USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 902 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 89 SER OG : rot 150:sc= 0 USER MOD Set 1.2: A 93 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 37 CYS SG : rot 130:sc= 0.608 USER MOD Set 2.2: A 40 CYS SG : rot 87:sc= -2.9 USER MOD Set 3.1: A 27 ASN : amide:sc= -1.11 X(o=-3.6,f=-3.1) USER MOD Set 3.2: A 59 ASN : amide:sc= -2.47! C(o=-3.6!,f=-5!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -69:sc= 0.0725 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ -116:sc= -0.0617 (180deg=-0.797) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -0.12 K(o=-0.12,f=-0.91) USER MOD Single : A 25 LYS NZ :NH3+ 146:sc= -0.302 (180deg=-1.66!) USER MOD Single : A 26 LYS NZ :NH3+ 145:sc= -0.148 (180deg=-1.61) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=-0.086) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= -0.0599 K(o=-0.06,f=-1.6!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 81:sc= 0.0572 USER MOD Single : A 54 TYR OH : rot 180:sc= -0.652 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 HIS : no HD1:sc= -4.16! C(o=-4.2!,f=-8.6!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 MET CE :methyl -150:sc= -0.136 (180deg=-1.83) USER MOD Single : A 67 SER OG : rot 130:sc= 0 USER MOD Single : A 68 THR OG1 : rot -64:sc= -2.52! USER MOD Single : A 70 ASN : amide:sc= -0.0266 K(o=-0.027,f=-1.3) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 HIS : no HD1:sc= -0.365 X(o=-0.37,f=-0.39) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 108:sc= 1.16 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 TYR OH : rot -92:sc= 1.27 USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot -170:sc= 0.115 USER MOD Single : A 107 LYS NZ :NH3+ -150:sc= -0.444 (180deg=-1.82!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 96:sc= 1.28 USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 SER OG : rot -47:sc= 0.634 USER MOD Single : A 119 SER OG : rot -120:sc= 0.00488 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -12.159 -15.299 13.283 1.00 0.00 N ATOM 2 CA GLY A 1 -12.311 -16.285 12.228 1.00 0.00 C ATOM 3 C GLY A 1 -11.168 -16.252 11.234 1.00 0.00 C ATOM 4 O GLY A 1 -10.837 -15.197 10.693 1.00 0.00 O ATOM 0 H1 GLY A 1 -12.966 -15.362 13.936 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.277 -15.481 13.803 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.125 -14.347 12.866 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.375 -17.279 12.671 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.250 -16.109 11.703 1.00 0.00 H new ATOM 8 N SER A 2 -10.561 -17.409 10.994 1.00 0.00 N ATOM 9 CA SER A 2 -9.443 -17.508 10.062 1.00 0.00 C ATOM 10 C SER A 2 -9.927 -17.917 8.675 1.00 0.00 C ATOM 11 O SER A 2 -9.564 -17.303 7.672 1.00 0.00 O ATOM 12 CB SER A 2 -8.413 -18.516 10.574 1.00 0.00 C ATOM 13 OG SER A 2 -7.824 -18.075 11.785 1.00 0.00 O ATOM 0 H SER A 2 -10.824 -18.292 11.432 1.00 0.00 H new ATOM 0 HA SER A 2 -8.974 -16.527 9.989 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.892 -19.482 10.730 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.638 -18.662 9.822 1.00 0.00 H new ATOM 0 HG SER A 2 -7.171 -18.738 12.092 1.00 0.00 H new ATOM 19 N SER A 3 -10.750 -18.961 8.626 1.00 0.00 N ATOM 20 CA SER A 3 -11.282 -19.456 7.362 1.00 0.00 C ATOM 21 C SER A 3 -11.759 -18.303 6.484 1.00 0.00 C ATOM 22 O SER A 3 -12.678 -17.570 6.847 1.00 0.00 O ATOM 23 CB SER A 3 -12.434 -20.429 7.616 1.00 0.00 C ATOM 24 OG SER A 3 -11.961 -21.759 7.742 1.00 0.00 O ATOM 0 H SER A 3 -11.062 -19.480 9.447 1.00 0.00 H new ATOM 0 HA SER A 3 -10.482 -19.980 6.840 1.00 0.00 H new ATOM 0 HB2 SER A 3 -12.964 -20.141 8.524 1.00 0.00 H new ATOM 0 HB3 SER A 3 -13.150 -20.371 6.797 1.00 0.00 H new ATOM 0 HG SER A 3 -12.717 -22.361 7.906 1.00 0.00 H new ATOM 30 N GLY A 4 -11.126 -18.149 5.325 1.00 0.00 N ATOM 31 CA GLY A 4 -11.498 -17.083 4.412 1.00 0.00 C ATOM 32 C GLY A 4 -10.295 -16.348 3.857 1.00 0.00 C ATOM 33 O GLY A 4 -10.164 -15.137 4.033 1.00 0.00 O ATOM 0 H GLY A 4 -10.362 -18.743 5.002 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.077 -17.500 3.588 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -12.145 -16.375 4.930 1.00 0.00 H new ATOM 37 N SER A 5 -9.413 -17.082 3.186 1.00 0.00 N ATOM 38 CA SER A 5 -8.210 -16.493 2.608 1.00 0.00 C ATOM 39 C SER A 5 -8.420 -16.170 1.132 1.00 0.00 C ATOM 40 O SER A 5 -7.550 -16.426 0.300 1.00 0.00 O ATOM 41 CB SER A 5 -7.022 -17.443 2.771 1.00 0.00 C ATOM 42 OG SER A 5 -6.587 -17.490 4.119 1.00 0.00 O ATOM 0 H SER A 5 -9.509 -18.085 3.029 1.00 0.00 H new ATOM 0 HA SER A 5 -7.998 -15.565 3.139 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.304 -18.443 2.442 1.00 0.00 H new ATOM 0 HB3 SER A 5 -6.201 -17.117 2.132 1.00 0.00 H new ATOM 0 HG SER A 5 -6.186 -16.630 4.363 1.00 0.00 H new ATOM 48 N SER A 6 -9.580 -15.605 0.815 1.00 0.00 N ATOM 49 CA SER A 6 -9.907 -15.250 -0.561 1.00 0.00 C ATOM 50 C SER A 6 -8.838 -14.338 -1.155 1.00 0.00 C ATOM 51 O SER A 6 -8.570 -13.256 -0.635 1.00 0.00 O ATOM 52 CB SER A 6 -11.272 -14.561 -0.622 1.00 0.00 C ATOM 53 OG SER A 6 -11.705 -14.406 -1.962 1.00 0.00 O ATOM 0 H SER A 6 -10.310 -15.383 1.492 1.00 0.00 H new ATOM 0 HA SER A 6 -9.945 -16.168 -1.148 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.004 -15.147 -0.065 1.00 0.00 H new ATOM 0 HB3 SER A 6 -11.212 -13.585 -0.141 1.00 0.00 H new ATOM 0 HG SER A 6 -12.580 -13.965 -1.974 1.00 0.00 H new ATOM 59 N GLY A 7 -8.229 -14.785 -2.250 1.00 0.00 N ATOM 60 CA GLY A 7 -7.196 -13.998 -2.898 1.00 0.00 C ATOM 61 C GLY A 7 -6.033 -13.695 -1.974 1.00 0.00 C ATOM 62 O GLY A 7 -6.116 -13.873 -0.758 1.00 0.00 O ATOM 0 H GLY A 7 -8.433 -15.678 -2.699 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.830 -14.534 -3.774 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -7.626 -13.062 -3.254 1.00 0.00 H new ATOM 66 N PRO A 8 -4.918 -13.228 -2.554 1.00 0.00 N ATOM 67 CA PRO A 8 -3.711 -12.891 -1.793 1.00 0.00 C ATOM 68 C PRO A 8 -3.899 -11.650 -0.928 1.00 0.00 C ATOM 69 O PRO A 8 -3.579 -11.654 0.261 1.00 0.00 O ATOM 70 CB PRO A 8 -2.666 -12.633 -2.881 1.00 0.00 C ATOM 71 CG PRO A 8 -3.456 -12.227 -4.076 1.00 0.00 C ATOM 72 CD PRO A 8 -4.749 -12.992 -3.997 1.00 0.00 C ATOM 0 HA PRO A 8 -3.434 -13.682 -1.097 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -1.969 -11.850 -2.583 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.075 -13.526 -3.082 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.638 -11.152 -4.077 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -2.920 -12.460 -4.996 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -5.580 -12.421 -4.411 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -4.697 -13.928 -4.554 1.00 0.00 H new ATOM 80 N VAL A 9 -4.420 -10.587 -1.533 1.00 0.00 N ATOM 81 CA VAL A 9 -4.652 -9.337 -0.817 1.00 0.00 C ATOM 82 C VAL A 9 -6.122 -8.937 -0.873 1.00 0.00 C ATOM 83 O VAL A 9 -6.752 -8.992 -1.930 1.00 0.00 O ATOM 84 CB VAL A 9 -3.797 -8.193 -1.394 1.00 0.00 C ATOM 85 CG1 VAL A 9 -3.732 -8.287 -2.910 1.00 0.00 C ATOM 86 CG2 VAL A 9 -4.349 -6.844 -0.958 1.00 0.00 C ATOM 0 H VAL A 9 -4.689 -10.566 -2.517 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.364 -9.508 0.220 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.783 -8.288 -1.005 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.124 -7.471 -3.299 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -3.287 -9.240 -3.197 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.739 -8.218 -3.322 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -3.733 -6.047 -1.374 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.373 -6.737 -1.317 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -4.337 -6.781 0.130 1.00 0.00 H new ATOM 96 N LYS A 10 -6.664 -8.533 0.271 1.00 0.00 N ATOM 97 CA LYS A 10 -8.060 -8.121 0.353 1.00 0.00 C ATOM 98 C LYS A 10 -8.283 -6.805 -0.385 1.00 0.00 C ATOM 99 O LYS A 10 -7.387 -5.964 -0.460 1.00 0.00 O ATOM 100 CB LYS A 10 -8.484 -7.975 1.817 1.00 0.00 C ATOM 101 CG LYS A 10 -9.915 -8.411 2.081 1.00 0.00 C ATOM 102 CD LYS A 10 -10.568 -7.558 3.155 1.00 0.00 C ATOM 103 CE LYS A 10 -11.290 -6.362 2.554 1.00 0.00 C ATOM 104 NZ LYS A 10 -12.407 -6.779 1.662 1.00 0.00 N ATOM 0 H LYS A 10 -6.157 -8.482 1.155 1.00 0.00 H new ATOM 0 HA LYS A 10 -8.669 -8.891 -0.121 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -7.812 -8.564 2.442 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -8.369 -6.934 2.118 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -10.493 -8.343 1.159 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -9.927 -9.457 2.388 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -11.275 -8.164 3.722 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -9.810 -7.211 3.857 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -11.680 -5.733 3.355 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -10.581 -5.756 1.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -12.205 -6.475 0.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -12.505 -7.814 1.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -13.292 -6.339 1.985 1.00 0.00 H new ATOM 118 N VAL A 11 -9.484 -6.633 -0.929 1.00 0.00 N ATOM 119 CA VAL A 11 -9.826 -5.418 -1.659 1.00 0.00 C ATOM 120 C VAL A 11 -10.884 -4.610 -0.917 1.00 0.00 C ATOM 121 O VAL A 11 -12.063 -4.966 -0.913 1.00 0.00 O ATOM 122 CB VAL A 11 -10.340 -5.741 -3.075 1.00 0.00 C ATOM 123 CG1 VAL A 11 -10.718 -4.463 -3.809 1.00 0.00 C ATOM 124 CG2 VAL A 11 -9.296 -6.525 -3.855 1.00 0.00 C ATOM 0 H VAL A 11 -10.236 -7.320 -0.878 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.913 -4.828 -1.738 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.233 -6.359 -2.987 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -11.079 -4.710 -4.807 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -11.503 -3.945 -3.257 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -9.844 -3.817 -3.889 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -9.676 -6.744 -4.853 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -8.383 -5.935 -3.936 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.079 -7.459 -3.336 1.00 0.00 H new ATOM 134 N LEU A 12 -10.456 -3.520 -0.290 1.00 0.00 N ATOM 135 CA LEU A 12 -11.368 -2.659 0.456 1.00 0.00 C ATOM 136 C LEU A 12 -12.034 -1.643 -0.466 1.00 0.00 C ATOM 137 O LEU A 12 -11.454 -1.224 -1.467 1.00 0.00 O ATOM 138 CB LEU A 12 -10.616 -1.935 1.574 1.00 0.00 C ATOM 139 CG LEU A 12 -9.624 -2.781 2.373 1.00 0.00 C ATOM 140 CD1 LEU A 12 -8.490 -1.916 2.902 1.00 0.00 C ATOM 141 CD2 LEU A 12 -10.330 -3.494 3.516 1.00 0.00 C ATOM 0 H LEU A 12 -9.484 -3.211 -0.283 1.00 0.00 H new ATOM 0 HA LEU A 12 -12.144 -3.286 0.895 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -10.077 -1.095 1.137 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -11.348 -1.519 2.266 1.00 0.00 H new ATOM 0 HG LEU A 12 -9.200 -3.534 1.708 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -7.794 -2.535 3.468 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -7.966 -1.452 2.066 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -8.896 -1.140 3.551 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.608 -4.091 4.073 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -10.782 -2.758 4.180 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -11.106 -4.145 3.114 1.00 0.00 H new ATOM 153 N VAL A 13 -13.255 -1.248 -0.119 1.00 0.00 N ATOM 154 CA VAL A 13 -13.999 -0.278 -0.913 1.00 0.00 C ATOM 155 C VAL A 13 -14.494 0.876 -0.048 1.00 0.00 C ATOM 156 O VAL A 13 -14.441 0.813 1.179 1.00 0.00 O ATOM 157 CB VAL A 13 -15.204 -0.933 -1.614 1.00 0.00 C ATOM 158 CG1 VAL A 13 -14.737 -1.845 -2.739 1.00 0.00 C ATOM 159 CG2 VAL A 13 -16.051 -1.701 -0.611 1.00 0.00 C ATOM 0 H VAL A 13 -13.750 -1.585 0.707 1.00 0.00 H new ATOM 0 HA VAL A 13 -13.313 0.106 -1.668 1.00 0.00 H new ATOM 0 HB VAL A 13 -15.821 -0.146 -2.049 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -15.602 -2.299 -3.222 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -14.176 -1.263 -3.470 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -14.097 -2.628 -2.331 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -16.898 -2.157 -1.124 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -15.447 -2.479 -0.145 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -16.416 -1.018 0.156 1.00 0.00 H new ATOM 169 N GLY A 14 -14.975 1.932 -0.698 1.00 0.00 N ATOM 170 CA GLY A 14 -15.473 3.086 0.027 1.00 0.00 C ATOM 171 C GLY A 14 -16.770 2.797 0.757 1.00 0.00 C ATOM 172 O GLY A 14 -17.353 3.685 1.379 1.00 0.00 O ATOM 0 H GLY A 14 -15.028 2.008 -1.714 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -14.721 3.413 0.745 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -15.628 3.910 -0.670 1.00 0.00 H new ATOM 176 N LYS A 15 -17.225 1.551 0.680 1.00 0.00 N ATOM 177 CA LYS A 15 -18.462 1.146 1.337 1.00 0.00 C ATOM 178 C LYS A 15 -18.174 0.511 2.694 1.00 0.00 C ATOM 179 O LYS A 15 -18.830 0.823 3.687 1.00 0.00 O ATOM 180 CB LYS A 15 -19.234 0.162 0.455 1.00 0.00 C ATOM 181 CG LYS A 15 -20.588 -0.229 1.021 1.00 0.00 C ATOM 182 CD LYS A 15 -21.356 -1.123 0.062 1.00 0.00 C ATOM 183 CE LYS A 15 -21.886 -0.339 -1.128 1.00 0.00 C ATOM 184 NZ LYS A 15 -23.055 -1.011 -1.759 1.00 0.00 N ATOM 0 H LYS A 15 -16.755 0.804 0.169 1.00 0.00 H new ATOM 0 HA LYS A 15 -19.070 2.037 1.494 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -19.376 0.605 -0.531 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -18.634 -0.737 0.317 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -20.451 -0.746 1.971 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -21.170 0.669 1.228 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -20.706 -1.924 -0.289 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -22.187 -1.594 0.588 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -22.173 0.662 -0.805 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -21.093 -0.220 -1.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -23.387 -0.445 -2.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -22.775 -1.956 -2.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -23.821 -1.102 -1.062 1.00 0.00 H new ATOM 198 N ASN A 16 -17.189 -0.380 2.728 1.00 0.00 N ATOM 199 CA ASN A 16 -16.814 -1.058 3.964 1.00 0.00 C ATOM 200 C ASN A 16 -15.308 -0.973 4.196 1.00 0.00 C ATOM 201 O ASN A 16 -14.708 -1.872 4.785 1.00 0.00 O ATOM 202 CB ASN A 16 -17.252 -2.524 3.919 1.00 0.00 C ATOM 203 CG ASN A 16 -16.511 -3.316 2.859 1.00 0.00 C ATOM 204 OD1 ASN A 16 -17.031 -3.554 1.769 1.00 0.00 O ATOM 205 ND2 ASN A 16 -15.290 -3.730 3.176 1.00 0.00 N ATOM 0 H ASN A 16 -16.636 -0.650 1.914 1.00 0.00 H new ATOM 0 HA ASN A 16 -17.320 -0.559 4.791 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -17.084 -2.981 4.894 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -18.323 -2.575 3.724 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -14.744 -4.268 2.504 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -14.898 -3.510 4.092 1.00 0.00 H new ATOM 212 N PHE A 17 -14.704 0.115 3.730 1.00 0.00 N ATOM 213 CA PHE A 17 -13.269 0.319 3.886 1.00 0.00 C ATOM 214 C PHE A 17 -12.885 0.377 5.362 1.00 0.00 C ATOM 215 O PHE A 17 -12.118 -0.454 5.847 1.00 0.00 O ATOM 216 CB PHE A 17 -12.836 1.608 3.184 1.00 0.00 C ATOM 217 CG PHE A 17 -11.656 2.275 3.831 1.00 0.00 C ATOM 218 CD1 PHE A 17 -10.401 1.690 3.787 1.00 0.00 C ATOM 219 CD2 PHE A 17 -11.802 3.489 4.483 1.00 0.00 C ATOM 220 CE1 PHE A 17 -9.314 2.302 4.382 1.00 0.00 C ATOM 221 CE2 PHE A 17 -10.719 4.106 5.080 1.00 0.00 C ATOM 222 CZ PHE A 17 -9.473 3.512 5.029 1.00 0.00 C ATOM 0 H PHE A 17 -15.186 0.869 3.241 1.00 0.00 H new ATOM 0 HA PHE A 17 -12.755 -0.526 3.428 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -12.592 1.383 2.146 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -13.675 2.304 3.170 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.270 0.744 3.282 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -12.774 3.959 4.525 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -8.341 1.835 4.341 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -10.847 5.052 5.586 1.00 0.00 H new ATOM 0 HZ PHE A 17 -8.625 3.993 5.494 1.00 0.00 H new ATOM 232 N GLU A 18 -13.425 1.364 6.069 1.00 0.00 N ATOM 233 CA GLU A 18 -13.138 1.531 7.489 1.00 0.00 C ATOM 234 C GLU A 18 -13.585 0.307 8.282 1.00 0.00 C ATOM 235 O GLU A 18 -13.078 0.040 9.372 1.00 0.00 O ATOM 236 CB GLU A 18 -13.833 2.784 8.029 1.00 0.00 C ATOM 237 CG GLU A 18 -13.616 4.018 7.169 1.00 0.00 C ATOM 238 CD GLU A 18 -14.699 4.198 6.123 1.00 0.00 C ATOM 239 OE1 GLU A 18 -15.422 3.218 5.844 1.00 0.00 O ATOM 240 OE2 GLU A 18 -14.824 5.317 5.584 1.00 0.00 O ATOM 0 H GLU A 18 -14.063 2.060 5.682 1.00 0.00 H new ATOM 0 HA GLU A 18 -12.060 1.644 7.605 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -14.903 2.590 8.109 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -13.470 2.985 9.037 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -13.583 4.900 7.808 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -12.647 3.946 6.675 1.00 0.00 H new ATOM 247 N ASP A 19 -14.539 -0.434 7.728 1.00 0.00 N ATOM 248 CA ASP A 19 -15.055 -1.630 8.382 1.00 0.00 C ATOM 249 C ASP A 19 -13.962 -2.684 8.528 1.00 0.00 C ATOM 250 O ASP A 19 -13.760 -3.239 9.609 1.00 0.00 O ATOM 251 CB ASP A 19 -16.231 -2.204 7.590 1.00 0.00 C ATOM 252 CG ASP A 19 -17.561 -1.618 8.023 1.00 0.00 C ATOM 253 OD1 ASP A 19 -18.005 -1.922 9.150 1.00 0.00 O ATOM 254 OD2 ASP A 19 -18.157 -0.856 7.234 1.00 0.00 O ATOM 0 H ASP A 19 -14.970 -0.227 6.827 1.00 0.00 H new ATOM 0 HA ASP A 19 -15.400 -1.349 9.377 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -16.080 -2.009 6.528 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -16.256 -3.286 7.715 1.00 0.00 H new ATOM 259 N VAL A 20 -13.259 -2.956 7.433 1.00 0.00 N ATOM 260 CA VAL A 20 -12.186 -3.944 7.439 1.00 0.00 C ATOM 261 C VAL A 20 -10.866 -3.318 7.876 1.00 0.00 C ATOM 262 O VAL A 20 -10.041 -3.969 8.515 1.00 0.00 O ATOM 263 CB VAL A 20 -12.004 -4.583 6.049 1.00 0.00 C ATOM 264 CG1 VAL A 20 -10.765 -5.464 6.025 1.00 0.00 C ATOM 265 CG2 VAL A 20 -13.242 -5.378 5.663 1.00 0.00 C ATOM 0 H VAL A 20 -13.413 -2.506 6.531 1.00 0.00 H new ATOM 0 HA VAL A 20 -12.471 -4.718 8.152 1.00 0.00 H new ATOM 0 HB VAL A 20 -11.868 -3.787 5.317 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.653 -5.907 5.035 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -9.886 -4.862 6.255 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -10.867 -6.256 6.767 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -13.097 -5.823 4.678 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -13.411 -6.167 6.396 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -14.107 -4.715 5.637 1.00 0.00 H new ATOM 275 N ALA A 21 -10.674 -2.051 7.526 1.00 0.00 N ATOM 276 CA ALA A 21 -9.455 -1.336 7.883 1.00 0.00 C ATOM 277 C ALA A 21 -9.294 -1.249 9.397 1.00 0.00 C ATOM 278 O ALA A 21 -8.352 -1.804 9.964 1.00 0.00 O ATOM 279 CB ALA A 21 -9.461 0.057 7.271 1.00 0.00 C ATOM 0 H ALA A 21 -11.347 -1.498 6.995 1.00 0.00 H new ATOM 0 HA ALA A 21 -8.607 -1.892 7.484 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.545 0.579 7.546 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -9.521 -0.023 6.186 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -10.321 0.614 7.642 1.00 0.00 H new ATOM 285 N PHE A 22 -10.218 -0.550 10.047 1.00 0.00 N ATOM 286 CA PHE A 22 -10.177 -0.389 11.496 1.00 0.00 C ATOM 287 C PHE A 22 -10.766 -1.611 12.195 1.00 0.00 C ATOM 288 O PHE A 22 -11.975 -1.690 12.417 1.00 0.00 O ATOM 289 CB PHE A 22 -10.942 0.869 11.912 1.00 0.00 C ATOM 290 CG PHE A 22 -10.379 2.134 11.330 1.00 0.00 C ATOM 291 CD1 PHE A 22 -9.025 2.413 11.426 1.00 0.00 C ATOM 292 CD2 PHE A 22 -11.202 3.042 10.685 1.00 0.00 C ATOM 293 CE1 PHE A 22 -8.504 3.576 10.891 1.00 0.00 C ATOM 294 CE2 PHE A 22 -10.687 4.207 10.148 1.00 0.00 C ATOM 295 CZ PHE A 22 -9.336 4.474 10.250 1.00 0.00 C ATOM 0 H PHE A 22 -11.005 -0.086 9.593 1.00 0.00 H new ATOM 0 HA PHE A 22 -9.134 -0.288 11.797 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -11.983 0.769 11.605 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -10.936 0.945 12.999 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -8.370 1.714 11.924 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -12.259 2.837 10.601 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -7.447 3.783 10.974 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -11.340 4.908 9.649 1.00 0.00 H new ATOM 0 HZ PHE A 22 -8.931 5.383 9.830 1.00 0.00 H new ATOM 305 N ASP A 23 -9.904 -2.560 12.540 1.00 0.00 N ATOM 306 CA ASP A 23 -10.337 -3.778 13.215 1.00 0.00 C ATOM 307 C ASP A 23 -9.559 -3.988 14.510 1.00 0.00 C ATOM 308 O ASP A 23 -8.364 -3.704 14.580 1.00 0.00 O ATOM 309 CB ASP A 23 -10.157 -4.988 12.295 1.00 0.00 C ATOM 310 CG ASP A 23 -11.373 -5.239 11.425 1.00 0.00 C ATOM 311 OD1 ASP A 23 -12.498 -4.942 11.877 1.00 0.00 O ATOM 312 OD2 ASP A 23 -11.198 -5.733 10.291 1.00 0.00 O ATOM 0 H ASP A 23 -8.901 -2.510 12.363 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.394 -3.672 13.461 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -9.285 -4.831 11.660 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -9.957 -5.873 12.899 1.00 0.00 H new ATOM 317 N GLU A 24 -10.246 -4.486 15.533 1.00 0.00 N ATOM 318 CA GLU A 24 -9.619 -4.732 16.826 1.00 0.00 C ATOM 319 C GLU A 24 -8.890 -6.073 16.832 1.00 0.00 C ATOM 320 O GLU A 24 -9.353 -7.046 16.237 1.00 0.00 O ATOM 321 CB GLU A 24 -10.668 -4.704 17.940 1.00 0.00 C ATOM 322 CG GLU A 24 -10.156 -5.228 19.271 1.00 0.00 C ATOM 323 CD GLU A 24 -9.332 -4.202 20.025 1.00 0.00 C ATOM 324 OE1 GLU A 24 -9.859 -3.103 20.297 1.00 0.00 O ATOM 325 OE2 GLU A 24 -8.162 -4.499 20.342 1.00 0.00 O ATOM 0 H GLU A 24 -11.236 -4.727 15.491 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.890 -3.941 17.003 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.018 -3.680 18.072 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.529 -5.298 17.632 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.002 -5.532 19.887 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -9.551 -6.118 19.098 1.00 0.00 H new ATOM 332 N LYS A 25 -7.747 -6.115 17.508 1.00 0.00 N ATOM 333 CA LYS A 25 -6.953 -7.335 17.593 1.00 0.00 C ATOM 334 C LYS A 25 -6.572 -7.834 16.203 1.00 0.00 C ATOM 335 O LYS A 25 -6.445 -9.038 15.978 1.00 0.00 O ATOM 336 CB LYS A 25 -7.728 -8.421 18.343 1.00 0.00 C ATOM 337 CG LYS A 25 -7.491 -8.412 19.843 1.00 0.00 C ATOM 338 CD LYS A 25 -6.138 -9.008 20.197 1.00 0.00 C ATOM 339 CE LYS A 25 -6.208 -10.523 20.308 1.00 0.00 C ATOM 340 NZ LYS A 25 -5.977 -11.186 18.995 1.00 0.00 N ATOM 0 H LYS A 25 -7.350 -5.318 18.005 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.039 -7.107 18.140 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.793 -8.293 18.151 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -7.447 -9.396 17.945 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -7.548 -7.389 20.215 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.280 -8.976 20.340 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -5.407 -8.731 19.437 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -5.790 -8.589 21.141 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -5.464 -10.869 21.026 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -7.184 -10.814 20.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -5.476 -12.085 19.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.891 -11.371 18.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -5.403 -10.566 18.389 1.00 0.00 H new ATOM 354 N LYS A 26 -6.390 -6.902 15.274 1.00 0.00 N ATOM 355 CA LYS A 26 -6.021 -7.247 13.906 1.00 0.00 C ATOM 356 C LYS A 26 -5.247 -6.109 13.248 1.00 0.00 C ATOM 357 O LYS A 26 -5.746 -4.990 13.138 1.00 0.00 O ATOM 358 CB LYS A 26 -7.271 -7.570 13.084 1.00 0.00 C ATOM 359 CG LYS A 26 -7.008 -7.673 11.592 1.00 0.00 C ATOM 360 CD LYS A 26 -6.539 -9.065 11.204 1.00 0.00 C ATOM 361 CE LYS A 26 -7.678 -10.071 11.251 1.00 0.00 C ATOM 362 NZ LYS A 26 -8.832 -9.642 10.413 1.00 0.00 N ATOM 0 H LYS A 26 -6.492 -5.901 15.443 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.379 -8.127 13.941 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -7.694 -8.511 13.436 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -8.021 -6.798 13.260 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -7.918 -7.428 11.043 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.255 -6.940 11.303 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.115 -9.040 10.200 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -5.744 -9.383 11.878 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -7.320 -11.041 10.907 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -8.006 -10.200 12.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -9.279 -10.477 9.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -9.526 -9.144 11.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -8.498 -9.005 9.662 1.00 0.00 H new ATOM 376 N ASN A 27 -4.027 -6.404 12.811 1.00 0.00 N ATOM 377 CA ASN A 27 -3.186 -5.405 12.163 1.00 0.00 C ATOM 378 C ASN A 27 -3.381 -5.428 10.650 1.00 0.00 C ATOM 379 O ASN A 27 -2.760 -6.223 9.945 1.00 0.00 O ATOM 380 CB ASN A 27 -1.714 -5.650 12.502 1.00 0.00 C ATOM 381 CG ASN A 27 -1.472 -5.740 13.996 1.00 0.00 C ATOM 382 OD1 ASN A 27 -1.200 -4.735 14.654 1.00 0.00 O ATOM 383 ND2 ASN A 27 -1.570 -6.947 14.540 1.00 0.00 N ATOM 0 H ASN A 27 -3.599 -7.326 12.894 1.00 0.00 H new ATOM 0 HA ASN A 27 -3.479 -4.423 12.535 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -1.383 -6.574 12.027 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -1.109 -4.844 12.087 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.418 -7.069 15.541 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -1.798 -7.752 13.957 1.00 0.00 H new ATOM 390 N VAL A 28 -4.248 -4.549 10.157 1.00 0.00 N ATOM 391 CA VAL A 28 -4.525 -4.466 8.728 1.00 0.00 C ATOM 392 C VAL A 28 -3.663 -3.399 8.062 1.00 0.00 C ATOM 393 O VAL A 28 -3.609 -2.256 8.518 1.00 0.00 O ATOM 394 CB VAL A 28 -6.009 -4.153 8.460 1.00 0.00 C ATOM 395 CG1 VAL A 28 -6.292 -4.147 6.966 1.00 0.00 C ATOM 396 CG2 VAL A 28 -6.902 -5.155 9.177 1.00 0.00 C ATOM 0 H VAL A 28 -4.771 -3.884 10.727 1.00 0.00 H new ATOM 0 HA VAL A 28 -4.285 -5.440 8.303 1.00 0.00 H new ATOM 0 HB VAL A 28 -6.230 -3.160 8.851 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -7.345 -3.924 6.796 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -5.678 -3.387 6.482 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -6.056 -5.125 6.547 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -7.947 -4.919 8.977 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -6.682 -6.160 8.818 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -6.718 -5.104 10.250 1.00 0.00 H new ATOM 406 N PHE A 29 -2.991 -3.779 6.980 1.00 0.00 N ATOM 407 CA PHE A 29 -2.131 -2.854 6.251 1.00 0.00 C ATOM 408 C PHE A 29 -2.712 -2.541 4.875 1.00 0.00 C ATOM 409 O PHE A 29 -2.565 -3.322 3.935 1.00 0.00 O ATOM 410 CB PHE A 29 -0.726 -3.441 6.102 1.00 0.00 C ATOM 411 CG PHE A 29 0.252 -2.499 5.461 1.00 0.00 C ATOM 412 CD1 PHE A 29 0.062 -1.128 5.531 1.00 0.00 C ATOM 413 CD2 PHE A 29 1.363 -2.983 4.789 1.00 0.00 C ATOM 414 CE1 PHE A 29 0.960 -0.258 4.942 1.00 0.00 C ATOM 415 CE2 PHE A 29 2.265 -2.118 4.199 1.00 0.00 C ATOM 416 CZ PHE A 29 2.062 -0.754 4.274 1.00 0.00 C ATOM 0 H PHE A 29 -3.025 -4.720 6.589 1.00 0.00 H new ATOM 0 HA PHE A 29 -2.072 -1.927 6.821 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -0.353 -3.725 7.086 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -0.783 -4.353 5.508 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -0.798 -0.735 6.052 1.00 0.00 H new ATOM 0 HD2 PHE A 29 1.526 -4.049 4.726 1.00 0.00 H new ATOM 0 HE1 PHE A 29 0.800 0.808 5.004 1.00 0.00 H new ATOM 0 HE2 PHE A 29 3.128 -2.508 3.680 1.00 0.00 H new ATOM 0 HZ PHE A 29 2.764 -0.076 3.811 1.00 0.00 H new ATOM 426 N VAL A 30 -3.373 -1.393 4.766 1.00 0.00 N ATOM 427 CA VAL A 30 -3.977 -0.976 3.506 1.00 0.00 C ATOM 428 C VAL A 30 -2.948 -0.312 2.597 1.00 0.00 C ATOM 429 O VAL A 30 -1.881 0.101 3.050 1.00 0.00 O ATOM 430 CB VAL A 30 -5.145 0.000 3.739 1.00 0.00 C ATOM 431 CG1 VAL A 30 -5.867 0.292 2.432 1.00 0.00 C ATOM 432 CG2 VAL A 30 -6.108 -0.560 4.776 1.00 0.00 C ATOM 0 H VAL A 30 -3.504 -0.735 5.535 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.357 -1.877 3.024 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.741 0.938 4.120 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -6.689 0.983 2.617 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.170 0.739 1.723 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.260 -0.637 2.018 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.927 0.142 4.928 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -6.507 -1.512 4.426 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.581 -0.712 5.718 1.00 0.00 H new ATOM 442 N GLU A 31 -3.277 -0.212 1.313 1.00 0.00 N ATOM 443 CA GLU A 31 -2.381 0.402 0.341 1.00 0.00 C ATOM 444 C GLU A 31 -3.165 1.221 -0.680 1.00 0.00 C ATOM 445 O GLU A 31 -3.811 0.669 -1.571 1.00 0.00 O ATOM 446 CB GLU A 31 -1.556 -0.670 -0.374 1.00 0.00 C ATOM 447 CG GLU A 31 -0.997 -0.216 -1.712 1.00 0.00 C ATOM 448 CD GLU A 31 -0.322 -1.341 -2.474 1.00 0.00 C ATOM 449 OE1 GLU A 31 0.874 -1.594 -2.222 1.00 0.00 O ATOM 450 OE2 GLU A 31 -0.991 -1.968 -3.322 1.00 0.00 O ATOM 0 H GLU A 31 -4.157 -0.548 0.922 1.00 0.00 H new ATOM 0 HA GLU A 31 -1.708 1.070 0.878 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.731 -0.972 0.271 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -2.178 -1.551 -0.530 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.804 0.195 -2.318 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.280 0.588 -1.548 1.00 0.00 H new ATOM 457 N PHE A 32 -3.103 2.542 -0.544 1.00 0.00 N ATOM 458 CA PHE A 32 -3.808 3.438 -1.453 1.00 0.00 C ATOM 459 C PHE A 32 -3.016 3.640 -2.741 1.00 0.00 C ATOM 460 O PHE A 32 -2.082 4.441 -2.790 1.00 0.00 O ATOM 461 CB PHE A 32 -4.060 4.788 -0.779 1.00 0.00 C ATOM 462 CG PHE A 32 -4.890 4.690 0.468 1.00 0.00 C ATOM 463 CD1 PHE A 32 -6.273 4.742 0.401 1.00 0.00 C ATOM 464 CD2 PHE A 32 -4.288 4.547 1.708 1.00 0.00 C ATOM 465 CE1 PHE A 32 -7.041 4.651 1.547 1.00 0.00 C ATOM 466 CE2 PHE A 32 -5.051 4.456 2.857 1.00 0.00 C ATOM 467 CZ PHE A 32 -6.428 4.509 2.777 1.00 0.00 C ATOM 0 H PHE A 32 -2.572 3.015 0.187 1.00 0.00 H new ATOM 0 HA PHE A 32 -4.765 2.981 -1.704 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -3.102 5.247 -0.533 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.558 5.451 -1.486 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -6.757 4.855 -0.558 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -3.211 4.506 1.777 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -8.118 4.691 1.481 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -4.570 4.343 3.817 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.025 4.440 3.674 1.00 0.00 H new ATOM 477 N TYR A 33 -3.394 2.907 -3.783 1.00 0.00 N ATOM 478 CA TYR A 33 -2.718 3.002 -5.071 1.00 0.00 C ATOM 479 C TYR A 33 -3.579 3.749 -6.085 1.00 0.00 C ATOM 480 O TYR A 33 -4.728 4.092 -5.807 1.00 0.00 O ATOM 481 CB TYR A 33 -2.383 1.606 -5.599 1.00 0.00 C ATOM 482 CG TYR A 33 -3.599 0.807 -6.010 1.00 0.00 C ATOM 483 CD1 TYR A 33 -4.223 1.032 -7.230 1.00 0.00 C ATOM 484 CD2 TYR A 33 -4.123 -0.175 -5.178 1.00 0.00 C ATOM 485 CE1 TYR A 33 -5.335 0.305 -7.609 1.00 0.00 C ATOM 486 CE2 TYR A 33 -5.233 -0.909 -5.549 1.00 0.00 C ATOM 487 CZ TYR A 33 -5.836 -0.665 -6.766 1.00 0.00 C ATOM 488 OH TYR A 33 -6.942 -1.393 -7.140 1.00 0.00 O ATOM 0 H TYR A 33 -4.166 2.240 -3.760 1.00 0.00 H new ATOM 0 HA TYR A 33 -1.793 3.560 -4.927 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -1.715 1.701 -6.455 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -1.840 1.056 -4.830 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -3.832 1.789 -7.894 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -3.654 -0.368 -4.224 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -5.810 0.495 -8.560 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -5.626 -1.669 -4.890 1.00 0.00 H new ATOM 0 HH TYR A 33 -7.165 -2.035 -6.434 1.00 0.00 H new ATOM 498 N ALA A 34 -3.015 3.996 -7.262 1.00 0.00 N ATOM 499 CA ALA A 34 -3.731 4.699 -8.319 1.00 0.00 C ATOM 500 C ALA A 34 -3.673 3.924 -9.631 1.00 0.00 C ATOM 501 O ALA A 34 -2.631 3.399 -10.025 1.00 0.00 O ATOM 502 CB ALA A 34 -3.159 6.097 -8.505 1.00 0.00 C ATOM 0 H ALA A 34 -2.064 3.720 -7.508 1.00 0.00 H new ATOM 0 HA ALA A 34 -4.776 4.782 -8.022 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -3.703 6.610 -9.298 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.258 6.657 -7.575 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.106 6.026 -8.776 1.00 0.00 H new ATOM 508 N PRO A 35 -4.818 3.847 -10.325 1.00 0.00 N ATOM 509 CA PRO A 35 -4.923 3.137 -11.603 1.00 0.00 C ATOM 510 C PRO A 35 -4.176 3.850 -12.726 1.00 0.00 C ATOM 511 O PRO A 35 -4.126 3.366 -13.856 1.00 0.00 O ATOM 512 CB PRO A 35 -6.428 3.131 -11.883 1.00 0.00 C ATOM 513 CG PRO A 35 -6.956 4.312 -11.144 1.00 0.00 C ATOM 514 CD PRO A 35 -6.099 4.449 -9.916 1.00 0.00 C ATOM 0 HA PRO A 35 -4.480 2.142 -11.554 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -6.632 3.209 -12.951 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -6.891 2.207 -11.536 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -6.905 5.211 -11.758 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -8.003 4.168 -10.875 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -5.978 5.492 -9.625 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -6.533 3.928 -9.063 1.00 0.00 H new ATOM 522 N TRP A 36 -3.597 5.002 -12.406 1.00 0.00 N ATOM 523 CA TRP A 36 -2.852 5.781 -13.388 1.00 0.00 C ATOM 524 C TRP A 36 -1.431 6.050 -12.906 1.00 0.00 C ATOM 525 O TRP A 36 -0.476 5.958 -13.677 1.00 0.00 O ATOM 526 CB TRP A 36 -3.567 7.103 -13.670 1.00 0.00 C ATOM 527 CG TRP A 36 -4.374 7.601 -12.509 1.00 0.00 C ATOM 528 CD1 TRP A 36 -5.697 7.362 -12.268 1.00 0.00 C ATOM 529 CD2 TRP A 36 -3.911 8.423 -11.432 1.00 0.00 C ATOM 530 NE1 TRP A 36 -6.084 7.986 -11.107 1.00 0.00 N ATOM 531 CE2 TRP A 36 -5.006 8.643 -10.574 1.00 0.00 C ATOM 532 CE3 TRP A 36 -2.677 8.994 -11.109 1.00 0.00 C ATOM 533 CZ2 TRP A 36 -4.903 9.410 -9.417 1.00 0.00 C ATOM 534 CZ3 TRP A 36 -2.576 9.754 -9.959 1.00 0.00 C ATOM 535 CH2 TRP A 36 -3.683 9.956 -9.124 1.00 0.00 C ATOM 0 H TRP A 36 -3.629 5.417 -11.475 1.00 0.00 H new ATOM 0 HA TRP A 36 -2.799 5.201 -14.309 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -2.828 7.857 -13.940 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -4.223 6.977 -14.532 1.00 0.00 H new ATOM 0 HD1 TRP A 36 -6.344 6.769 -12.898 1.00 0.00 H new ATOM 0 HE1 TRP A 36 -7.022 7.964 -10.707 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -1.818 8.844 -11.746 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -5.756 9.569 -8.773 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -1.627 10.200 -9.699 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -3.571 10.554 -8.232 1.00 0.00 H new ATOM 546 N CYS A 37 -1.299 6.382 -11.626 1.00 0.00 N ATOM 547 CA CYS A 37 0.007 6.665 -11.041 1.00 0.00 C ATOM 548 C CYS A 37 1.022 5.596 -11.434 1.00 0.00 C ATOM 549 O CYS A 37 0.771 4.401 -11.280 1.00 0.00 O ATOM 550 CB CYS A 37 -0.101 6.748 -9.518 1.00 0.00 C ATOM 551 SG CYS A 37 1.408 7.317 -8.701 1.00 0.00 S ATOM 0 H CYS A 37 -2.080 6.462 -10.974 1.00 0.00 H new ATOM 0 HA CYS A 37 0.350 7.625 -11.426 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -0.918 7.421 -9.259 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.363 5.764 -9.129 1.00 0.00 H new ATOM 0 HG CYS A 37 1.118 8.279 -7.876 1.00 0.00 H new ATOM 557 N GLY A 38 2.169 6.035 -11.943 1.00 0.00 N ATOM 558 CA GLY A 38 3.204 5.103 -12.351 1.00 0.00 C ATOM 559 C GLY A 38 3.745 4.292 -11.191 1.00 0.00 C ATOM 560 O GLY A 38 3.538 3.080 -11.121 1.00 0.00 O ATOM 0 H GLY A 38 2.400 7.019 -12.080 1.00 0.00 H new ATOM 0 HA2 GLY A 38 2.803 4.427 -13.106 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.021 5.654 -12.817 1.00 0.00 H new ATOM 564 N HIS A 39 4.442 4.960 -10.277 1.00 0.00 N ATOM 565 CA HIS A 39 5.015 4.293 -9.114 1.00 0.00 C ATOM 566 C HIS A 39 4.059 3.239 -8.565 1.00 0.00 C ATOM 567 O HIS A 39 4.487 2.199 -8.062 1.00 0.00 O ATOM 568 CB HIS A 39 5.346 5.314 -8.025 1.00 0.00 C ATOM 569 CG HIS A 39 6.682 5.968 -8.202 1.00 0.00 C ATOM 570 ND1 HIS A 39 7.869 5.267 -8.193 1.00 0.00 N ATOM 571 CD2 HIS A 39 7.014 7.265 -8.396 1.00 0.00 C ATOM 572 CE1 HIS A 39 8.874 6.106 -8.371 1.00 0.00 C ATOM 573 NE2 HIS A 39 8.382 7.325 -8.497 1.00 0.00 N ATOM 0 H HIS A 39 4.623 5.963 -10.320 1.00 0.00 H new ATOM 0 HA HIS A 39 5.933 3.797 -9.428 1.00 0.00 H new ATOM 0 HB2 HIS A 39 4.573 6.083 -8.013 1.00 0.00 H new ATOM 0 HB3 HIS A 39 5.319 4.819 -7.054 1.00 0.00 H new ATOM 0 HD2 HIS A 39 6.330 8.098 -8.460 1.00 0.00 H new ATOM 0 HE1 HIS A 39 9.920 5.840 -8.407 1.00 0.00 H new ATOM 0 HE2 HIS A 39 8.929 8.173 -8.645 1.00 0.00 H new ATOM 582 N CYS A 40 2.763 3.514 -8.665 1.00 0.00 N ATOM 583 CA CYS A 40 1.745 2.589 -8.178 1.00 0.00 C ATOM 584 C CYS A 40 1.683 1.340 -9.050 1.00 0.00 C ATOM 585 O CYS A 40 1.642 0.218 -8.545 1.00 0.00 O ATOM 586 CB CYS A 40 0.378 3.273 -8.147 1.00 0.00 C ATOM 587 SG CYS A 40 0.194 4.499 -6.830 1.00 0.00 S ATOM 0 H CYS A 40 2.392 4.369 -9.079 1.00 0.00 H new ATOM 0 HA CYS A 40 2.016 2.289 -7.166 1.00 0.00 H new ATOM 0 HB2 CYS A 40 0.205 3.759 -9.107 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -0.394 2.512 -8.031 1.00 0.00 H new ATOM 0 HG CYS A 40 0.623 5.653 -7.248 1.00 0.00 H new ATOM 593 N LYS A 41 1.675 1.541 -10.364 1.00 0.00 N ATOM 594 CA LYS A 41 1.617 0.432 -11.308 1.00 0.00 C ATOM 595 C LYS A 41 2.680 -0.613 -10.985 1.00 0.00 C ATOM 596 O LYS A 41 2.528 -1.788 -11.317 1.00 0.00 O ATOM 597 CB LYS A 41 1.806 0.942 -12.738 1.00 0.00 C ATOM 598 CG LYS A 41 0.578 1.635 -13.304 1.00 0.00 C ATOM 599 CD LYS A 41 0.813 2.111 -14.728 1.00 0.00 C ATOM 600 CE LYS A 41 -0.498 2.405 -15.440 1.00 0.00 C ATOM 601 NZ LYS A 41 -1.161 1.160 -15.919 1.00 0.00 N ATOM 0 H LYS A 41 1.708 2.463 -10.799 1.00 0.00 H new ATOM 0 HA LYS A 41 0.636 -0.035 -11.222 1.00 0.00 H new ATOM 0 HB2 LYS A 41 2.647 1.636 -12.759 1.00 0.00 H new ATOM 0 HB3 LYS A 41 2.069 0.103 -13.382 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -0.269 0.950 -13.284 1.00 0.00 H new ATOM 0 HG3 LYS A 41 0.316 2.485 -12.674 1.00 0.00 H new ATOM 0 HD2 LYS A 41 1.431 3.009 -14.715 1.00 0.00 H new ATOM 0 HD3 LYS A 41 1.366 1.351 -15.280 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -1.168 2.936 -14.763 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -0.311 3.066 -16.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -2.051 1.403 -16.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -0.533 0.666 -16.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -1.363 0.540 -15.109 1.00 0.00 H new ATOM 615 N GLN A 42 3.755 -0.177 -10.336 1.00 0.00 N ATOM 616 CA GLN A 42 4.842 -1.076 -9.968 1.00 0.00 C ATOM 617 C GLN A 42 4.572 -1.734 -8.619 1.00 0.00 C ATOM 618 O GLN A 42 5.121 -2.793 -8.312 1.00 0.00 O ATOM 619 CB GLN A 42 6.168 -0.314 -9.922 1.00 0.00 C ATOM 620 CG GLN A 42 6.592 0.253 -11.267 1.00 0.00 C ATOM 621 CD GLN A 42 7.220 -0.791 -12.169 1.00 0.00 C ATOM 622 OE1 GLN A 42 7.605 -1.869 -11.716 1.00 0.00 O ATOM 623 NE2 GLN A 42 7.327 -0.476 -13.454 1.00 0.00 N ATOM 0 H GLN A 42 3.896 0.793 -10.054 1.00 0.00 H new ATOM 0 HA GLN A 42 4.906 -1.857 -10.725 1.00 0.00 H new ATOM 0 HB2 GLN A 42 6.084 0.502 -9.204 1.00 0.00 H new ATOM 0 HB3 GLN A 42 6.948 -0.981 -9.556 1.00 0.00 H new ATOM 0 HG2 GLN A 42 5.723 0.683 -11.766 1.00 0.00 H new ATOM 0 HG3 GLN A 42 7.302 1.064 -11.107 1.00 0.00 H new ATOM 0 HE21 GLN A 42 6.995 0.429 -13.787 1.00 0.00 H new ATOM 0 HE22 GLN A 42 7.742 -1.139 -14.109 1.00 0.00 H new ATOM 632 N LEU A 43 3.724 -1.100 -7.817 1.00 0.00 N ATOM 633 CA LEU A 43 3.381 -1.624 -6.499 1.00 0.00 C ATOM 634 C LEU A 43 2.299 -2.694 -6.604 1.00 0.00 C ATOM 635 O LEU A 43 2.094 -3.476 -5.676 1.00 0.00 O ATOM 636 CB LEU A 43 2.908 -0.491 -5.586 1.00 0.00 C ATOM 637 CG LEU A 43 2.995 -0.760 -4.084 1.00 0.00 C ATOM 638 CD1 LEU A 43 4.447 -0.872 -3.645 1.00 0.00 C ATOM 639 CD2 LEU A 43 2.284 0.336 -3.304 1.00 0.00 C ATOM 0 H LEU A 43 3.261 -0.223 -8.056 1.00 0.00 H new ATOM 0 HA LEU A 43 4.275 -2.078 -6.071 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.496 0.399 -5.810 1.00 0.00 H new ATOM 0 HB3 LEU A 43 1.872 -0.260 -5.834 1.00 0.00 H new ATOM 0 HG LEU A 43 2.499 -1.708 -3.875 1.00 0.00 H new ATOM 0 HD11 LEU A 43 4.489 -1.064 -2.573 1.00 0.00 H new ATOM 0 HD12 LEU A 43 4.926 -1.692 -4.179 1.00 0.00 H new ATOM 0 HD13 LEU A 43 4.967 0.059 -3.868 1.00 0.00 H new ATOM 0 HD21 LEU A 43 2.356 0.128 -2.236 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.751 1.297 -3.519 1.00 0.00 H new ATOM 0 HD23 LEU A 43 1.235 0.369 -3.597 1.00 0.00 H new ATOM 651 N ALA A 44 1.611 -2.724 -7.740 1.00 0.00 N ATOM 652 CA ALA A 44 0.553 -3.701 -7.967 1.00 0.00 C ATOM 653 C ALA A 44 1.038 -5.115 -7.667 1.00 0.00 C ATOM 654 O ALA A 44 0.437 -5.851 -6.885 1.00 0.00 O ATOM 655 CB ALA A 44 0.047 -3.607 -9.399 1.00 0.00 C ATOM 0 H ALA A 44 1.767 -2.083 -8.518 1.00 0.00 H new ATOM 0 HA ALA A 44 -0.269 -3.475 -7.287 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -0.743 -4.342 -9.555 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -0.347 -2.607 -9.581 1.00 0.00 H new ATOM 0 HB3 ALA A 44 0.868 -3.805 -10.089 1.00 0.00 H new ATOM 661 N PRO A 45 2.152 -5.507 -8.304 1.00 0.00 N ATOM 662 CA PRO A 45 2.743 -6.836 -8.121 1.00 0.00 C ATOM 663 C PRO A 45 3.354 -7.013 -6.735 1.00 0.00 C ATOM 664 O PRO A 45 3.067 -7.987 -6.039 1.00 0.00 O ATOM 665 CB PRO A 45 3.830 -6.892 -9.197 1.00 0.00 C ATOM 666 CG PRO A 45 4.188 -5.468 -9.448 1.00 0.00 C ATOM 667 CD PRO A 45 2.922 -4.682 -9.250 1.00 0.00 C ATOM 0 HA PRO A 45 1.999 -7.628 -8.206 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.694 -7.464 -8.858 1.00 0.00 H new ATOM 0 HB3 PRO A 45 3.465 -7.374 -10.104 1.00 0.00 H new ATOM 0 HG2 PRO A 45 4.966 -5.134 -8.761 1.00 0.00 H new ATOM 0 HG3 PRO A 45 4.576 -5.335 -10.458 1.00 0.00 H new ATOM 0 HD2 PRO A 45 3.124 -3.690 -8.846 1.00 0.00 H new ATOM 0 HD3 PRO A 45 2.386 -4.541 -10.188 1.00 0.00 H new ATOM 675 N ILE A 46 4.198 -6.065 -6.341 1.00 0.00 N ATOM 676 CA ILE A 46 4.849 -6.116 -5.037 1.00 0.00 C ATOM 677 C ILE A 46 3.823 -6.240 -3.916 1.00 0.00 C ATOM 678 O ILE A 46 4.024 -6.986 -2.957 1.00 0.00 O ATOM 679 CB ILE A 46 5.714 -4.867 -4.790 1.00 0.00 C ATOM 680 CG1 ILE A 46 6.751 -4.709 -5.905 1.00 0.00 C ATOM 681 CG2 ILE A 46 6.397 -4.955 -3.434 1.00 0.00 C ATOM 682 CD1 ILE A 46 7.118 -3.269 -6.190 1.00 0.00 C ATOM 0 H ILE A 46 4.447 -5.253 -6.906 1.00 0.00 H new ATOM 0 HA ILE A 46 5.491 -6.997 -5.039 1.00 0.00 H new ATOM 0 HB ILE A 46 5.067 -3.990 -4.793 1.00 0.00 H new ATOM 0 HG12 ILE A 46 7.652 -5.258 -5.632 1.00 0.00 H new ATOM 0 HG13 ILE A 46 6.364 -5.164 -6.817 1.00 0.00 H new ATOM 0 HG21 ILE A 46 7.005 -4.064 -3.274 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.643 -5.025 -2.650 1.00 0.00 H new ATOM 0 HG23 ILE A 46 7.034 -5.839 -3.404 1.00 0.00 H new ATOM 0 HD11 ILE A 46 7.857 -3.233 -6.991 1.00 0.00 H new ATOM 0 HD12 ILE A 46 6.227 -2.720 -6.494 1.00 0.00 H new ATOM 0 HD13 ILE A 46 7.535 -2.815 -5.291 1.00 0.00 H new ATOM 694 N TRP A 47 2.724 -5.506 -4.043 1.00 0.00 N ATOM 695 CA TRP A 47 1.665 -5.535 -3.041 1.00 0.00 C ATOM 696 C TRP A 47 0.941 -6.877 -3.052 1.00 0.00 C ATOM 697 O TRP A 47 0.518 -7.373 -2.008 1.00 0.00 O ATOM 698 CB TRP A 47 0.668 -4.402 -3.289 1.00 0.00 C ATOM 699 CG TRP A 47 -0.236 -4.140 -2.122 1.00 0.00 C ATOM 700 CD1 TRP A 47 -1.589 -4.317 -2.079 1.00 0.00 C ATOM 701 CD2 TRP A 47 0.149 -3.653 -0.832 1.00 0.00 C ATOM 702 NE1 TRP A 47 -2.069 -3.969 -0.839 1.00 0.00 N ATOM 703 CE2 TRP A 47 -1.023 -3.559 -0.056 1.00 0.00 C ATOM 704 CE3 TRP A 47 1.369 -3.289 -0.257 1.00 0.00 C ATOM 705 CZ2 TRP A 47 -1.008 -3.115 1.263 1.00 0.00 C ATOM 706 CZ3 TRP A 47 1.382 -2.848 1.053 1.00 0.00 C ATOM 707 CH2 TRP A 47 0.201 -2.765 1.802 1.00 0.00 C ATOM 0 H TRP A 47 2.543 -4.883 -4.830 1.00 0.00 H new ATOM 0 HA TRP A 47 2.123 -5.398 -2.061 1.00 0.00 H new ATOM 0 HB2 TRP A 47 1.217 -3.490 -3.526 1.00 0.00 H new ATOM 0 HB3 TRP A 47 0.062 -4.646 -4.162 1.00 0.00 H new ATOM 0 HD1 TRP A 47 -2.193 -4.677 -2.899 1.00 0.00 H new ATOM 0 HE1 TRP A 47 -3.046 -4.010 -0.549 1.00 0.00 H new ATOM 0 HE3 TRP A 47 2.285 -3.351 -0.826 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 -1.918 -3.049 1.841 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 2.319 -2.562 1.507 1.00 0.00 H new ATOM 0 HH2 TRP A 47 0.245 -2.418 2.824 1.00 0.00 H new ATOM 718 N ASP A 48 0.802 -7.459 -4.238 1.00 0.00 N ATOM 719 CA ASP A 48 0.130 -8.745 -4.385 1.00 0.00 C ATOM 720 C ASP A 48 1.000 -9.877 -3.847 1.00 0.00 C ATOM 721 O ASP A 48 0.492 -10.887 -3.359 1.00 0.00 O ATOM 722 CB ASP A 48 -0.212 -9.001 -5.853 1.00 0.00 C ATOM 723 CG ASP A 48 -0.310 -10.480 -6.176 1.00 0.00 C ATOM 724 OD1 ASP A 48 0.705 -11.190 -6.019 1.00 0.00 O ATOM 725 OD2 ASP A 48 -1.402 -10.926 -6.583 1.00 0.00 O ATOM 0 H ASP A 48 1.146 -7.061 -5.112 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.793 -8.713 -3.806 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.159 -8.516 -6.092 1.00 0.00 H new ATOM 0 HB3 ASP A 48 0.549 -8.544 -6.485 1.00 0.00 H new ATOM 730 N LYS A 49 2.314 -9.703 -3.941 1.00 0.00 N ATOM 731 CA LYS A 49 3.255 -10.709 -3.464 1.00 0.00 C ATOM 732 C LYS A 49 3.345 -10.691 -1.941 1.00 0.00 C ATOM 733 O LYS A 49 3.661 -11.705 -1.316 1.00 0.00 O ATOM 734 CB LYS A 49 4.640 -10.469 -4.070 1.00 0.00 C ATOM 735 CG LYS A 49 4.749 -10.894 -5.524 1.00 0.00 C ATOM 736 CD LYS A 49 5.766 -10.052 -6.276 1.00 0.00 C ATOM 737 CE LYS A 49 7.177 -10.593 -6.099 1.00 0.00 C ATOM 738 NZ LYS A 49 7.513 -11.615 -7.128 1.00 0.00 N ATOM 0 H LYS A 49 2.751 -8.874 -4.343 1.00 0.00 H new ATOM 0 HA LYS A 49 2.892 -11.688 -3.778 1.00 0.00 H new ATOM 0 HB2 LYS A 49 4.884 -9.410 -3.991 1.00 0.00 H new ATOM 0 HB3 LYS A 49 5.383 -11.012 -3.485 1.00 0.00 H new ATOM 0 HG2 LYS A 49 5.035 -11.945 -5.577 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.775 -10.804 -6.004 1.00 0.00 H new ATOM 0 HD2 LYS A 49 5.512 -10.034 -7.336 1.00 0.00 H new ATOM 0 HD3 LYS A 49 5.722 -9.023 -5.920 1.00 0.00 H new ATOM 0 HE2 LYS A 49 7.891 -9.771 -6.157 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.276 -11.032 -5.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.482 -11.958 -6.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 6.848 -12.411 -7.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 7.444 -11.190 -8.075 1.00 0.00 H new ATOM 752 N LEU A 50 3.065 -9.535 -1.350 1.00 0.00 N ATOM 753 CA LEU A 50 3.113 -9.386 0.101 1.00 0.00 C ATOM 754 C LEU A 50 1.784 -9.786 0.733 1.00 0.00 C ATOM 755 O LEU A 50 1.748 -10.319 1.842 1.00 0.00 O ATOM 756 CB LEU A 50 3.455 -7.943 0.474 1.00 0.00 C ATOM 757 CG LEU A 50 2.930 -7.457 1.825 1.00 0.00 C ATOM 758 CD1 LEU A 50 3.708 -8.099 2.963 1.00 0.00 C ATOM 759 CD2 LEU A 50 3.008 -5.940 1.913 1.00 0.00 C ATOM 0 H LEU A 50 2.802 -8.687 -1.852 1.00 0.00 H new ATOM 0 HA LEU A 50 3.890 -10.047 0.484 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.540 -7.835 0.468 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.064 -7.286 -0.303 1.00 0.00 H new ATOM 0 HG LEU A 50 1.885 -7.753 1.914 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.320 -7.741 3.917 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.601 -9.182 2.911 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.762 -7.834 2.878 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.630 -5.612 2.881 1.00 0.00 H new ATOM 0 HD22 LEU A 50 4.045 -5.622 1.801 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.405 -5.498 1.120 1.00 0.00 H new ATOM 771 N GLY A 51 0.693 -9.527 0.019 1.00 0.00 N ATOM 772 CA GLY A 51 -0.624 -9.869 0.526 1.00 0.00 C ATOM 773 C GLY A 51 -0.800 -11.361 0.723 1.00 0.00 C ATOM 774 O GLY A 51 -1.401 -11.797 1.704 1.00 0.00 O ATOM 0 H GLY A 51 0.697 -9.087 -0.901 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -0.788 -9.359 1.475 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -1.382 -9.505 -0.167 1.00 0.00 H new ATOM 778 N GLU A 52 -0.276 -12.146 -0.213 1.00 0.00 N ATOM 779 CA GLU A 52 -0.381 -13.599 -0.138 1.00 0.00 C ATOM 780 C GLU A 52 0.412 -14.141 1.048 1.00 0.00 C ATOM 781 O GLU A 52 0.083 -15.190 1.603 1.00 0.00 O ATOM 782 CB GLU A 52 0.120 -14.236 -1.436 1.00 0.00 C ATOM 783 CG GLU A 52 1.634 -14.328 -1.524 1.00 0.00 C ATOM 784 CD GLU A 52 2.107 -14.918 -2.838 1.00 0.00 C ATOM 785 OE1 GLU A 52 1.487 -14.618 -3.880 1.00 0.00 O ATOM 786 OE2 GLU A 52 3.097 -15.679 -2.825 1.00 0.00 O ATOM 0 H GLU A 52 0.225 -11.801 -1.032 1.00 0.00 H new ATOM 0 HA GLU A 52 -1.431 -13.856 0.002 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -0.302 -15.237 -1.526 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -0.250 -13.656 -2.282 1.00 0.00 H new ATOM 0 HG2 GLU A 52 2.062 -13.333 -1.402 1.00 0.00 H new ATOM 0 HG3 GLU A 52 2.006 -14.939 -0.701 1.00 0.00 H new ATOM 793 N THR A 53 1.461 -13.419 1.430 1.00 0.00 N ATOM 794 CA THR A 53 2.303 -13.827 2.548 1.00 0.00 C ATOM 795 C THR A 53 1.542 -13.751 3.866 1.00 0.00 C ATOM 796 O THR A 53 1.764 -14.557 4.770 1.00 0.00 O ATOM 797 CB THR A 53 3.567 -12.953 2.647 1.00 0.00 C ATOM 798 OG1 THR A 53 4.373 -13.122 1.475 1.00 0.00 O ATOM 799 CG2 THR A 53 4.379 -13.314 3.882 1.00 0.00 C ATOM 0 H THR A 53 1.748 -12.549 0.982 1.00 0.00 H new ATOM 0 HA THR A 53 2.598 -14.860 2.361 1.00 0.00 H new ATOM 0 HB THR A 53 3.256 -11.911 2.727 1.00 0.00 H new ATOM 0 HG1 THR A 53 4.012 -12.573 0.748 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.267 -12.684 3.931 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.773 -13.157 4.774 1.00 0.00 H new ATOM 0 HG23 THR A 53 4.679 -14.360 3.827 1.00 0.00 H new ATOM 807 N TYR A 54 0.643 -12.778 3.970 1.00 0.00 N ATOM 808 CA TYR A 54 -0.150 -12.596 5.180 1.00 0.00 C ATOM 809 C TYR A 54 -1.639 -12.741 4.881 1.00 0.00 C ATOM 810 O TYR A 54 -2.476 -12.088 5.505 1.00 0.00 O ATOM 811 CB TYR A 54 0.127 -11.223 5.794 1.00 0.00 C ATOM 812 CG TYR A 54 1.593 -10.960 6.053 1.00 0.00 C ATOM 813 CD1 TYR A 54 2.438 -10.552 5.029 1.00 0.00 C ATOM 814 CD2 TYR A 54 2.134 -11.119 7.324 1.00 0.00 C ATOM 815 CE1 TYR A 54 3.778 -10.311 5.261 1.00 0.00 C ATOM 816 CE2 TYR A 54 3.473 -10.879 7.566 1.00 0.00 C ATOM 817 CZ TYR A 54 4.291 -10.476 6.531 1.00 0.00 C ATOM 818 OH TYR A 54 5.625 -10.237 6.767 1.00 0.00 O ATOM 0 H TYR A 54 0.445 -12.103 3.231 1.00 0.00 H new ATOM 0 HA TYR A 54 0.136 -13.370 5.892 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -0.260 -10.452 5.128 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -0.420 -11.137 6.733 1.00 0.00 H new ATOM 0 HD1 TYR A 54 2.040 -10.421 4.034 1.00 0.00 H new ATOM 0 HD2 TYR A 54 1.496 -11.436 8.136 1.00 0.00 H new ATOM 0 HE1 TYR A 54 4.421 -9.995 4.453 1.00 0.00 H new ATOM 0 HE2 TYR A 54 3.877 -11.006 8.560 1.00 0.00 H new ATOM 0 HH TYR A 54 5.824 -10.399 7.713 1.00 0.00 H new ATOM 828 N LYS A 55 -1.963 -13.603 3.923 1.00 0.00 N ATOM 829 CA LYS A 55 -3.350 -13.838 3.541 1.00 0.00 C ATOM 830 C LYS A 55 -4.045 -14.747 4.550 1.00 0.00 C ATOM 831 O LYS A 55 -5.249 -14.628 4.780 1.00 0.00 O ATOM 832 CB LYS A 55 -3.418 -14.461 2.145 1.00 0.00 C ATOM 833 CG LYS A 55 -3.053 -15.935 2.119 1.00 0.00 C ATOM 834 CD LYS A 55 -2.776 -16.415 0.704 1.00 0.00 C ATOM 835 CE LYS A 55 -1.754 -17.541 0.687 1.00 0.00 C ATOM 836 NZ LYS A 55 -2.382 -18.865 0.953 1.00 0.00 N ATOM 0 H LYS A 55 -1.283 -14.151 3.396 1.00 0.00 H new ATOM 0 HA LYS A 55 -3.865 -12.878 3.528 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -4.426 -14.338 1.750 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -2.747 -13.917 1.480 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -2.174 -16.104 2.740 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -3.865 -16.520 2.550 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -3.704 -16.758 0.247 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -2.412 -15.583 0.101 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -1.255 -17.564 -0.282 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.987 -17.346 1.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -1.652 -19.606 0.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -2.836 -18.852 1.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -3.097 -19.063 0.224 1.00 0.00 H new ATOM 850 N ASP A 56 -3.280 -15.653 5.148 1.00 0.00 N ATOM 851 CA ASP A 56 -3.823 -16.581 6.133 1.00 0.00 C ATOM 852 C ASP A 56 -3.231 -16.314 7.514 1.00 0.00 C ATOM 853 O ASP A 56 -3.198 -17.200 8.369 1.00 0.00 O ATOM 854 CB ASP A 56 -3.542 -18.025 5.715 1.00 0.00 C ATOM 855 CG ASP A 56 -2.100 -18.427 5.956 1.00 0.00 C ATOM 856 OD1 ASP A 56 -1.207 -17.573 5.777 1.00 0.00 O ATOM 857 OD2 ASP A 56 -1.865 -19.597 6.326 1.00 0.00 O ATOM 0 H ASP A 56 -2.282 -15.765 4.968 1.00 0.00 H new ATOM 0 HA ASP A 56 -4.901 -16.429 6.183 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -4.200 -18.695 6.268 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -3.778 -18.147 4.658 1.00 0.00 H new ATOM 862 N HIS A 57 -2.765 -15.088 7.725 1.00 0.00 N ATOM 863 CA HIS A 57 -2.174 -14.704 9.003 1.00 0.00 C ATOM 864 C HIS A 57 -3.225 -14.703 10.109 1.00 0.00 C ATOM 865 O HIS A 57 -4.378 -15.066 9.882 1.00 0.00 O ATOM 866 CB HIS A 57 -1.528 -13.322 8.895 1.00 0.00 C ATOM 867 CG HIS A 57 -0.244 -13.200 9.656 1.00 0.00 C ATOM 868 ND1 HIS A 57 -0.183 -12.768 10.965 1.00 0.00 N ATOM 869 CD2 HIS A 57 1.032 -13.458 9.287 1.00 0.00 C ATOM 870 CE1 HIS A 57 1.076 -12.764 11.366 1.00 0.00 C ATOM 871 NE2 HIS A 57 1.833 -13.179 10.366 1.00 0.00 N ATOM 0 H HIS A 57 -2.785 -14.343 7.029 1.00 0.00 H new ATOM 0 HA HIS A 57 -1.407 -15.436 9.256 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -1.341 -13.099 7.845 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -2.230 -12.572 9.260 1.00 0.00 H new ATOM 0 HD2 HIS A 57 1.359 -13.817 8.322 1.00 0.00 H new ATOM 0 HE1 HIS A 57 1.427 -12.471 12.345 1.00 0.00 H new ATOM 0 HE2 HIS A 57 2.848 -13.276 10.392 1.00 0.00 H new ATOM 880 N GLU A 58 -2.816 -14.294 11.306 1.00 0.00 N ATOM 881 CA GLU A 58 -3.723 -14.248 12.447 1.00 0.00 C ATOM 882 C GLU A 58 -4.174 -12.817 12.726 1.00 0.00 C ATOM 883 O GLU A 58 -5.364 -12.551 12.891 1.00 0.00 O ATOM 884 CB GLU A 58 -3.046 -14.832 13.689 1.00 0.00 C ATOM 885 CG GLU A 58 -2.239 -13.814 14.478 1.00 0.00 C ATOM 886 CD GLU A 58 -1.577 -14.417 15.702 1.00 0.00 C ATOM 887 OE1 GLU A 58 -2.306 -14.850 16.618 1.00 0.00 O ATOM 888 OE2 GLU A 58 -0.330 -14.455 15.743 1.00 0.00 O ATOM 0 H GLU A 58 -1.864 -13.990 11.511 1.00 0.00 H new ATOM 0 HA GLU A 58 -4.601 -14.847 12.205 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -3.808 -15.262 14.339 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.389 -15.647 13.385 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -1.475 -13.382 13.832 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.893 -12.999 14.788 1.00 0.00 H new ATOM 895 N ASN A 59 -3.214 -11.899 12.778 1.00 0.00 N ATOM 896 CA ASN A 59 -3.512 -10.496 13.038 1.00 0.00 C ATOM 897 C ASN A 59 -3.126 -9.627 11.844 1.00 0.00 C ATOM 898 O ASN A 59 -3.737 -8.587 11.598 1.00 0.00 O ATOM 899 CB ASN A 59 -2.772 -10.019 14.290 1.00 0.00 C ATOM 900 CG ASN A 59 -1.267 -9.998 14.099 1.00 0.00 C ATOM 901 OD1 ASN A 59 -0.719 -9.074 13.499 1.00 0.00 O ATOM 902 ND2 ASN A 59 -0.592 -11.021 14.610 1.00 0.00 N ATOM 0 H ASN A 59 -2.223 -12.102 12.643 1.00 0.00 H new ATOM 0 HA ASN A 59 -4.586 -10.403 13.201 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.116 -9.019 14.553 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.020 -10.672 15.127 1.00 0.00 H new ATOM 0 HD21 ASN A 59 0.422 -11.062 14.513 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.088 -11.766 15.100 1.00 0.00 H new ATOM 909 N ILE A 60 -2.110 -10.063 11.107 1.00 0.00 N ATOM 910 CA ILE A 60 -1.645 -9.326 9.938 1.00 0.00 C ATOM 911 C ILE A 60 -2.514 -9.622 8.720 1.00 0.00 C ATOM 912 O ILE A 60 -2.479 -10.723 8.172 1.00 0.00 O ATOM 913 CB ILE A 60 -0.180 -9.667 9.605 1.00 0.00 C ATOM 914 CG1 ILE A 60 0.713 -9.425 10.823 1.00 0.00 C ATOM 915 CG2 ILE A 60 0.298 -8.844 8.418 1.00 0.00 C ATOM 916 CD1 ILE A 60 2.159 -9.806 10.598 1.00 0.00 C ATOM 0 H ILE A 60 -1.594 -10.922 11.298 1.00 0.00 H new ATOM 0 HA ILE A 60 -1.717 -8.266 10.183 1.00 0.00 H new ATOM 0 HB ILE A 60 -0.119 -10.722 9.339 1.00 0.00 H new ATOM 0 HG12 ILE A 60 0.662 -8.371 11.097 1.00 0.00 H new ATOM 0 HG13 ILE A 60 0.323 -9.993 11.668 1.00 0.00 H new ATOM 0 HG21 ILE A 60 1.335 -9.096 8.195 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -0.324 -9.062 7.550 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.226 -7.783 8.658 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.733 -9.607 11.503 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.222 -10.866 10.354 1.00 0.00 H new ATOM 0 HD13 ILE A 60 2.566 -9.219 9.774 1.00 0.00 H new ATOM 928 N VAL A 61 -3.292 -8.629 8.301 1.00 0.00 N ATOM 929 CA VAL A 61 -4.169 -8.781 7.146 1.00 0.00 C ATOM 930 C VAL A 61 -3.913 -7.687 6.115 1.00 0.00 C ATOM 931 O VAL A 61 -4.265 -6.526 6.326 1.00 0.00 O ATOM 932 CB VAL A 61 -5.652 -8.746 7.558 1.00 0.00 C ATOM 933 CG1 VAL A 61 -6.519 -8.290 6.395 1.00 0.00 C ATOM 934 CG2 VAL A 61 -6.097 -10.110 8.063 1.00 0.00 C ATOM 0 H VAL A 61 -3.333 -7.711 8.744 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.946 -9.752 6.705 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.768 -8.028 8.370 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -7.564 -8.272 6.705 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.215 -7.290 6.085 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.401 -8.981 5.560 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -7.148 -10.067 8.350 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -5.966 -10.850 7.274 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -5.496 -10.392 8.928 1.00 0.00 H new ATOM 944 N ILE A 62 -3.299 -8.066 4.999 1.00 0.00 N ATOM 945 CA ILE A 62 -2.998 -7.117 3.934 1.00 0.00 C ATOM 946 C ILE A 62 -4.250 -6.773 3.134 1.00 0.00 C ATOM 947 O ILE A 62 -5.104 -7.628 2.900 1.00 0.00 O ATOM 948 CB ILE A 62 -1.926 -7.669 2.975 1.00 0.00 C ATOM 949 CG1 ILE A 62 -0.652 -8.018 3.748 1.00 0.00 C ATOM 950 CG2 ILE A 62 -1.626 -6.658 1.878 1.00 0.00 C ATOM 951 CD1 ILE A 62 0.071 -6.809 4.300 1.00 0.00 C ATOM 0 H ILE A 62 -3.000 -9.023 4.809 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.617 -6.215 4.413 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.308 -8.578 2.510 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -0.908 -8.685 4.571 1.00 0.00 H new ATOM 0 HG13 ILE A 62 0.023 -8.566 3.091 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -0.867 -7.062 1.208 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -2.536 -6.453 1.314 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.260 -5.734 2.325 1.00 0.00 H new ATOM 0 HD11 ILE A 62 0.964 -7.132 4.835 1.00 0.00 H new ATOM 0 HD12 ILE A 62 0.358 -6.151 3.480 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -0.587 -6.272 4.983 1.00 0.00 H new ATOM 963 N ALA A 63 -4.351 -5.516 2.715 1.00 0.00 N ATOM 964 CA ALA A 63 -5.496 -5.059 1.937 1.00 0.00 C ATOM 965 C ALA A 63 -5.110 -3.907 1.016 1.00 0.00 C ATOM 966 O ALA A 63 -4.146 -3.186 1.276 1.00 0.00 O ATOM 967 CB ALA A 63 -6.629 -4.641 2.863 1.00 0.00 C ATOM 0 H ALA A 63 -3.653 -4.796 2.901 1.00 0.00 H new ATOM 0 HA ALA A 63 -5.836 -5.887 1.315 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.478 -4.302 2.269 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.931 -5.491 3.475 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.291 -3.831 3.509 1.00 0.00 H new ATOM 973 N LYS A 64 -5.867 -3.739 -0.063 1.00 0.00 N ATOM 974 CA LYS A 64 -5.605 -2.674 -1.023 1.00 0.00 C ATOM 975 C LYS A 64 -6.881 -1.900 -1.338 1.00 0.00 C ATOM 976 O LYS A 64 -7.970 -2.472 -1.387 1.00 0.00 O ATOM 977 CB LYS A 64 -5.018 -3.254 -2.312 1.00 0.00 C ATOM 978 CG LYS A 64 -5.989 -4.130 -3.083 1.00 0.00 C ATOM 979 CD LYS A 64 -5.438 -4.507 -4.448 1.00 0.00 C ATOM 980 CE LYS A 64 -6.466 -5.264 -5.275 1.00 0.00 C ATOM 981 NZ LYS A 64 -5.823 -6.112 -6.318 1.00 0.00 N ATOM 0 H LYS A 64 -6.667 -4.327 -0.294 1.00 0.00 H new ATOM 0 HA LYS A 64 -4.884 -1.988 -0.579 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -4.693 -2.435 -2.954 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -4.131 -3.838 -2.067 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -6.197 -5.034 -2.511 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -6.936 -3.605 -3.205 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -5.134 -3.606 -4.980 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -4.546 -5.121 -4.324 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -7.070 -5.891 -4.619 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -7.143 -4.555 -5.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -6.557 -6.612 -6.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -5.267 -5.511 -6.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -5.196 -6.806 -5.863 1.00 0.00 H new ATOM 995 N MET A 65 -6.739 -0.596 -1.553 1.00 0.00 N ATOM 996 CA MET A 65 -7.881 0.256 -1.866 1.00 0.00 C ATOM 997 C MET A 65 -7.503 1.315 -2.897 1.00 0.00 C ATOM 998 O MET A 65 -6.442 1.932 -2.805 1.00 0.00 O ATOM 999 CB MET A 65 -8.406 0.928 -0.596 1.00 0.00 C ATOM 1000 CG MET A 65 -9.807 1.498 -0.745 1.00 0.00 C ATOM 1001 SD MET A 65 -10.475 2.116 0.812 1.00 0.00 S ATOM 1002 CE MET A 65 -10.912 3.791 0.352 1.00 0.00 C ATOM 0 H MET A 65 -5.845 -0.106 -1.516 1.00 0.00 H new ATOM 0 HA MET A 65 -8.666 -0.372 -2.287 1.00 0.00 H new ATOM 0 HB2 MET A 65 -8.402 0.202 0.217 1.00 0.00 H new ATOM 0 HB3 MET A 65 -7.725 1.730 -0.311 1.00 0.00 H new ATOM 0 HG2 MET A 65 -9.790 2.307 -1.475 1.00 0.00 H new ATOM 0 HG3 MET A 65 -10.469 0.727 -1.139 1.00 0.00 H new ATOM 0 HE1 MET A 65 -10.826 4.442 1.222 1.00 0.00 H new ATOM 0 HE2 MET A 65 -10.239 4.141 -0.430 1.00 0.00 H new ATOM 0 HE3 MET A 65 -11.938 3.811 -0.016 1.00 0.00 H new ATOM 1012 N ASP A 66 -8.376 1.519 -3.876 1.00 0.00 N ATOM 1013 CA ASP A 66 -8.134 2.503 -4.924 1.00 0.00 C ATOM 1014 C ASP A 66 -8.626 3.883 -4.498 1.00 0.00 C ATOM 1015 O ASP A 66 -9.809 4.198 -4.626 1.00 0.00 O ATOM 1016 CB ASP A 66 -8.826 2.080 -6.221 1.00 0.00 C ATOM 1017 CG ASP A 66 -8.502 3.005 -7.378 1.00 0.00 C ATOM 1018 OD1 ASP A 66 -7.799 4.013 -7.154 1.00 0.00 O ATOM 1019 OD2 ASP A 66 -8.952 2.721 -8.508 1.00 0.00 O ATOM 0 H ASP A 66 -9.259 1.016 -3.966 1.00 0.00 H new ATOM 0 HA ASP A 66 -7.059 2.557 -5.096 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -8.524 1.064 -6.476 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -9.905 2.062 -6.065 1.00 0.00 H new ATOM 1024 N SER A 67 -7.710 4.701 -3.989 1.00 0.00 N ATOM 1025 CA SER A 67 -8.051 6.045 -3.538 1.00 0.00 C ATOM 1026 C SER A 67 -8.670 6.857 -4.672 1.00 0.00 C ATOM 1027 O SER A 67 -9.451 7.781 -4.437 1.00 0.00 O ATOM 1028 CB SER A 67 -6.807 6.758 -3.005 1.00 0.00 C ATOM 1029 OG SER A 67 -7.154 7.731 -2.034 1.00 0.00 O ATOM 0 H SER A 67 -6.726 4.456 -3.879 1.00 0.00 H new ATOM 0 HA SER A 67 -8.783 5.958 -2.735 1.00 0.00 H new ATOM 0 HB2 SER A 67 -6.126 6.029 -2.567 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.276 7.235 -3.829 1.00 0.00 H new ATOM 0 HG SER A 67 -6.601 7.607 -1.235 1.00 0.00 H new ATOM 1035 N THR A 68 -8.316 6.507 -5.905 1.00 0.00 N ATOM 1036 CA THR A 68 -8.834 7.202 -7.076 1.00 0.00 C ATOM 1037 C THR A 68 -10.245 6.733 -7.414 1.00 0.00 C ATOM 1038 O THR A 68 -10.972 7.403 -8.147 1.00 0.00 O ATOM 1039 CB THR A 68 -7.927 6.990 -8.302 1.00 0.00 C ATOM 1040 OG1 THR A 68 -8.188 5.711 -8.890 1.00 0.00 O ATOM 1041 CG2 THR A 68 -6.459 7.085 -7.913 1.00 0.00 C ATOM 0 H THR A 68 -7.672 5.745 -6.118 1.00 0.00 H new ATOM 0 HA THR A 68 -8.856 8.264 -6.830 1.00 0.00 H new ATOM 0 HB THR A 68 -8.146 7.774 -9.027 1.00 0.00 H new ATOM 0 HG1 THR A 68 -7.950 5.004 -8.254 1.00 0.00 H new ATOM 0 HG21 THR A 68 -5.838 6.932 -8.796 1.00 0.00 H new ATOM 0 HG22 THR A 68 -6.257 8.071 -7.494 1.00 0.00 H new ATOM 0 HG23 THR A 68 -6.229 6.321 -7.171 1.00 0.00 H new ATOM 1049 N ALA A 69 -10.625 5.579 -6.876 1.00 0.00 N ATOM 1050 CA ALA A 69 -11.949 5.022 -7.119 1.00 0.00 C ATOM 1051 C ALA A 69 -12.803 5.064 -5.856 1.00 0.00 C ATOM 1052 O ALA A 69 -14.024 4.925 -5.916 1.00 0.00 O ATOM 1053 CB ALA A 69 -11.836 3.595 -7.634 1.00 0.00 C ATOM 0 H ALA A 69 -10.034 5.012 -6.269 1.00 0.00 H new ATOM 0 HA ALA A 69 -12.438 5.633 -7.878 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -12.833 3.192 -7.811 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -11.271 3.588 -8.566 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -11.323 2.981 -6.894 1.00 0.00 H new ATOM 1059 N ASN A 70 -12.152 5.256 -4.713 1.00 0.00 N ATOM 1060 CA ASN A 70 -12.851 5.315 -3.435 1.00 0.00 C ATOM 1061 C ASN A 70 -12.265 6.405 -2.544 1.00 0.00 C ATOM 1062 O ASN A 70 -11.052 6.479 -2.353 1.00 0.00 O ATOM 1063 CB ASN A 70 -12.773 3.962 -2.724 1.00 0.00 C ATOM 1064 CG ASN A 70 -13.237 2.819 -3.605 1.00 0.00 C ATOM 1065 OD1 ASN A 70 -14.435 2.562 -3.729 1.00 0.00 O ATOM 1066 ND2 ASN A 70 -12.288 2.124 -4.222 1.00 0.00 N ATOM 0 H ASN A 70 -11.141 5.373 -4.646 1.00 0.00 H new ATOM 0 HA ASN A 70 -13.896 5.555 -3.632 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -11.746 3.780 -2.408 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -13.384 3.993 -1.822 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -12.540 1.342 -4.827 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -11.307 2.372 -4.091 1.00 0.00 H new ATOM 1073 N GLU A 71 -13.136 7.250 -2.000 1.00 0.00 N ATOM 1074 CA GLU A 71 -12.704 8.336 -1.129 1.00 0.00 C ATOM 1075 C GLU A 71 -13.292 8.178 0.271 1.00 0.00 C ATOM 1076 O GLU A 71 -14.466 7.842 0.429 1.00 0.00 O ATOM 1077 CB GLU A 71 -13.117 9.687 -1.718 1.00 0.00 C ATOM 1078 CG GLU A 71 -12.176 10.823 -1.353 1.00 0.00 C ATOM 1079 CD GLU A 71 -12.347 12.033 -2.251 1.00 0.00 C ATOM 1080 OE1 GLU A 71 -11.687 12.083 -3.310 1.00 0.00 O ATOM 1081 OE2 GLU A 71 -13.140 12.929 -1.894 1.00 0.00 O ATOM 0 H GLU A 71 -14.144 7.203 -2.147 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.617 8.297 -1.054 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.166 9.601 -2.804 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -14.121 9.933 -1.373 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.350 11.116 -0.318 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -11.146 10.471 -1.416 1.00 0.00 H new ATOM 1088 N VAL A 72 -12.467 8.422 1.284 1.00 0.00 N ATOM 1089 CA VAL A 72 -12.904 8.308 2.670 1.00 0.00 C ATOM 1090 C VAL A 72 -12.296 9.410 3.531 1.00 0.00 C ATOM 1091 O VAL A 72 -11.127 9.759 3.374 1.00 0.00 O ATOM 1092 CB VAL A 72 -12.527 6.939 3.267 1.00 0.00 C ATOM 1093 CG1 VAL A 72 -13.417 5.845 2.698 1.00 0.00 C ATOM 1094 CG2 VAL A 72 -11.060 6.632 3.008 1.00 0.00 C ATOM 0 H VAL A 72 -11.492 8.700 1.171 1.00 0.00 H new ATOM 0 HA VAL A 72 -13.989 8.409 2.668 1.00 0.00 H new ATOM 0 HB VAL A 72 -12.683 6.977 4.345 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -13.136 4.885 3.131 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -14.458 6.061 2.939 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -13.296 5.804 1.616 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -10.810 5.661 3.436 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -10.876 6.613 1.934 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -10.440 7.402 3.468 1.00 0.00 H new ATOM 1104 N GLU A 73 -13.099 9.953 4.441 1.00 0.00 N ATOM 1105 CA GLU A 73 -12.639 11.017 5.326 1.00 0.00 C ATOM 1106 C GLU A 73 -11.696 10.467 6.393 1.00 0.00 C ATOM 1107 O GLU A 73 -10.833 11.181 6.901 1.00 0.00 O ATOM 1108 CB GLU A 73 -13.831 11.708 5.991 1.00 0.00 C ATOM 1109 CG GLU A 73 -14.614 10.804 6.928 1.00 0.00 C ATOM 1110 CD GLU A 73 -16.023 11.305 7.179 1.00 0.00 C ATOM 1111 OE1 GLU A 73 -16.776 11.480 6.198 1.00 0.00 O ATOM 1112 OE2 GLU A 73 -16.373 11.523 8.359 1.00 0.00 O ATOM 0 H GLU A 73 -14.070 9.674 4.585 1.00 0.00 H new ATOM 0 HA GLU A 73 -12.095 11.745 4.725 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -13.473 12.573 6.549 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -14.501 12.083 5.217 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -14.659 9.800 6.505 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -14.085 10.726 7.878 1.00 0.00 H new ATOM 1119 N ALA A 74 -11.869 9.192 6.727 1.00 0.00 N ATOM 1120 CA ALA A 74 -11.034 8.545 7.731 1.00 0.00 C ATOM 1121 C ALA A 74 -9.574 8.511 7.291 1.00 0.00 C ATOM 1122 O ALA A 74 -8.682 8.225 8.089 1.00 0.00 O ATOM 1123 CB ALA A 74 -11.537 7.137 8.008 1.00 0.00 C ATOM 0 H ALA A 74 -12.580 8.587 6.317 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.096 9.128 8.650 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.904 6.666 8.760 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -12.563 7.183 8.374 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.506 6.552 7.089 1.00 0.00 H new ATOM 1129 N VAL A 75 -9.338 8.802 6.016 1.00 0.00 N ATOM 1130 CA VAL A 75 -7.986 8.805 5.470 1.00 0.00 C ATOM 1131 C VAL A 75 -7.889 9.709 4.247 1.00 0.00 C ATOM 1132 O VAL A 75 -8.499 9.441 3.212 1.00 0.00 O ATOM 1133 CB VAL A 75 -7.535 7.384 5.081 1.00 0.00 C ATOM 1134 CG1 VAL A 75 -6.354 7.442 4.125 1.00 0.00 C ATOM 1135 CG2 VAL A 75 -7.187 6.578 6.323 1.00 0.00 C ATOM 0 H VAL A 75 -10.066 9.039 5.342 1.00 0.00 H new ATOM 0 HA VAL A 75 -7.330 9.186 6.252 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.360 6.886 4.571 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.049 6.429 3.861 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.643 7.981 3.222 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.522 7.958 4.605 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.870 5.577 6.030 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.378 7.071 6.862 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -8.063 6.507 6.968 1.00 0.00 H new ATOM 1145 N LYS A 76 -7.117 10.784 4.372 1.00 0.00 N ATOM 1146 CA LYS A 76 -6.937 11.729 3.277 1.00 0.00 C ATOM 1147 C LYS A 76 -5.610 11.490 2.564 1.00 0.00 C ATOM 1148 O LYS A 76 -4.541 11.749 3.117 1.00 0.00 O ATOM 1149 CB LYS A 76 -6.995 13.166 3.802 1.00 0.00 C ATOM 1150 CG LYS A 76 -8.408 13.680 4.013 1.00 0.00 C ATOM 1151 CD LYS A 76 -9.097 13.977 2.691 1.00 0.00 C ATOM 1152 CE LYS A 76 -10.608 14.042 2.853 1.00 0.00 C ATOM 1153 NZ LYS A 76 -11.294 14.301 1.556 1.00 0.00 N ATOM 0 H LYS A 76 -6.606 11.022 5.222 1.00 0.00 H new ATOM 0 HA LYS A 76 -7.745 11.577 2.562 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -6.453 13.221 4.746 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -6.480 13.822 3.100 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -8.986 12.941 4.567 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -8.380 14.584 4.621 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -8.731 14.924 2.293 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -8.841 13.206 1.964 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -10.969 13.104 3.274 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -10.864 14.829 3.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -12.322 14.338 1.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.969 15.209 1.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -11.071 13.537 0.887 1.00 0.00 H new ATOM 1167 N VAL A 77 -5.686 10.995 1.333 1.00 0.00 N ATOM 1168 CA VAL A 77 -4.491 10.723 0.543 1.00 0.00 C ATOM 1169 C VAL A 77 -4.319 11.754 -0.566 1.00 0.00 C ATOM 1170 O VAL A 77 -5.192 11.915 -1.420 1.00 0.00 O ATOM 1171 CB VAL A 77 -4.538 9.316 -0.081 1.00 0.00 C ATOM 1172 CG1 VAL A 77 -3.168 8.919 -0.609 1.00 0.00 C ATOM 1173 CG2 VAL A 77 -5.042 8.300 0.933 1.00 0.00 C ATOM 0 H VAL A 77 -6.563 10.774 0.861 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.642 10.781 1.224 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.233 9.334 -0.920 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.221 7.922 -1.046 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -2.851 9.632 -1.370 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -2.449 8.918 0.210 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.069 7.311 0.475 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.374 8.283 1.794 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.045 8.577 1.258 1.00 0.00 H new ATOM 1183 N HIS A 78 -3.187 12.451 -0.550 1.00 0.00 N ATOM 1184 CA HIS A 78 -2.900 13.467 -1.556 1.00 0.00 C ATOM 1185 C HIS A 78 -1.677 13.081 -2.384 1.00 0.00 C ATOM 1186 O HIS A 78 -0.969 13.944 -2.903 1.00 0.00 O ATOM 1187 CB HIS A 78 -2.672 14.824 -0.891 1.00 0.00 C ATOM 1188 CG HIS A 78 -3.754 15.208 0.072 1.00 0.00 C ATOM 1189 ND1 HIS A 78 -3.545 16.055 1.139 1.00 0.00 N ATOM 1190 CD2 HIS A 78 -5.060 14.857 0.122 1.00 0.00 C ATOM 1191 CE1 HIS A 78 -4.676 16.207 1.806 1.00 0.00 C ATOM 1192 NE2 HIS A 78 -5.611 15.490 1.208 1.00 0.00 N ATOM 0 H HIS A 78 -2.454 12.331 0.149 1.00 0.00 H new ATOM 0 HA HIS A 78 -3.761 13.537 -2.221 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -1.718 14.806 -0.364 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -2.595 15.590 -1.663 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -5.573 14.201 -0.565 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -4.813 16.814 2.689 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -6.584 15.419 1.505 1.00 0.00 H new ATOM 1201 N SER A 79 -1.435 11.779 -2.502 1.00 0.00 N ATOM 1202 CA SER A 79 -0.295 11.280 -3.262 1.00 0.00 C ATOM 1203 C SER A 79 -0.353 9.761 -3.393 1.00 0.00 C ATOM 1204 O SER A 79 -1.169 9.102 -2.749 1.00 0.00 O ATOM 1205 CB SER A 79 1.015 11.695 -2.590 1.00 0.00 C ATOM 1206 OG SER A 79 2.054 11.838 -3.542 1.00 0.00 O ATOM 0 H SER A 79 -2.013 11.051 -2.081 1.00 0.00 H new ATOM 0 HA SER A 79 -0.337 11.716 -4.260 1.00 0.00 H new ATOM 0 HB2 SER A 79 0.872 12.636 -2.059 1.00 0.00 H new ATOM 0 HB3 SER A 79 1.298 10.949 -1.847 1.00 0.00 H new ATOM 0 HG SER A 79 2.880 12.105 -3.087 1.00 0.00 H new ATOM 1212 N PHE A 80 0.519 9.212 -4.232 1.00 0.00 N ATOM 1213 CA PHE A 80 0.568 7.771 -4.449 1.00 0.00 C ATOM 1214 C PHE A 80 1.891 7.362 -5.089 1.00 0.00 C ATOM 1215 O PHE A 80 2.525 8.132 -5.811 1.00 0.00 O ATOM 1216 CB PHE A 80 -0.598 7.328 -5.335 1.00 0.00 C ATOM 1217 CG PHE A 80 -1.883 8.048 -5.039 1.00 0.00 C ATOM 1218 CD1 PHE A 80 -2.743 7.584 -4.057 1.00 0.00 C ATOM 1219 CD2 PHE A 80 -2.231 9.189 -5.745 1.00 0.00 C ATOM 1220 CE1 PHE A 80 -3.925 8.245 -3.782 1.00 0.00 C ATOM 1221 CE2 PHE A 80 -3.411 9.854 -5.474 1.00 0.00 C ATOM 1222 CZ PHE A 80 -4.260 9.381 -4.492 1.00 0.00 C ATOM 0 H PHE A 80 1.201 9.743 -4.773 1.00 0.00 H new ATOM 0 HA PHE A 80 0.486 7.280 -3.479 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -0.332 7.490 -6.380 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -0.754 6.257 -5.208 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -2.487 6.695 -3.500 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -1.572 9.562 -6.515 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -4.586 7.874 -3.013 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -3.670 10.743 -6.029 1.00 0.00 H new ATOM 0 HZ PHE A 80 -5.184 9.899 -4.280 1.00 0.00 H new ATOM 1232 N PRO A 81 2.320 6.120 -4.819 1.00 0.00 N ATOM 1233 CA PRO A 81 1.574 5.194 -3.961 1.00 0.00 C ATOM 1234 C PRO A 81 1.586 5.622 -2.498 1.00 0.00 C ATOM 1235 O PRO A 81 2.568 6.188 -2.013 1.00 0.00 O ATOM 1236 CB PRO A 81 2.319 3.869 -4.137 1.00 0.00 C ATOM 1237 CG PRO A 81 3.703 4.261 -4.525 1.00 0.00 C ATOM 1238 CD PRO A 81 3.565 5.523 -5.330 1.00 0.00 C ATOM 0 HA PRO A 81 0.520 5.145 -4.234 1.00 0.00 H new ATOM 0 HB2 PRO A 81 2.316 3.288 -3.215 1.00 0.00 H new ATOM 0 HB3 PRO A 81 1.853 3.252 -4.905 1.00 0.00 H new ATOM 0 HG2 PRO A 81 4.323 4.426 -3.644 1.00 0.00 H new ATOM 0 HG3 PRO A 81 4.182 3.475 -5.110 1.00 0.00 H new ATOM 0 HD2 PRO A 81 4.417 6.187 -5.186 1.00 0.00 H new ATOM 0 HD3 PRO A 81 3.501 5.313 -6.398 1.00 0.00 H new ATOM 1246 N THR A 82 0.491 5.349 -1.796 1.00 0.00 N ATOM 1247 CA THR A 82 0.376 5.706 -0.388 1.00 0.00 C ATOM 1248 C THR A 82 0.032 4.488 0.462 1.00 0.00 C ATOM 1249 O THR A 82 -0.976 3.820 0.229 1.00 0.00 O ATOM 1250 CB THR A 82 -0.697 6.790 -0.169 1.00 0.00 C ATOM 1251 OG1 THR A 82 -0.223 8.052 -0.651 1.00 0.00 O ATOM 1252 CG2 THR A 82 -1.055 6.907 1.305 1.00 0.00 C ATOM 0 H THR A 82 -0.330 4.881 -2.180 1.00 0.00 H new ATOM 0 HA THR A 82 1.346 6.098 -0.081 1.00 0.00 H new ATOM 0 HB THR A 82 -1.591 6.502 -0.722 1.00 0.00 H new ATOM 0 HG1 THR A 82 -0.694 8.284 -1.479 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.814 7.678 1.435 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.442 5.953 1.662 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.165 7.174 1.875 1.00 0.00 H new ATOM 1260 N LEU A 83 0.875 4.205 1.449 1.00 0.00 N ATOM 1261 CA LEU A 83 0.660 3.067 2.336 1.00 0.00 C ATOM 1262 C LEU A 83 0.356 3.533 3.756 1.00 0.00 C ATOM 1263 O LEU A 83 0.990 4.456 4.268 1.00 0.00 O ATOM 1264 CB LEU A 83 1.889 2.157 2.338 1.00 0.00 C ATOM 1265 CG LEU A 83 2.439 1.768 0.965 1.00 0.00 C ATOM 1266 CD1 LEU A 83 3.644 0.853 1.111 1.00 0.00 C ATOM 1267 CD2 LEU A 83 1.358 1.099 0.128 1.00 0.00 C ATOM 0 H LEU A 83 1.714 4.748 1.655 1.00 0.00 H new ATOM 0 HA LEU A 83 -0.198 2.507 1.966 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.682 2.653 2.898 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.639 1.244 2.879 1.00 0.00 H new ATOM 0 HG LEU A 83 2.759 2.676 0.453 1.00 0.00 H new ATOM 0 HD11 LEU A 83 4.021 0.587 0.123 1.00 0.00 H new ATOM 0 HD12 LEU A 83 4.425 1.367 1.671 1.00 0.00 H new ATOM 0 HD13 LEU A 83 3.351 -0.052 1.643 1.00 0.00 H new ATOM 0 HD21 LEU A 83 1.767 0.829 -0.846 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.008 0.201 0.636 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.524 1.788 -0.007 1.00 0.00 H new ATOM 1279 N LYS A 84 -0.617 2.887 4.390 1.00 0.00 N ATOM 1280 CA LYS A 84 -1.004 3.231 5.753 1.00 0.00 C ATOM 1281 C LYS A 84 -1.230 1.975 6.588 1.00 0.00 C ATOM 1282 O LYS A 84 -2.039 1.118 6.232 1.00 0.00 O ATOM 1283 CB LYS A 84 -2.273 4.086 5.744 1.00 0.00 C ATOM 1284 CG LYS A 84 -2.193 5.284 4.814 1.00 0.00 C ATOM 1285 CD LYS A 84 -3.030 6.445 5.326 1.00 0.00 C ATOM 1286 CE LYS A 84 -2.761 7.717 4.537 1.00 0.00 C ATOM 1287 NZ LYS A 84 -1.596 8.470 5.079 1.00 0.00 N ATOM 0 H LYS A 84 -1.153 2.121 3.981 1.00 0.00 H new ATOM 0 HA LYS A 84 -0.191 3.802 6.202 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.118 3.464 5.449 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -2.473 4.436 6.757 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -1.154 5.599 4.714 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -2.536 4.998 3.820 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -4.088 6.190 5.258 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -2.811 6.616 6.380 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -2.576 7.464 3.493 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -3.646 8.352 4.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -1.445 9.330 4.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.782 8.733 6.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -0.746 7.873 5.034 1.00 0.00 H new ATOM 1301 N PHE A 85 -0.511 1.873 7.701 1.00 0.00 N ATOM 1302 CA PHE A 85 -0.634 0.721 8.587 1.00 0.00 C ATOM 1303 C PHE A 85 -1.663 0.985 9.683 1.00 0.00 C ATOM 1304 O PHE A 85 -1.602 2.002 10.375 1.00 0.00 O ATOM 1305 CB PHE A 85 0.721 0.387 9.215 1.00 0.00 C ATOM 1306 CG PHE A 85 0.640 -0.650 10.298 1.00 0.00 C ATOM 1307 CD1 PHE A 85 0.673 -2.000 9.988 1.00 0.00 C ATOM 1308 CD2 PHE A 85 0.532 -0.275 11.628 1.00 0.00 C ATOM 1309 CE1 PHE A 85 0.598 -2.956 10.983 1.00 0.00 C ATOM 1310 CE2 PHE A 85 0.457 -1.227 12.628 1.00 0.00 C ATOM 1311 CZ PHE A 85 0.491 -2.569 12.305 1.00 0.00 C ATOM 0 H PHE A 85 0.163 2.574 8.011 1.00 0.00 H new ATOM 0 HA PHE A 85 -0.971 -0.128 7.993 1.00 0.00 H new ATOM 0 HB2 PHE A 85 1.397 0.035 8.436 1.00 0.00 H new ATOM 0 HB3 PHE A 85 1.156 1.298 9.627 1.00 0.00 H new ATOM 0 HD1 PHE A 85 0.758 -2.309 8.957 1.00 0.00 H new ATOM 0 HD2 PHE A 85 0.506 0.773 11.886 1.00 0.00 H new ATOM 0 HE1 PHE A 85 0.623 -4.005 10.727 1.00 0.00 H new ATOM 0 HE2 PHE A 85 0.372 -0.921 13.660 1.00 0.00 H new ATOM 0 HZ PHE A 85 0.434 -3.315 13.084 1.00 0.00 H new ATOM 1321 N PHE A 86 -2.608 0.064 9.833 1.00 0.00 N ATOM 1322 CA PHE A 86 -3.652 0.196 10.842 1.00 0.00 C ATOM 1323 C PHE A 86 -3.451 -0.812 11.969 1.00 0.00 C ATOM 1324 O PHE A 86 -3.547 -2.024 11.776 1.00 0.00 O ATOM 1325 CB PHE A 86 -5.031 0.002 10.209 1.00 0.00 C ATOM 1326 CG PHE A 86 -5.284 0.903 9.034 1.00 0.00 C ATOM 1327 CD1 PHE A 86 -4.517 2.040 8.839 1.00 0.00 C ATOM 1328 CD2 PHE A 86 -6.289 0.613 8.126 1.00 0.00 C ATOM 1329 CE1 PHE A 86 -4.746 2.871 7.758 1.00 0.00 C ATOM 1330 CE2 PHE A 86 -6.523 1.440 7.044 1.00 0.00 C ATOM 1331 CZ PHE A 86 -5.752 2.571 6.860 1.00 0.00 C ATOM 0 H PHE A 86 -2.673 -0.783 9.268 1.00 0.00 H new ATOM 0 HA PHE A 86 -3.591 1.200 11.262 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -5.133 -1.035 9.890 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -5.797 0.179 10.964 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -3.731 2.280 9.540 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -6.896 -0.269 8.265 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -4.139 3.753 7.616 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -7.309 1.202 6.342 1.00 0.00 H new ATOM 0 HZ PHE A 86 -5.935 3.219 6.016 1.00 0.00 H new ATOM 1341 N PRO A 87 -3.163 -0.301 13.176 1.00 0.00 N ATOM 1342 CA PRO A 87 -2.941 -1.139 14.358 1.00 0.00 C ATOM 1343 C PRO A 87 -4.222 -1.812 14.840 1.00 0.00 C ATOM 1344 O PRO A 87 -5.316 -1.483 14.383 1.00 0.00 O ATOM 1345 CB PRO A 87 -2.431 -0.147 15.406 1.00 0.00 C ATOM 1346 CG PRO A 87 -2.984 1.170 14.981 1.00 0.00 C ATOM 1347 CD PRO A 87 -3.031 1.134 13.478 1.00 0.00 C ATOM 0 HA PRO A 87 -2.250 -1.957 14.154 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -2.773 -0.416 16.405 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -1.342 -0.128 15.436 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -3.978 1.329 15.399 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -2.356 1.989 15.332 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -3.873 1.706 13.088 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -2.128 1.556 13.037 1.00 0.00 H new ATOM 1355 N ALA A 88 -4.078 -2.754 15.766 1.00 0.00 N ATOM 1356 CA ALA A 88 -5.223 -3.471 16.312 1.00 0.00 C ATOM 1357 C ALA A 88 -5.887 -2.675 17.431 1.00 0.00 C ATOM 1358 O ALA A 88 -6.293 -3.236 18.448 1.00 0.00 O ATOM 1359 CB ALA A 88 -4.797 -4.841 16.817 1.00 0.00 C ATOM 0 H ALA A 88 -3.179 -3.038 16.154 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.952 -3.602 15.513 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.663 -5.365 17.222 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.376 -5.418 15.993 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.046 -4.723 17.598 1.00 0.00 H new ATOM 1365 N SER A 89 -5.992 -1.364 17.236 1.00 0.00 N ATOM 1366 CA SER A 89 -6.602 -0.490 18.231 1.00 0.00 C ATOM 1367 C SER A 89 -8.119 -0.460 18.072 1.00 0.00 C ATOM 1368 O SER A 89 -8.650 -0.806 17.016 1.00 0.00 O ATOM 1369 CB SER A 89 -6.038 0.927 18.111 1.00 0.00 C ATOM 1370 OG SER A 89 -6.256 1.455 16.814 1.00 0.00 O ATOM 0 H SER A 89 -5.663 -0.884 16.398 1.00 0.00 H new ATOM 0 HA SER A 89 -6.365 -0.886 19.219 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.507 1.573 18.853 1.00 0.00 H new ATOM 0 HB3 SER A 89 -4.970 0.916 18.328 1.00 0.00 H new ATOM 0 HG SER A 89 -6.350 2.429 16.869 1.00 0.00 H new ATOM 1376 N ALA A 90 -8.811 -0.046 19.128 1.00 0.00 N ATOM 1377 CA ALA A 90 -10.266 0.031 19.106 1.00 0.00 C ATOM 1378 C ALA A 90 -10.737 1.377 18.565 1.00 0.00 C ATOM 1379 O ALA A 90 -11.848 1.820 18.858 1.00 0.00 O ATOM 1380 CB ALA A 90 -10.829 -0.206 20.499 1.00 0.00 C ATOM 0 H ALA A 90 -8.387 0.241 20.010 1.00 0.00 H new ATOM 0 HA ALA A 90 -10.636 -0.748 18.440 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.917 -0.145 20.467 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -10.531 -1.194 20.849 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.443 0.552 21.181 1.00 0.00 H new ATOM 1386 N ASP A 91 -9.885 2.023 17.777 1.00 0.00 N ATOM 1387 CA ASP A 91 -10.214 3.320 17.196 1.00 0.00 C ATOM 1388 C ASP A 91 -9.792 3.381 15.731 1.00 0.00 C ATOM 1389 O ASP A 91 -9.320 2.392 15.169 1.00 0.00 O ATOM 1390 CB ASP A 91 -9.535 4.442 17.982 1.00 0.00 C ATOM 1391 CG ASP A 91 -9.965 4.473 19.435 1.00 0.00 C ATOM 1392 OD1 ASP A 91 -9.733 3.472 20.145 1.00 0.00 O ATOM 1393 OD2 ASP A 91 -10.534 5.499 19.864 1.00 0.00 O ATOM 0 H ASP A 91 -8.962 1.670 17.526 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.295 3.452 17.251 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -8.454 4.316 17.929 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -9.768 5.400 17.517 1.00 0.00 H new ATOM 1398 N ARG A 92 -9.966 4.547 15.118 1.00 0.00 N ATOM 1399 CA ARG A 92 -9.606 4.737 13.718 1.00 0.00 C ATOM 1400 C ARG A 92 -8.193 5.298 13.592 1.00 0.00 C ATOM 1401 O ARG A 92 -7.964 6.281 12.885 1.00 0.00 O ATOM 1402 CB ARG A 92 -10.602 5.675 13.036 1.00 0.00 C ATOM 1403 CG ARG A 92 -10.691 7.047 13.685 1.00 0.00 C ATOM 1404 CD ARG A 92 -11.044 8.122 12.670 1.00 0.00 C ATOM 1405 NE ARG A 92 -12.470 8.129 12.354 1.00 0.00 N ATOM 1406 CZ ARG A 92 -13.406 8.571 13.187 1.00 0.00 C ATOM 1407 NH1 ARG A 92 -13.068 9.040 14.380 1.00 0.00 N ATOM 1408 NH2 ARG A 92 -14.682 8.544 12.827 1.00 0.00 N ATOM 0 H ARG A 92 -10.354 5.375 15.569 1.00 0.00 H new ATOM 0 HA ARG A 92 -9.638 3.765 13.225 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -10.318 5.795 11.991 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -11.589 5.213 13.047 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -11.443 7.029 14.474 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -9.739 7.290 14.157 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -10.754 9.098 13.060 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -10.471 7.961 11.757 1.00 0.00 H new ATOM 0 HE ARG A 92 -12.763 7.775 11.444 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -12.087 9.062 14.660 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -13.788 9.379 15.018 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -14.946 8.184 11.910 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -15.400 8.884 13.467 1.00 0.00 H new ATOM 1422 N THR A 93 -7.247 4.668 14.282 1.00 0.00 N ATOM 1423 CA THR A 93 -5.857 5.105 14.249 1.00 0.00 C ATOM 1424 C THR A 93 -5.167 4.645 12.970 1.00 0.00 C ATOM 1425 O THR A 93 -5.422 3.547 12.475 1.00 0.00 O ATOM 1426 CB THR A 93 -5.072 4.573 15.462 1.00 0.00 C ATOM 1427 OG1 THR A 93 -5.740 4.936 16.676 1.00 0.00 O ATOM 1428 CG2 THR A 93 -3.654 5.126 15.474 1.00 0.00 C ATOM 0 H THR A 93 -7.419 3.853 14.871 1.00 0.00 H new ATOM 0 HA THR A 93 -5.867 6.194 14.282 1.00 0.00 H new ATOM 0 HB THR A 93 -5.022 3.487 15.386 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.235 4.592 17.442 1.00 0.00 H new ATOM 0 HG21 THR A 93 -3.119 4.736 16.340 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.138 4.824 14.562 1.00 0.00 H new ATOM 0 HG23 THR A 93 -3.688 6.214 15.528 1.00 0.00 H new ATOM 1436 N VAL A 94 -4.290 5.492 12.438 1.00 0.00 N ATOM 1437 CA VAL A 94 -3.561 5.171 11.217 1.00 0.00 C ATOM 1438 C VAL A 94 -2.082 5.513 11.355 1.00 0.00 C ATOM 1439 O VAL A 94 -1.724 6.567 11.881 1.00 0.00 O ATOM 1440 CB VAL A 94 -4.140 5.923 10.004 1.00 0.00 C ATOM 1441 CG1 VAL A 94 -3.149 5.918 8.850 1.00 0.00 C ATOM 1442 CG2 VAL A 94 -5.466 5.311 9.581 1.00 0.00 C ATOM 0 H VAL A 94 -4.068 6.405 12.834 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.669 4.099 11.055 1.00 0.00 H new ATOM 0 HB VAL A 94 -4.320 6.959 10.293 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.575 6.454 8.002 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -2.226 6.407 9.161 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -2.935 4.890 8.559 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -5.860 5.855 8.723 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -5.315 4.266 9.310 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -6.175 5.373 10.407 1.00 0.00 H new ATOM 1452 N ILE A 95 -1.226 4.614 10.878 1.00 0.00 N ATOM 1453 CA ILE A 95 0.215 4.821 10.947 1.00 0.00 C ATOM 1454 C ILE A 95 0.804 5.051 9.559 1.00 0.00 C ATOM 1455 O ILE A 95 0.532 4.295 8.626 1.00 0.00 O ATOM 1456 CB ILE A 95 0.925 3.622 11.602 1.00 0.00 C ATOM 1457 CG1 ILE A 95 0.511 3.496 13.069 1.00 0.00 C ATOM 1458 CG2 ILE A 95 2.435 3.772 11.484 1.00 0.00 C ATOM 1459 CD1 ILE A 95 1.294 2.450 13.831 1.00 0.00 C ATOM 0 H ILE A 95 -1.506 3.736 10.440 1.00 0.00 H new ATOM 0 HA ILE A 95 0.378 5.708 11.560 1.00 0.00 H new ATOM 0 HB ILE A 95 0.627 2.713 11.080 1.00 0.00 H new ATOM 0 HG12 ILE A 95 0.639 4.462 13.558 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -0.550 3.251 13.119 1.00 0.00 H new ATOM 0 HG21 ILE A 95 2.923 2.917 11.952 1.00 0.00 H new ATOM 0 HG22 ILE A 95 2.715 3.819 10.432 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.750 4.688 11.984 1.00 0.00 H new ATOM 0 HD11 ILE A 95 0.947 2.416 14.864 1.00 0.00 H new ATOM 0 HD12 ILE A 95 1.147 1.475 13.366 1.00 0.00 H new ATOM 0 HD13 ILE A 95 2.354 2.704 13.813 1.00 0.00 H new ATOM 1471 N ASP A 96 1.613 6.096 9.431 1.00 0.00 N ATOM 1472 CA ASP A 96 2.244 6.424 8.158 1.00 0.00 C ATOM 1473 C ASP A 96 3.426 5.500 7.883 1.00 0.00 C ATOM 1474 O ASP A 96 4.268 5.278 8.754 1.00 0.00 O ATOM 1475 CB ASP A 96 2.708 7.881 8.154 1.00 0.00 C ATOM 1476 CG ASP A 96 1.550 8.858 8.217 1.00 0.00 C ATOM 1477 OD1 ASP A 96 0.516 8.513 8.825 1.00 0.00 O ATOM 1478 OD2 ASP A 96 1.678 9.967 7.657 1.00 0.00 O ATOM 0 H ASP A 96 1.848 6.731 10.194 1.00 0.00 H new ATOM 0 HA ASP A 96 1.505 6.284 7.369 1.00 0.00 H new ATOM 0 HB2 ASP A 96 3.369 8.051 9.004 1.00 0.00 H new ATOM 0 HB3 ASP A 96 3.291 8.071 7.253 1.00 0.00 H new ATOM 1483 N TYR A 97 3.481 4.963 6.669 1.00 0.00 N ATOM 1484 CA TYR A 97 4.558 4.060 6.281 1.00 0.00 C ATOM 1485 C TYR A 97 5.635 4.802 5.495 1.00 0.00 C ATOM 1486 O TYR A 97 5.413 5.219 4.359 1.00 0.00 O ATOM 1487 CB TYR A 97 4.006 2.904 5.446 1.00 0.00 C ATOM 1488 CG TYR A 97 5.041 1.855 5.107 1.00 0.00 C ATOM 1489 CD1 TYR A 97 5.896 2.019 4.024 1.00 0.00 C ATOM 1490 CD2 TYR A 97 5.162 0.699 5.868 1.00 0.00 C ATOM 1491 CE1 TYR A 97 6.842 1.062 3.709 1.00 0.00 C ATOM 1492 CE2 TYR A 97 6.106 -0.262 5.562 1.00 0.00 C ATOM 1493 CZ TYR A 97 6.944 -0.076 4.481 1.00 0.00 C ATOM 1494 OH TYR A 97 7.884 -1.032 4.172 1.00 0.00 O ATOM 0 H TYR A 97 2.792 5.137 5.937 1.00 0.00 H new ATOM 0 HA TYR A 97 5.008 3.660 7.190 1.00 0.00 H new ATOM 0 HB2 TYR A 97 3.187 2.432 5.990 1.00 0.00 H new ATOM 0 HB3 TYR A 97 3.587 3.302 4.522 1.00 0.00 H new ATOM 0 HD1 TYR A 97 5.820 2.910 3.418 1.00 0.00 H new ATOM 0 HD2 TYR A 97 4.507 0.549 6.713 1.00 0.00 H new ATOM 0 HE1 TYR A 97 7.498 1.205 2.863 1.00 0.00 H new ATOM 0 HE2 TYR A 97 6.188 -1.154 6.165 1.00 0.00 H new ATOM 0 HH TYR A 97 7.487 -1.701 3.576 1.00 0.00 H new ATOM 1504 N ASN A 98 6.802 4.963 6.109 1.00 0.00 N ATOM 1505 CA ASN A 98 7.915 5.654 5.467 1.00 0.00 C ATOM 1506 C ASN A 98 9.173 4.791 5.483 1.00 0.00 C ATOM 1507 O ASN A 98 10.125 5.075 6.209 1.00 0.00 O ATOM 1508 CB ASN A 98 8.188 6.986 6.169 1.00 0.00 C ATOM 1509 CG ASN A 98 6.917 7.650 6.663 1.00 0.00 C ATOM 1510 OD1 ASN A 98 6.565 7.546 7.838 1.00 0.00 O ATOM 1511 ND2 ASN A 98 6.221 8.337 5.765 1.00 0.00 N ATOM 0 H ASN A 98 7.002 4.625 7.050 1.00 0.00 H new ATOM 0 HA ASN A 98 7.641 5.847 4.430 1.00 0.00 H new ATOM 0 HB2 ASN A 98 8.859 6.819 7.012 1.00 0.00 H new ATOM 0 HB3 ASN A 98 8.702 7.658 5.481 1.00 0.00 H new ATOM 0 HD21 ASN A 98 5.357 8.805 6.039 1.00 0.00 H new ATOM 0 HD22 ASN A 98 6.550 8.397 4.801 1.00 0.00 H new ATOM 1518 N GLY A 99 9.170 3.735 4.674 1.00 0.00 N ATOM 1519 CA GLY A 99 10.316 2.847 4.609 1.00 0.00 C ATOM 1520 C GLY A 99 10.774 2.595 3.187 1.00 0.00 C ATOM 1521 O GLY A 99 10.614 3.450 2.316 1.00 0.00 O ATOM 0 H GLY A 99 8.394 3.479 4.063 1.00 0.00 H new ATOM 0 HA2 GLY A 99 11.138 3.277 5.181 1.00 0.00 H new ATOM 0 HA3 GLY A 99 10.063 1.897 5.080 1.00 0.00 H new ATOM 1525 N GLU A 100 11.346 1.418 2.951 1.00 0.00 N ATOM 1526 CA GLU A 100 11.831 1.058 1.624 1.00 0.00 C ATOM 1527 C GLU A 100 10.667 0.814 0.667 1.00 0.00 C ATOM 1528 O GLU A 100 10.793 1.006 -0.542 1.00 0.00 O ATOM 1529 CB GLU A 100 12.713 -0.190 1.700 1.00 0.00 C ATOM 1530 CG GLU A 100 12.028 -1.381 2.348 1.00 0.00 C ATOM 1531 CD GLU A 100 13.007 -2.319 3.027 1.00 0.00 C ATOM 1532 OE1 GLU A 100 13.628 -3.140 2.320 1.00 0.00 O ATOM 1533 OE2 GLU A 100 13.151 -2.233 4.264 1.00 0.00 O ATOM 0 H GLU A 100 11.485 0.699 3.661 1.00 0.00 H new ATOM 0 HA GLU A 100 12.423 1.890 1.244 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.026 -0.465 0.693 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.617 0.048 2.261 1.00 0.00 H new ATOM 0 HG2 GLU A 100 11.304 -1.025 3.081 1.00 0.00 H new ATOM 0 HG3 GLU A 100 11.470 -1.931 1.590 1.00 0.00 H new ATOM 1540 N ARG A 101 9.535 0.388 1.218 1.00 0.00 N ATOM 1541 CA ARG A 101 8.349 0.115 0.415 1.00 0.00 C ATOM 1542 C ARG A 101 8.582 -1.074 -0.512 1.00 0.00 C ATOM 1543 O ARG A 101 8.218 -1.040 -1.688 1.00 0.00 O ATOM 1544 CB ARG A 101 7.969 1.349 -0.406 1.00 0.00 C ATOM 1545 CG ARG A 101 6.549 1.306 -0.947 1.00 0.00 C ATOM 1546 CD ARG A 101 6.065 2.691 -1.349 1.00 0.00 C ATOM 1547 NE ARG A 101 5.839 3.550 -0.190 1.00 0.00 N ATOM 1548 CZ ARG A 101 5.655 4.863 -0.273 1.00 0.00 C ATOM 1549 NH1 ARG A 101 5.670 5.464 -1.455 1.00 0.00 N ATOM 1550 NH2 ARG A 101 5.455 5.577 0.827 1.00 0.00 N ATOM 0 H ARG A 101 9.414 0.224 2.218 1.00 0.00 H new ATOM 0 HA ARG A 101 7.530 -0.129 1.092 1.00 0.00 H new ATOM 0 HB2 ARG A 101 8.086 2.238 0.214 1.00 0.00 H new ATOM 0 HB3 ARG A 101 8.664 1.448 -1.240 1.00 0.00 H new ATOM 0 HG2 ARG A 101 6.507 0.640 -1.809 1.00 0.00 H new ATOM 0 HG3 ARG A 101 5.882 0.891 -0.191 1.00 0.00 H new ATOM 0 HD2 ARG A 101 6.800 3.155 -2.006 1.00 0.00 H new ATOM 0 HD3 ARG A 101 5.140 2.600 -1.919 1.00 0.00 H new ATOM 0 HE ARG A 101 5.821 3.118 0.734 1.00 0.00 H new ATOM 0 HH11 ARG A 101 5.823 4.918 -2.303 1.00 0.00 H new ATOM 0 HH12 ARG A 101 5.528 6.472 -1.516 1.00 0.00 H new ATOM 0 HH21 ARG A 101 5.442 5.118 1.738 1.00 0.00 H new ATOM 0 HH22 ARG A 101 5.314 6.585 0.762 1.00 0.00 H new ATOM 1564 N THR A 102 9.193 -2.126 0.025 1.00 0.00 N ATOM 1565 CA THR A 102 9.476 -3.325 -0.753 1.00 0.00 C ATOM 1566 C THR A 102 8.812 -4.551 -0.136 1.00 0.00 C ATOM 1567 O THR A 102 8.529 -4.579 1.063 1.00 0.00 O ATOM 1568 CB THR A 102 10.991 -3.578 -0.864 1.00 0.00 C ATOM 1569 OG1 THR A 102 11.526 -3.921 0.419 1.00 0.00 O ATOM 1570 CG2 THR A 102 11.707 -2.348 -1.404 1.00 0.00 C ATOM 0 H THR A 102 9.501 -2.171 0.996 1.00 0.00 H new ATOM 0 HA THR A 102 9.069 -3.158 -1.750 1.00 0.00 H new ATOM 0 HB THR A 102 11.149 -4.405 -1.556 1.00 0.00 H new ATOM 0 HG1 THR A 102 12.505 -3.925 0.375 1.00 0.00 H new ATOM 0 HG21 THR A 102 12.776 -2.550 -1.474 1.00 0.00 H new ATOM 0 HG22 THR A 102 11.318 -2.106 -2.393 1.00 0.00 H new ATOM 0 HG23 THR A 102 11.540 -1.506 -0.732 1.00 0.00 H new ATOM 1578 N LEU A 103 8.567 -5.563 -0.961 1.00 0.00 N ATOM 1579 CA LEU A 103 7.936 -6.793 -0.495 1.00 0.00 C ATOM 1580 C LEU A 103 8.569 -7.270 0.808 1.00 0.00 C ATOM 1581 O LEU A 103 7.869 -7.608 1.763 1.00 0.00 O ATOM 1582 CB LEU A 103 8.053 -7.884 -1.561 1.00 0.00 C ATOM 1583 CG LEU A 103 7.543 -9.270 -1.162 1.00 0.00 C ATOM 1584 CD1 LEU A 103 6.082 -9.202 -0.748 1.00 0.00 C ATOM 1585 CD2 LEU A 103 7.730 -10.256 -2.306 1.00 0.00 C ATOM 0 H LEU A 103 8.795 -5.556 -1.955 1.00 0.00 H new ATOM 0 HA LEU A 103 6.882 -6.585 -0.310 1.00 0.00 H new ATOM 0 HB2 LEU A 103 7.507 -7.559 -2.446 1.00 0.00 H new ATOM 0 HB3 LEU A 103 9.101 -7.973 -1.848 1.00 0.00 H new ATOM 0 HG LEU A 103 8.125 -9.619 -0.309 1.00 0.00 H new ATOM 0 HD11 LEU A 103 5.737 -10.197 -0.468 1.00 0.00 H new ATOM 0 HD12 LEU A 103 5.976 -8.528 0.102 1.00 0.00 H new ATOM 0 HD13 LEU A 103 5.485 -8.832 -1.581 1.00 0.00 H new ATOM 0 HD21 LEU A 103 7.362 -11.237 -2.005 1.00 0.00 H new ATOM 0 HD22 LEU A 103 7.174 -9.912 -3.178 1.00 0.00 H new ATOM 0 HD23 LEU A 103 8.789 -10.327 -2.556 1.00 0.00 H new ATOM 1597 N ASP A 104 9.897 -7.293 0.841 1.00 0.00 N ATOM 1598 CA ASP A 104 10.625 -7.725 2.029 1.00 0.00 C ATOM 1599 C ASP A 104 10.624 -6.634 3.094 1.00 0.00 C ATOM 1600 O ASP A 104 10.569 -6.919 4.290 1.00 0.00 O ATOM 1601 CB ASP A 104 12.062 -8.098 1.664 1.00 0.00 C ATOM 1602 CG ASP A 104 12.187 -9.534 1.194 1.00 0.00 C ATOM 1603 OD1 ASP A 104 12.041 -9.775 -0.023 1.00 0.00 O ATOM 1604 OD2 ASP A 104 12.431 -10.417 2.042 1.00 0.00 O ATOM 0 H ASP A 104 10.491 -7.018 0.059 1.00 0.00 H new ATOM 0 HA ASP A 104 10.122 -8.603 2.434 1.00 0.00 H new ATOM 0 HB2 ASP A 104 12.420 -7.430 0.880 1.00 0.00 H new ATOM 0 HB3 ASP A 104 12.705 -7.945 2.531 1.00 0.00 H new ATOM 1609 N GLY A 105 10.685 -5.381 2.651 1.00 0.00 N ATOM 1610 CA GLY A 105 10.691 -4.266 3.580 1.00 0.00 C ATOM 1611 C GLY A 105 9.413 -4.178 4.390 1.00 0.00 C ATOM 1612 O GLY A 105 9.436 -3.799 5.561 1.00 0.00 O ATOM 0 H GLY A 105 10.730 -5.119 1.666 1.00 0.00 H new ATOM 0 HA2 GLY A 105 11.540 -4.366 4.256 1.00 0.00 H new ATOM 0 HA3 GLY A 105 10.831 -3.337 3.027 1.00 0.00 H new ATOM 1616 N PHE A 106 8.294 -4.529 3.765 1.00 0.00 N ATOM 1617 CA PHE A 106 6.999 -4.486 4.435 1.00 0.00 C ATOM 1618 C PHE A 106 6.963 -5.455 5.613 1.00 0.00 C ATOM 1619 O PHE A 106 6.525 -5.104 6.708 1.00 0.00 O ATOM 1620 CB PHE A 106 5.879 -4.822 3.448 1.00 0.00 C ATOM 1621 CG PHE A 106 5.698 -3.791 2.371 1.00 0.00 C ATOM 1622 CD1 PHE A 106 5.668 -2.441 2.685 1.00 0.00 C ATOM 1623 CD2 PHE A 106 5.559 -4.170 1.046 1.00 0.00 C ATOM 1624 CE1 PHE A 106 5.501 -1.490 1.696 1.00 0.00 C ATOM 1625 CE2 PHE A 106 5.392 -3.224 0.053 1.00 0.00 C ATOM 1626 CZ PHE A 106 5.365 -1.882 0.378 1.00 0.00 C ATOM 0 H PHE A 106 8.258 -4.846 2.796 1.00 0.00 H new ATOM 0 HA PHE A 106 6.848 -3.476 4.815 1.00 0.00 H new ATOM 0 HB2 PHE A 106 6.091 -5.786 2.985 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.943 -4.931 3.996 1.00 0.00 H new ATOM 0 HD1 PHE A 106 5.776 -2.129 3.713 1.00 0.00 H new ATOM 0 HD2 PHE A 106 5.581 -5.218 0.786 1.00 0.00 H new ATOM 0 HE1 PHE A 106 5.477 -0.441 1.953 1.00 0.00 H new ATOM 0 HE2 PHE A 106 5.283 -3.534 -0.976 1.00 0.00 H new ATOM 0 HZ PHE A 106 5.238 -1.140 -0.397 1.00 0.00 H new ATOM 1636 N LYS A 107 7.427 -6.678 5.378 1.00 0.00 N ATOM 1637 CA LYS A 107 7.450 -7.700 6.418 1.00 0.00 C ATOM 1638 C LYS A 107 8.115 -7.173 7.685 1.00 0.00 C ATOM 1639 O LYS A 107 7.672 -7.459 8.797 1.00 0.00 O ATOM 1640 CB LYS A 107 8.188 -8.945 5.922 1.00 0.00 C ATOM 1641 CG LYS A 107 7.844 -9.327 4.492 1.00 0.00 C ATOM 1642 CD LYS A 107 7.992 -10.822 4.264 1.00 0.00 C ATOM 1643 CE LYS A 107 8.321 -11.134 2.812 1.00 0.00 C ATOM 1644 NZ LYS A 107 9.790 -11.186 2.575 1.00 0.00 N ATOM 0 H LYS A 107 7.792 -6.985 4.477 1.00 0.00 H new ATOM 0 HA LYS A 107 6.419 -7.966 6.654 1.00 0.00 H new ATOM 0 HB2 LYS A 107 9.262 -8.774 5.995 1.00 0.00 H new ATOM 0 HB3 LYS A 107 7.953 -9.782 6.579 1.00 0.00 H new ATOM 0 HG2 LYS A 107 6.821 -9.023 4.269 1.00 0.00 H new ATOM 0 HG3 LYS A 107 8.494 -8.787 3.804 1.00 0.00 H new ATOM 0 HD2 LYS A 107 8.779 -11.213 4.909 1.00 0.00 H new ATOM 0 HD3 LYS A 107 7.068 -11.327 4.546 1.00 0.00 H new ATOM 0 HE2 LYS A 107 7.875 -12.089 2.536 1.00 0.00 H new ATOM 0 HE3 LYS A 107 7.876 -10.376 2.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 9.995 -10.895 1.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 10.271 -10.543 3.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 10.132 -12.157 2.725 1.00 0.00 H new ATOM 1658 N LYS A 108 9.182 -6.400 7.510 1.00 0.00 N ATOM 1659 CA LYS A 108 9.908 -5.829 8.638 1.00 0.00 C ATOM 1660 C LYS A 108 9.012 -4.894 9.445 1.00 0.00 C ATOM 1661 O LYS A 108 8.952 -4.982 10.672 1.00 0.00 O ATOM 1662 CB LYS A 108 11.143 -5.071 8.146 1.00 0.00 C ATOM 1663 CG LYS A 108 12.028 -5.886 7.220 1.00 0.00 C ATOM 1664 CD LYS A 108 13.454 -5.363 7.208 1.00 0.00 C ATOM 1665 CE LYS A 108 14.202 -5.756 8.472 1.00 0.00 C ATOM 1666 NZ LYS A 108 14.751 -7.138 8.385 1.00 0.00 N ATOM 0 H LYS A 108 9.563 -6.155 6.596 1.00 0.00 H new ATOM 0 HA LYS A 108 10.226 -6.647 9.285 1.00 0.00 H new ATOM 0 HB2 LYS A 108 10.822 -4.168 7.626 1.00 0.00 H new ATOM 0 HB3 LYS A 108 11.730 -4.751 9.007 1.00 0.00 H new ATOM 0 HG2 LYS A 108 12.025 -6.929 7.537 1.00 0.00 H new ATOM 0 HG3 LYS A 108 11.621 -5.859 6.209 1.00 0.00 H new ATOM 0 HD2 LYS A 108 13.979 -5.755 6.337 1.00 0.00 H new ATOM 0 HD3 LYS A 108 13.444 -4.277 7.113 1.00 0.00 H new ATOM 0 HE2 LYS A 108 15.016 -5.052 8.646 1.00 0.00 H new ATOM 0 HE3 LYS A 108 13.531 -5.685 9.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 15.254 -7.368 9.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 13.972 -7.813 8.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 15.411 -7.200 7.584 1.00 0.00 H new ATOM 1680 N PHE A 109 8.317 -4.002 8.748 1.00 0.00 N ATOM 1681 CA PHE A 109 7.423 -3.051 9.400 1.00 0.00 C ATOM 1682 C PHE A 109 6.292 -3.775 10.124 1.00 0.00 C ATOM 1683 O PHE A 109 5.958 -3.447 11.263 1.00 0.00 O ATOM 1684 CB PHE A 109 6.844 -2.076 8.373 1.00 0.00 C ATOM 1685 CG PHE A 109 6.095 -0.930 8.990 1.00 0.00 C ATOM 1686 CD1 PHE A 109 4.759 -1.063 9.333 1.00 0.00 C ATOM 1687 CD2 PHE A 109 6.726 0.280 9.227 1.00 0.00 C ATOM 1688 CE1 PHE A 109 4.066 -0.011 9.901 1.00 0.00 C ATOM 1689 CE2 PHE A 109 6.039 1.336 9.796 1.00 0.00 C ATOM 1690 CZ PHE A 109 4.707 1.191 10.132 1.00 0.00 C ATOM 0 H PHE A 109 8.355 -3.917 7.732 1.00 0.00 H new ATOM 0 HA PHE A 109 8.002 -2.492 10.135 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.655 -1.682 7.761 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.175 -2.619 7.705 1.00 0.00 H new ATOM 0 HD1 PHE A 109 4.253 -2.000 9.154 1.00 0.00 H new ATOM 0 HD2 PHE A 109 7.767 0.400 8.964 1.00 0.00 H new ATOM 0 HE1 PHE A 109 3.025 -0.128 10.164 1.00 0.00 H new ATOM 0 HE2 PHE A 109 6.543 2.274 9.978 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.168 2.016 10.574 1.00 0.00 H new ATOM 1700 N LEU A 110 5.707 -4.762 9.455 1.00 0.00 N ATOM 1701 CA LEU A 110 4.612 -5.535 10.033 1.00 0.00 C ATOM 1702 C LEU A 110 5.106 -6.398 11.190 1.00 0.00 C ATOM 1703 O LEU A 110 4.694 -6.213 12.334 1.00 0.00 O ATOM 1704 CB LEU A 110 3.964 -6.416 8.964 1.00 0.00 C ATOM 1705 CG LEU A 110 3.383 -5.686 7.753 1.00 0.00 C ATOM 1706 CD1 LEU A 110 3.147 -6.656 6.607 1.00 0.00 C ATOM 1707 CD2 LEU A 110 2.090 -4.976 8.128 1.00 0.00 C ATOM 0 H LEU A 110 5.972 -5.046 8.512 1.00 0.00 H new ATOM 0 HA LEU A 110 3.869 -4.836 10.417 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.708 -7.130 8.610 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.166 -6.993 9.432 1.00 0.00 H new ATOM 0 HG LEU A 110 4.104 -4.937 7.425 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.733 -6.118 5.754 1.00 0.00 H new ATOM 0 HD12 LEU A 110 4.092 -7.118 6.321 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.446 -7.429 6.923 1.00 0.00 H new ATOM 0 HD21 LEU A 110 1.691 -4.462 7.254 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.363 -5.707 8.483 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.289 -4.250 8.917 1.00 0.00 H new ATOM 1719 N GLU A 111 5.993 -7.339 10.882 1.00 0.00 N ATOM 1720 CA GLU A 111 6.544 -8.230 11.897 1.00 0.00 C ATOM 1721 C GLU A 111 6.805 -7.476 13.198 1.00 0.00 C ATOM 1722 O GLU A 111 6.595 -8.008 14.288 1.00 0.00 O ATOM 1723 CB GLU A 111 7.841 -8.869 11.396 1.00 0.00 C ATOM 1724 CG GLU A 111 7.619 -9.997 10.403 1.00 0.00 C ATOM 1725 CD GLU A 111 8.737 -11.021 10.423 1.00 0.00 C ATOM 1726 OE1 GLU A 111 9.913 -10.612 10.530 1.00 0.00 O ATOM 1727 OE2 GLU A 111 8.438 -12.230 10.333 1.00 0.00 O ATOM 0 H GLU A 111 6.345 -7.504 9.939 1.00 0.00 H new ATOM 0 HA GLU A 111 5.813 -9.014 12.092 1.00 0.00 H new ATOM 0 HB2 GLU A 111 8.458 -8.101 10.929 1.00 0.00 H new ATOM 0 HB3 GLU A 111 8.401 -9.252 12.249 1.00 0.00 H new ATOM 0 HG2 GLU A 111 6.674 -10.492 10.627 1.00 0.00 H new ATOM 0 HG3 GLU A 111 7.531 -9.580 9.400 1.00 0.00 H new ATOM 1734 N SER A 112 7.264 -6.235 13.074 1.00 0.00 N ATOM 1735 CA SER A 112 7.558 -5.409 14.240 1.00 0.00 C ATOM 1736 C SER A 112 6.272 -4.988 14.946 1.00 0.00 C ATOM 1737 O SER A 112 6.195 -4.994 16.173 1.00 0.00 O ATOM 1738 CB SER A 112 8.354 -4.170 13.825 1.00 0.00 C ATOM 1739 OG SER A 112 9.571 -4.533 13.196 1.00 0.00 O ATOM 0 H SER A 112 7.440 -5.779 12.179 1.00 0.00 H new ATOM 0 HA SER A 112 8.155 -6.001 14.933 1.00 0.00 H new ATOM 0 HB2 SER A 112 7.757 -3.561 13.146 1.00 0.00 H new ATOM 0 HB3 SER A 112 8.563 -3.557 14.702 1.00 0.00 H new ATOM 0 HG SER A 112 9.450 -4.529 12.223 1.00 0.00 H new ATOM 1745 N GLY A 113 5.264 -4.624 14.159 1.00 0.00 N ATOM 1746 CA GLY A 113 3.995 -4.205 14.725 1.00 0.00 C ATOM 1747 C GLY A 113 3.729 -2.727 14.521 1.00 0.00 C ATOM 1748 O GLY A 113 3.134 -2.072 15.376 1.00 0.00 O ATOM 0 H GLY A 113 5.304 -4.612 13.140 1.00 0.00 H new ATOM 0 HA2 GLY A 113 3.190 -4.782 14.270 1.00 0.00 H new ATOM 0 HA3 GLY A 113 3.985 -4.429 15.792 1.00 0.00 H new ATOM 1752 N GLY A 114 4.172 -2.199 13.384 1.00 0.00 N ATOM 1753 CA GLY A 114 3.970 -0.792 13.092 1.00 0.00 C ATOM 1754 C GLY A 114 4.452 0.108 14.212 1.00 0.00 C ATOM 1755 O GLY A 114 3.777 1.070 14.578 1.00 0.00 O ATOM 0 H GLY A 114 4.667 -2.720 12.660 1.00 0.00 H new ATOM 0 HA2 GLY A 114 4.496 -0.536 12.172 1.00 0.00 H new ATOM 0 HA3 GLY A 114 2.910 -0.610 12.914 1.00 0.00 H new ATOM 1759 N GLN A 115 5.622 -0.205 14.759 1.00 0.00 N ATOM 1760 CA GLN A 115 6.192 0.582 15.846 1.00 0.00 C ATOM 1761 C GLN A 115 6.960 1.783 15.305 1.00 0.00 C ATOM 1762 O GLN A 115 6.939 2.863 15.895 1.00 0.00 O ATOM 1763 CB GLN A 115 7.117 -0.286 16.702 1.00 0.00 C ATOM 1764 CG GLN A 115 8.495 -0.491 16.093 1.00 0.00 C ATOM 1765 CD GLN A 115 9.507 -1.003 17.099 1.00 0.00 C ATOM 1766 OE1 GLN A 115 9.336 -2.077 17.677 1.00 0.00 O ATOM 1767 NE2 GLN A 115 10.569 -0.236 17.313 1.00 0.00 N ATOM 0 H GLN A 115 6.194 -0.998 14.467 1.00 0.00 H new ATOM 0 HA GLN A 115 5.372 0.947 16.464 1.00 0.00 H new ATOM 0 HB2 GLN A 115 7.228 0.174 17.684 1.00 0.00 H new ATOM 0 HB3 GLN A 115 6.649 -1.258 16.857 1.00 0.00 H new ATOM 0 HG2 GLN A 115 8.421 -1.197 15.266 1.00 0.00 H new ATOM 0 HG3 GLN A 115 8.848 0.452 15.676 1.00 0.00 H new ATOM 0 HE21 GLN A 115 10.670 0.647 16.812 1.00 0.00 H new ATOM 0 HE22 GLN A 115 11.284 -0.529 17.979 1.00 0.00 H new ATOM 1776 N SER A 116 7.638 1.586 14.178 1.00 0.00 N ATOM 1777 CA SER A 116 8.417 2.653 13.559 1.00 0.00 C ATOM 1778 C SER A 116 7.502 3.735 12.994 1.00 0.00 C ATOM 1779 O SER A 116 6.298 3.531 12.846 1.00 0.00 O ATOM 1780 CB SER A 116 9.303 2.086 12.448 1.00 0.00 C ATOM 1781 OG SER A 116 8.607 2.040 11.214 1.00 0.00 O ATOM 0 H SER A 116 7.664 0.699 13.676 1.00 0.00 H new ATOM 0 HA SER A 116 9.049 3.101 14.326 1.00 0.00 H new ATOM 0 HB2 SER A 116 10.197 2.701 12.342 1.00 0.00 H new ATOM 0 HB3 SER A 116 9.635 1.084 12.719 1.00 0.00 H new ATOM 0 HG SER A 116 7.718 1.653 11.354 1.00 0.00 H new ATOM 1787 N GLY A 117 8.085 4.888 12.678 1.00 0.00 N ATOM 1788 CA GLY A 117 7.309 5.986 12.133 1.00 0.00 C ATOM 1789 C GLY A 117 7.143 7.125 13.119 1.00 0.00 C ATOM 1790 O GLY A 117 7.083 6.921 14.332 1.00 0.00 O ATOM 0 H GLY A 117 9.080 5.081 12.790 1.00 0.00 H new ATOM 0 HA2 GLY A 117 7.796 6.358 11.231 1.00 0.00 H new ATOM 0 HA3 GLY A 117 6.326 5.620 11.837 1.00 0.00 H new ATOM 1794 N PRO A 118 7.069 8.359 12.598 1.00 0.00 N ATOM 1795 CA PRO A 118 6.910 9.559 13.424 1.00 0.00 C ATOM 1796 C PRO A 118 5.529 9.642 14.067 1.00 0.00 C ATOM 1797 O PRO A 118 5.297 10.459 14.958 1.00 0.00 O ATOM 1798 CB PRO A 118 7.104 10.704 12.427 1.00 0.00 C ATOM 1799 CG PRO A 118 6.731 10.125 11.107 1.00 0.00 C ATOM 1800 CD PRO A 118 7.134 8.677 11.162 1.00 0.00 C ATOM 0 HA PRO A 118 7.613 9.576 14.257 1.00 0.00 H new ATOM 0 HB2 PRO A 118 6.474 11.557 12.677 1.00 0.00 H new ATOM 0 HB3 PRO A 118 8.135 11.058 12.427 1.00 0.00 H new ATOM 0 HG2 PRO A 118 5.661 10.226 10.925 1.00 0.00 H new ATOM 0 HG3 PRO A 118 7.243 10.642 10.295 1.00 0.00 H new ATOM 0 HD2 PRO A 118 6.458 8.050 10.581 1.00 0.00 H new ATOM 0 HD3 PRO A 118 8.136 8.523 10.761 1.00 0.00 H new ATOM 1808 N SER A 119 4.617 8.790 13.610 1.00 0.00 N ATOM 1809 CA SER A 119 3.258 8.769 14.139 1.00 0.00 C ATOM 1810 C SER A 119 3.269 8.744 15.664 1.00 0.00 C ATOM 1811 O SER A 119 2.644 9.582 16.315 1.00 0.00 O ATOM 1812 CB SER A 119 2.498 7.554 13.603 1.00 0.00 C ATOM 1813 OG SER A 119 2.013 7.793 12.293 1.00 0.00 O ATOM 0 H SER A 119 4.794 8.105 12.875 1.00 0.00 H new ATOM 0 HA SER A 119 2.753 9.678 13.812 1.00 0.00 H new ATOM 0 HB2 SER A 119 3.154 6.684 13.598 1.00 0.00 H new ATOM 0 HB3 SER A 119 1.665 7.321 14.266 1.00 0.00 H new ATOM 0 HG SER A 119 1.036 7.714 12.286 1.00 0.00 H new ATOM 1819 N SER A 120 3.984 7.776 16.229 1.00 0.00 N ATOM 1820 CA SER A 120 4.075 7.638 17.678 1.00 0.00 C ATOM 1821 C SER A 120 5.165 8.543 18.243 1.00 0.00 C ATOM 1822 O SER A 120 6.190 8.773 17.602 1.00 0.00 O ATOM 1823 CB SER A 120 4.357 6.183 18.056 1.00 0.00 C ATOM 1824 OG SER A 120 5.532 5.710 17.420 1.00 0.00 O ATOM 0 H SER A 120 4.509 7.076 15.705 1.00 0.00 H new ATOM 0 HA SER A 120 3.119 7.939 18.107 1.00 0.00 H new ATOM 0 HB2 SER A 120 4.466 6.099 19.137 1.00 0.00 H new ATOM 0 HB3 SER A 120 3.509 5.559 17.772 1.00 0.00 H new ATOM 0 HG SER A 120 5.692 4.778 17.679 1.00 0.00 H new ATOM 1830 N GLY A 121 4.936 9.054 19.449 1.00 0.00 N ATOM 1831 CA GLY A 121 5.906 9.928 20.081 1.00 0.00 C ATOM 1832 C GLY A 121 5.595 10.179 21.543 1.00 0.00 C ATOM 1833 O GLY A 121 6.451 9.993 22.408 1.00 0.00 O ATOM 0 H GLY A 121 4.096 8.878 19.999 1.00 0.00 H new ATOM 0 HA2 GLY A 121 6.899 9.486 19.995 1.00 0.00 H new ATOM 0 HA3 GLY A 121 5.933 10.880 19.550 1.00 0.00 H new TER 1837 GLY A 121