOM 216 C VAL A 20 -13.062 6.221 2.889 1.00 0.00 C ATOM 217 O VAL A 20 -13.958 7.061 2.818 1.00 0.00 O ATOM 218 CB VAL A 20 -11.501 7.268 1.246 1.00 0.00 C ATOM 219 CG1 VAL A 20 -10.576 7.803 2.328 1.00 0.00 C ATOM 220 CG2 VAL A 20 -10.749 7.075 -0.063 1.00 0.00 C ATOM 0 H VAL A 20 -13.879 5.563 0.573 1.00 0.00 H new ATOM 0 HA VAL A 20 -11.369 5.249 1.994 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.289 8.002 1.079 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.125 8.737 1.992 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -11.147 7.983 3.239 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.792 7.073 2.530 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -10.296 8.019 -0.365 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -9.969 6.326 0.072 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -11.442 6.742 -0.835 1.00 0.00 H new ATOM 230 N LYS A 21 -12.826 5.504 3.983 1.00 0.00 N ATOM 231 CA LYS A 21 -13.625 5.669 5.192 1.00 0.00 C ATOM 232 C LYS A 21 -12.945 6.624 6.166 1.00 0.00 C ATOM 233 O LYS A 21 -11.888 6.316 6.718 1.00 0.00 O ATOM 234 CB LYS A 21 -13.858 4.314 5.863 1.00 0.00 C ATOM 235 CG LYS A 21 -15.034 4.306 6.825 1.00 0.00 C ATOM 236 CD LYS A 21 -15.212 2.946 7.478 1.00 0.00 C ATOM 237 CE LYS A 21 -16.341 2.160 6.832 1.00 0.00 C ATOM 238 NZ LYS A 21 -16.128 1.981 5.369 1.00 0.00 N ATOM 0 H LYS A 21 -12.088 4.803 4.057 1.00 0.00 H new ATOM 0 HA LYS A 21 -14.587 6.095 4.908 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -14.024 3.560 5.093 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -12.956 4.025 6.403 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -14.881 5.063 7.594 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -15.945 4.575 6.290 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -14.283 2.380 7.401 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -15.419 3.076 8.540 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -16.422 1.183 7.309 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -17.286 2.677 7.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -16.823 1.303 4.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -16.244 2.895 4.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -15.167 1.620 5.200 1.00 0.00 H new ATOM 252 N ILE A 22 -13.556 7.786 6.370 1.00 0.00 N ATOM 253 CA ILE A 22 -13.011 8.789 7.273 1.00 0.00 C ATOM 254 C ILE A 22 -13.300 8.435 8.729 1.00 0.00 C ATOM 255 O ILE A 22 -14.385 8.708 9.240 1.00 0.00 O ATOM 256 CB ILE A 22 -13.588 10.186 6.974 1.00 0.00 C ATOM 257 CG1 ILE A 22 -13.612 10.445 5.466 1.00 0.00 C ATOM 258 CG2 ILE A 22 -12.776 11.255 7.685 1.00 0.00 C ATOM 259 CD1 ILE A 22 -12.251 10.345 4.813 1.00 0.00 C ATOM 0 H ILE A 22 -14.431 8.055 5.920 1.00 0.00 H new ATOM 0 HA ILE A 22 -11.933 8.806 7.113 1.00 0.00 H new ATOM 0 HB ILE A 22 -14.612 10.225 7.345 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -14.286 9.730 4.994 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -14.022 11.438 5.283 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -13.195 12.237 7.465 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -12.807 11.080 8.760 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -11.743 11.216 7.341 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -12.345 10.540 3.745 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -11.579 11.079 5.258 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -11.847 9.344 4.965 1.00 0.00 H new ATOM 271 N ASN A 23 -12.321 7.827 9.391 1.00 0.00 N ATOM 272 CA ASN A 23 -12.471 7.441 10.789 1.00 0.00 C ATOM 273 C ASN A 23 -12.013 8.567 11.715 1.00 0.00 C ATOM 274 O ASN A 23 -11.039 9.261 11.422 1.00 0.00 O ATOM 275 CB ASN A 23 -11.672 6.166 11.077 1.00 0.00 C ATOM 276 CG ASN A 23 -12.455 5.169 11.910 1.00 0.00 C ATOM 277 OD1 ASN A 23 -12.381 5.176 13.138 1.00 0.00 O ATOM 278 ND2 ASN A 23 -13.209 4.304 11.242 1.00 0.00 N ATOM 0 H ASN A 23 -11.417 7.591 8.982 1.00 0.00 H new ATOM 0 HA ASN A 23 -13.527 7.247 10.977 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.383 5.701 10.135 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -10.751 6.427 11.599 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -13.757 3.608 11.748 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -13.240 4.335 10.223 1.00 0.00 H new ATOM 285 N PRO A 24 -12.711 8.765 12.847 1.00 0.00 N ATOM 286 CA PRO A 24 -12.369 9.818 13.811 1.00 0.00 C ATOM 287 C PRO A 24 -10.902 9.777 14.230 1.00 0.00 C ATOM 288 O PRO A 24 -10.344 10.785 14.666 1.00 0.00 O ATOM 289 CB PRO A 24 -13.272 9.511 15.007 1.00 0.00 C ATOM 290 CG PRO A 24 -14.432 8.779 14.430 1.00 0.00 C ATOM 291 CD PRO A 24 -13.888 7.985 13.274 1.00 0.00 C ATOM 0 HA PRO A 24 -12.514 10.813 13.390 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.752 8.906 15.750 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -13.591 10.426 15.507 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -14.889 8.124 15.172 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -15.205 9.472 14.098 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -13.613 6.974 13.575 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -14.620 7.890 12.472 1.00 0.00 H new ATOM 299 N LYS A 25 -10.282 8.607 14.105 1.00 0.00 N ATOM 300 CA LYS A 25 -8.883 8.443 14.480 1.00 0.00 C ATOM 301 C LYS A 25 -7.963 8.576 13.270 1.00 0.00 C ATOM 302 O LYS A 25 -6.818 9.012 13.396 1.00 0.00 O ATOM 303 CB LYS A 25 -8.670 7.083 15.149 1.00 0.00 C ATOM 304 CG LYS A 25 -8.805 7.121 16.663 1.00 0.00 C ATOM 305 CD LYS A 25 -7.838 6.158 17.335 1.00 0.00 C ATOM 306 CE LYS A 25 -8.554 4.927 17.872 1.00 0.00 C ATOM 307 NZ LYS A 25 -8.051 3.675 17.243 1.00 0.00 N ATOM 0 H LYS A 25 -10.726 7.761 13.748 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.633 9.235 15.185 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.392 6.372 14.746 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -7.678 6.712 14.890 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.618 8.134 17.020 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.827 6.867 16.944 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.073 5.852 16.621 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -7.326 6.667 18.152 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -8.419 4.871 18.952 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.624 5.021 17.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -8.563 2.859 17.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -8.203 3.718 16.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -7.035 3.572 17.439 1.00 0.00 H new ATOM 321 N TYR A 26 -8.464 8.199 12.099 1.00 0.00 N ATOM 322 CA TYR A 26 -7.676 8.277 10.873 1.00 0.00 C ATOM 323 C TYR A 26 -8.523 7.938 9.651 1.00 0.00 C ATOM 324 O TYR A 26 -9.587 7.331 9.770 1.00 0.00 O ATOM 325 CB TYR A 26 -6.475 7.332 10.953 1.00 0.00 C ATOM 326 CG TYR A 26 -6.800 5.985 11.561 1.00 0.00 C ATOM 327 CD1 TYR A 26 -7.689 5.118 10.939 1.00 0.00 C ATOM 328 CD2 TYR A 26 -6.218 5.583 12.757 1.00 0.00 C ATOM 329 CE1 TYR A 26 -7.989 3.888 11.492 1.00 0.00 C ATOM 330 CE2 TYR A 26 -6.513 4.354 13.315 1.00 0.00 C ATOM 331 CZ TYR A 26 -7.399 3.510 12.680 1.00 0.00 C ATOM 332 OH TYR A 26 -7.696 2.287 13.233 1.00 0.00 O ATOM 0 H TYR A 26 -9.409 7.837 11.972 1.00 0.00 H new ATOM 0 HA TYR A 26 -7.320 9.302 10.769 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -6.075 7.181 9.950 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -5.689 7.806 11.541 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -8.153 5.410 10.008 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -5.524 6.242 13.258 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -8.683 3.225 10.996 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -6.051 4.056 14.245 1.00 0.00 H new ATOM 0 HH TYR A 26 -7.196 2.175 14.068 1.00 0.00 H new ATOM 342 N VAL A 27 -8.042 8.335 8.477 1.00 0.00 N ATOM 343 CA VAL A 27 -8.754 8.074 7.231 1.00 0.00 C ATOM 344 C VAL A 27 -8.274 6.777 6.585 1.00 0.00 C ATOM 345 O VAL A 27 -7.092 6.627 6.275 1.00 0.00 O ATOM 346 CB VAL A 27 -8.573 9.230 6.229 1.00 0.00 C ATOM 347 CG1 VAL A 27 -9.464 9.030 5.013 1.00 0.00 C ATOM 348 CG2 VAL A 27 -8.859 10.568 6.895 1.00 0.00 C ATOM 0 H VAL A 27 -7.162 8.839 8.363 1.00 0.00 H new ATOM 0 HA VAL A 27 -9.811 7.983 7.483 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.536 9.233 5.893 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.321 9.857 4.317 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.203 8.093 4.521 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.507 8.996 5.328 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.725 11.371 6.170 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.885 10.579 7.264 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -8.172 10.714 7.729 1.00 0.00 H new ATOM 358 N LEU A 28 -9.198 5.843 6.386 1.00 0.00 N ATOM 359 CA LEU A 28 -8.869 4.558 5.778 1.00 0.00 C ATOM 360 C LEU A 28 -9.019 4.617 4.261 1.00 0.00 C ATOM 361 O LEU A 28 -9.711 5.485 3.728 1.00 0.00 O ATOM 362 CB LEU A 28 -9.766 3.455 6.346 1.00 0.00 C ATOM 363 CG LEU A 28 -9.655 3.241 7.857 1.00 0.00 C ATOM 364 CD1 LEU A 28 -10.480 2.038 8.286 1.00 0.00 C ATOM 365 CD2 LEU A 28 -8.200 3.064 8.265 1.00 0.00 C ATOM 0 H LEU A 28 -10.181 5.951 6.637 1.00 0.00 H new ATOM 0 HA LEU A 28 -7.829 4.331 6.014 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -10.802 3.690 6.103 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.526 2.518 5.844 1.00 0.00 H new ATOM 0 HG LEU A 28 -10.048 4.125 8.360 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -10.390 1.900 9.363 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -11.526 2.203 8.028 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.117 1.147 7.775 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.140 2.913 9.343 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.782 2.197 7.753 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -7.634 3.955 7.992 1.00 0.00 H new ATOM 377 N TYR A 29 -8.368 3.685 3.571 1.00 0.00 N ATOM 378 CA TYR A 29 -8.428 3.628 2.115 1.00 0.00 C ATOM 379 C TYR A 29 -8.816 2.230 1.644 1.00 0.00 C ATOM 380 O TYR A 29 -8.158 1.247 1.985 1.00 0.00 O ATOM 381 CB TYR A 29 -7.079 4.024 1.510 1.00 0.00 C ATOM 382 CG TYR A 29 -6.858 5.518 1.448 1.00 0.00 C ATOM 383 CD1 TYR A 29 -6.327 6.207 2.532 1.00 0.00 C ATOM 384 CD2 TYR A 29 -7.178 6.239 0.305 1.00 0.00 C ATOM 385 CE1 TYR A 29 -6.124 7.572 2.479 1.00 0.00 C ATOM 386 CE2 TYR A 29 -6.976 7.605 0.244 1.00 0.00 C ATOM 387 CZ TYR A 29 -6.449 8.266 1.332 1.00 0.00 C ATOM 388 OH TYR A 29 -6.248 9.626 1.275 1.00 0.00 O ATOM 0 H TYR A 29 -7.793 2.959 3.998 1.00 0.00 H new ATOM 0 HA TYR A 29 -9.189 4.333 1.780 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -6.280 3.571 2.097 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -7.007 3.613 0.503 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -6.069 5.666 3.430 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -7.591 5.724 -0.550 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -5.713 8.093 3.331 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -7.230 8.152 -0.652 1.00 0.00 H new ATOM 0 HH TYR A 29 -6.629 9.978 0.444 1.00 0.00 H new ATOM 398 N GLY A 30 -9.886 2.148 0.862 1.00 0.00 N ATOM 399 CA GLY A 30 -10.339 0.863 0.361 1.00 0.00 C ATOM 400 C GLY A 30 -9.692 0.496 -0.959 1.00 0.00 C ATOM 401 O GLY A 30 -10.172 0.890 -2.022 1.00 0.00 O ATOM 0 H GLY A 30 -10.447 2.946 0.566 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.118 0.091 1.098 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -11.422 0.886 0.238 1.00 0.00 H new ATOM 405 N VAL A 31 -8.604 -0.264 -0.892 1.00 0.00 N ATOM 406 CA VAL A 31 -7.890 -0.684 -2.092 1.00 0.00 C ATOM 407 C VAL A 31 -8.478 -1.973 -2.652 1.00 0.00 C ATOM 408 O VAL A 31 -8.389 -3.031 -2.030 1.00 0.00 O ATOM 409 CB VAL A 31 -6.392 -0.897 -1.810 1.00 0.00 C ATOM 410 CG1 VAL A 31 -5.633 -1.143 -3.106 1.00 0.00 C ATOM 411 CG2 VAL A 31 -5.814 0.295 -1.063 1.00 0.00 C ATOM 0 H VAL A 31 -8.198 -0.602 -0.020 1.00 0.00 H new ATOM 0 HA VAL A 31 -8.002 0.115 -2.825 1.00 0.00 H new ATOM 0 HB VAL A 31 -6.282 -1.779 -1.179 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.576 -1.291 -2.886 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -6.030 -2.032 -3.597 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -5.749 -0.282 -3.765 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -4.754 0.126 -0.873 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.935 1.195 -1.665 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.338 0.419 -0.115 1.00 0.00 H new ATOM 421 N SER A 32 -9.085 -1.873 -3.830 1.00 0.00 N ATOM 422 CA SER A 32 -9.696 -3.031 -4.475 1.00 0.00 C ATOM 423 C SER A 32 -8.657 -3.853 -5.233 1.00 0.00 C ATOM 424 O SER A 32 -7.781 -3.304 -5.900 1.00 0.00 O ATOM 425 CB SER A 32 -10.807 -2.583 -5.427 1.00 0.00 C ATOM 426 OG SER A 32 -12.005 -3.300 -5.186 1.00 0.00 O ATOM 0 H SER A 32 -9.167 -1.004 -4.357 1.00 0.00 H new ATOM 0 HA SER A 32 -10.125 -3.661 -3.696 1.00 0.00 H new ATOM 0 HB2 SER A 32 -10.987 -1.515 -5.303 1.00 0.00 H new ATOM 0 HB3 SER A 32 -10.490 -2.735 -6.459 1.00 0.00 H new ATOM 0 HG SER A 32 -12.700 -2.994 -5.806 1.00 0.00 H new ATOM 432 N THR A 33 -8.764 -5.175 -5.123 1.00 0.00 N ATOM 433 CA THR A 33 -7.838 -6.078 -5.796 1.00 0.00 C ATOM 434 C THR A 33 -8.525 -7.401 -6.134 1.00 0.00 C ATOM 435 O THR A 33 -9.573 -7.721 -5.573 1.00 0.00 O ATOM 436 CB THR A 33 -6.616 -6.332 -4.913 1.00 0.00 C ATOM 437 OG1 THR A 33 -7.008 -6.581 -3.574 1.00 0.00 O ATOM 438 CG2 THR A 33 -5.641 -5.174 -4.897 1.00 0.00 C ATOM 0 H THR A 33 -9.484 -5.644 -4.573 1.00 0.00 H new ATOM 0 HA THR A 33 -7.514 -5.610 -6.725 1.00 0.00 H new ATOM 0 HB THR A 33 -6.120 -7.200 -5.347 1.00 0.00 H new ATOM 0 HG1 THR A 33 -7.986 -6.605 -3.518 1.00 0.00 H new ATOM 0 HG21 THR A 33 -4.797 -5.418 -4.252 1.00 0.00 H new ATOM 0 HG22 THR A 33 -5.282 -4.986 -5.909 1.00 0.00 H new ATOM 0 HG23 THR A 33 -6.141 -4.283 -4.518 1.00 0.00 H new ATOM 446 N PRO A 34 -7.945 -8.190 -7.059 1.00 0.00 N ATOM 447 CA PRO A 34 -8.508 -9.478 -7.468 1.00 0.00 C ATOM 448 C PRO A 34 -9.057 -10.281 -6.293 1.00 0.00 C ATOM 449 O PRO A 34 -10.018 -11.037 -6.437 1.00 0.00 O ATOM 450 CB PRO A 34 -7.310 -10.187 -8.093 1.00 0.00 C ATOM 451 CG PRO A 34 -6.489 -9.087 -8.673 1.00 0.00 C ATOM 452 CD PRO A 34 -6.694 -7.885 -7.783 1.00 0.00 C ATOM 0 HA PRO A 34 -9.358 -9.361 -8.140 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -6.749 -10.751 -7.348 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -7.623 -10.896 -8.860 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -5.436 -9.367 -8.711 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -6.798 -8.870 -9.696 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -5.858 -7.748 -7.097 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -6.782 -6.967 -8.365 1.00 0.00 H new ATOM 460 N ASN A 35 -8.445 -10.103 -5.128 1.00 0.00 N ATOM 461 CA ASN A 35 -8.878 -10.803 -3.926 1.00 0.00 C ATOM 462 C ASN A 35 -10.083 -10.103 -3.307 1.00 0.00 C ATOM 463 O ASN A 35 -11.114 -10.727 -3.053 1.00 0.00 O ATOM 464 CB ASN A 35 -7.735 -10.873 -2.910 1.00 0.00 C ATOM 465 CG ASN A 35 -7.812 -12.112 -2.039 1.00 0.00 C ATOM 466 OD1 ASN A 35 -7.168 -13.123 -2.319 1.00 0.00 O ATOM 467 ND2 ASN A 35 -8.603 -12.040 -0.975 1.00 0.00 N ATOM 0 H ASN A 35 -7.649 -9.481 -4.991 1.00 0.00 H new ATOM 0 HA ASN A 35 -9.166 -11.817 -4.203 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -6.782 -10.862 -3.438 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -7.759 -9.985 -2.278 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -8.695 -12.843 -0.352 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -9.119 -11.182 -0.780 1.00 0.00 H new ATOM 474 N LYS A 36 -9.945 -8.799 -3.072 1.00 0.00 N ATOM 475 CA LYS A 36 -11.019 -7.998 -2.487 1.00 0.00 C ATOM 476 C LYS A 36 -10.505 -6.623 -2.075 1.00 0.00 C ATOM 477 O LYS A 36 -9.333 -6.302 -2.275 1.00 0.00 O ATOM 478 CB LYS A 36 -11.628 -8.707 -1.273 1.00 0.00 C ATOM 479 CG LYS A 36 -10.592 -9.283 -0.321 1.00 0.00 C ATOM 480 CD LYS A 36 -10.530 -8.502 0.985 1.00 0.00 C ATOM 481 CE LYS A 36 -10.714 -9.409 2.192 1.00 0.00 C ATOM 482 NZ LYS A 36 -9.433 -9.638 2.916 1.00 0.00 N ATOM 0 H LYS A 36 -9.096 -8.273 -3.279 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.791 -7.873 -3.246 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.257 -8.002 -0.729 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -12.277 -9.511 -1.620 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -10.831 -10.325 -0.110 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -9.612 -9.271 -0.799 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -9.571 -7.990 1.058 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -11.303 -7.733 0.986 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -11.441 -8.965 2.872 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -11.124 -10.366 1.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -9.602 -10.261 3.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -8.747 -10.085 2.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -9.054 -8.728 3.248 1.00 0.00 H new ATOM 496 N ARG A 37 -11.389 -5.814 -1.499 1.00 0.00 N ATOM 497 CA ARG A 37 -11.022 -4.473 -1.060 1.00 0.00 C ATOM 498 C ARG A 37 -10.318 -4.515 0.294 1.00 0.00 C ATOM 499 O ARG A 37 -10.815 -5.116 1.246 1.00 0.00 O ATOM 500 CB ARG A 37 -12.262 -3.580 -0.978 1.00 0.00 C ATOM 501 CG ARG A 37 -12.046 -2.189 -1.552 1.00 0.00 C ATOM 502 CD ARG A 37 -13.346 -1.403 -1.611 1.00 0.00 C ATOM 503 NE ARG A 37 -14.042 -1.593 -2.881 1.00 0.00 N ATOM 504 CZ ARG A 37 -15.301 -1.220 -3.099 1.00 0.00 C ATOM 505 NH1 ARG A 37 -16.005 -0.639 -2.135 1.00 0.00 N ATOM 506 NH2 ARG A 37 -15.859 -1.429 -4.284 1.00 0.00 N ATOM 0 H ARG A 37 -12.363 -6.064 -1.326 1.00 0.00 H new ATOM 0 HA ARG A 37 -10.332 -4.056 -1.794 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -13.082 -4.061 -1.511 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -12.568 -3.491 0.064 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -11.321 -1.651 -0.941 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -11.622 -2.269 -2.553 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -13.995 -1.713 -0.792 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.136 -0.343 -1.468 1.00 0.00 H new ATOM 0 HE ARG A 37 -13.534 -2.037 -3.645 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -15.581 -0.476 -1.221 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -16.969 -0.355 -2.308 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -15.323 -1.876 -5.028 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -16.824 -1.143 -4.451 1.00 0.00 H new ATOM 520 N LEU A 38 -9.159 -3.872 0.367 1.00 0.00 N ATOM 521 CA LEU A 38 -8.382 -3.830 1.599 1.00 0.00 C ATOM 522 C LEU A 38 -8.403 -2.429 2.201 1.00 0.00 C ATOM 523 O LEU A 38 -8.162 -1.441 1.507 1.00 0.00 O ATOM 524 CB LEU A 38 -6.938 -4.267 1.329 1.00 0.00 C ATOM 525 CG LEU A 38 -6.309 -5.156 2.403 1.00 0.00 C ATOM 526 CD1 LEU A 38 -6.007 -4.349 3.655 1.00 0.00 C ATOM 527 CD2 LEU A 38 -7.218 -6.332 2.730 1.00 0.00 C ATOM 0 H LEU A 38 -8.736 -3.371 -0.415 1.00 0.00 H new ATOM 0 HA LEU A 38 -8.832 -4.519 2.313 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -6.909 -4.799 0.378 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -6.322 -3.375 1.213 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.370 -5.550 2.013 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.560 -4.999 4.408 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -5.313 -3.545 3.411 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -6.932 -3.924 4.046 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.751 -6.951 3.496 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -8.175 -5.961 3.097 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.380 -6.927 1.832 1.00 0.00 H new ATOM 539 N TYR A 39 -8.695 -2.348 3.495 1.00 0.00 N ATOM 540 CA TYR A 39 -8.752 -1.065 4.187 1.00 0.00 C ATOM 541 C TYR A 39 -7.490 -0.831 5.012 1.00 0.00 C ATOM 542 O TYR A 39 -7.180 -1.598 5.924 1.00 0.00 O ATOM 543 CB TYR A 39 -9.986 -1.002 5.087 1.00 0.00 C ATOM 544 CG TYR A 39 -11.281 -0.827 4.325 1.00 0.00 C ATOM 545 CD1 TYR A 39 -11.506 0.304 3.551 1.00 0.00 C ATOM 546 CD2 TYR A 39 -12.279 -1.793 4.382 1.00 0.00 C ATOM 547 CE1 TYR A 39 -12.687 0.468 2.853 1.00 0.00 C ATOM 548 CE2 TYR A 39 -13.463 -1.635 3.687 1.00 0.00 C ATOM 549 CZ TYR A 39 -13.662 -0.504 2.924 1.00 0.00 C ATOM 550 OH TYR A 39 -14.840 -0.345 2.230 1.00 0.00 O ATOM 0 H TYR A 39 -8.896 -3.155 4.086 1.00 0.00 H new ATOM 0 HA TYR A 39 -8.820 -0.279 3.435 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -10.042 -1.916 5.678 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -9.872 -0.176 5.789 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -10.745 1.068 3.494 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -12.127 -2.680 4.978 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -12.846 1.353 2.255 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -14.229 -2.394 3.741 1.00 0.00 H new ATOM 0 HH TYR A 39 -14.858 0.543 1.816 1.00 0.00 H new ATOM 560 N LYS A 40 -6.769 0.237 4.687 1.00 0.00 N ATOM 561 CA LYS A 40 -5.541 0.579 5.395 1.00 0.00 C ATOM 562 C LYS A 40 -5.405 2.092 5.540 1.00 0.00 C ATOM 563 O LYS A 40 -6.196 2.851 4.981 1.00 0.00 O ATOM 564 CB LYS A 40 -4.324 0.015 4.658 1.00 0.00 C ATOM 565 CG LYS A 40 -4.520 -1.404 4.149 1.00 0.00 C ATOM 566 CD LYS A 40 -3.457 -1.782 3.131 1.00 0.00 C ATOM 567 CE LYS A 40 -3.624 -1.006 1.832 1.00 0.00 C ATOM 568 NZ LYS A 40 -3.757 -1.912 0.658 1.00 0.00 N ATOM 0 H LYS A 40 -7.015 0.882 3.936 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.589 0.136 6.390 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -4.088 0.664 3.815 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -3.464 0.036 5.327 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -4.487 -2.100 4.987 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -5.508 -1.496 3.697 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -2.468 -1.588 3.547 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -3.512 -2.851 2.926 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -4.506 -0.369 1.901 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -2.766 -0.349 1.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -4.212 -1.401 -0.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -2.814 -2.234 0.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -4.338 -2.735 0.918 1.00 0.00 H new ATOM 582 N ARG A 41 -4.396 2.522 6.291 1.00 0.00 N ATOM 583 CA ARG A 41 -4.157 3.945 6.505 1.00 0.00 C ATOM 584 C ARG A 41 -2.829 4.370 5.888 1.00 0.00 C ATOM 585 O ARG A 41 -1.949 3.543 5.654 1.00 0.00 O ATOM 586 CB ARG A 41 -4.168 4.270 8.001 1.00 0.00 C ATOM 587 CG ARG A 41 -3.384 3.278 8.845 1.00 0.00 C ATOM 588 CD ARG A 41 -3.277 3.739 10.290 1.00 0.00 C ATOM 589 NE ARG A 41 -2.840 2.664 11.176 1.00 0.00 N ATOM 590 CZ ARG A 41 -2.327 2.864 12.388 1.00 0.00 C ATOM 591 NH1 ARG A 41 -2.184 4.095 12.862 1.00 0.00 N ATOM 592 NH2 ARG A 41 -1.955 1.828 13.128 1.00 0.00 N ATOM 0 H ARG A 41 -3.732 1.907 6.761 1.00 0.00 H new ATOM 0 HA ARG A 41 -4.959 4.500 6.017 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.755 5.268 8.151 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -5.200 4.296 8.351 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -3.870 2.303 8.808 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.385 3.152 8.427 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -2.575 4.570 10.354 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -4.245 4.113 10.624 1.00 0.00 H new ATOM 0 HE ARG A 41 -2.933 1.703 10.847 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -2.468 4.895 12.297 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -1.790 4.241 13.792 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -2.062 0.880 12.768 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -1.562 1.980 14.057 1.00 0.00 H new ATOM 606 N TYR A 42 -2.692 5.666 5.625 1.00 0.00 N ATOM 607 CA TYR A 42 -1.471 6.200 5.032 1.00 0.00 C ATOM 608 C TYR A 42 -0.260 5.892 5.908 1.00 0.00 C ATOM 609 O TYR A 42 0.789 5.480 5.411 1.00 0.00 O ATOM 610 CB TYR A 42 -1.597 7.711 4.831 1.00 0.00 C ATOM 611 CG TYR A 42 -0.708 8.253 3.736 1.00 0.00 C ATOM 612 CD1 TYR A 42 0.609 8.607 3.998 1.00 0.00 C ATOM 613 CD2 TYR A 42 -1.185 8.413 2.442 1.00 0.00 C ATOM 614 CE1 TYR A 42 1.426 9.104 3.001 1.00 0.00 C ATOM 615 CE2 TYR A 42 -0.375 8.909 1.438 1.00 0.00 C ATOM 616 CZ TYR A 42 0.930 9.254 1.723 1.00 0.00 C ATOM 617 OH TYR A 42 1.739 9.749 0.727 1.00 0.00 O ATOM 0 H TYR A 42 -3.411 6.365 5.813 1.00 0.00 H new ATOM 0 HA TYR A 42 -1.327 5.721 4.063 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -2.634 7.953 4.598 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -1.355 8.215 5.767 1.00 0.00 H new ATOM 0 HD1 TYR A 42 1.001 8.492 4.998 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -2.207 8.145 2.216 1.00 0.00 H new ATOM 0 HE1 TYR A 42 2.448 9.374 3.221 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -0.761 9.026 0.436 1.00 0.00 H new ATOM 0 HH TYR A 42 1.236 9.790 -0.113 1.00 0.00 H new ATOM 627 N SER A 43 -0.413 6.094 7.212 1.00 0.00 N ATOM 628 CA SER A 43 0.668 5.838 8.157 1.00 0.00 C ATOM 629 C SER A 43 1.093 4.373 8.119 1.00 0.00 C ATOM 630 O SER A 43 2.235 4.040 8.436 1.00 0.00 O ATOM 631 CB SER A 43 0.235 6.218 9.574 1.00 0.00 C ATOM 632 OG SER A 43 -0.216 7.561 9.628 1.00 0.00 O ATOM 0 H SER A 43 -1.275 6.434 7.639 1.00 0.00 H new ATOM 0 HA SER A 43 1.521 6.451 7.867 1.00 0.00 H new ATOM 0 HB2 SER A 43 -0.560 5.551 9.906 1.00 0.00 H new ATOM 0 HB3 SER A 43 1.071 6.084 10.261 1.00 0.00 H new ATOM 0 HG SER A 43 -0.488 7.778 10.544 1.00 0.00 H new ATOM 638 N GLU A 44 0.168 3.499 7.731 1.00 0.00 N ATOM 639 CA GLU A 44 0.452 2.070 7.653 1.00 0.00 C ATOM 640 C GLU A 44 1.344 1.754 6.456 1.00 0.00 C ATOM 641 O GLU A 44 2.174 0.849 6.511 1.00 0.00 O ATOM 642 CB GLU A 44 -0.850 1.272 7.558 1.00 0.00 C ATOM 643 CG GLU A 44 -1.334 0.736 8.896 1.00 0.00 C ATOM 644 CD GLU A 44 -2.702 0.089 8.806 1.00 0.00 C ATOM 645 OE1 GLU A 44 -2.955 -0.627 7.814 1.00 0.00 O ATOM 646 OE2 GLU A 44 -3.520 0.300 9.726 1.00 0.00 O ATOM 0 H GLU A 44 -0.783 3.755 7.466 1.00 0.00 H new ATOM 0 HA GLU A 44 0.980 1.783 8.562 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -1.625 1.907 7.128 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -0.706 0.437 6.872 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -0.616 0.007 9.272 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -1.369 1.551 9.618 1.00 0.00 H new ATOM 653 N PHE A 45 1.168 2.506 5.376 1.00 0.00 N ATOM 654 CA PHE A 45 1.960 2.299 4.170 1.00 0.00 C ATOM 655 C PHE A 45 3.435 2.577 4.436 1.00 0.00 C ATOM 656 O PHE A 45 4.303 1.789 4.061 1.00 0.00 O ATOM 657 CB PHE A 45 1.450 3.192 3.036 1.00 0.00 C ATOM 658 CG PHE A 45 0.772 2.430 1.934 1.00 0.00 C ATOM 659 CD1 PHE A 45 1.515 1.835 0.927 1.00 0.00 C ATOM 660 CD2 PHE A 45 -0.607 2.308 1.905 1.00 0.00 C ATOM 661 CE1 PHE A 45 0.895 1.132 -0.088 1.00 0.00 C ATOM 662 CE2 PHE A 45 -1.234 1.606 0.892 1.00 0.00 C ATOM 663 CZ PHE A 45 -0.481 1.017 -0.106 1.00 0.00 C ATOM 0 H PHE A 45 0.486 3.262 5.311 1.00 0.00 H new ATOM 0 HA PHE A 45 1.855 1.256 3.870 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.752 3.922 3.445 1.00 0.00 H new ATOM 0 HB3 PHE A 45 2.288 3.751 2.619 1.00 0.00 H new ATOM 0 HD1 PHE A 45 2.591 1.922 0.936 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -1.200 2.766 2.683 1.00 0.00 H new ATOM 0 HE1 PHE A 45 1.486 0.673 -0.867 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.310 1.518 0.881 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.968 0.468 -0.898 1.00 0.00 H new ATOM 673 N TRP A 46 3.713 3.699 5.090 1.00 0.00 N ATOM 674 CA TRP A 46 5.085 4.074 5.409 1.00 0.00 C ATOM 675 C TRP A 46 5.725 3.040 6.329 1.00 0.00 C ATOM 676 O TRP A 46 6.924 2.777 6.245 1.00 0.00 O ATOM 677 CB TRP A 46 5.121 5.458 6.066 1.00 0.00 C ATOM 678 CG TRP A 46 6.457 5.806 6.653 1.00 0.00 C ATOM 679 CD1 TRP A 46 6.859 5.611 7.943 1.00 0.00 C ATOM 680 CD2 TRP A 46 7.566 6.403 5.972 1.00 0.00 C ATOM 681 NE1 TRP A 46 8.151 6.050 8.106 1.00 0.00 N ATOM 682 CE2 TRP A 46 8.605 6.543 6.911 1.00 0.00 C ATOM 683 CE3 TRP A 46 7.781 6.835 4.660 1.00 0.00 C ATOM 684 CZ2 TRP A 46 9.840 7.095 6.579 1.00 0.00 C ATOM 685 CZ3 TRP A 46 9.007 7.383 4.331 1.00 0.00 C ATOM 686 CH2 TRP A 46 10.023 7.508 5.287 1.00 0.00 C ATOM 0 H TRP A 46 3.008 4.363 5.409 1.00 0.00 H new ATOM 0 HA TRP A 46 5.654 4.111 4.480 1.00 0.00 H new ATOM 0 HB2 TRP A 46 4.851 6.211 5.325 1.00 0.00 H new ATOM 0 HB3 TRP A 46 4.366 5.499 6.851 1.00 0.00 H new ATOM 0 HD1 TRP A 46 6.251 5.175 8.722 1.00 0.00 H new ATOM 0 HE1 TRP A 46 8.685 6.015 8.975 1.00 0.00 H new ATOM 0 HE3 TRP A 46 7.003 6.742 3.916 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 10.625 7.194 7.314 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 9.184 7.720 3.320 1.00 0.00 H new ATOM 0 HH2 TRP A 46 10.970 7.939 4.999 1.00 0.00 H new ATOM 697 N LYS A 47 4.918 2.461 7.213 1.00 0.00 N ATOM 698 CA LYS A 47 5.411 1.463 8.152 1.00 0.00 C ATOM 699 C LYS A 47 5.940 0.234 7.414 1.00 0.00 C ATOM 700 O LYS A 47 6.876 -0.416 7.874 1.00 0.00 O ATOM 701 CB LYS A 47 4.307 1.073 9.149 1.00 0.00 C ATOM 702 CG LYS A 47 3.541 -0.193 8.786 1.00 0.00 C ATOM 703 CD LYS A 47 4.161 -1.424 9.429 1.00 0.00 C ATOM 704 CE LYS A 47 3.134 -2.225 10.215 1.00 0.00 C ATOM 705 NZ LYS A 47 3.255 -3.687 9.957 1.00 0.00 N ATOM 0 H LYS A 47 3.922 2.666 7.298 1.00 0.00 H new ATOM 0 HA LYS A 47 6.239 1.898 8.711 1.00 0.00 H new ATOM 0 HB2 LYS A 47 4.755 0.941 10.134 1.00 0.00 H new ATOM 0 HB3 LYS A 47 3.600 1.899 9.229 1.00 0.00 H new ATOM 0 HG2 LYS A 47 2.504 -0.097 9.108 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.529 -0.314 7.703 1.00 0.00 H new ATOM 0 HD2 LYS A 47 4.602 -2.055 8.657 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.971 -1.120 10.092 1.00 0.00 H new ATOM 0 HE2 LYS A 47 3.261 -2.032 11.280 1.00 0.00 H new ATOM 0 HE3 LYS A 47 2.131 -1.891 9.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.538 -4.198 10.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 3.108 -3.874 8.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 4.203 -4.011 10.235 1.00 0.00 H new ATOM 719 N LEU A 48 5.334 -0.077 6.271 1.00 0.00 N ATOM 720 CA LEU A 48 5.749 -1.231 5.477 1.00 0.00 C ATOM 721 C LEU A 48 6.925 -0.879 4.569 1.00 0.00 C ATOM 722 O LEU A 48 7.800 -1.706 4.321 1.00 0.00 O ATOM 723 CB LEU A 48 4.574 -1.744 4.638 1.00 0.00 C ATOM 724 CG LEU A 48 4.922 -2.847 3.634 1.00 0.00 C ATOM 725 CD1 LEU A 48 5.170 -4.163 4.352 1.00 0.00 C ATOM 726 CD2 LEU A 48 3.812 -3.000 2.604 1.00 0.00 C ATOM 0 H LEU A 48 4.557 0.451 5.875 1.00 0.00 H new ATOM 0 HA LEU A 48 6.070 -2.016 6.162 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.803 -2.118 5.312 1.00 0.00 H new ATOM 0 HB3 LEU A 48 4.142 -0.904 4.095 1.00 0.00 H new ATOM 0 HG LEU A 48 5.837 -2.563 3.114 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.416 -4.935 3.623 1.00 0.00 H new ATOM 0 HD12 LEU A 48 5.999 -4.046 5.050 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.273 -4.454 4.899 1.00 0.00 H new ATOM 0 HD21 LEU A 48 4.076 -3.788 1.899 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.881 -3.261 3.108 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.682 -2.061 2.067 1.00 0.00 H new ATOM 738 N LYS A 49 6.930 0.354 4.073 1.00 0.00 N ATOM 739 CA LYS A 49 7.989 0.824 3.182 1.00 0.00 C ATOM 740 C LYS A 49 9.378 0.546 3.757 1.00 0.00 C ATOM 741 O LYS A 49 10.112 -0.302 3.252 1.00 0.00 O ATOM 742 CB LYS A 49 7.827 2.323 2.925 1.00 0.00 C ATOM 743 CG LYS A 49 7.984 2.709 1.464 1.00 0.00 C ATOM 744 CD LYS A 49 8.181 4.209 1.301 1.00 0.00 C ATOM 745 CE LYS A 49 9.530 4.657 1.842 1.00 0.00 C ATOM 746 NZ LYS A 49 10.495 4.954 0.747 1.00 0.00 N ATOM 0 H LYS A 49 6.211 1.049 4.273 1.00 0.00 H new ATOM 0 HA LYS A 49 7.899 0.277 2.244 1.00 0.00 H new ATOM 0 HB2 LYS A 49 6.843 2.639 3.272 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.563 2.867 3.517 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.836 2.181 1.037 1.00 0.00 H new ATOM 0 HG3 LYS A 49 7.102 2.394 0.907 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.105 4.474 0.247 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.384 4.740 1.822 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.397 5.545 2.460 1.00 0.00 H new ATOM 0 HE3 LYS A 49 9.940 3.879 2.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 11.455 4.695 1.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 10.240 4.406 -0.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.465 5.969 0.523 1.00 0.00 H new ATOM 760 N THR A 50 9.732 1.279 4.808 1.00 0.00 N ATOM 761 CA THR A 50 11.038 1.133 5.450 1.00 0.00 C ATOM 762 C THR A 50 11.386 -0.333 5.710 1.00 0.00 C ATOM 763 O THR A 50 12.534 -0.742 5.539 1.00 0.00 O ATOM 764 CB THR A 50 11.080 1.927 6.761 1.00 0.00 C ATOM 765 OG1 THR A 50 12.092 1.430 7.620 1.00 0.00 O ATOM 766 CG2 THR A 50 9.773 1.901 7.528 1.00 0.00 C ATOM 0 H THR A 50 9.131 1.983 5.236 1.00 0.00 H new ATOM 0 HA THR A 50 11.785 1.532 4.764 1.00 0.00 H new ATOM 0 HB THR A 50 11.284 2.955 6.463 1.00 0.00 H new ATOM 0 HG1 THR A 50 12.102 1.952 8.450 1.00 0.00 H new ATOM 0 HG21 THR A 50 9.877 2.483 8.444 1.00 0.00 H new ATOM 0 HG22 THR A 50 8.982 2.330 6.913 1.00 0.00 H new ATOM 0 HG23 THR A 50 9.519 0.871 7.779 1.00 0.00 H new ATOM 774 N ARG A 51 10.397 -1.121 6.119 1.00 0.00 N ATOM 775 CA ARG A 51 10.627 -2.538 6.392 1.00 0.00 C ATOM 776 C ARG A 51 11.169 -3.237 5.155 1.00 0.00 C ATOM 777 O ARG A 51 12.262 -3.798 5.169 1.00 0.00 O ATOM 778 CB ARG A 51 9.336 -3.223 6.838 1.00 0.00 C ATOM 779 CG ARG A 51 8.586 -2.469 7.916 1.00 0.00 C ATOM 780 CD ARG A 51 8.850 -3.053 9.294 1.00 0.00 C ATOM 781 NE ARG A 51 7.825 -2.667 10.260 1.00 0.00 N ATOM 782 CZ ARG A 51 7.933 -2.856 11.573 1.00 0.00 C ATOM 783 NH1 ARG A 51 9.018 -3.427 12.080 1.00 0.00 N ATOM 784 NH2 ARG A 51 6.954 -2.474 12.381 1.00 0.00 N ATOM 0 H ARG A 51 9.438 -0.808 6.268 1.00 0.00 H new ATOM 0 HA ARG A 51 11.360 -2.608 7.196 1.00 0.00 H new ATOM 0 HB2 ARG A 51 8.684 -3.347 5.973 1.00 0.00 H new ATOM 0 HB3 ARG A 51 9.573 -4.222 7.204 1.00 0.00 H new ATOM 0 HG2 ARG A 51 8.883 -1.420 7.901 1.00 0.00 H new ATOM 0 HG3 ARG A 51 7.517 -2.500 7.706 1.00 0.00 H new ATOM 0 HD2 ARG A 51 8.891 -4.140 9.225 1.00 0.00 H new ATOM 0 HD3 ARG A 51 9.825 -2.719 9.648 1.00 0.00 H new ATOM 0 HE ARG A 51 6.975 -2.226 9.907 1.00 0.00 H new ATOM 0 HH11 ARG A 51 9.774 -3.723 11.463 1.00 0.00 H new ATOM 0 HH12 ARG A 51 9.096 -3.570 13.087 1.00 0.00 H new ATOM 0 HH21 ARG A 51 6.117 -2.035 11.997 1.00 0.00 H new ATOM 0 HH22 ARG A 51 7.037 -2.619 13.387 1.00 0.00 H new ATOM 798 N LEU A 52 10.388 -3.192 4.082 1.00 0.00 N ATOM 799 CA LEU A 52 10.775 -3.818 2.820 1.00 0.00 C ATOM 800 C LEU A 52 12.204 -3.442 2.433 1.00 0.00 C ATOM 801 O LEU A 52 12.889 -4.200 1.746 1.00 0.00 O ATOM 802 CB LEU A 52 9.811 -3.403 1.708 1.00 0.00 C ATOM 803 CG LEU A 52 8.339 -3.716 1.974 1.00 0.00 C ATOM 804 CD1 LEU A 52 7.443 -2.896 1.059 1.00 0.00 C ATOM 805 CD2 LEU A 52 8.070 -5.202 1.795 1.00 0.00 C ATOM 0 H LEU A 52 9.480 -2.728 4.059 1.00 0.00 H new ATOM 0 HA LEU A 52 10.729 -4.899 2.953 1.00 0.00 H new ATOM 0 HB2 LEU A 52 9.914 -2.331 1.541 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.111 -3.899 0.785 1.00 0.00 H new ATOM 0 HG LEU A 52 8.111 -3.447 3.005 1.00 0.00 H new ATOM 0 HD11 LEU A 52 6.399 -3.133 1.264 1.00 0.00 H new ATOM 0 HD12 LEU A 52 7.615 -1.835 1.237 1.00 0.00 H new ATOM 0 HD13 LEU A 52 7.671 -3.132 0.020 1.00 0.00 H new ATOM 0 HD21 LEU A 52 7.017 -5.407 1.988 1.00 0.00 H new ATOM 0 HD22 LEU A 52 8.316 -5.496 0.774 1.00 0.00 H new ATOM 0 HD23 LEU A 52 8.684 -5.770 2.494 1.00 0.00 H new ATOM 817 N GLU A 53 12.647 -2.268 2.873 1.00 0.00 N ATOM 818 CA GLU A 53 13.993 -1.796 2.563 1.00 0.00 C ATOM 819 C GLU A 53 15.046 -2.543 3.379 1.00 0.00 C ATOM 820 O GLU A 53 15.979 -3.122 2.823 1.00 0.00 O ATOM 821 CB GLU A 53 14.101 -0.293 2.827 1.00 0.00 C ATOM 822 CG GLU A 53 13.868 0.560 1.591 1.00 0.00 C ATOM 823 CD GLU A 53 13.796 2.040 1.910 1.00 0.00 C ATOM 824 OE1 GLU A 53 12.960 2.427 2.754 1.00 0.00 O ATOM 825 OE2 GLU A 53 14.577 2.815 1.317 1.00 0.00 O ATOM 0 H GLU A 53 12.095 -1.627 3.444 1.00 0.00 H new ATOM 0 HA GLU A 53 14.179 -1.991 1.507 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.377 -0.014 3.592 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.090 -0.073 3.229 1.00 0.00 H new ATOM 0 HG2 GLU A 53 14.672 0.385 0.876 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.940 0.250 1.110 1.00 0.00 H new ATOM 832 N ARG A 54 14.896 -2.518 4.700 1.00 0.00 N ATOM 833 CA ARG A 54 15.841 -3.183 5.593 1.00 0.00 C ATOM 834 C ARG A 54 15.638 -4.696 5.604 1.00 0.00 C ATOM 835 O ARG A 54 16.553 -5.451 5.932 1.00 0.00 O ATOM 836 CB ARG A 54 15.698 -2.635 7.014 1.00 0.00 C ATOM 837 CG ARG A 54 14.258 -2.566 7.500 1.00 0.00 C ATOM 838 CD ARG A 54 14.073 -3.294 8.824 1.00 0.00 C ATOM 839 NE ARG A 54 13.787 -2.372 9.920 1.00 0.00 N ATOM 840 CZ ARG A 54 13.245 -2.742 11.078 1.00 0.00 C ATOM 841 NH1 ARG A 54 12.931 -4.013 11.296 1.00 0.00 N ATOM 842 NH2 ARG A 54 13.017 -1.839 12.022 1.00 0.00 N ATOM 0 H ARG A 54 14.129 -2.044 5.177 1.00 0.00 H new ATOM 0 HA ARG A 54 16.845 -2.979 5.220 1.00 0.00 H new ATOM 0 HB2 ARG A 54 16.273 -3.262 7.696 1.00 0.00 H new ATOM 0 HB3 ARG A 54 16.134 -1.637 7.055 1.00 0.00 H new ATOM 0 HG2 ARG A 54 13.962 -1.523 7.614 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.600 -3.003 6.749 1.00 0.00 H new ATOM 0 HD2 ARG A 54 13.258 -4.012 8.732 1.00 0.00 H new ATOM 0 HD3 ARG A 54 14.974 -3.862 9.054 1.00 0.00 H new ATOM 0 HE ARG A 54 14.016 -1.387 9.790 1.00 0.00 H new ATOM 0 HH11 ARG A 54 13.105 -4.712 10.574 1.00 0.00 H new ATOM 0 HH12 ARG A 54 12.516 -4.290 12.185 1.00 0.00 H new ATOM 0 HH21 ARG A 54 13.257 -0.861 11.861 1.00 0.00 H new ATOM 0 HH22 ARG A 54 12.602 -2.123 12.909 1.00 0.00 H new ATOM 856 N ASP A 55 14.436 -5.134 5.249 1.00 0.00 N ATOM 857 CA ASP A 55 14.118 -6.557 5.223 1.00 0.00 C ATOM 858 C ASP A 55 14.599 -7.199 3.930 1.00 0.00 C ATOM 859 O ASP A 55 15.198 -8.274 3.941 1.00 0.00 O ATOM 860 CB ASP A 55 12.611 -6.770 5.383 1.00 0.00 C ATOM 861 CG ASP A 55 12.285 -8.003 6.203 1.00 0.00 C ATOM 862 OD1 ASP A 55 12.197 -7.885 7.443 1.00 0.00 O ATOM 863 OD2 ASP A 55 12.119 -9.086 5.604 1.00 0.00 O ATOM 0 H ASP A 55 13.665 -4.525 4.975 1.00 0.00 H new ATOM 0 HA ASP A 55 14.635 -7.032 6.057 1.00 0.00 H new ATOM 0 HB2 ASP A 55 12.172 -5.894 5.859 1.00 0.00 H new ATOM 0 HB3 ASP A 55 12.153 -6.861 4.398 1.00 0.00 H new ATOM 868 N VAL A 56 14.335 -6.531 2.814 1.00 0.00 N ATOM 869 CA VAL A 56 14.742 -7.031 1.511 1.00 0.00 C ATOM 870 C VAL A 56 16.171 -6.611 1.193 1.00 0.00 C ATOM 871 O VAL A 56 16.897 -7.314 0.489 1.00 0.00 O ATOM 872 CB VAL A 56 13.811 -6.516 0.400 1.00 0.00 C ATOM 873 CG1 VAL A 56 14.134 -7.193 -0.921 1.00 0.00 C ATOM 874 CG2 VAL A 56 12.354 -6.734 0.782 1.00 0.00 C ATOM 0 H VAL A 56 13.840 -5.640 2.787 1.00 0.00 H new ATOM 0 HA VAL A 56 14.682 -8.119 1.551 1.00 0.00 H new ATOM 0 HB VAL A 56 13.973 -5.445 0.280 1.00 0.00 H new ATOM 0 HG11 VAL A 56 13.466 -6.817 -1.696 1.00 0.00 H new ATOM 0 HG12 VAL A 56 15.166 -6.979 -1.197 1.00 0.00 H new ATOM 0 HG13 VAL A 56 14.002 -8.270 -0.820 1.00 0.00 H new ATOM 0 HG21 VAL A 56 11.710 -6.364 -0.015 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.172 -7.798 0.931 1.00 0.00 H new ATOM 0 HG23 VAL A 56 12.135 -6.196 1.704 1.00 0.00 H new ATOM 884 N GLY A 57 16.565 -5.457 1.717 1.00 0.00 N ATOM 885 CA GLY A 57 17.906 -4.954 1.482 1.00 0.00 C ATOM 886 C GLY A 57 18.031 -4.219 0.160 1.00 0.00 C ATOM 887 O GLY A 57 19.109 -3.738 -0.188 1.00 0.00 O ATOM 0 H GLY A 57 15.980 -4.860 2.301 1.00 0.00 H new ATOM 0 HA2 GLY A 57 18.186 -4.283 2.294 1.00 0.00 H new ATOM 0 HA3 GLY A 57 18.610 -5.786 1.499 1.00 0.00 H new ATOM 891 N SER A 58 16.929 -4.130 -0.581 1.00 0.00 N ATOM 892 CA SER A 58 16.928 -3.447 -1.869 1.00 0.00 C ATOM 893 C SER A 58 16.273 -2.074 -1.755 1.00 0.00 C ATOM 894 O SER A 58 15.382 -1.868 -0.931 1.00 0.00 O ATOM 895 CB SER A 58 16.198 -4.291 -2.916 1.00 0.00 C ATOM 896 OG SER A 58 17.115 -5.017 -3.716 1.00 0.00 O ATOM 0 H SER A 58 16.027 -4.522 -0.311 1.00 0.00 H new ATOM 0 HA SER A 58 17.963 -3.310 -2.182 1.00 0.00 H new ATOM 0 HB2 SER A 58 15.517 -4.982 -2.420 1.00 0.00 H new ATOM 0 HB3 SER A 58 15.590 -3.645 -3.549 1.00 0.00 H new ATOM 0 HG SER A 58 16.623 -5.549 -4.376 1.00 0.00 H new ATOM 902 N THR A 59 16.721 -1.140 -2.586 1.00 0.00 N ATOM 903 CA THR A 59 16.179 0.214 -2.578 1.00 0.00 C ATOM 904 C THR A 59 14.792 0.244 -3.212 1.00 0.00 C ATOM 905 O THR A 59 14.634 -0.041 -4.398 1.00 0.00 O ATOM 906 CB THR A 59 17.115 1.170 -3.323 1.00 0.00 C ATOM 907 OG1 THR A 59 18.188 0.462 -3.920 1.00 0.00 O ATOM 908 CG2 THR A 59 17.712 2.237 -2.431 1.00 0.00 C ATOM 0 H THR A 59 17.458 -1.295 -3.274 1.00 0.00 H new ATOM 0 HA THR A 59 16.095 0.539 -1.541 1.00 0.00 H new ATOM 0 HB THR A 59 16.493 1.652 -4.077 1.00 0.00 H new ATOM 0 HG1 THR A 59 17.861 -0.027 -4.704 1.00 0.00 H new ATOM 0 HG21 THR A 59 18.365 2.881 -3.021 1.00 0.00 H new ATOM 0 HG22 THR A 59 16.912 2.835 -1.993 1.00 0.00 H new ATOM 0 HG23 THR A 59 18.289 1.765 -1.636 1.00 0.00 H new ATOM 916 N ILE A 60 13.788 0.595 -2.413 1.00 0.00 N ATOM 917 CA ILE A 60 12.417 0.663 -2.900 1.00 0.00 C ATOM 918 C ILE A 60 12.256 1.801 -3.911 1.00 0.00 C ATOM 919 O ILE A 60 12.656 2.935 -3.645 1.00 0.00 O ATOM 920 CB ILE A 60 11.418 0.857 -1.740 1.00 0.00 C ATOM 921 CG1 ILE A 60 9.985 0.673 -2.237 1.00 0.00 C ATOM 922 CG2 ILE A 60 11.590 2.228 -1.099 1.00 0.00 C ATOM 923 CD1 ILE A 60 9.486 -0.753 -2.126 1.00 0.00 C ATOM 0 H ILE A 60 13.899 0.836 -1.428 1.00 0.00 H new ATOM 0 HA ILE A 60 12.199 -0.286 -3.391 1.00 0.00 H new ATOM 0 HB ILE A 60 11.623 0.101 -0.982 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.324 1.326 -1.667 1.00 0.00 H new ATOM 0 HG13 ILE A 60 9.926 0.990 -3.278 1.00 0.00 H new ATOM 0 HG21 ILE A 60 10.875 2.341 -0.284 1.00 0.00 H new ATOM 0 HG22 ILE A 60 12.603 2.322 -0.708 1.00 0.00 H new ATOM 0 HG23 ILE A 60 11.415 3.003 -1.845 1.00 0.00 H new ATOM 0 HD11 ILE A 60 8.462 -0.810 -2.496 1.00 0.00 H new ATOM 0 HD12 ILE A 60 10.124 -1.409 -2.719 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.512 -1.068 -1.083 1.00 0.00 H new ATOM 935 N PRO A 61 11.679 1.515 -5.093 1.00 0.00 N ATOM 936 CA PRO A 61 11.485 2.518 -6.140 1.00 0.00 C ATOM 937 C PRO A 61 10.207 3.336 -5.963 1.00 0.00 C ATOM 938 O PRO A 61 9.483 3.583 -6.927 1.00 0.00 O ATOM 939 CB PRO A 61 11.402 1.665 -7.402 1.00 0.00 C ATOM 940 CG PRO A 61 10.772 0.389 -6.950 1.00 0.00 C ATOM 941 CD PRO A 61 11.183 0.189 -5.512 1.00 0.00 C ATOM 0 HA PRO A 61 12.281 3.263 -6.145 1.00 0.00 H new ATOM 0 HB2 PRO A 61 10.804 2.152 -8.172 1.00 0.00 H new ATOM 0 HB3 PRO A 61 12.390 1.491 -7.829 1.00 0.00 H new ATOM 0 HG2 PRO A 61 9.687 0.440 -7.039 1.00 0.00 H new ATOM 0 HG3 PRO A 61 11.103 -0.446 -7.567 1.00 0.00 H new ATOM 0 HD2 PRO A 61 10.342 -0.135 -4.898 1.00 0.00 H new ATOM 0 HD3 PRO A 61 11.957 -0.573 -5.421 1.00 0.00 H new ATOM 949 N TYR A 62 9.933 3.756 -4.732 1.00 0.00 N ATOM 950 CA TYR A 62 8.741 4.549 -4.446 1.00 0.00 C ATOM 951 C TYR A 62 9.078 5.764 -3.588 1.00 0.00 C ATOM 952 O TYR A 62 10.098 5.791 -2.901 1.00 0.00 O ATOM 953 CB TYR A 62 7.693 3.692 -3.738 1.00 0.00 C ATOM 954 CG TYR A 62 7.129 2.588 -4.600 1.00 0.00 C ATOM 955 CD1 TYR A 62 6.407 2.877 -5.750 1.00 0.00 C ATOM 956 CD2 TYR A 62 7.316 1.256 -4.259 1.00 0.00 C ATOM 957 CE1 TYR A 62 5.887 1.868 -6.538 1.00 0.00 C ATOM 958 CE2 TYR A 62 6.798 0.240 -5.039 1.00 0.00 C ATOM 959 CZ TYR A 62 6.085 0.552 -6.177 1.00 0.00 C ATOM 960 OH TYR A 62 5.562 -0.454 -6.955 1.00 0.00 O ATOM 0 H TYR A 62 10.517 3.562 -3.919 1.00 0.00 H new ATOM 0 HA TYR A 62 8.339 4.901 -5.396 1.00 0.00 H new ATOM 0 HB2 TYR A 62 8.138 3.253 -2.846 1.00 0.00 H new ATOM 0 HB3 TYR A 62 6.877 4.333 -3.404 1.00 0.00 H new ATOM 0 HD1 TYR A 62 6.249 3.907 -6.033 1.00 0.00 H new ATOM 0 HD2 TYR A 62 7.876 1.009 -3.369 1.00 0.00 H new ATOM 0 HE1 TYR A 62 5.329 2.109 -7.431 1.00 0.00 H new ATOM 0 HE2 TYR A 62 6.951 -0.792 -4.759 1.00 0.00 H new ATOM 0 HH TYR A 62 4.602 -0.305 -7.080 1.00 0.00 H new ATOM 970 N ASP A 63 8.204 6.765 -3.627 1.00 0.00 N ATOM 971 CA ASP A 63 8.394 7.985 -2.850 1.00 0.00 C ATOM 972 C ASP A 63 7.362 8.069 -1.730 1.00 0.00 C ATOM 973 O ASP A 63 6.236 7.597 -1.878 1.00 0.00 O ATOM 974 CB ASP A 63 8.290 9.216 -3.752 1.00 0.00 C ATOM 975 CG ASP A 63 9.640 9.669 -4.274 1.00 0.00 C ATOM 976 OD1 ASP A 63 10.603 9.696 -3.481 1.00 0.00 O ATOM 977 OD2 ASP A 63 9.732 9.996 -5.475 1.00 0.00 O ATOM 0 H ASP A 63 7.354 6.755 -4.191 1.00 0.00 H new ATOM 0 HA ASP A 63 9.390 7.958 -2.408 1.00 0.00 H new ATOM 0 HB2 ASP A 63 7.635 8.991 -4.594 1.00 0.00 H new ATOM 0 HB3 ASP A 63 7.827 10.031 -3.197 1.00 0.00 H new ATOM 982 N PHE A 64 7.753 8.667 -0.609 1.00 0.00 N ATOM 983 CA PHE A 64 6.854 8.801 0.532 1.00 0.00 C ATOM 984 C PHE A 64 7.178 10.050 1.351 1.00 0.00 C ATOM 985 O PHE A 64 8.066 10.028 2.203 1.00 0.00 O ATOM 986 CB PHE A 64 6.948 7.559 1.421 1.00 0.00 C ATOM 987 CG PHE A 64 5.613 7.039 1.871 1.00 0.00 C ATOM 988 CD1 PHE A 64 4.928 7.655 2.907 1.00 0.00 C ATOM 989 CD2 PHE A 64 5.045 5.933 1.261 1.00 0.00 C ATOM 990 CE1 PHE A 64 3.701 7.178 3.325 1.00 0.00 C ATOM 991 CE2 PHE A 64 3.818 5.451 1.674 1.00 0.00 C ATOM 992 CZ PHE A 64 3.146 6.074 2.707 1.00 0.00 C ATOM 0 H PHE A 64 8.681 9.065 -0.466 1.00 0.00 H new ATOM 0 HA PHE A 64 5.838 8.899 0.150 1.00 0.00 H new ATOM 0 HB2 PHE A 64 7.471 6.772 0.877 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.551 7.795 2.298 1.00 0.00 H new ATOM 0 HD1 PHE A 64 5.359 8.518 3.393 1.00 0.00 H new ATOM 0 HD2 PHE A 64 5.567 5.442 0.453 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.177 7.667 4.133 1.00 0.00 H new ATOM 0 HE2 PHE A 64 3.385 4.588 1.190 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.187 5.698 3.032 1.00 0.00 H new ATOM 1002 N PRO A 65 6.458 11.160 1.107 1.00 0.00 N ATOM 1003 CA PRO A 65 6.675 12.414 1.830 1.00 0.00 C ATOM 1004 C PRO A 65 6.047 12.393 3.221 1.00 0.00 C ATOM 1005 O PRO A 65 4.825 12.371 3.359 1.00 0.00 O ATOM 1006 CB PRO A 65 5.980 13.445 0.945 1.00 0.00 C ATOM 1007 CG PRO A 65 4.877 12.691 0.286 1.00 0.00 C ATOM 1008 CD PRO A 65 5.375 11.279 0.109 1.00 0.00 C ATOM 0 HA PRO A 65 7.732 12.617 1.999 1.00 0.00 H new ATOM 0 HB2 PRO A 65 5.595 14.278 1.534 1.00 0.00 H new ATOM 0 HB3 PRO A 65 6.667 13.865 0.211 1.00 0.00 H new ATOM 0 HG2 PRO A 65 3.974 12.711 0.896 1.00 0.00 H new ATOM 0 HG3 PRO A 65 4.622 13.137 -0.676 1.00 0.00 H new ATOM 0 HD2 PRO A 65 4.584 10.550 0.288 1.00 0.00 H new ATOM 0 HD3 PRO A 65 5.743 11.108 -0.903 1.00 0.00 H new ATOM 1016 N GLU A 66 6.892 12.396 4.247 1.00 0.00 N ATOM 1017 CA GLU A 66 6.417 12.373 5.627 1.00 0.00 C ATOM 1018 C GLU A 66 5.858 13.733 6.036 1.00 0.00 C ATOM 1019 O GLU A 66 6.253 14.767 5.496 1.00 0.00 O ATOM 1020 CB GLU A 66 7.552 11.967 6.571 1.00 0.00 C ATOM 1021 CG GLU A 66 7.443 10.534 7.069 1.00 0.00 C ATOM 1022 CD GLU A 66 7.034 10.454 8.527 1.00 0.00 C ATOM 1023 OE1 GLU A 66 6.296 11.351 8.988 1.00 0.00 O ATOM 1024 OE2 GLU A 66 7.450 9.494 9.209 1.00 0.00 O ATOM 0 H GLU A 66 7.907 12.414 4.150 1.00 0.00 H new ATOM 0 HA GLU A 66 5.615 11.638 5.697 1.00 0.00 H new ATOM 0 HB2 GLU A 66 8.505 12.093 6.056 1.00 0.00 H new ATOM 0 HB3 GLU A 66 7.561 12.641 7.427 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.715 9.996 6.461 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.402 10.033 6.936 1.00 0.00 H new ATOM 1031 N LYS A 67 4.938 13.722 6.995 1.00 0.00 N ATOM 1032 CA LYS A 67 4.321 14.952 7.480 1.00 0.00 C ATOM 1033 C LYS A 67 4.366 15.019 9.006 1.00 0.00 C ATOM 1034 O LYS A 67 3.590 14.346 9.685 1.00 0.00 O ATOM 1035 CB LYS A 67 2.872 15.043 6.998 1.00 0.00 C ATOM 1036 CG LYS A 67 2.088 13.754 7.178 1.00 0.00 C ATOM 1037 CD LYS A 67 0.594 13.984 7.016 1.00 0.00 C ATOM 1038 CE LYS A 67 0.197 14.054 5.551 1.00 0.00 C ATOM 1039 NZ LYS A 67 -1.231 14.439 5.380 1.00 0.00 N ATOM 0 H LYS A 67 4.603 12.874 7.452 1.00 0.00 H new ATOM 0 HA LYS A 67 4.885 15.795 7.080 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.368 15.844 7.539 1.00 0.00 H new ATOM 0 HB3 LYS A 67 2.866 15.318 5.943 1.00 0.00 H new ATOM 0 HG2 LYS A 67 2.425 13.017 6.449 1.00 0.00 H new ATOM 0 HG3 LYS A 67 2.289 13.340 8.166 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.046 13.178 7.505 1.00 0.00 H new ATOM 0 HD3 LYS A 67 0.311 14.911 7.515 1.00 0.00 H new ATOM 0 HE2 LYS A 67 0.832 14.776 5.037 1.00 0.00 H new ATOM 0 HE3 LYS A 67 0.371 13.086 5.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -1.462 14.475 4.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -1.838 13.737 5.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.392 15.374 5.805 1.00 0.00 H new ATOM 1053 N PRO A 68 5.277 15.833 9.571 1.00 0.00 N ATOM 1054 CA PRO A 68 5.411 15.977 11.025 1.00 0.00 C ATOM 1055 C PRO A 68 4.079 16.279 11.702 1.00 0.00 C ATOM 1056 O PRO A 68 3.182 16.865 11.098 1.00 0.00 O ATOM 1057 CB PRO A 68 6.368 17.161 11.178 1.00 0.00 C ATOM 1058 CG PRO A 68 7.168 17.164 9.922 1.00 0.00 C ATOM 1059 CD PRO A 68 6.244 16.675 8.841 1.00 0.00 C ATOM 0 HA PRO A 68 5.767 15.060 11.494 1.00 0.00 H new ATOM 0 HB2 PRO A 68 5.823 18.097 11.303 1.00 0.00 H new ATOM 0 HB3 PRO A 68 7.006 17.044 12.054 1.00 0.00 H new ATOM 0 HG2 PRO A 68 7.537 18.165 9.697 1.00 0.00 H new ATOM 0 HG3 PRO A 68 8.040 16.516 10.013 1.00 0.00 H new ATOM 0 HD2 PRO A 68 5.751 17.502 8.330 1.00 0.00 H new ATOM 0 HD3 PRO A 68 6.780 16.105 8.082 1.00 0.00 H new ATOM 1067 N GLY A 69 3.956 15.872 12.963 1.00 0.00 N ATOM 1068 CA GLY A 69 2.729 16.108 13.700 1.00 0.00 C ATOM 1069 C GLY A 69 2.961 16.224 15.194 1.00 0.00 C ATOM 1070 O GLY A 69 2.621 15.317 15.953 1.00 0.00 O ATOM 0 H GLY A 69 4.683 15.384 13.486 1.00 0.00 H new ATOM 0 HA2 GLY A 69 2.261 17.023 13.336 1.00 0.00 H new ATOM 0 HA3 GLY A 69 2.031 15.294 13.506 1.00 0.00 H new ATOM 1074 N VAL A 70 3.538 17.343 15.615 1.00 0.00 N ATOM 1075 CA VAL A 70 3.813 17.575 17.028 1.00 0.00 C ATOM 1076 C VAL A 70 2.758 18.490 17.648 1.00 0.00 C ATOM 1077 O VAL A 70 1.841 18.024 18.326 1.00 0.00 O ATOM 1078 CB VAL A 70 5.215 18.189 17.234 1.00 0.00 C ATOM 1079 CG1 VAL A 70 5.463 18.496 18.704 1.00 0.00 C ATOM 1080 CG2 VAL A 70 6.288 17.258 16.690 1.00 0.00 C ATOM 0 H VAL A 70 3.824 18.104 14.999 1.00 0.00 H new ATOM 0 HA VAL A 70 3.780 16.606 17.526 1.00 0.00 H new ATOM 0 HB VAL A 70 5.261 19.128 16.682 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.457 18.927 18.823 1.00 0.00 H new ATOM 0 HG12 VAL A 70 4.715 19.205 19.059 1.00 0.00 H new ATOM 0 HG13 VAL A 70 5.395 17.576 19.284 1.00 0.00 H new ATOM 0 HG21 VAL A 70 7.270 17.706 16.843 1.00 0.00 H new ATOM 0 HG22 VAL A 70 6.239 16.302 17.212 1.00 0.00 H new ATOM 0 HG23 VAL A 70 6.125 17.098 15.624 1.00 0.00 H new ATOM 1090 N LEU A 71 2.891 19.792 17.413 1.00 0.00 N ATOM 1091 CA LEU A 71 1.946 20.766 17.949 1.00 0.00 C ATOM 1092 C LEU A 71 1.307 21.578 16.826 1.00 0.00 C ATOM 1093 O LEU A 71 1.099 22.784 16.959 1.00 0.00 O ATOM 1094 CB LEU A 71 2.650 21.700 18.935 1.00 0.00 C ATOM 1095 CG LEU A 71 1.807 22.127 20.138 1.00 0.00 C ATOM 1096 CD1 LEU A 71 0.518 22.792 19.679 1.00 0.00 C ATOM 1097 CD2 LEU A 71 1.502 20.929 21.026 1.00 0.00 C ATOM 0 H LEU A 71 3.643 20.197 16.855 1.00 0.00 H new ATOM 0 HA LEU A 71 1.159 20.223 18.473 1.00 0.00 H new ATOM 0 HB2 LEU A 71 3.551 21.206 19.299 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.970 22.594 18.400 1.00 0.00 H new ATOM 0 HG LEU A 71 2.379 22.851 20.719 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -0.068 23.089 20.549 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.755 23.674 19.084 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.058 22.091 19.075 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.902 21.250 21.877 1.00 0.00 H new ATOM 0 HD22 LEU A 71 0.950 20.183 20.454 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.435 20.494 21.384 1.00 0.00 H new ATOM 1109 N ASP A 72 0.999 20.907 15.722 1.00 0.00 N ATOM 1110 CA ASP A 72 0.384 21.565 14.574 1.00 0.00 C ATOM 1111 C ASP A 72 -1.057 21.961 14.879 1.00 0.00 C ATOM 1112 O ASP A 72 -1.761 21.266 15.611 1.00 0.00 O ATOM 1113 CB ASP A 72 0.428 20.645 13.353 1.00 0.00 C ATOM 1114 CG ASP A 72 -0.400 19.387 13.544 1.00 0.00 C ATOM 1115 OD1 ASP A 72 -0.361 18.814 14.651 1.00 0.00 O ATOM 1116 OD2 ASP A 72 -1.087 18.978 12.583 1.00 0.00 O ATOM 0 H ASP A 72 1.165 19.908 15.597 1.00 0.00 H new ATOM 0 HA ASP A 72 0.949 22.472 14.359 1.00 0.00 H new ATOM 0 HB2 ASP A 72 0.064 21.187 12.480 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.462 20.368 13.148 1.00 0.00 H new ATOM 1121 N ARG A 73 -1.489 23.083 14.313 1.00 0.00 N ATOM 1122 CA ARG A 73 -2.847 23.572 14.523 1.00 0.00 C ATOM 1123 C ARG A 73 -3.243 24.568 13.440 1.00 0.00 C ATOM 1124 O ARG A 73 -4.351 24.515 12.907 1.00 0.00 O ATOM 1125 CB ARG A 73 -2.968 24.224 15.902 1.00 0.00 C ATOM 1126 CG ARG A 73 -3.045 23.225 17.045 1.00 0.00 C ATOM 1127 CD ARG A 73 -3.640 23.853 18.295 1.00 0.00 C ATOM 1128 NE ARG A 73 -5.074 23.594 18.408 1.00 0.00 N ATOM 1129 CZ ARG A 73 -5.597 22.383 18.585 1.00 0.00 C ATOM 1130 NH1 ARG A 73 -4.809 21.318 18.669 1.00 0.00 N ATOM 1131 NH2 ARG A 73 -6.911 22.238 18.680 1.00 0.00 N ATOM 0 H ARG A 73 -0.918 23.671 13.705 1.00 0.00 H new ATOM 0 HA ARG A 73 -3.525 22.720 14.470 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -2.112 24.879 16.061 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -3.858 24.853 15.920 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.650 22.370 16.743 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -2.047 22.846 17.266 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -3.130 23.461 19.175 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -3.466 24.929 18.278 1.00 0.00 H new ATOM 0 HE ARG A 73 -5.711 24.388 18.348 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -3.797 21.425 18.598 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -5.215 20.392 18.805 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -7.520 23.054 18.617 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -7.313 21.311 18.816 1.00 0.00 H new ATOM 1145 N ARG A 74 -2.328 25.475 13.121 1.00 0.00 N ATOM 1146 CA ARG A 74 -2.577 26.487 12.102 1.00 0.00 C ATOM 1147 C ARG A 74 -2.081 26.021 10.736 1.00 0.00 C ATOM 1148 O ARG A 74 -2.690 26.319 9.709 1.00 0.00 O ATOM 1149 CB ARG A 74 -1.896 27.803 12.484 1.00 0.00 C ATOM 1150 CG ARG A 74 -0.379 27.715 12.522 1.00 0.00 C ATOM 1151 CD ARG A 74 0.226 28.871 13.302 1.00 0.00 C ATOM 1152 NE ARG A 74 0.320 30.085 12.496 1.00 0.00 N ATOM 1153 CZ ARG A 74 1.094 31.123 12.807 1.00 0.00 C ATOM 1154 NH1 ARG A 74 1.838 31.099 13.905 1.00 0.00 N ATOM 1155 NH2 ARG A 74 1.122 32.189 12.018 1.00 0.00 N ATOM 0 H ARG A 74 -1.406 25.530 13.554 1.00 0.00 H new ATOM 0 HA ARG A 74 -3.653 26.647 12.041 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -2.189 28.574 11.772 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -2.258 28.119 13.462 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -0.079 26.771 12.977 1.00 0.00 H new ATOM 0 HG3 ARG A 74 0.012 27.717 11.505 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -0.380 29.069 14.186 1.00 0.00 H new ATOM 0 HD3 ARG A 74 1.219 28.591 13.653 1.00 0.00 H new ATOM 0 HE ARG A 74 -0.240 30.141 11.645 1.00 0.00 H new ATOM 0 HH11 ARG A 74 1.819 30.283 14.516 1.00 0.00 H new ATOM 0 HH12 ARG A 74 2.429 31.897 14.138 1.00 0.00 H new ATOM 0 HH21 ARG A 74 0.551 32.213 11.173 1.00 0.00 H new ATOM 0 HH22 ARG A 74 1.715 32.984 12.256 1.00 0.00 H new ATOM 1169 N TRP A 75 -0.972 25.288 10.732 1.00 0.00 N ATOM 1170 CA TRP A 75 -0.397 24.783 9.490 1.00 0.00 C ATOM 1171 C TRP A 75 -0.800 23.329 9.253 1.00 0.00 C ATOM 1172 O TRP A 75 -0.074 22.572 8.608 1.00 0.00 O ATOM 1173 CB TRP A 75 1.129 24.908 9.520 1.00 0.00 C ATOM 1174 CG TRP A 75 1.794 23.941 10.454 1.00 0.00 C ATOM 1175 CD1 TRP A 75 1.776 23.975 11.819 1.00 0.00 C ATOM 1176 CD2 TRP A 75 2.575 22.798 10.090 1.00 0.00 C ATOM 1177 NE1 TRP A 75 2.498 22.921 12.325 1.00 0.00 N ATOM 1178 CE2 TRP A 75 2.999 22.185 11.283 1.00 0.00 C ATOM 1179 CE3 TRP A 75 2.957 22.231 8.870 1.00 0.00 C ATOM 1180 CZ2 TRP A 75 3.784 21.035 11.292 1.00 0.00 C ATOM 1181 CZ3 TRP A 75 3.736 21.090 8.880 1.00 0.00 C ATOM 1182 CH2 TRP A 75 4.142 20.502 10.084 1.00 0.00 C ATOM 0 H TRP A 75 -0.455 25.031 11.573 1.00 0.00 H new ATOM 0 HA TRP A 75 -0.786 25.385 8.668 1.00 0.00 H new ATOM 0 HB2 TRP A 75 1.517 24.753 8.513 1.00 0.00 H new ATOM 0 HB3 TRP A 75 1.396 25.924 9.812 1.00 0.00 H new ATOM 0 HD1 TRP A 75 1.269 24.721 12.413 1.00 0.00 H new ATOM 0 HE1 TRP A 75 2.638 22.719 13.315 1.00 0.00 H new ATOM 0 HE3 TRP A 75 2.648 22.677 7.936 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 4.099 20.580 12.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 4.037 20.644 7.943 1.00 0.00 H new ATOM 0 HH2 TRP A 75 4.750 19.610 10.059 1.00 0.00 H new ATOM 1193 N GLN A 76 -1.959 22.946 9.778 1.00 0.00 N ATOM 1194 CA GLN A 76 -2.454 21.583 9.622 1.00 0.00 C ATOM 1195 C GLN A 76 -3.776 21.567 8.862 1.00 0.00 C ATOM 1196 O GLN A 76 -4.703 22.308 9.191 1.00 0.00 O ATOM 1197 CB GLN A 76 -2.631 20.923 10.989 1.00 0.00 C ATOM 1198 CG GLN A 76 -3.657 21.615 11.871 1.00 0.00 C ATOM 1199 CD GLN A 76 -5.064 21.094 11.649 1.00 0.00 C ATOM 1200 OE1 GLN A 76 -5.268 20.109 10.939 1.00 0.00 O ATOM 1201 NE2 GLN A 76 -6.043 21.755 12.256 1.00 0.00 N ATOM 0 H GLN A 76 -2.573 23.559 10.315 1.00 0.00 H new ATOM 0 HA GLN A 76 -1.719 21.020 9.047 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -2.929 19.884 10.846 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -1.671 20.911 11.504 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -3.383 21.477 12.917 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -3.635 22.687 11.675 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -5.828 22.566 12.835 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -7.010 21.451 12.143 1.00 0.00 H new ATOM 1210 N ARG A 77 -3.856 20.717 7.845 1.00 0.00 N ATOM 1211 CA ARG A 77 -5.065 20.601 7.038 1.00 0.00 C ATOM 1212 C ARG A 77 -6.018 19.572 7.637 1.00 0.00 C ATOM 1213 O ARG A 77 -5.624 18.760 8.473 1.00 0.00 O ATOM 1214 CB ARG A 77 -4.711 20.211 5.602 1.00 0.00 C ATOM 1215 CG ARG A 77 -3.547 21.004 5.026 1.00 0.00 C ATOM 1216 CD ARG A 77 -2.374 20.103 4.675 1.00 0.00 C ATOM 1217 NE ARG A 77 -2.289 19.848 3.238 1.00 0.00 N ATOM 1218 CZ ARG A 77 -1.583 18.857 2.700 1.00 0.00 C ATOM 1219 NH1 ARG A 77 -0.899 18.024 3.476 1.00 0.00 N ATOM 1220 NH2 ARG A 77 -1.560 18.696 1.384 1.00 0.00 N ATOM 0 H ARG A 77 -3.098 20.098 7.559 1.00 0.00 H new ATOM 0 HA ARG A 77 -5.562 21.571 7.030 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -4.467 19.149 5.572 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -5.587 20.355 4.969 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -3.876 21.538 4.134 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -3.226 21.756 5.747 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -1.448 20.565 5.017 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -2.473 19.156 5.206 1.00 0.00 H new ATOM 0 HE ARG A 77 -2.802 20.467 2.610 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -0.914 18.143 4.489 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -0.359 17.266 3.059 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -2.084 19.332 0.783 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -1.018 17.936 0.973 1.00 0.00 H new ATOM 1234 N ARG A 78 -7.273 19.612 7.202 1.00 0.00 N ATOM 1235 CA ARG A 78 -8.281 18.681 7.695 1.00 0.00 C ATOM 1236 C ARG A 78 -8.027 17.275 7.159 1.00 0.00 C ATOM 1237 O ARG A 78 -8.200 17.014 5.969 1.00 0.00 O ATOM 1238 CB ARG A 78 -9.681 19.152 7.294 1.00 0.00 C ATOM 1239 CG ARG A 78 -10.684 19.115 8.435 1.00 0.00 C ATOM 1240 CD ARG A 78 -10.289 20.061 9.557 1.00 0.00 C ATOM 1241 NE ARG A 78 -10.654 19.537 10.871 1.00 0.00 N ATOM 1242 CZ ARG A 78 -11.887 19.589 11.372 1.00 0.00 C ATOM 1243 NH1 ARG A 78 -12.873 20.134 10.673 1.00 0.00 N ATOM 1244 NH2 ARG A 78 -12.132 19.092 12.577 1.00 0.00 N ATOM 0 H ARG A 78 -7.616 20.278 6.510 1.00 0.00 H new ATOM 0 HA ARG A 78 -8.216 18.653 8.783 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -9.617 20.170 6.910 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -10.046 18.527 6.479 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -11.672 19.385 8.061 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -10.757 18.099 8.823 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -9.214 20.235 9.522 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -10.773 21.026 9.405 1.00 0.00 H new ATOM 0 HE ARG A 78 -9.923 19.107 11.437 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -12.690 20.517 9.745 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -13.815 20.170 11.063 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -11.377 18.671 13.118 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -13.076 19.131 12.963 1.00 0.00 H new ATOM 1258 N TYR A 79 -7.613 16.374 8.046 1.00 0.00 N ATOM 1259 CA TYR A 79 -7.333 14.994 7.663 1.00 0.00 C ATOM 1260 C TYR A 79 -8.513 14.378 6.912 1.00 0.00 C ATOM 1261 O TYR A 79 -8.340 13.453 6.118 1.00 0.00 O ATOM 1262 CB TYR A 79 -6.997 14.156 8.902 1.00 0.00 C ATOM 1263 CG TYR A 79 -8.199 13.795 9.749 1.00 0.00 C ATOM 1264 CD1 TYR A 79 -8.914 14.772 10.428 1.00 0.00 C ATOM 1265 CD2 TYR A 79 -8.616 12.475 9.866 1.00 0.00 C ATOM 1266 CE1 TYR A 79 -10.012 14.444 11.202 1.00 0.00 C ATOM 1267 CE2 TYR A 79 -9.712 12.138 10.638 1.00 0.00 C ATOM 1268 CZ TYR A 79 -10.407 13.126 11.303 1.00 0.00 C ATOM 1269 OH TYR A 79 -11.499 12.795 12.072 1.00 0.00 O ATOM 0 H TYR A 79 -7.464 16.575 9.035 1.00 0.00 H new ATOM 0 HA TYR A 79 -6.473 14.999 6.994 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -6.502 13.239 8.584 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -6.285 14.706 9.517 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -8.608 15.805 10.351 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -8.075 11.699 9.345 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -10.558 15.216 11.725 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -10.022 11.107 10.720 1.00 0.00 H new ATOM 0 HH TYR A 79 -12.106 12.228 11.552 1.00 0.00 H new ATOM 1279 N ASP A 80 -9.709 14.898 7.166 1.00 0.00 N ATOM 1280 CA ASP A 80 -10.913 14.399 6.512 1.00 0.00 C ATOM 1281 C ASP A 80 -11.289 15.271 5.317 1.00 0.00 C ATOM 1282 O ASP A 80 -12.452 15.329 4.921 1.00 0.00 O ATOM 1283 CB ASP A 80 -12.075 14.350 7.506 1.00 0.00 C ATOM 1284 CG ASP A 80 -12.378 15.709 8.107 1.00 0.00 C ATOM 1285 OD1 ASP A 80 -12.857 16.593 7.366 1.00 0.00 O ATOM 1286 OD2 ASP A 80 -12.136 15.889 9.319 1.00 0.00 O ATOM 0 H ASP A 80 -9.870 15.664 7.820 1.00 0.00 H new ATOM 0 HA ASP A 80 -10.707 13.391 6.152 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -12.965 13.972 7.003 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -11.837 13.647 8.305 1.00 0.00 H new ATOM 1291 N ASP A 81 -10.296 15.946 4.744 1.00 0.00 N ATOM 1292 CA ASP A 81 -10.527 16.813 3.594 1.00 0.00 C ATOM 1293 C ASP A 81 -10.396 16.028 2.288 1.00 0.00 C ATOM 1294 O ASP A 81 -9.306 15.577 1.937 1.00 0.00 O ATOM 1295 CB ASP A 81 -9.535 17.977 3.602 1.00 0.00 C ATOM 1296 CG ASP A 81 -9.980 19.122 2.713 1.00 0.00 C ATOM 1297 OD1 ASP A 81 -11.205 19.305 2.549 1.00 0.00 O ATOM 1298 OD2 ASP A 81 -9.104 19.837 2.183 1.00 0.00 O ATOM 0 H ASP A 81 -9.326 15.909 5.057 1.00 0.00 H new ATOM 0 HA ASP A 81 -11.541 17.207 3.662 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -9.413 18.339 4.623 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -8.559 17.622 3.271 1.00 0.00 H new ATOM 1303 N PRO A 82 -11.506 15.853 1.545 1.00 0.00 N ATOM 1304 CA PRO A 82 -11.495 15.117 0.276 1.00 0.00 C ATOM 1305 C PRO A 82 -10.530 15.723 -0.740 1.00 0.00 C ATOM 1306 O PRO A 82 -10.134 15.064 -1.701 1.00 0.00 O ATOM 1307 CB PRO A 82 -12.941 15.222 -0.228 1.00 0.00 C ATOM 1308 CG PRO A 82 -13.547 16.344 0.544 1.00 0.00 C ATOM 1309 CD PRO A 82 -12.851 16.356 1.873 1.00 0.00 C ATOM 0 HA PRO A 82 -11.158 14.090 0.413 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.971 15.421 -1.299 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -13.484 14.292 -0.061 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -13.412 17.293 0.024 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -14.620 16.198 0.667 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -12.814 17.358 2.301 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -13.355 15.718 2.599 1.00 0.00 H new ATOM 1317 N GLU A 83 -10.155 16.981 -0.524 1.00 0.00 N ATOM 1318 CA GLU A 83 -9.236 17.668 -1.426 1.00 0.00 C ATOM 1319 C GLU A 83 -7.855 17.022 -1.391 1.00 0.00 C ATOM 1320 O GLU A 83 -7.288 16.694 -2.434 1.00 0.00 O ATOM 1321 CB GLU A 83 -9.132 19.148 -1.053 1.00 0.00 C ATOM 1322 CG GLU A 83 -10.214 20.010 -1.682 1.00 0.00 C ATOM 1323 CD GLU A 83 -11.442 20.136 -0.801 1.00 0.00 C ATOM 1324 OE1 GLU A 83 -11.293 20.537 0.372 1.00 0.00 O ATOM 1325 OE2 GLU A 83 -12.554 19.834 -1.286 1.00 0.00 O ATOM 0 H GLU A 83 -10.472 17.544 0.265 1.00 0.00 H new ATOM 0 HA GLU A 83 -9.630 17.584 -2.439 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -9.186 19.246 0.031 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -8.156 19.524 -1.359 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -9.812 21.003 -1.883 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.502 19.582 -2.642 1.00 0.00 H new ATOM 1332 N MET A 84 -7.321 16.835 -0.188 1.00 0.00 N ATOM 1333 CA MET A 84 -6.008 16.221 -0.026 1.00 0.00 C ATOM 1334 C MET A 84 -6.119 14.701 -0.070 1.00 0.00 C ATOM 1335 O MET A 84 -5.196 14.012 -0.505 1.00 0.00 O ATOM 1336 CB MET A 84 -5.368 16.661 1.291 1.00 0.00 C ATOM 1337 CG MET A 84 -6.293 16.539 2.491 1.00 0.00 C ATOM 1338 SD MET A 84 -5.460 15.885 3.950 1.00 0.00 S ATOM 1339 CE MET A 84 -6.217 14.266 4.075 1.00 0.00 C ATOM 0 H MET A 84 -7.776 17.099 0.686 1.00 0.00 H new ATOM 0 HA MET A 84 -5.375 16.550 -0.850 1.00 0.00 H new ATOM 0 HB2 MET A 84 -4.475 16.061 1.469 1.00 0.00 H new ATOM 0 HB3 MET A 84 -5.043 17.697 1.198 1.00 0.00 H new ATOM 0 HG2 MET A 84 -6.709 17.519 2.724 1.00 0.00 H new ATOM 0 HG3 MET A 84 -7.130 15.890 2.234 1.00 0.00 H new ATOM 0 HE1 MET A 84 -5.766 13.716 4.901 1.00 0.00 H new ATOM 0 HE2 MET A 84 -7.286 14.377 4.254 1.00 0.00 H new ATOM 0 HE3 MET A 84 -6.060 13.718 3.146 1.00 0.00 H new ATOM 1349 N ILE A 85 -7.259 14.187 0.378 1.00 0.00 N ATOM 1350 CA ILE A 85 -7.502 12.752 0.384 1.00 0.00 C ATOM 1351 C ILE A 85 -7.549 12.206 -1.040 1.00 0.00 C ATOM 1352 O ILE A 85 -7.010 11.137 -1.326 1.00 0.00 O ATOM 1353 CB ILE A 85 -8.824 12.416 1.108 1.00 0.00 C ATOM 1354 CG1 ILE A 85 -8.738 12.820 2.580 1.00 0.00 C ATOM 1355 CG2 ILE A 85 -9.152 10.935 0.979 1.00 0.00 C ATOM 1356 CD1 ILE A 85 -10.090 12.977 3.243 1.00 0.00 C ATOM 0 H ILE A 85 -8.031 14.746 0.742 1.00 0.00 H new ATOM 0 HA ILE A 85 -6.678 12.282 0.920 1.00 0.00 H new ATOM 0 HB ILE A 85 -9.627 12.982 0.636 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -8.162 12.070 3.121 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -8.192 13.760 2.659 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -10.087 10.723 1.497 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -9.254 10.675 -0.075 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -8.350 10.345 1.422 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -9.953 13.264 4.285 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -10.661 13.748 2.726 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -10.631 12.032 3.195 1.00 0.00 H new ATOM 1368 N ASP A 86 -8.201 12.951 -1.928 1.00 0.00 N ATOM 1369 CA ASP A 86 -8.325 12.549 -3.326 1.00 0.00 C ATOM 1370 C ASP A 86 -6.958 12.250 -3.936 1.00 0.00 C ATOM 1371 O ASP A 86 -6.790 11.263 -4.652 1.00 0.00 O ATOM 1372 CB ASP A 86 -9.028 13.644 -4.131 1.00 0.00 C ATOM 1373 CG ASP A 86 -10.510 13.375 -4.304 1.00 0.00 C ATOM 1374 OD1 ASP A 86 -10.860 12.423 -5.031 1.00 0.00 O ATOM 1375 OD2 ASP A 86 -11.321 14.117 -3.711 1.00 0.00 O ATOM 0 H ASP A 86 -8.652 13.838 -1.704 1.00 0.00 H new ATOM 0 HA ASP A 86 -8.922 11.638 -3.363 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.892 14.603 -3.631 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.560 13.727 -5.112 1.00 0.00 H new ATOM 1380 N GLU A 87 -5.983 13.109 -3.647 1.00 0.00 N ATOM 1381 CA GLU A 87 -4.631 12.934 -4.169 1.00 0.00 C ATOM 1382 C GLU A 87 -3.865 11.896 -3.358 1.00 0.00 C ATOM 1383 O GLU A 87 -2.996 11.203 -3.883 1.00 0.00 O ATOM 1384 CB GLU A 87 -3.880 14.267 -4.159 1.00 0.00 C ATOM 1385 CG GLU A 87 -4.123 15.110 -5.400 1.00 0.00 C ATOM 1386 CD GLU A 87 -2.836 15.517 -6.092 1.00 0.00 C ATOM 1387 OE1 GLU A 87 -1.857 14.742 -6.027 1.00 0.00 O ATOM 1388 OE2 GLU A 87 -2.806 16.607 -6.699 1.00 0.00 O ATOM 0 H GLU A 87 -6.104 13.931 -3.056 1.00 0.00 H new ATOM 0 HA GLU A 87 -4.708 12.579 -5.197 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -4.178 14.836 -3.279 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -2.812 14.072 -4.065 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -4.745 14.550 -6.098 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -4.681 16.005 -5.123 1.00 0.00 H new ATOM 1395 N ARG A 88 -4.195 11.789 -2.078 1.00 0.00 N ATOM 1396 CA ARG A 88 -3.538 10.825 -1.206 1.00 0.00 C ATOM 1397 C ARG A 88 -3.934 9.399 -1.584 1.00 0.00 C ATOM 1398 O ARG A 88 -3.261 8.438 -1.212 1.00 0.00 O ATOM 1399 CB ARG A 88 -3.894 11.100 0.256 1.00 0.00 C ATOM 1400 CG ARG A 88 -3.259 12.366 0.807 1.00 0.00 C ATOM 1401 CD ARG A 88 -1.961 12.069 1.539 1.00 0.00 C ATOM 1402 NE ARG A 88 -0.981 13.141 1.375 1.00 0.00 N ATOM 1403 CZ ARG A 88 -0.135 13.227 0.349 1.00 0.00 C ATOM 1404 NH1 ARG A 88 -0.142 12.308 -0.607 1.00 0.00 N ATOM 1405 NH2 ARG A 88 0.719 14.239 0.279 1.00 0.00 N ATOM 0 H ARG A 88 -4.911 12.355 -1.622 1.00 0.00 H new ATOM 0 HA ARG A 88 -2.460 10.930 -1.331 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.977 11.176 0.350 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -3.580 10.251 0.864 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -3.066 13.062 -0.010 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -3.956 12.857 1.486 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -2.168 11.926 2.600 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -1.541 11.134 1.167 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.942 13.868 2.090 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -0.798 11.528 -0.560 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.509 12.381 -1.389 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.728 14.950 1.010 1.00 0.00 H new ATOM 0 HH22 ARG A 88 1.367 14.306 -0.506 1.00 0.00 H new ATOM 1419 N ARG A 89 -5.033 9.269 -2.323 1.00 0.00 N ATOM 1420 CA ARG A 89 -5.522 7.965 -2.748 1.00 0.00 C ATOM 1421 C ARG A 89 -4.584 7.325 -3.767 1.00 0.00 C ATOM 1422 O ARG A 89 -4.326 6.123 -3.711 1.00 0.00 O ATOM 1423 CB ARG A 89 -6.926 8.089 -3.340 1.00 0.00 C ATOM 1424 CG ARG A 89 -7.826 6.906 -3.024 1.00 0.00 C ATOM 1425 CD ARG A 89 -8.645 6.490 -4.233 1.00 0.00 C ATOM 1426 NE ARG A 89 -9.471 7.586 -4.733 1.00 0.00 N ATOM 1427 CZ ARG A 89 -9.801 7.749 -6.014 1.00 0.00 C ATOM 1428 NH1 ARG A 89 -9.398 6.878 -6.932 1.00 0.00 N ATOM 1429 NH2 ARG A 89 -10.543 8.786 -6.378 1.00 0.00 N ATOM 0 H ARG A 89 -5.601 10.055 -2.639 1.00 0.00 H new ATOM 0 HA ARG A 89 -5.559 7.323 -1.868 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -7.391 9.000 -2.963 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -6.847 8.196 -4.422 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -7.219 6.065 -2.688 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -8.494 7.165 -2.203 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -7.977 6.148 -5.024 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -9.282 5.647 -3.967 1.00 0.00 H new ATOM 0 HE ARG A 89 -9.817 8.270 -4.060 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -8.831 6.075 -6.659 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -9.656 7.012 -7.910 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -10.860 9.457 -5.678 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -10.797 8.913 -7.358 1.00 0.00 H new ATOM 1443 N ILE A 90 -4.068 8.128 -4.698 1.00 0.00 N ATOM 1444 CA ILE A 90 -3.156 7.605 -5.714 1.00 0.00 C ATOM 1445 C ILE A 90 -1.744 7.475 -5.155 1.00 0.00 C ATOM 1446 O ILE A 90 -1.365 8.185 -4.225 1.00 0.00 O ATOM 1447 CB ILE A 90 -3.114 8.469 -6.997 1.00 0.00 C ATOM 1448 CG1 ILE A 90 -3.215 9.967 -6.669 1.00 0.00 C ATOM 1449 CG2 ILE A 90 -4.210 8.037 -7.963 1.00 0.00 C ATOM 1450 CD1 ILE A 90 -4.634 10.490 -6.531 1.00 0.00 C ATOM 0 H ILE A 90 -4.262 9.127 -4.770 1.00 0.00 H new ATOM 0 HA ILE A 90 -3.545 6.625 -5.988 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.150 8.311 -7.482 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -2.679 10.159 -5.739 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.708 10.532 -7.451 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.168 8.654 -8.861 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -4.065 6.991 -8.234 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.183 8.156 -7.486 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -4.608 11.555 -6.299 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -5.172 10.335 -7.466 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -5.142 9.956 -5.728 1.00 0.00 H new ATOM 1462 N GLY A 91 -0.976 6.550 -5.720 1.00 0.00 N ATOM 1463 CA GLY A 91 0.380 6.328 -5.257 1.00 0.00 C ATOM 1464 C GLY A 91 0.489 5.077 -4.410 1.00 0.00 C ATOM 1465 O GLY A 91 1.533 4.427 -4.379 1.00 0.00 O ATOM 0 H GLY A 91 -1.269 5.950 -6.491 1.00 0.00 H new ATOM 0 HA2 GLY A 91 1.048 6.245 -6.115 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.711 7.189 -4.677 1.00 0.00 H new ATOM 1469 N LEU A 92 -0.600 4.739 -3.727 1.00 0.00 N ATOM 1470 CA LEU A 92 -0.637 3.555 -2.879 1.00 0.00 C ATOM 1471 C LEU A 92 -0.811 2.296 -3.722 1.00 0.00 C ATOM 1472 O LEU A 92 -0.024 1.353 -3.622 1.00 0.00 O ATOM 1473 CB LEU A 92 -1.778 3.666 -1.865 1.00 0.00 C ATOM 1474 CG LEU A 92 -1.714 4.889 -0.950 1.00 0.00 C ATOM 1475 CD1 LEU A 92 -2.940 4.948 -0.053 1.00 0.00 C ATOM 1476 CD2 LEU A 92 -0.442 4.864 -0.116 1.00 0.00 C ATOM 0 H LEU A 92 -1.470 5.271 -3.745 1.00 0.00 H new ATOM 0 HA LEU A 92 0.310 3.487 -2.343 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -2.724 3.685 -2.406 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.783 2.768 -1.247 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.700 5.784 -1.571 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -2.877 5.825 0.591 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -3.838 5.013 -0.668 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -2.985 4.049 0.561 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.413 5.742 0.529 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.426 3.963 0.496 1.00 0.00 H new ATOM 0 HD23 LEU A 92 0.426 4.870 -0.776 1.00 0.00 H new ATOM 1488 N GLU A 93 -1.845 2.291 -4.558 1.00 0.00 N ATOM 1489 CA GLU A 93 -2.122 1.152 -5.426 1.00 0.00 C ATOM 1490 C GLU A 93 -0.900 0.811 -6.271 1.00 0.00 C ATOM 1491 O GLU A 93 -0.580 -0.360 -6.477 1.00 0.00 O ATOM 1492 CB GLU A 93 -3.317 1.454 -6.332 1.00 0.00 C ATOM 1493 CG GLU A 93 -3.188 2.764 -7.092 1.00 0.00 C ATOM 1494 CD GLU A 93 -2.688 2.571 -8.512 1.00 0.00 C ATOM 1495 OE1 GLU A 93 -2.369 1.421 -8.879 1.00 0.00 O ATOM 1496 OE2 GLU A 93 -2.617 3.572 -9.257 1.00 0.00 O ATOM 0 H GLU A 93 -2.505 3.063 -4.652 1.00 0.00 H new ATOM 0 HA GLU A 93 -2.361 0.293 -4.799 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -3.436 0.639 -7.046 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.223 1.482 -5.727 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.157 3.262 -7.117 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -2.505 3.424 -6.557 1.00 0.00 H new ATOM 1503 N ARG A 94 -0.215 1.844 -6.754 1.00 0.00 N ATOM 1504 CA ARG A 94 0.978 1.655 -7.570 1.00 0.00 C ATOM 1505 C ARG A 94 2.094 1.028 -6.743 1.00 0.00 C ATOM 1506 O ARG A 94 2.884 0.227 -7.247 1.00 0.00 O ATOM 1507 CB ARG A 94 1.443 2.993 -8.149 1.00 0.00 C ATOM 1508 CG ARG A 94 0.688 3.409 -9.400 1.00 0.00 C ATOM 1509 CD ARG A 94 0.808 4.904 -9.651 1.00 0.00 C ATOM 1510 NE ARG A 94 0.756 5.227 -11.074 1.00 0.00 N ATOM 1511 CZ ARG A 94 0.925 6.453 -11.563 1.00 0.00 C ATOM 1512 NH1 ARG A 94 1.160 7.474 -10.748 1.00 0.00 N ATOM 1513 NH2 ARG A 94 0.861 6.660 -12.871 1.00 0.00 N ATOM 0 H ARG A 94 -0.466 2.819 -6.594 1.00 0.00 H new ATOM 0 HA ARG A 94 0.731 0.983 -8.392 1.00 0.00 H new ATOM 0 HB2 ARG A 94 1.328 3.767 -7.391 1.00 0.00 H new ATOM 0 HB3 ARG A 94 2.506 2.929 -8.381 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.076 2.862 -10.259 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -0.363 3.139 -9.299 1.00 0.00 H new ATOM 0 HD2 ARG A 94 0.003 5.424 -9.132 1.00 0.00 H new ATOM 0 HD3 ARG A 94 1.746 5.268 -9.231 1.00 0.00 H new ATOM 0 HE ARG A 94 0.580 4.468 -11.732 1.00 0.00 H new ATOM 0 HH11 ARG A 94 1.212 7.321 -9.741 1.00 0.00 H new ATOM 0 HH12 ARG A 94 1.289 8.411 -11.129 1.00 0.00 H new ATOM 0 HH21 ARG A 94 0.682 5.879 -13.503 1.00 0.00 H new ATOM 0 HH22 ARG A 94 0.991 7.600 -13.246 1.00 0.00 H new ATOM 1527 N PHE A 95 2.151 1.398 -5.465 1.00 0.00 N ATOM 1528 CA PHE A 95 3.166 0.875 -4.557 1.00 0.00 C ATOM 1529 C PHE A 95 3.136 -0.649 -4.532 1.00 0.00 C ATOM 1530 O PHE A 95 4.178 -1.300 -4.464 1.00 0.00 O ATOM 1531 CB PHE A 95 2.951 1.424 -3.145 1.00 0.00 C ATOM 1532 CG PHE A 95 4.043 1.047 -2.183 1.00 0.00 C ATOM 1533 CD1 PHE A 95 5.233 1.757 -2.152 1.00 0.00 C ATOM 1534 CD2 PHE A 95 3.878 -0.017 -1.312 1.00 0.00 C ATOM 1535 CE1 PHE A 95 6.237 1.412 -1.268 1.00 0.00 C ATOM 1536 CE2 PHE A 95 4.879 -0.367 -0.426 1.00 0.00 C ATOM 1537 CZ PHE A 95 6.061 0.349 -0.404 1.00 0.00 C ATOM 0 H PHE A 95 1.504 2.059 -5.036 1.00 0.00 H new ATOM 0 HA PHE A 95 4.143 1.197 -4.918 1.00 0.00 H new ATOM 0 HB2 PHE A 95 2.879 2.511 -3.193 1.00 0.00 H new ATOM 0 HB3 PHE A 95 1.998 1.058 -2.762 1.00 0.00 H new ATOM 0 HD1 PHE A 95 5.377 2.589 -2.826 1.00 0.00 H new ATOM 0 HD2 PHE A 95 2.956 -0.580 -1.325 1.00 0.00 H new ATOM 0 HE1 PHE A 95 7.159 1.973 -1.253 1.00 0.00 H new ATOM 0 HE2 PHE A 95 4.738 -1.199 0.248 1.00 0.00 H new ATOM 0 HZ PHE A 95 6.845 0.078 0.287 1.00 0.00 H new ATOM 1547 N LEU A 96 1.933 -1.209 -4.586 1.00 0.00 N ATOM 1548 CA LEU A 96 1.762 -2.657 -4.570 1.00 0.00 C ATOM 1549 C LEU A 96 1.837 -3.240 -5.980 1.00 0.00 C ATOM 1550 O LEU A 96 2.093 -4.431 -6.154 1.00 0.00 O ATOM 1551 CB LEU A 96 0.423 -3.025 -3.926 1.00 0.00 C ATOM 1552 CG LEU A 96 0.072 -2.234 -2.665 1.00 0.00 C ATOM 1553 CD1 LEU A 96 -1.363 -2.513 -2.244 1.00 0.00 C ATOM 1554 CD2 LEU A 96 1.037 -2.575 -1.539 1.00 0.00 C ATOM 0 H LEU A 96 1.061 -0.682 -4.641 1.00 0.00 H new ATOM 0 HA LEU A 96 2.575 -3.083 -3.981 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.369 -2.878 -4.661 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.436 -4.087 -3.679 1.00 0.00 H new ATOM 0 HG LEU A 96 0.164 -1.171 -2.886 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.596 -1.942 -1.345 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.041 -2.220 -3.046 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.482 -3.577 -2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.774 -2.004 -0.649 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.976 -3.641 -1.318 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.054 -2.325 -1.843 1.00 0.00 H new ATOM 1566 N ASN A 97 1.608 -2.397 -6.985 1.00 0.00 N ATOM 1567 CA ASN A 97 1.647 -2.840 -8.375 1.00 0.00 C ATOM 1568 C ASN A 97 2.984 -3.493 -8.712 1.00 0.00 C ATOM 1569 O ASN A 97 3.035 -4.666 -9.075 1.00 0.00 O ATOM 1570 CB ASN A 97 1.390 -1.660 -9.315 1.00 0.00 C ATOM 1571 CG ASN A 97 -0.021 -1.658 -9.867 1.00 0.00 C ATOM 1572 OD1 ASN A 97 -0.300 -2.282 -10.891 1.00 0.00 O ATOM 1573 ND2 ASN A 97 -0.922 -0.954 -9.191 1.00 0.00 N ATOM 0 H ASN A 97 1.394 -1.407 -6.862 1.00 0.00 H new ATOM 0 HA ASN A 97 0.862 -3.584 -8.510 1.00 0.00 H new ATOM 0 HB2 ASN A 97 1.569 -0.727 -8.780 1.00 0.00 H new ATOM 0 HB3 ASN A 97 2.100 -1.696 -10.141 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -1.888 -0.916 -9.516 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -0.648 -0.451 -8.347 1.00 0.00 H new ATOM 1580 N GLU A 98 4.065 -2.731 -8.585 1.00 0.00 N ATOM 1581 CA GLU A 98 5.398 -3.253 -8.879 1.00 0.00 C ATOM 1582 C GLU A 98 5.824 -4.292 -7.844 1.00 0.00 C ATOM 1583 O GLU A 98 6.799 -5.017 -8.044 1.00 0.00 O ATOM 1584 CB GLU A 98 6.421 -2.115 -8.920 1.00 0.00 C ATOM 1585 CG GLU A 98 7.586 -2.378 -9.861 1.00 0.00 C ATOM 1586 CD GLU A 98 7.978 -1.152 -10.661 1.00 0.00 C ATOM 1587 OE1 GLU A 98 7.074 -0.495 -11.221 1.00 0.00 O ATOM 1588 OE2 GLU A 98 9.187 -0.849 -10.728 1.00 0.00 O ATOM 0 H GLU A 98 4.047 -1.757 -8.283 1.00 0.00 H new ATOM 0 HA GLU A 98 5.358 -3.735 -9.856 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.919 -1.197 -9.225 1.00 0.00 H new ATOM 0 HB3 GLU A 98 6.807 -1.948 -7.914 1.00 0.00 H new ATOM 0 HG2 GLU A 98 8.445 -2.720 -9.283 1.00 0.00 H new ATOM 0 HG3 GLU A 98 7.321 -3.184 -10.545 1.00 0.00 H new ATOM 1595 N LEU A 99 5.093 -4.357 -6.734 1.00 0.00 N ATOM 1596 CA LEU A 99 5.399 -5.301 -5.669 1.00 0.00 C ATOM 1597 C LEU A 99 4.860 -6.694 -5.984 1.00 0.00 C ATOM 1598 O LEU A 99 5.613 -7.666 -6.024 1.00 0.00 O ATOM 1599 CB LEU A 99 4.813 -4.807 -4.347 1.00 0.00 C ATOM 1600 CG LEU A 99 5.500 -5.354 -3.095 1.00 0.00 C ATOM 1601 CD1 LEU A 99 5.740 -4.242 -2.087 1.00 0.00 C ATOM 1602 CD2 LEU A 99 4.673 -6.471 -2.477 1.00 0.00 C ATOM 0 H LEU A 99 4.283 -3.764 -6.551 1.00 0.00 H new ATOM 0 HA LEU A 99 6.484 -5.369 -5.586 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.866 -3.718 -4.327 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.757 -5.075 -4.311 1.00 0.00 H new ATOM 0 HG LEU A 99 6.467 -5.765 -3.385 1.00 0.00 H new ATOM 0 HD11 LEU A 99 6.230 -4.651 -1.203 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.376 -3.478 -2.533 1.00 0.00 H new ATOM 0 HD13 LEU A 99 4.786 -3.798 -1.801 1.00 0.00 H new ATOM 0 HD21 LEU A 99 5.178 -6.848 -1.587 1.00 0.00 H new ATOM 0 HD22 LEU A 99 3.691 -6.087 -2.202 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.557 -7.280 -3.198 1.00 0.00 H new ATOM 1614 N TYR A 100 3.552 -6.783 -6.193 1.00 0.00 N ATOM 1615 CA TYR A 100 2.911 -8.060 -6.489 1.00 0.00 C ATOM 1616 C TYR A 100 3.014 -8.417 -7.970 1.00 0.00 C ATOM 1617 O TYR A 100 2.892 -9.585 -8.340 1.00 0.00 O ATOM 1618 CB TYR A 100 1.444 -8.021 -6.058 1.00 0.00 C ATOM 1619 CG TYR A 100 1.259 -7.845 -4.567 1.00 0.00 C ATOM 1620 CD1 TYR A 100 1.287 -8.939 -3.711 1.00 0.00 C ATOM 1621 CD2 TYR A 100 1.059 -6.586 -4.016 1.00 0.00 C ATOM 1622 CE1 TYR A 100 1.121 -8.782 -2.348 1.00 0.00 C ATOM 1623 CE2 TYR A 100 0.893 -6.421 -2.653 1.00 0.00 C ATOM 1624 CZ TYR A 100 0.925 -7.522 -1.825 1.00 0.00 C ATOM 1625 OH TYR A 100 0.760 -7.363 -0.468 1.00 0.00 O ATOM 0 H TYR A 100 2.914 -5.987 -6.163 1.00 0.00 H new ATOM 0 HA TYR A 100 3.435 -8.833 -5.927 1.00 0.00 H new ATOM 0 HB2 TYR A 100 0.942 -7.205 -6.577 1.00 0.00 H new ATOM 0 HB3 TYR A 100 0.957 -8.945 -6.370 1.00 0.00 H new ATOM 0 HD1 TYR A 100 1.441 -9.928 -4.117 1.00 0.00 H new ATOM 0 HD2 TYR A 100 1.033 -5.721 -4.663 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.145 -9.643 -1.696 1.00 0.00 H new ATOM 0 HE2 TYR A 100 0.739 -5.435 -2.240 1.00 0.00 H new ATOM 0 HH TYR A 100 0.634 -6.413 -0.263 1.00 0.00 H new ATOM 1635 N ASN A 101 3.236 -7.415 -8.817 1.00 0.00 N ATOM 1636 CA ASN A 101 3.349 -7.650 -10.252 1.00 0.00 C ATOM 1637 C ASN A 101 4.808 -7.821 -10.668 1.00 0.00 C ATOM 1638 O ASN A 101 5.252 -7.253 -11.666 1.00 0.00 O ATOM 1639 CB ASN A 101 2.714 -6.500 -11.036 1.00 0.00 C ATOM 1640 CG ASN A 101 2.077 -6.968 -12.330 1.00 0.00 C ATOM 1641 OD1 ASN A 101 2.664 -6.845 -13.404 1.00 0.00 O ATOM 1642 ND2 ASN A 101 0.868 -7.510 -12.233 1.00 0.00 N ATOM 0 H ASN A 101 3.340 -6.440 -8.536 1.00 0.00 H new ATOM 0 HA ASN A 101 2.816 -8.573 -10.481 1.00 0.00 H new ATOM 0 HB2 ASN A 101 1.959 -6.014 -10.417 1.00 0.00 H new ATOM 0 HB3 ASN A 101 3.474 -5.751 -11.258 1.00 0.00 H new ATOM 0 HD21 ASN A 101 0.390 -7.844 -13.070 1.00 0.00 H new ATOM 0 HD22 ASN A 101 0.418 -7.592 -11.322 1.00 0.00 H new ATOM 1649 N ASP A 102 5.549 -8.612 -9.898 1.00 0.00 N ATOM 1650 CA ASP A 102 6.955 -8.865 -10.191 1.00 0.00 C ATOM 1651 C ASP A 102 7.097 -9.949 -11.253 1.00 0.00 C ATOM 1652 O ASP A 102 6.239 -10.821 -11.382 1.00 0.00 O ATOM 1653 CB ASP A 102 7.701 -9.278 -8.921 1.00 0.00 C ATOM 1654 CG ASP A 102 6.973 -10.355 -8.142 1.00 0.00 C ATOM 1655 OD1 ASP A 102 6.728 -11.438 -8.714 1.00 0.00 O ATOM 1656 OD2 ASP A 102 6.645 -10.115 -6.962 1.00 0.00 O ATOM 0 H ASP A 102 5.199 -9.088 -9.067 1.00 0.00 H new ATOM 0 HA ASP A 102 7.393 -7.943 -10.573 1.00 0.00 H new ATOM 0 HB2 ASP A 102 8.695 -9.637 -9.188 1.00 0.00 H new ATOM 0 HB3 ASP A 102 7.838 -8.404 -8.284 1.00 0.00 H new ATOM 1661 N ARG A 103 8.184 -9.887 -12.017 1.00 0.00 N ATOM 1662 CA ARG A 103 8.428 -10.867 -13.072 1.00 0.00 C ATOM 1663 C ARG A 103 9.228 -12.056 -12.551 1.00 0.00 C ATOM 1664 O ARG A 103 8.818 -13.206 -12.706 1.00 0.00 O ATOM 1665 CB ARG A 103 9.153 -10.226 -14.263 1.00 0.00 C ATOM 1666 CG ARG A 103 10.116 -9.109 -13.886 1.00 0.00 C ATOM 1667 CD ARG A 103 10.893 -8.614 -15.094 1.00 0.00 C ATOM 1668 NE ARG A 103 11.933 -9.558 -15.497 1.00 0.00 N ATOM 1669 CZ ARG A 103 13.091 -9.701 -14.856 1.00 0.00 C ATOM 1670 NH1 ARG A 103 13.361 -8.965 -13.785 1.00 0.00 N ATOM 1671 NH2 ARG A 103 13.983 -10.583 -15.288 1.00 0.00 N ATOM 0 H ARG A 103 8.907 -9.173 -11.927 1.00 0.00 H new ATOM 0 HA ARG A 103 7.457 -11.229 -13.409 1.00 0.00 H new ATOM 0 HB2 ARG A 103 9.705 -11.000 -14.796 1.00 0.00 H new ATOM 0 HB3 ARG A 103 8.410 -9.830 -14.955 1.00 0.00 H new ATOM 0 HG2 ARG A 103 9.560 -8.281 -13.445 1.00 0.00 H new ATOM 0 HG3 ARG A 103 10.811 -9.467 -13.126 1.00 0.00 H new ATOM 0 HD2 ARG A 103 10.207 -8.453 -15.926 1.00 0.00 H new ATOM 0 HD3 ARG A 103 11.347 -7.650 -14.864 1.00 0.00 H new ATOM 0 HE ARG A 103 11.762 -10.141 -16.316 1.00 0.00 H new ATOM 0 HH11 ARG A 103 12.679 -8.285 -13.448 1.00 0.00 H new ATOM 0 HH12 ARG A 103 14.250 -9.080 -13.298 1.00 0.00 H new ATOM 0 HH21 ARG A 103 13.781 -11.151 -16.111 1.00 0.00 H new ATOM 0 HH22 ARG A 103 14.870 -10.693 -14.797 1.00 0.00 H new ATOM 1685 N PHE A 104 10.373 -11.778 -11.937 1.00 0.00 N ATOM 1686 CA PHE A 104 11.226 -12.836 -11.404 1.00 0.00 C ATOM 1687 C PHE A 104 11.648 -12.550 -9.962 1.00 0.00 C ATOM 1688 O PHE A 104 12.042 -13.461 -9.234 1.00 0.00 O ATOM 1689 CB PHE A 104 12.468 -13.005 -12.280 1.00 0.00 C ATOM 1690 CG PHE A 104 12.248 -13.900 -13.465 1.00 0.00 C ATOM 1691 CD1 PHE A 104 11.413 -13.509 -14.500 1.00 0.00 C ATOM 1692 CD2 PHE A 104 12.874 -15.134 -13.544 1.00 0.00 C ATOM 1693 CE1 PHE A 104 11.207 -14.332 -15.591 1.00 0.00 C ATOM 1694 CE2 PHE A 104 12.672 -15.960 -14.632 1.00 0.00 C ATOM 1695 CZ PHE A 104 11.837 -15.559 -15.657 1.00 0.00 C ATOM 0 H PHE A 104 10.731 -10.834 -11.796 1.00 0.00 H new ATOM 0 HA PHE A 104 10.646 -13.759 -11.410 1.00 0.00 H new ATOM 0 HB2 PHE A 104 12.792 -12.025 -12.630 1.00 0.00 H new ATOM 0 HB3 PHE A 104 13.278 -13.411 -11.674 1.00 0.00 H new ATOM 0 HD1 PHE A 104 10.918 -12.550 -14.453 1.00 0.00 H new ATOM 0 HD2 PHE A 104 13.527 -15.453 -12.745 1.00 0.00 H new ATOM 0 HE1 PHE A 104 10.554 -14.016 -16.391 1.00 0.00 H new ATOM 0 HE2 PHE A 104 13.166 -16.919 -14.682 1.00 0.00 H new ATOM 0 HZ PHE A 104 11.677 -16.204 -16.508 1.00 0.00 H new ATOM 1705 N ASP A 105 11.570 -11.287 -9.552 1.00 0.00 N ATOM 1706 CA ASP A 105 11.953 -10.904 -8.197 1.00 0.00 C ATOM 1707 C ASP A 105 10.729 -10.540 -7.363 1.00 0.00 C ATOM 1708 O ASP A 105 10.150 -9.466 -7.528 1.00 0.00 O ATOM 1709 CB ASP A 105 12.927 -9.725 -8.235 1.00 0.00 C ATOM 1710 CG ASP A 105 14.151 -10.013 -9.084 1.00 0.00 C ATOM 1711 OD1 ASP A 105 14.100 -9.757 -10.305 1.00 0.00 O ATOM 1712 OD2 ASP A 105 15.160 -10.494 -8.526 1.00 0.00 O ATOM 0 H ASP A 105 11.247 -10.515 -10.135 1.00 0.00 H new ATOM 0 HA ASP A 105 12.443 -11.759 -7.732 1.00 0.00 H new ATOM 0 HB2 ASP A 105 12.415 -8.847 -8.627 1.00 0.00 H new ATOM 0 HB3 ASP A 105 13.241 -9.484 -7.219 1.00 0.00 H new ATOM 1717 N SER A 106 10.344 -11.440 -6.463 1.00 0.00 N ATOM 1718 CA SER A 106 9.190 -11.209 -5.601 1.00 0.00 C ATOM 1719 C SER A 106 9.612 -11.091 -4.140 1.00 0.00 C ATOM 1720 O SER A 106 8.828 -11.373 -3.234 1.00 0.00 O ATOM 1721 CB SER A 106 8.174 -12.340 -5.754 1.00 0.00 C ATOM 1722 OG SER A 106 8.804 -13.607 -5.676 1.00 0.00 O ATOM 0 H SER A 106 10.813 -12.333 -6.312 1.00 0.00 H new ATOM 0 HA SER A 106 8.729 -10.270 -5.906 1.00 0.00 H new ATOM 0 HB2 SER A 106 7.416 -12.259 -4.975 1.00 0.00 H new ATOM 0 HB3 SER A 106 7.660 -12.244 -6.711 1.00 0.00 H new ATOM 0 HG SER A 106 8.132 -14.313 -5.775 1.00 0.00 H new ATOM 1728 N ARG A 107 10.852 -10.670 -3.915 1.00 0.00 N ATOM 1729 CA ARG A 107 11.366 -10.513 -2.559 1.00 0.00 C ATOM 1730 C ARG A 107 10.534 -9.495 -1.788 1.00 0.00 C ATOM 1731 O ARG A 107 10.410 -9.574 -0.565 1.00 0.00 O ATOM 1732 CB ARG A 107 12.831 -10.070 -2.593 1.00 0.00 C ATOM 1733 CG ARG A 107 13.691 -10.889 -3.542 1.00 0.00 C ATOM 1734 CD ARG A 107 14.639 -10.006 -4.338 1.00 0.00 C ATOM 1735 NE ARG A 107 13.933 -8.941 -5.044 1.00 0.00 N ATOM 1736 CZ ARG A 107 14.542 -7.937 -5.672 1.00 0.00 C ATOM 1737 NH1 ARG A 107 15.866 -7.859 -5.684 1.00 0.00 N ATOM 1738 NH2 ARG A 107 13.824 -7.009 -6.290 1.00 0.00 N ATOM 0 H ARG A 107 11.517 -10.432 -4.651 1.00 0.00 H new ATOM 0 HA ARG A 107 11.299 -11.476 -2.053 1.00 0.00 H new ATOM 0 HB2 ARG A 107 12.878 -9.021 -2.886 1.00 0.00 H new ATOM 0 HB3 ARG A 107 13.247 -10.139 -1.588 1.00 0.00 H new ATOM 0 HG2 ARG A 107 14.265 -11.621 -2.974 1.00 0.00 H new ATOM 0 HG3 ARG A 107 13.051 -11.446 -4.226 1.00 0.00 H new ATOM 0 HD2 ARG A 107 15.377 -9.568 -3.666 1.00 0.00 H new ATOM 0 HD3 ARG A 107 15.186 -10.617 -5.057 1.00 0.00 H new ATOM 0 HE ARG A 107 12.913 -8.967 -5.057 1.00 0.00 H new ATOM 0 HH11 ARG A 107 16.423 -8.570 -5.211 1.00 0.00 H new ATOM 0 HH12 ARG A 107 16.327 -7.088 -6.167 1.00 0.00 H new ATOM 0 HH21 ARG A 107 12.806 -7.064 -6.284 1.00 0.00 H new ATOM 0 HH22 ARG A 107 14.290 -6.240 -6.771 1.00 0.00 H new ATOM 1752 N TRP A 108 9.968 -8.539 -2.515 1.00 0.00 N ATOM 1753 CA TRP A 108 9.147 -7.499 -1.909 1.00 0.00 C ATOM 1754 C TRP A 108 7.885 -8.088 -1.283 1.00 0.00 C ATOM 1755 O TRP A 108 7.531 -7.752 -0.152 1.00 0.00 O ATOM 1756 CB TRP A 108 8.767 -6.448 -2.953 1.00 0.00 C ATOM 1757 CG TRP A 108 9.948 -5.849 -3.654 1.00 0.00 C ATOM 1758 CD1 TRP A 108 10.306 -6.032 -4.960 1.00 0.00 C ATOM 1759 CD2 TRP A 108 10.926 -4.968 -3.090 1.00 0.00 C ATOM 1760 NE1 TRP A 108 11.446 -5.318 -5.241 1.00 0.00 N ATOM 1761 CE2 TRP A 108 11.846 -4.658 -4.109 1.00 0.00 C ATOM 1762 CE3 TRP A 108 11.112 -4.412 -1.822 1.00 0.00 C ATOM 1763 CZ2 TRP A 108 12.935 -3.816 -3.898 1.00 0.00 C ATOM 1764 CZ3 TRP A 108 12.194 -3.576 -1.613 1.00 0.00 C ATOM 1765 CH2 TRP A 108 13.093 -3.285 -2.647 1.00 0.00 C ATOM 0 H TRP A 108 10.063 -8.463 -3.528 1.00 0.00 H new ATOM 0 HA TRP A 108 9.733 -7.027 -1.120 1.00 0.00 H new ATOM 0 HB2 TRP A 108 8.108 -6.903 -3.692 1.00 0.00 H new ATOM 0 HB3 TRP A 108 8.201 -5.653 -2.468 1.00 0.00 H new ATOM 0 HD1 TRP A 108 9.771 -6.648 -5.668 1.00 0.00 H new ATOM 0 HE1 TRP A 108 11.917 -5.285 -6.145 1.00 0.00 H new ATOM 0 HE3 TRP A 108 10.423 -4.631 -1.019 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 13.630 -3.590 -4.693 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 12.348 -3.141 -0.637 1.00 0.00 H new ATOM 0 HH2 TRP A 108 13.928 -2.628 -2.453 1.00 0.00 H new ATOM 1776 N ARG A 109 7.206 -8.962 -2.021 1.00 0.00 N ATOM 1777 CA ARG A 109 5.984 -9.587 -1.527 1.00 0.00 C ATOM 1778 C ARG A 109 6.301 -10.774 -0.620 1.00 0.00 C ATOM 1779 O ARG A 109 5.619 -11.004 0.378 1.00 0.00 O ATOM 1780 CB ARG A 109 5.113 -10.046 -2.697 1.00 0.00 C ATOM 1781 CG ARG A 109 5.760 -11.125 -3.546 1.00 0.00 C ATOM 1782 CD ARG A 109 4.983 -11.366 -4.829 1.00 0.00 C ATOM 1783 NE ARG A 109 4.049 -12.482 -4.703 1.00 0.00 N ATOM 1784 CZ ARG A 109 3.551 -13.153 -5.739 1.00 0.00 C ATOM 1785 NH1 ARG A 109 3.890 -12.823 -6.980 1.00 0.00 N ATOM 1786 NH2 ARG A 109 2.711 -14.159 -5.534 1.00 0.00 N ATOM 0 H ARG A 109 7.480 -9.252 -2.960 1.00 0.00 H new ATOM 0 HA ARG A 109 5.440 -8.844 -0.944 1.00 0.00 H new ATOM 0 HB2 ARG A 109 4.165 -10.419 -2.309 1.00 0.00 H new ATOM 0 HB3 ARG A 109 4.884 -9.187 -3.328 1.00 0.00 H new ATOM 0 HG2 ARG A 109 6.782 -10.835 -3.788 1.00 0.00 H new ATOM 0 HG3 ARG A 109 5.818 -12.052 -2.975 1.00 0.00 H new ATOM 0 HD2 ARG A 109 4.434 -10.463 -5.095 1.00 0.00 H new ATOM 0 HD3 ARG A 109 5.680 -11.567 -5.642 1.00 0.00 H new ATOM 0 HE ARG A 109 3.761 -12.764 -3.766 1.00 0.00 H new ATOM 0 HH11 ARG A 109 4.536 -12.051 -7.144 1.00 0.00 H new ATOM 0 HH12 ARG A 109 3.504 -13.342 -7.769 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.447 -14.418 -4.583 1.00 0.00 H new ATOM 0 HH22 ARG A 109 2.329 -14.674 -6.327 1.00 0.00 H new ATOM 1800 N ASP A 110 7.341 -11.525 -0.976 1.00 0.00 N ATOM 1801 CA ASP A 110 7.748 -12.690 -0.195 1.00 0.00 C ATOM 1802 C ASP A 110 7.937 -12.325 1.275 1.00 0.00 C ATOM 1803 O ASP A 110 7.724 -13.151 2.162 1.00 0.00 O ATOM 1804 CB ASP A 110 9.044 -13.279 -0.756 1.00 0.00 C ATOM 1805 CG ASP A 110 9.131 -14.780 -0.554 1.00 0.00 C ATOM 1806 OD1 ASP A 110 8.481 -15.520 -1.323 1.00 0.00 O ATOM 1807 OD2 ASP A 110 9.847 -15.214 0.372 1.00 0.00 O ATOM 0 H ASP A 110 7.916 -11.348 -1.799 1.00 0.00 H new ATOM 0 HA ASP A 110 6.956 -13.436 -0.266 1.00 0.00 H new ATOM 0 HB2 ASP A 110 9.112 -13.054 -1.820 1.00 0.00 H new ATOM 0 HB3 ASP A 110 9.896 -12.800 -0.274 1.00 0.00 H new ATOM 1812 N THR A 111 8.338 -11.082 1.523 1.00 0.00 N ATOM 1813 CA THR A 111 8.555 -10.602 2.882 1.00 0.00 C ATOM 1814 C THR A 111 7.300 -10.776 3.731 1.00 0.00 C ATOM 1815 O THR A 111 6.190 -10.485 3.285 1.00 0.00 O ATOM 1816 CB THR A 111 8.974 -9.131 2.861 1.00 0.00 C ATOM 1817 OG1 THR A 111 9.115 -8.665 1.530 1.00 0.00 O ATOM 1818 CG2 THR A 111 10.281 -8.872 3.576 1.00 0.00 C ATOM 0 H THR A 111 8.519 -10.388 0.798 1.00 0.00 H new ATOM 0 HA THR A 111 9.354 -11.195 3.328 1.00 0.00 H new ATOM 0 HB THR A 111 8.179 -8.599 3.383 1.00 0.00 H new ATOM 0 HG1 THR A 111 8.232 -8.455 1.162 1.00 0.00 H new ATOM 0 HG21 THR A 111 10.520 -7.810 3.524 1.00 0.00 H new ATOM 0 HG22 THR A 111 10.191 -9.173 4.620 1.00 0.00 H new ATOM 0 HG23 THR A 111 11.076 -9.447 3.101 1.00 0.00 H new ATOM 1826 N LYS A 112 7.483 -11.250 4.961 1.00 0.00 N ATOM 1827 CA LYS A 112 6.365 -11.460 5.874 1.00 0.00 C ATOM 1828 C LYS A 112 5.601 -10.157 6.098 1.00 0.00 C ATOM 1829 O LYS A 112 4.391 -10.166 6.323 1.00 0.00 O ATOM 1830 CB LYS A 112 6.866 -12.012 7.211 1.00 0.00 C ATOM 1831 CG LYS A 112 6.525 -13.478 7.429 1.00 0.00 C ATOM 1832 CD LYS A 112 5.429 -13.647 8.469 1.00 0.00 C ATOM 1833 CE LYS A 112 5.633 -14.906 9.297 1.00 0.00 C ATOM 1834 NZ LYS A 112 4.593 -15.933 9.013 1.00 0.00 N ATOM 0 H LYS A 112 8.395 -11.495 5.347 1.00 0.00 H new ATOM 0 HA LYS A 112 5.688 -12.186 5.424 1.00 0.00 H new ATOM 0 HB2 LYS A 112 7.948 -11.887 7.264 1.00 0.00 H new ATOM 0 HB3 LYS A 112 6.437 -11.423 8.022 1.00 0.00 H new ATOM 0 HG2 LYS A 112 6.205 -13.922 6.486 1.00 0.00 H new ATOM 0 HG3 LYS A 112 7.417 -14.016 7.748 1.00 0.00 H new ATOM 0 HD2 LYS A 112 5.413 -12.777 9.126 1.00 0.00 H new ATOM 0 HD3 LYS A 112 4.459 -13.690 7.973 1.00 0.00 H new ATOM 0 HE2 LYS A 112 6.619 -15.321 9.089 1.00 0.00 H new ATOM 0 HE3 LYS A 112 5.611 -14.651 10.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 4.768 -16.775 9.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 3.653 -15.546 9.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 4.630 -16.196 8.007 1.00 0.00 H new ATOM 1848 N ILE A 113 6.318 -9.041 6.032 1.00 0.00 N ATOM 1849 CA ILE A 113 5.713 -7.729 6.223 1.00 0.00 C ATOM 1850 C ILE A 113 4.695 -7.431 5.127 1.00 0.00 C ATOM 1851 O ILE A 113 3.676 -6.785 5.372 1.00 0.00 O ATOM 1852 CB ILE A 113 6.778 -6.616 6.232 1.00 0.00 C ATOM 1853 CG1 ILE A 113 7.650 -6.705 4.979 1.00 0.00 C ATOM 1854 CG2 ILE A 113 7.636 -6.713 7.484 1.00 0.00 C ATOM 1855 CD1 ILE A 113 8.577 -5.523 4.802 1.00 0.00 C ATOM 0 H ILE A 113 7.321 -9.019 5.847 1.00 0.00 H new ATOM 0 HA ILE A 113 5.210 -7.749 7.190 1.00 0.00 H new ATOM 0 HB ILE A 113 6.272 -5.651 6.234 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.243 -7.618 5.023 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.006 -6.786 4.103 1.00 0.00 H new ATOM 0 HG21 ILE A 113 8.384 -5.920 7.475 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.005 -6.607 8.367 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.135 -7.682 7.509 1.00 0.00 H new ATOM 0 HD11 ILE A 113 9.165 -5.654 3.893 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.989 -4.608 4.725 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.246 -5.454 5.660 1.00 0.00 H new ATOM 1867 N ALA A 114 4.978 -7.909 3.920 1.00 0.00 N ATOM 1868 CA ALA A 114 4.088 -7.695 2.786 1.00 0.00 C ATOM 1869 C ALA A 114 2.792 -8.479 2.950 1.00 0.00 C ATOM 1870 O ALA A 114 1.713 -7.993 2.612 1.00 0.00 O ATOM 1871 CB ALA A 114 4.784 -8.084 1.489 1.00 0.00 C ATOM 0 H ALA A 114 5.817 -8.447 3.702 1.00 0.00 H new ATOM 0 HA ALA A 114 3.837 -6.635 2.747 1.00 0.00 H new ATOM 0 HB1 ALA A 114 4.108 -7.919 0.650 1.00 0.00 H new ATOM 0 HB2 ALA A 114 5.679 -7.475 1.359 1.00 0.00 H new ATOM 0 HB3 ALA A 114 5.064 -9.137 1.528 1.00 0.00 H new ATOM 1877 N GLN A 115 2.905 -9.695 3.475 1.00 0.00 N ATOM 1878 CA GLN A 115 1.741 -10.548 3.687 1.00 0.00 C ATOM 1879 C GLN A 115 0.815 -9.950 4.741 1.00 0.00 C ATOM 1880 O GLN A 115 -0.406 -10.080 4.655 1.00 0.00 O ATOM 1881 CB GLN A 115 2.180 -11.949 4.114 1.00 0.00 C ATOM 1882 CG GLN A 115 3.121 -12.620 3.125 1.00 0.00 C ATOM 1883 CD GLN A 115 2.522 -13.867 2.504 1.00 0.00 C ATOM 1884 OE1 GLN A 115 2.296 -14.867 3.185 1.00 0.00 O ATOM 1885 NE2 GLN A 115 2.262 -13.813 1.203 1.00 0.00 N ATOM 0 H GLN A 115 3.791 -10.112 3.761 1.00 0.00 H new ATOM 0 HA GLN A 115 1.196 -10.617 2.746 1.00 0.00 H new ATOM 0 HB2 GLN A 115 2.671 -11.887 5.085 1.00 0.00 H new ATOM 0 HB3 GLN A 115 1.296 -12.574 4.243 1.00 0.00 H new ATOM 0 HG2 GLN A 115 3.377 -11.913 2.336 1.00 0.00 H new ATOM 0 HG3 GLN A 115 4.049 -12.881 3.633 1.00 0.00 H new ATOM 0 HE21 GLN A 115 2.465 -12.963 0.677 1.00 0.00 H new ATOM 0 HE22 GLN A 115 1.859 -14.621 0.730 1.00 0.00 H new ATOM 1894 N ASP A 116 1.406 -9.296 5.735 1.00 0.00 N ATOM 1895 CA ASP A 116 0.635 -8.676 6.807 1.00 0.00 C ATOM 1896 C ASP A 116 0.007 -7.365 6.342 1.00 0.00 C ATOM 1897 O ASP A 116 -1.007 -6.925 6.886 1.00 0.00 O ATOM 1898 CB ASP A 116 1.529 -8.425 8.023 1.00 0.00 C ATOM 1899 CG ASP A 116 0.740 -7.973 9.237 1.00 0.00 C ATOM 1900 OD1 ASP A 116 0.296 -6.806 9.255 1.00 0.00 O ATOM 1901 OD2 ASP A 116 0.569 -8.785 10.169 1.00 0.00 O ATOM 0 H ASP A 116 2.416 -9.181 5.821 1.00 0.00 H new ATOM 0 HA ASP A 116 -0.167 -9.360 7.087 1.00 0.00 H new ATOM 0 HB2 ASP A 116 2.073 -9.338 8.266 1.00 0.00 H new ATOM 0 HB3 ASP A 116 2.273 -7.668 7.774 1.00 0.00 H new ATOM 1906 N PHE A 117 0.615 -6.744 5.335 1.00 0.00 N ATOM 1907 CA PHE A 117 0.120 -5.483 4.794 1.00 0.00 C ATOM 1908 C PHE A 117 -1.371 -5.560 4.479 1.00 0.00 C ATOM 1909 O PHE A 117 -2.140 -4.672 4.847 1.00 0.00 O ATOM 1910 CB PHE A 117 0.899 -5.118 3.532 1.00 0.00 C ATOM 1911 CG PHE A 117 0.724 -3.688 3.114 1.00 0.00 C ATOM 1912 CD1 PHE A 117 1.041 -2.660 3.985 1.00 0.00 C ATOM 1913 CD2 PHE A 117 0.243 -3.375 1.855 1.00 0.00 C ATOM 1914 CE1 PHE A 117 0.881 -1.340 3.606 1.00 0.00 C ATOM 1915 CE2 PHE A 117 0.081 -2.058 1.469 1.00 0.00 C ATOM 1916 CZ PHE A 117 0.400 -1.040 2.346 1.00 0.00 C ATOM 0 H PHE A 117 1.455 -7.096 4.876 1.00 0.00 H new ATOM 0 HA PHE A 117 0.266 -4.711 5.550 1.00 0.00 H new ATOM 0 HB2 PHE A 117 1.958 -5.312 3.699 1.00 0.00 H new ATOM 0 HB3 PHE A 117 0.581 -5.768 2.717 1.00 0.00 H new ATOM 0 HD1 PHE A 117 1.417 -2.891 4.971 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -0.008 -4.168 1.167 1.00 0.00 H new ATOM 0 HE1 PHE A 117 1.131 -0.545 4.293 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -0.294 -1.825 0.483 1.00 0.00 H new ATOM 0 HZ PHE A 117 0.274 -0.010 2.047 1.00 0.00 H new ATOM 1926 N LEU A 118 -1.771 -6.627 3.797 1.00 0.00 N ATOM 1927 CA LEU A 118 -3.169 -6.822 3.431 1.00 0.00 C ATOM 1928 C LEU A 118 -3.802 -7.928 4.270 1.00 0.00 C ATOM 1929 O LEU A 118 -4.733 -8.599 3.826 1.00 0.00 O ATOM 1930 CB LEU A 118 -3.293 -7.159 1.942 1.00 0.00 C ATOM 1931 CG LEU A 118 -2.637 -6.162 0.978 1.00 0.00 C ATOM 1932 CD1 LEU A 118 -3.293 -6.239 -0.392 1.00 0.00 C ATOM 1933 CD2 LEU A 118 -2.717 -4.741 1.524 1.00 0.00 C ATOM 0 H LEU A 118 -1.146 -7.371 3.486 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.700 -5.891 3.628 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.854 -8.142 1.773 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -4.351 -7.235 1.692 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.585 -6.429 0.879 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -2.816 -5.526 -1.064 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -3.181 -7.246 -0.793 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -4.353 -6.000 -0.302 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -2.245 -4.054 0.822 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -3.762 -4.461 1.658 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.202 -4.690 2.483 1.00 0.00 H new ATOM 1945 N GLN A 119 -3.278 -8.119 5.481 1.00 0.00 N ATOM 1946 CA GLN A 119 -3.777 -9.148 6.392 1.00 0.00 C ATOM 1947 C GLN A 119 -3.900 -10.493 5.683 1.00 0.00 C ATOM 1948 O GLN A 119 -4.909 -11.187 5.808 1.00 0.00 O ATOM 1949 CB GLN A 119 -5.125 -8.734 6.994 1.00 0.00 C ATOM 1950 CG GLN A 119 -6.247 -8.607 5.976 1.00 0.00 C ATOM 1951 CD GLN A 119 -7.613 -8.516 6.625 1.00 0.00 C ATOM 1952 OE1 GLN A 119 -8.162 -9.516 7.088 1.00 0.00 O ATOM 1953 NE2 GLN A 119 -8.172 -7.312 6.661 1.00 0.00 N ATOM 0 H GLN A 119 -2.503 -7.571 5.855 1.00 0.00 H new ATOM 0 HA GLN A 119 -3.056 -9.255 7.202 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -5.414 -9.466 7.748 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -5.004 -7.780 7.506 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -6.079 -7.721 5.364 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -6.224 -9.466 5.305 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -7.682 -6.510 6.265 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -9.092 -7.189 7.084 1.00 0.00 H new ATOM 1962 N LEU A 120 -2.858 -10.853 4.941 1.00 0.00 N ATOM 1963 CA LEU A 120 -2.834 -12.112 4.207 1.00 0.00 C ATOM 1964 C LEU A 120 -2.083 -13.179 4.995 1.00 0.00 C ATOM 1965 O LEU A 120 -1.370 -14.004 4.423 1.00 0.00 O ATOM 1966 CB LEU A 120 -2.179 -11.922 2.834 1.00 0.00 C ATOM 1967 CG LEU A 120 -2.356 -10.536 2.208 1.00 0.00 C ATOM 1968 CD1 LEU A 120 -1.209 -10.225 1.260 1.00 0.00 C ATOM 1969 CD2 LEU A 120 -3.690 -10.448 1.484 1.00 0.00 C ATOM 0 H LEU A 120 -2.016 -10.288 4.832 1.00 0.00 H new ATOM 0 HA LEU A 120 -3.864 -12.440 4.065 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -1.112 -12.126 2.928 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -2.587 -12.666 2.150 1.00 0.00 H new ATOM 0 HG LEU A 120 -2.348 -9.794 3.006 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.354 -9.236 0.826 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -0.267 -10.246 1.809 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -1.182 -10.970 0.465 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.801 -9.457 1.044 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -3.727 -11.200 0.696 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -4.500 -10.624 2.192 1.00 0.00 H new ATOM 1981 N SER A 121 -2.250 -13.155 6.312 1.00 0.00 N ATOM 1982 CA SER A 121 -1.589 -14.119 7.185 1.00 0.00 C ATOM 1983 C SER A 121 -2.419 -14.378 8.438 1.00 0.00 C ATOM 1984 O SER A 121 -3.572 -13.958 8.529 1.00 0.00 O ATOM 1985 CB SER A 121 -0.198 -13.614 7.576 1.00 0.00 C ATOM 1986 OG SER A 121 0.524 -13.176 6.439 1.00 0.00 O ATOM 0 H SER A 121 -2.838 -12.479 6.799 1.00 0.00 H new ATOM 0 HA SER A 121 -1.488 -15.057 6.638 1.00 0.00 H new ATOM 0 HB2 SER A 121 -0.292 -12.795 8.289 1.00 0.00 H new ATOM 0 HB3 SER A 121 0.354 -14.410 8.077 1.00 0.00 H new ATOM 0 HG SER A 121 1.408 -12.857 6.716 1.00 0.00 H new ATOM 1992 N LYS A 122 -1.823 -15.075 9.401 1.00 0.00 N ATOM 1993 CA LYS A 122 -2.507 -15.392 10.650 1.00 0.00 C ATOM 1994 C LYS A 122 -1.694 -14.915 11.851 1.00 0.00 C ATOM 1995 O LYS A 122 -0.466 -14.858 11.797 1.00 0.00 O ATOM 1996 CB LYS A 122 -2.751 -16.899 10.751 1.00 0.00 C ATOM 1997 CG LYS A 122 -1.482 -17.729 10.648 1.00 0.00 C ATOM 1998 CD LYS A 122 -1.759 -19.202 10.902 1.00 0.00 C ATOM 1999 CE LYS A 122 -0.498 -19.943 11.317 1.00 0.00 C ATOM 2000 NZ LYS A 122 -0.442 -21.312 10.735 1.00 0.00 N ATOM 0 H LYS A 122 -0.869 -15.431 9.340 1.00 0.00 H new ATOM 0 HA LYS A 122 -3.466 -14.874 10.654 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -3.241 -17.116 11.700 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -3.438 -17.201 9.961 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -1.044 -17.605 9.657 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -0.749 -17.366 11.368 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -2.514 -19.302 11.682 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -2.169 -19.657 10.000 1.00 0.00 H new ATOM 0 HE2 LYS A 122 0.377 -19.377 10.998 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -0.457 -20.009 12.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 0.433 -21.784 11.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -1.264 -21.861 11.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -0.456 -21.249 9.697 1.00 0.00 H new ATOM 2014 N PRO A 123 -2.373 -14.565 12.957 1.00 0.00 N ATOM 2015 CA PRO A 123 -1.707 -14.092 14.174 1.00 0.00 C ATOM 2016 C PRO A 123 -0.960 -15.207 14.896 1.00 0.00 C ATOM 2017 O PRO A 123 -1.569 -16.145 15.411 1.00 0.00 O ATOM 2018 CB PRO A 123 -2.865 -13.579 15.035 1.00 0.00 C ATOM 2019 CG PRO A 123 -4.049 -14.357 14.576 1.00 0.00 C ATOM 2020 CD PRO A 123 -3.841 -14.603 13.107 1.00 0.00 C ATOM 0 HA PRO A 123 -0.951 -13.337 13.958 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -2.672 -13.740 16.096 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -3.017 -12.508 14.898 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -4.133 -15.297 15.121 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -4.971 -13.803 14.752 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -4.251 -15.565 12.799 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -4.327 -13.840 12.499 1.00 0.00 H new ATOM 2028 N ASN A 124 0.364 -15.099 14.930 1.00 0.00 N ATOM 2029 CA ASN A 124 1.196 -16.099 15.589 1.00 0.00 C ATOM 2030 C ASN A 124 1.464 -15.714 17.040 1.00 0.00 C ATOM 2031 O ASN A 124 1.201 -14.547 17.400 1.00 0.00 O ATOM 2032 CB ASN A 124 2.520 -16.266 14.840 1.00 0.00 C ATOM 2033 CG ASN A 124 2.976 -17.710 14.790 1.00 0.00 C ATOM 2034 OD1 ASN A 124 3.401 -18.203 13.744 1.00 0.00 O ATOM 2035 ND2 ASN A 124 2.892 -18.399 15.922 1.00 0.00 N ATOM 2036 OXT ASN A 124 1.933 -16.582 17.806 1.00 0.00 O ATOM 0 H ASN A 124 0.884 -14.329 14.509 1.00 0.00 H new ATOM 0 HA ASN A 124 0.658 -17.047 15.577 1.00 0.00 H new ATOM 0 HB2 ASN A 124 2.410 -15.887 13.824 1.00 0.00 H new ATOM 0 HB3 ASN A 124 3.287 -15.662 15.324 1.00 0.00 H new ATOM 0 HD21 ASN A 124 3.186 -19.375 15.948 1.00 0.00 H new ATOM 0 HD22 ASN A 124 2.534 -17.952 16.766 1.00 0.00 H new TER 2043 ASN A 124