USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1314 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 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 100 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 65 THR OG1 : rot 91:sc= 0.837 USER MOD Set 2.2: A 69 LYS NZ :NH3+ -149:sc= 0.147 (180deg=-0.409) USER MOD Set 3.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 62 TYR OH : rot 180:sc= -2.17! USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.0247 USER MOD Single : A 9 SER OG : rot 12:sc= 0.176! USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ -163:sc= -1.2 (180deg=-1.65) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 93:sc= -0.124 USER MOD Single : A 29 GLN : amide:sc= -0.0104 X(o=-0.01,f=-0.01) USER MOD Single : A 34 GLN : amide:sc= -0.0226 K(o=-0.023,f=-2.2) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 152:sc= -0.542 (180deg=-0.568) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 98:sc= 0.155 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 145:sc= -0.131 (180deg=-0.555) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.0431 X(o=-0.043,f=0) USER MOD Single : A 48 GLN : amide:sc= -4.95 K(o=-5,f=-8.4!) USER MOD Single : A 53 MET CE :methyl -165:sc= -6.69! (180deg=-7.86!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 HIS : no HE2:sc= -1.82! C(o=-1.8!,f=-4!) USER MOD Single : A 57 HIS : no HD1:sc= -4.18! C(o=-4.2!,f=-5.7!) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 SER OG : rot -52:sc= 1.14 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -134:sc= -0.0154 (180deg=-0.173) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 146:sc= 1.07 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 62:sc= 0.0831 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 156:sc= -0.0666 (180deg=-0.866) USER MOD Single : A 112 ASN : amide:sc= -1.5 K(o=-1.5,f=-3.4!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.0706 USER MOD Single : A 115 ASN : amide:sc= -0.736 K(o=-0.74,f=-4.7!) USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 SER OG : rot 180:sc= -0.0946 USER MOD Single : A 119 THR OG1 : rot -49:sc= -0.0282 USER MOD Single : A 128 GLN : amide:sc= -0.927 X(o=-0.93,f=-1!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -155:sc= 0.0299 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.118 USER MOD Single : A 139 GLN : amide:sc= -0.0986 X(o=-0.099,f=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.414 X(o=-0.41,f=-0.1) USER MOD Single : A 144 GLN : amide:sc= -0.878 K(o=-0.88,f=-2.4!) USER MOD Single : A 147 HIS : no HD1:sc= -0.505 X(o=-0.51,f=-0.32) USER MOD Single : A 155 SER OG : rot -175:sc= 0.505 USER MOD Single : A 156 THR OG1 : rot -49:sc= 1.02 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -31.490 -38.795 7.639 1.00 0.00 N ATOM 2 CA GLY A -1 -30.692 -39.656 6.719 1.00 0.00 C ATOM 3 C GLY A -1 -29.274 -39.831 7.281 1.00 0.00 C ATOM 4 O GLY A -1 -28.300 -39.620 6.582 1.00 0.00 O ATOM 0 H1 GLY A -1 -32.450 -38.677 7.258 1.00 0.00 H new ATOM 0 H2 GLY A -1 -31.542 -39.243 8.576 1.00 0.00 H new ATOM 0 H3 GLY A -1 -31.035 -37.864 7.725 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -31.172 -40.628 6.606 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -30.648 -39.205 5.728 1.00 0.00 H new ATOM 10 N GLY A 0 -29.144 -40.213 8.536 1.00 0.00 N ATOM 11 CA GLY A 0 -27.785 -40.394 9.127 1.00 0.00 C ATOM 12 C GLY A 0 -27.539 -39.315 10.190 1.00 0.00 C ATOM 13 O GLY A 0 -27.195 -39.622 11.317 1.00 0.00 O ATOM 0 H GLY A 0 -29.921 -40.405 9.169 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -27.700 -41.385 9.573 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -27.026 -40.330 8.347 1.00 0.00 H new ATOM 17 N SER A 1 -27.711 -38.054 9.848 1.00 0.00 N ATOM 18 CA SER A 1 -27.483 -36.969 10.848 1.00 0.00 C ATOM 19 C SER A 1 -28.630 -35.944 10.791 1.00 0.00 C ATOM 20 O SER A 1 -28.490 -34.904 10.178 1.00 0.00 O ATOM 21 CB SER A 1 -26.162 -36.322 10.437 1.00 0.00 C ATOM 22 OG SER A 1 -25.103 -36.895 11.192 1.00 0.00 O ATOM 0 H SER A 1 -27.998 -37.737 8.922 1.00 0.00 H new ATOM 0 HA SER A 1 -27.449 -37.349 11.869 1.00 0.00 H new ATOM 0 HB2 SER A 1 -25.987 -36.472 9.372 1.00 0.00 H new ATOM 0 HB3 SER A 1 -26.203 -35.246 10.605 1.00 0.00 H new ATOM 0 HG SER A 1 -24.254 -36.483 10.929 1.00 0.00 H new ATOM 28 N PRO A 2 -29.734 -36.266 11.430 1.00 0.00 N ATOM 29 CA PRO A 2 -30.896 -35.341 11.432 1.00 0.00 C ATOM 30 C PRO A 2 -30.613 -34.129 12.333 1.00 0.00 C ATOM 31 O PRO A 2 -30.958 -34.130 13.500 1.00 0.00 O ATOM 32 CB PRO A 2 -32.032 -36.187 12.000 1.00 0.00 C ATOM 33 CG PRO A 2 -31.359 -37.241 12.821 1.00 0.00 C ATOM 34 CD PRO A 2 -30.011 -37.493 12.200 1.00 0.00 C ATOM 0 HA PRO A 2 -31.125 -34.940 10.445 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -32.707 -35.584 12.608 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -32.630 -36.630 11.204 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -31.251 -36.913 13.855 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -31.953 -38.155 12.836 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -29.249 -37.668 12.959 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -30.027 -38.372 11.556 1.00 0.00 H new ATOM 42 N ARG A 3 -29.990 -33.094 11.805 1.00 0.00 N ATOM 43 CA ARG A 3 -29.694 -31.892 12.643 1.00 0.00 C ATOM 44 C ARG A 3 -29.909 -30.608 11.826 1.00 0.00 C ATOM 45 O ARG A 3 -29.769 -30.610 10.616 1.00 0.00 O ATOM 46 CB ARG A 3 -28.223 -32.037 13.036 1.00 0.00 C ATOM 47 CG ARG A 3 -28.076 -33.174 14.049 1.00 0.00 C ATOM 48 CD ARG A 3 -26.920 -32.861 15.003 1.00 0.00 C ATOM 49 NE ARG A 3 -27.553 -32.154 16.158 1.00 0.00 N ATOM 50 CZ ARG A 3 -28.301 -32.805 17.037 1.00 0.00 C ATOM 51 NH1 ARG A 3 -28.515 -34.096 16.932 1.00 0.00 N ATOM 52 NH2 ARG A 3 -28.840 -32.152 18.034 1.00 0.00 N ATOM 0 H ARG A 3 -29.678 -33.035 10.836 1.00 0.00 H new ATOM 0 HA ARG A 3 -30.345 -31.826 13.515 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -27.618 -32.242 12.153 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -27.856 -31.104 13.464 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -29.002 -33.297 14.611 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -27.890 -34.115 13.531 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -26.417 -33.772 15.326 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -26.169 -32.236 14.521 1.00 0.00 H new ATOM 0 HE ARG A 3 -27.406 -31.151 16.272 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -28.102 -34.620 16.161 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -29.095 -34.575 17.621 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -28.683 -31.149 18.131 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -29.417 -32.646 18.715 1.00 0.00 H new ATOM 66 N ILE A 4 -30.250 -29.511 12.471 1.00 0.00 N ATOM 67 CA ILE A 4 -30.471 -28.236 11.720 1.00 0.00 C ATOM 68 C ILE A 4 -29.957 -27.039 12.536 1.00 0.00 C ATOM 69 O ILE A 4 -30.728 -26.332 13.158 1.00 0.00 O ATOM 70 CB ILE A 4 -31.989 -28.141 11.517 1.00 0.00 C ATOM 71 CG1 ILE A 4 -32.711 -28.205 12.877 1.00 0.00 C ATOM 72 CG2 ILE A 4 -32.455 -29.298 10.632 1.00 0.00 C ATOM 73 CD1 ILE A 4 -33.741 -27.075 12.971 1.00 0.00 C ATOM 0 H ILE A 4 -30.383 -29.448 13.480 1.00 0.00 H new ATOM 0 HA ILE A 4 -29.936 -28.224 10.770 1.00 0.00 H new ATOM 0 HB ILE A 4 -32.227 -27.192 11.036 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -33.205 -29.170 12.992 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -31.988 -28.118 13.688 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -33.533 -29.233 10.486 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -31.954 -29.242 9.666 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -32.210 -30.245 11.113 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -34.249 -27.125 13.934 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -33.236 -26.114 12.876 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -34.472 -27.182 12.170 1.00 0.00 H new ATOM 85 N LYS A 5 -28.660 -26.797 12.536 1.00 0.00 N ATOM 86 CA LYS A 5 -28.113 -25.642 13.313 1.00 0.00 C ATOM 87 C LYS A 5 -27.527 -24.590 12.357 1.00 0.00 C ATOM 88 O LYS A 5 -26.879 -24.930 11.384 1.00 0.00 O ATOM 89 CB LYS A 5 -27.014 -26.236 14.196 1.00 0.00 C ATOM 90 CG LYS A 5 -26.969 -25.488 15.530 1.00 0.00 C ATOM 91 CD LYS A 5 -26.225 -26.334 16.565 1.00 0.00 C ATOM 92 CE LYS A 5 -25.518 -25.416 17.564 1.00 0.00 C ATOM 93 NZ LYS A 5 -25.195 -26.288 18.727 1.00 0.00 N ATOM 0 H LYS A 5 -27.965 -27.349 12.033 1.00 0.00 H new ATOM 0 HA LYS A 5 -28.881 -25.143 13.904 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -27.204 -27.296 14.368 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -26.050 -26.162 13.693 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -26.470 -24.527 15.404 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -27.981 -25.278 15.876 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -26.925 -26.987 17.087 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -25.498 -26.977 16.069 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -24.615 -24.984 17.132 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -26.159 -24.586 17.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -24.708 -25.728 19.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -26.074 -26.680 19.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -24.578 -27.065 18.417 1.00 0.00 H new ATOM 107 N THR A 6 -27.748 -23.318 12.621 1.00 0.00 N ATOM 108 CA THR A 6 -27.199 -22.260 11.720 1.00 0.00 C ATOM 109 C THR A 6 -26.696 -21.065 12.547 1.00 0.00 C ATOM 110 O THR A 6 -27.483 -20.290 13.057 1.00 0.00 O ATOM 111 CB THR A 6 -28.377 -21.845 10.836 1.00 0.00 C ATOM 112 OG1 THR A 6 -28.877 -22.985 10.151 1.00 0.00 O ATOM 113 CG2 THR A 6 -27.914 -20.799 9.820 1.00 0.00 C ATOM 0 H THR A 6 -28.283 -22.974 13.419 1.00 0.00 H new ATOM 0 HA THR A 6 -26.353 -22.615 11.132 1.00 0.00 H new ATOM 0 HB THR A 6 -29.165 -21.419 11.457 1.00 0.00 H new ATOM 0 HG1 THR A 6 -29.633 -22.721 9.585 1.00 0.00 H new ATOM 0 HG21 THR A 6 -28.755 -20.505 9.192 1.00 0.00 H new ATOM 0 HG22 THR A 6 -27.531 -19.925 10.347 1.00 0.00 H new ATOM 0 HG23 THR A 6 -27.125 -21.221 9.197 1.00 0.00 H new ATOM 121 N ARG A 7 -25.395 -20.908 12.684 1.00 0.00 N ATOM 122 CA ARG A 7 -24.861 -19.760 13.479 1.00 0.00 C ATOM 123 C ARG A 7 -23.578 -19.217 12.828 1.00 0.00 C ATOM 124 O ARG A 7 -22.629 -19.950 12.620 1.00 0.00 O ATOM 125 CB ARG A 7 -24.558 -20.343 14.863 1.00 0.00 C ATOM 126 CG ARG A 7 -25.045 -19.376 15.947 1.00 0.00 C ATOM 127 CD ARG A 7 -26.579 -19.400 16.013 1.00 0.00 C ATOM 128 NE ARG A 7 -26.905 -19.855 17.400 1.00 0.00 N ATOM 129 CZ ARG A 7 -26.812 -19.032 18.434 1.00 0.00 C ATOM 130 NH1 ARG A 7 -26.421 -17.786 18.286 1.00 0.00 N ATOM 131 NH2 ARG A 7 -27.112 -19.464 19.632 1.00 0.00 N ATOM 0 H ARG A 7 -24.688 -21.523 12.281 1.00 0.00 H new ATOM 0 HA ARG A 7 -25.565 -18.930 13.533 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -25.049 -21.310 14.977 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -23.487 -20.515 14.970 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -24.626 -19.657 16.913 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -24.697 -18.366 15.730 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -26.997 -18.413 15.814 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -26.995 -20.079 15.268 1.00 0.00 H new ATOM 0 HE ARG A 7 -27.205 -20.818 17.553 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -26.181 -17.433 17.359 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -26.357 -17.172 19.098 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -27.415 -20.429 19.765 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -27.043 -18.836 20.433 1.00 0.00 H new ATOM 145 N ARG A 8 -23.538 -17.940 12.501 1.00 0.00 N ATOM 146 CA ARG A 8 -22.312 -17.368 11.863 1.00 0.00 C ATOM 147 C ARG A 8 -22.090 -15.921 12.333 1.00 0.00 C ATOM 148 O ARG A 8 -22.714 -15.004 11.832 1.00 0.00 O ATOM 149 CB ARG A 8 -22.594 -17.408 10.361 1.00 0.00 C ATOM 150 CG ARG A 8 -21.336 -16.998 9.593 1.00 0.00 C ATOM 151 CD ARG A 8 -21.424 -17.515 8.149 1.00 0.00 C ATOM 152 NE ARG A 8 -20.536 -16.622 7.320 1.00 0.00 N ATOM 153 CZ ARG A 8 -20.001 -17.049 6.185 1.00 0.00 C ATOM 154 NH1 ARG A 8 -20.251 -18.251 5.714 1.00 0.00 N ATOM 155 NH2 ARG A 8 -19.217 -16.255 5.502 1.00 0.00 N ATOM 0 H ARG A 8 -24.299 -17.277 12.649 1.00 0.00 H new ATOM 0 HA ARG A 8 -21.413 -17.925 12.125 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -22.903 -18.411 10.065 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -23.417 -16.736 10.117 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -21.233 -15.913 9.596 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -20.450 -17.404 10.082 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -21.096 -18.553 8.088 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -22.452 -17.484 7.788 1.00 0.00 H new ATOM 0 HE ARG A 8 -20.344 -15.672 7.638 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -20.870 -18.880 6.225 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -19.826 -18.554 4.838 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -19.021 -15.314 5.844 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -18.802 -16.577 4.628 1.00 0.00 H new ATOM 169 N SER A 9 -21.207 -15.705 13.287 1.00 0.00 N ATOM 170 CA SER A 9 -20.957 -14.315 13.776 1.00 0.00 C ATOM 171 C SER A 9 -19.479 -14.141 14.163 1.00 0.00 C ATOM 172 O SER A 9 -18.884 -15.026 14.750 1.00 0.00 O ATOM 173 CB SER A 9 -21.853 -14.160 15.004 1.00 0.00 C ATOM 174 OG SER A 9 -21.371 -14.998 16.046 1.00 0.00 O ATOM 0 H SER A 9 -20.654 -16.431 13.743 1.00 0.00 H new ATOM 0 HA SER A 9 -21.174 -13.566 13.014 1.00 0.00 H new ATOM 0 HB2 SER A 9 -21.863 -13.121 15.333 1.00 0.00 H new ATOM 0 HB3 SER A 9 -22.880 -14.425 14.755 1.00 0.00 H new ATOM 0 HG SER A 9 -20.482 -15.335 15.810 1.00 0.00 H new ATOM 180 N LYS A 10 -18.879 -13.011 13.843 1.00 0.00 N ATOM 181 CA LYS A 10 -17.444 -12.799 14.199 1.00 0.00 C ATOM 182 C LYS A 10 -17.231 -11.370 14.732 1.00 0.00 C ATOM 183 O LYS A 10 -16.669 -10.537 14.047 1.00 0.00 O ATOM 184 CB LYS A 10 -16.676 -13.012 12.892 1.00 0.00 C ATOM 185 CG LYS A 10 -15.324 -13.659 13.196 1.00 0.00 C ATOM 186 CD LYS A 10 -14.290 -13.201 12.163 1.00 0.00 C ATOM 187 CE LYS A 10 -14.193 -14.236 11.037 1.00 0.00 C ATOM 188 NZ LYS A 10 -12.735 -14.377 10.765 1.00 0.00 N ATOM 0 H LYS A 10 -19.324 -12.235 13.353 1.00 0.00 H new ATOM 0 HA LYS A 10 -17.107 -13.478 14.982 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -17.252 -13.647 12.218 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -16.529 -12.059 12.384 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -14.996 -13.386 14.199 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -15.417 -14.745 13.176 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -14.574 -12.231 11.755 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -13.318 -13.074 12.639 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -14.632 -15.187 11.337 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -14.730 -13.904 10.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -12.597 -14.832 9.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -12.291 -13.437 10.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -12.298 -14.961 11.506 1.00 0.00 H new ATOM 202 N PRO A 11 -17.686 -11.125 15.943 1.00 0.00 N ATOM 203 CA PRO A 11 -17.527 -9.778 16.547 1.00 0.00 C ATOM 204 C PRO A 11 -16.066 -9.538 16.953 1.00 0.00 C ATOM 205 O PRO A 11 -15.305 -10.473 17.122 1.00 0.00 O ATOM 206 CB PRO A 11 -18.430 -9.824 17.778 1.00 0.00 C ATOM 207 CG PRO A 11 -18.531 -11.273 18.131 1.00 0.00 C ATOM 208 CD PRO A 11 -18.380 -12.054 16.852 1.00 0.00 C ATOM 0 HA PRO A 11 -17.789 -8.972 15.862 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -18.007 -9.246 18.600 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -19.411 -9.401 17.563 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -17.755 -11.550 18.845 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.490 -11.488 18.602 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -17.803 -12.965 17.007 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -19.348 -12.354 16.452 1.00 0.00 H new ATOM 216 N ALA A 12 -15.671 -8.293 17.116 1.00 0.00 N ATOM 217 CA ALA A 12 -14.247 -8.011 17.521 1.00 0.00 C ATOM 218 C ALA A 12 -14.097 -8.188 19.042 1.00 0.00 C ATOM 219 O ALA A 12 -14.995 -7.846 19.787 1.00 0.00 O ATOM 220 CB ALA A 12 -13.952 -6.556 17.115 1.00 0.00 C ATOM 0 H ALA A 12 -16.261 -7.471 16.989 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.550 -8.695 17.036 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.928 -6.302 17.389 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.078 -6.446 16.038 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.641 -5.887 17.631 1.00 0.00 H new ATOM 226 N PRO A 13 -12.970 -8.723 19.466 1.00 0.00 N ATOM 227 CA PRO A 13 -12.740 -8.937 20.918 1.00 0.00 C ATOM 228 C PRO A 13 -12.505 -7.603 21.637 1.00 0.00 C ATOM 229 O PRO A 13 -12.205 -6.603 21.015 1.00 0.00 O ATOM 230 CB PRO A 13 -11.485 -9.806 20.962 1.00 0.00 C ATOM 231 CG PRO A 13 -10.770 -9.519 19.683 1.00 0.00 C ATOM 232 CD PRO A 13 -11.819 -9.169 18.661 1.00 0.00 C ATOM 0 HA PRO A 13 -13.592 -9.399 21.416 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.865 -9.560 21.824 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.740 -10.863 21.043 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.066 -8.696 19.811 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.192 -10.385 19.361 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.474 -8.383 17.989 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.075 -10.029 18.042 1.00 0.00 H new ATOM 240 N ASP A 14 -12.645 -7.582 22.950 1.00 0.00 N ATOM 241 CA ASP A 14 -12.429 -6.296 23.719 1.00 0.00 C ATOM 242 C ASP A 14 -11.107 -5.613 23.311 1.00 0.00 C ATOM 243 O ASP A 14 -11.008 -4.401 23.325 1.00 0.00 O ATOM 244 CB ASP A 14 -12.380 -6.678 25.206 1.00 0.00 C ATOM 245 CG ASP A 14 -13.804 -6.781 25.754 1.00 0.00 C ATOM 246 OD1 ASP A 14 -14.602 -7.479 25.149 1.00 0.00 O ATOM 247 OD2 ASP A 14 -14.074 -6.161 26.769 1.00 0.00 O ATOM 0 H ASP A 14 -12.897 -8.390 23.520 1.00 0.00 H new ATOM 0 HA ASP A 14 -13.232 -5.590 23.508 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -11.861 -7.628 25.331 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -11.817 -5.931 25.766 1.00 0.00 H new ATOM 252 N GLY A 15 -10.092 -6.374 22.944 1.00 0.00 N ATOM 253 CA GLY A 15 -8.790 -5.756 22.534 1.00 0.00 C ATOM 254 C GLY A 15 -9.016 -4.688 21.444 1.00 0.00 C ATOM 255 O GLY A 15 -8.318 -3.693 21.403 1.00 0.00 O ATOM 0 H GLY A 15 -10.114 -7.393 22.913 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -8.307 -5.303 23.400 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -8.116 -6.527 22.161 1.00 0.00 H new ATOM 259 N PHE A 16 -9.986 -4.876 20.564 1.00 0.00 N ATOM 260 CA PHE A 16 -10.232 -3.843 19.489 1.00 0.00 C ATOM 261 C PHE A 16 -10.452 -2.452 20.113 1.00 0.00 C ATOM 262 O PHE A 16 -10.087 -1.449 19.529 1.00 0.00 O ATOM 263 CB PHE A 16 -11.497 -4.282 18.730 1.00 0.00 C ATOM 264 CG PHE A 16 -11.724 -3.368 17.548 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.691 -3.134 16.629 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.970 -2.755 17.369 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.905 -2.289 15.535 1.00 0.00 C ATOM 268 CE2 PHE A 16 -13.183 -1.909 16.274 1.00 0.00 C ATOM 269 CZ PHE A 16 -12.150 -1.676 15.357 1.00 0.00 C ATOM 0 H PHE A 16 -10.607 -5.685 20.543 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.373 -3.773 18.821 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.390 -5.312 18.390 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.360 -4.254 19.395 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.730 -3.607 16.766 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.767 -2.935 18.076 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -10.109 -2.110 14.828 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -14.144 -1.436 16.136 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.315 -1.023 14.513 1.00 0.00 H new ATOM 279 N GLU A 17 -11.039 -2.377 21.294 1.00 0.00 N ATOM 280 CA GLU A 17 -11.264 -1.026 21.935 1.00 0.00 C ATOM 281 C GLU A 17 -9.938 -0.252 22.025 1.00 0.00 C ATOM 282 O GLU A 17 -9.904 0.948 21.829 1.00 0.00 O ATOM 283 CB GLU A 17 -11.816 -1.290 23.346 1.00 0.00 C ATOM 284 CG GLU A 17 -12.490 -0.022 23.875 1.00 0.00 C ATOM 285 CD GLU A 17 -13.425 -0.385 25.031 1.00 0.00 C ATOM 286 OE1 GLU A 17 -13.072 -1.267 25.797 1.00 0.00 O ATOM 287 OE2 GLU A 17 -14.477 0.224 25.129 1.00 0.00 O ATOM 0 H GLU A 17 -11.367 -3.177 21.835 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.959 -0.427 21.346 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.532 -2.112 23.320 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -11.009 -1.591 24.014 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -11.736 0.689 24.213 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -13.052 0.464 23.077 1.00 0.00 H new ATOM 294 N LYS A 18 -8.844 -0.930 22.311 1.00 0.00 N ATOM 295 CA LYS A 18 -7.520 -0.209 22.398 1.00 0.00 C ATOM 296 C LYS A 18 -7.218 0.505 21.069 1.00 0.00 C ATOM 297 O LYS A 18 -6.681 1.598 21.060 1.00 0.00 O ATOM 298 CB LYS A 18 -6.449 -1.277 22.680 1.00 0.00 C ATOM 299 CG LYS A 18 -6.537 -1.713 24.143 1.00 0.00 C ATOM 300 CD LYS A 18 -5.144 -2.096 24.647 1.00 0.00 C ATOM 301 CE LYS A 18 -5.091 -1.942 26.169 1.00 0.00 C ATOM 302 NZ LYS A 18 -4.517 -0.588 26.399 1.00 0.00 N ATOM 0 H LYS A 18 -8.807 -1.934 22.486 1.00 0.00 H new ATOM 0 HA LYS A 18 -7.537 0.545 23.185 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.595 -2.135 22.024 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -5.457 -0.878 22.467 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.945 -0.905 24.750 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -7.216 -2.560 24.241 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -4.914 -3.124 24.367 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.390 -1.462 24.180 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -6.084 -2.030 26.609 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -4.472 -2.716 26.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -4.449 -0.409 27.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -3.569 -0.536 25.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -5.131 0.128 25.962 1.00 0.00 H new ATOM 316 N ILE A 19 -7.566 -0.094 19.948 1.00 0.00 N ATOM 317 CA ILE A 19 -7.304 0.570 18.631 1.00 0.00 C ATOM 318 C ILE A 19 -8.634 0.883 17.912 1.00 0.00 C ATOM 319 O ILE A 19 -8.721 0.793 16.702 1.00 0.00 O ATOM 320 CB ILE A 19 -6.458 -0.431 17.821 1.00 0.00 C ATOM 321 CG1 ILE A 19 -7.241 -1.734 17.575 1.00 0.00 C ATOM 322 CG2 ILE A 19 -5.172 -0.756 18.591 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.997 -2.229 16.144 1.00 0.00 C ATOM 0 H ILE A 19 -8.017 -1.007 19.892 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.784 1.520 18.751 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.215 0.021 16.859 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.930 -2.496 18.290 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.306 -1.564 17.733 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.574 -1.464 18.018 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.600 0.159 18.747 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.427 -1.194 19.556 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.554 -3.151 15.978 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.330 -1.471 15.435 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.933 -2.417 16.001 1.00 0.00 H new ATOM 335 N LYS A 20 -9.674 1.234 18.646 1.00 0.00 N ATOM 336 CA LYS A 20 -10.997 1.530 17.982 1.00 0.00 C ATOM 337 C LYS A 20 -11.098 2.978 17.444 1.00 0.00 C ATOM 338 O LYS A 20 -11.608 3.170 16.358 1.00 0.00 O ATOM 339 CB LYS A 20 -12.078 1.288 19.049 1.00 0.00 C ATOM 340 CG LYS A 20 -13.460 1.306 18.389 1.00 0.00 C ATOM 341 CD LYS A 20 -14.064 2.707 18.508 1.00 0.00 C ATOM 342 CE LYS A 20 -14.910 3.006 17.268 1.00 0.00 C ATOM 343 NZ LYS A 20 -16.059 3.809 17.771 1.00 0.00 N ATOM 0 H LYS A 20 -9.666 1.328 19.662 1.00 0.00 H new ATOM 0 HA LYS A 20 -11.117 0.885 17.111 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.911 0.330 19.541 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -12.021 2.056 19.820 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.377 1.022 17.340 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -14.113 0.575 18.867 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.679 2.774 19.406 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.272 3.449 18.608 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -14.338 3.559 16.523 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -15.250 2.087 16.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.686 4.053 16.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -16.589 3.254 18.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.706 4.681 18.214 1.00 0.00 H new ATOM 357 N PRO A 21 -10.649 3.962 18.205 1.00 0.00 N ATOM 358 CA PRO A 21 -10.762 5.369 17.737 1.00 0.00 C ATOM 359 C PRO A 21 -9.709 5.697 16.665 1.00 0.00 C ATOM 360 O PRO A 21 -9.983 6.448 15.747 1.00 0.00 O ATOM 361 CB PRO A 21 -10.533 6.192 18.998 1.00 0.00 C ATOM 362 CG PRO A 21 -9.730 5.317 19.905 1.00 0.00 C ATOM 363 CD PRO A 21 -10.009 3.883 19.528 1.00 0.00 C ATOM 0 HA PRO A 21 -11.724 5.572 17.266 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -10.001 7.116 18.772 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -11.479 6.473 19.460 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -8.667 5.538 19.807 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.998 5.497 20.946 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.090 3.298 19.489 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.662 3.402 20.256 1.00 0.00 H new ATOM 371 N THR A 22 -8.511 5.153 16.762 1.00 0.00 N ATOM 372 CA THR A 22 -7.469 5.473 15.717 1.00 0.00 C ATOM 373 C THR A 22 -7.963 5.026 14.336 1.00 0.00 C ATOM 374 O THR A 22 -7.851 5.759 13.370 1.00 0.00 O ATOM 375 CB THR A 22 -6.190 4.709 16.101 1.00 0.00 C ATOM 376 OG1 THR A 22 -5.789 5.088 17.415 1.00 0.00 O ATOM 377 CG2 THR A 22 -5.073 5.052 15.111 1.00 0.00 C ATOM 0 H THR A 22 -8.213 4.516 17.500 1.00 0.00 H new ATOM 0 HA THR A 22 -7.275 6.545 15.673 1.00 0.00 H new ATOM 0 HB THR A 22 -6.385 3.637 16.073 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.975 4.601 17.662 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.167 4.511 15.383 1.00 0.00 H new ATOM 0 HG22 THR A 22 -5.378 4.766 14.105 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.878 6.124 15.140 1.00 0.00 H new ATOM 385 N LEU A 23 -8.518 3.838 14.232 1.00 0.00 N ATOM 386 CA LEU A 23 -9.026 3.374 12.893 1.00 0.00 C ATOM 387 C LEU A 23 -10.192 4.270 12.451 1.00 0.00 C ATOM 388 O LEU A 23 -10.300 4.619 11.291 1.00 0.00 O ATOM 389 CB LEU A 23 -9.495 1.923 13.071 1.00 0.00 C ATOM 390 CG LEU A 23 -8.272 1.015 13.223 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.610 -0.173 14.134 1.00 0.00 C ATOM 392 CD2 LEU A 23 -7.846 0.504 11.843 1.00 0.00 C ATOM 0 H LEU A 23 -8.641 3.179 15.000 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.251 3.431 12.129 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.136 1.840 13.949 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.089 1.612 12.212 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.456 1.582 13.671 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.734 -0.814 14.236 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.908 0.195 15.116 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.429 -0.745 13.697 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.975 -0.143 11.948 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.665 -0.059 11.395 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.595 1.350 11.203 1.00 0.00 H new ATOM 404 N THR A 24 -11.062 4.662 13.365 1.00 0.00 N ATOM 405 CA THR A 24 -12.207 5.558 12.965 1.00 0.00 C ATOM 406 C THR A 24 -11.667 6.860 12.346 1.00 0.00 C ATOM 407 O THR A 24 -12.256 7.400 11.427 1.00 0.00 O ATOM 408 CB THR A 24 -13.001 5.871 14.250 1.00 0.00 C ATOM 409 OG1 THR A 24 -13.287 4.660 14.959 1.00 0.00 O ATOM 410 CG2 THR A 24 -14.305 6.592 13.884 1.00 0.00 C ATOM 0 H THR A 24 -11.030 4.406 14.352 1.00 0.00 H new ATOM 0 HA THR A 24 -12.842 5.074 12.223 1.00 0.00 H new ATOM 0 HB THR A 24 -12.404 6.517 14.894 1.00 0.00 H new ATOM 0 HG1 THR A 24 -12.580 4.491 15.616 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.866 6.813 14.792 1.00 0.00 H new ATOM 0 HG22 THR A 24 -14.073 7.522 13.365 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.904 5.954 13.234 1.00 0.00 H new ATOM 418 N ASP A 25 -10.549 7.370 12.832 1.00 0.00 N ATOM 419 CA ASP A 25 -9.986 8.640 12.243 1.00 0.00 C ATOM 420 C ASP A 25 -9.757 8.474 10.729 1.00 0.00 C ATOM 421 O ASP A 25 -9.945 9.405 9.970 1.00 0.00 O ATOM 422 CB ASP A 25 -8.645 8.901 12.953 1.00 0.00 C ATOM 423 CG ASP A 25 -8.060 10.229 12.469 1.00 0.00 C ATOM 424 OD1 ASP A 25 -8.775 11.216 12.502 1.00 0.00 O ATOM 425 OD2 ASP A 25 -6.905 10.236 12.073 1.00 0.00 O ATOM 0 H ASP A 25 -10.010 6.969 13.599 1.00 0.00 H new ATOM 0 HA ASP A 25 -10.676 9.472 12.383 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.793 8.929 14.033 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.948 8.088 12.747 1.00 0.00 H new ATOM 430 N PHE A 26 -9.355 7.299 10.280 1.00 0.00 N ATOM 431 CA PHE A 26 -9.123 7.101 8.801 1.00 0.00 C ATOM 432 C PHE A 26 -10.396 7.438 8.007 1.00 0.00 C ATOM 433 O PHE A 26 -10.321 7.973 6.916 1.00 0.00 O ATOM 434 CB PHE A 26 -8.764 5.621 8.603 1.00 0.00 C ATOM 435 CG PHE A 26 -7.271 5.448 8.712 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.672 5.314 9.971 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.485 5.424 7.556 1.00 0.00 C ATOM 438 CE1 PHE A 26 -5.285 5.155 10.071 1.00 0.00 C ATOM 439 CE2 PHE A 26 -5.098 5.264 7.656 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.499 5.130 8.914 1.00 0.00 C ATOM 0 H PHE A 26 -9.180 6.480 10.862 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.326 7.754 8.445 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.267 5.010 9.352 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -9.110 5.279 7.628 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.280 5.333 10.864 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.948 5.529 6.586 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.822 5.052 11.041 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.491 5.244 6.763 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.429 5.007 8.992 1.00 0.00 H new ATOM 450 N GLU A 27 -11.566 7.128 8.535 1.00 0.00 N ATOM 451 CA GLU A 27 -12.832 7.440 7.776 1.00 0.00 C ATOM 452 C GLU A 27 -12.917 8.942 7.466 1.00 0.00 C ATOM 453 O GLU A 27 -13.345 9.329 6.394 1.00 0.00 O ATOM 454 CB GLU A 27 -14.006 7.020 8.675 1.00 0.00 C ATOM 455 CG GLU A 27 -14.167 5.499 8.628 1.00 0.00 C ATOM 456 CD GLU A 27 -15.089 5.118 7.469 1.00 0.00 C ATOM 457 OE1 GLU A 27 -16.220 5.578 7.461 1.00 0.00 O ATOM 458 OE2 GLU A 27 -14.649 4.374 6.609 1.00 0.00 O ATOM 0 H GLU A 27 -11.699 6.681 9.442 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.853 6.906 6.826 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.828 7.346 9.700 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.924 7.504 8.342 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -13.194 5.024 8.504 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -14.581 5.137 9.569 1.00 0.00 H new ATOM 465 N ILE A 28 -12.506 9.793 8.384 1.00 0.00 N ATOM 466 CA ILE A 28 -12.571 11.272 8.101 1.00 0.00 C ATOM 467 C ILE A 28 -11.591 11.609 6.960 1.00 0.00 C ATOM 468 O ILE A 28 -11.913 12.383 6.078 1.00 0.00 O ATOM 469 CB ILE A 28 -12.202 12.002 9.416 1.00 0.00 C ATOM 470 CG1 ILE A 28 -13.360 11.857 10.414 1.00 0.00 C ATOM 471 CG2 ILE A 28 -11.966 13.497 9.150 1.00 0.00 C ATOM 472 CD1 ILE A 28 -13.076 10.701 11.373 1.00 0.00 C ATOM 0 H ILE A 28 -12.135 9.536 9.299 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.564 11.587 7.780 1.00 0.00 H new ATOM 0 HB ILE A 28 -11.291 11.560 9.820 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -13.487 12.783 10.974 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -14.293 11.677 9.879 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -11.708 13.996 10.084 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -11.150 13.615 8.437 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.873 13.941 8.740 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.901 10.603 12.079 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -12.971 9.776 10.807 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -12.153 10.899 11.919 1.00 0.00 H new ATOM 484 N GLN A 29 -10.408 11.025 6.956 1.00 0.00 N ATOM 485 CA GLN A 29 -9.443 11.323 5.839 1.00 0.00 C ATOM 486 C GLN A 29 -9.985 10.713 4.541 1.00 0.00 C ATOM 487 O GLN A 29 -10.027 11.368 3.515 1.00 0.00 O ATOM 488 CB GLN A 29 -8.101 10.677 6.218 1.00 0.00 C ATOM 489 CG GLN A 29 -6.958 11.447 5.553 1.00 0.00 C ATOM 490 CD GLN A 29 -6.610 12.679 6.398 1.00 0.00 C ATOM 491 OE1 GLN A 29 -5.961 12.559 7.419 1.00 0.00 O ATOM 492 NE2 GLN A 29 -7.015 13.867 6.021 1.00 0.00 N ATOM 0 H GLN A 29 -10.074 10.369 7.662 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.315 12.395 5.689 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.976 10.682 7.301 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -8.085 9.634 5.900 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.084 10.804 5.451 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.248 11.753 4.548 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -7.560 13.972 5.165 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.785 14.686 6.583 1.00 0.00 H new ATOM 501 N LEU A 30 -10.426 9.470 4.577 1.00 0.00 N ATOM 502 CA LEU A 30 -10.993 8.847 3.325 1.00 0.00 C ATOM 503 C LEU A 30 -12.233 9.642 2.880 1.00 0.00 C ATOM 504 O LEU A 30 -12.461 9.824 1.701 1.00 0.00 O ATOM 505 CB LEU A 30 -11.389 7.398 3.672 1.00 0.00 C ATOM 506 CG LEU A 30 -10.983 6.473 2.526 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.465 6.287 2.536 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.666 5.114 2.699 1.00 0.00 C ATOM 0 H LEU A 30 -10.419 8.869 5.401 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.265 8.858 2.514 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.901 7.087 4.595 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.464 7.334 3.843 1.00 0.00 H new ATOM 0 HG LEU A 30 -11.289 6.914 1.577 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.174 5.627 1.719 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.979 7.255 2.412 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -9.159 5.846 3.485 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.376 4.454 1.881 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -11.361 4.672 3.647 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.748 5.247 2.692 1.00 0.00 H new ATOM 520 N ARG A 31 -13.036 10.125 3.815 1.00 0.00 N ATOM 521 CA ARG A 31 -14.257 10.915 3.416 1.00 0.00 C ATOM 522 C ARG A 31 -13.853 12.122 2.554 1.00 0.00 C ATOM 523 O ARG A 31 -14.560 12.483 1.631 1.00 0.00 O ATOM 524 CB ARG A 31 -14.914 11.407 4.719 1.00 0.00 C ATOM 525 CG ARG A 31 -15.717 10.272 5.359 1.00 0.00 C ATOM 526 CD ARG A 31 -15.827 10.508 6.873 1.00 0.00 C ATOM 527 NE ARG A 31 -17.290 10.429 7.174 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.946 9.282 7.104 1.00 0.00 C ATOM 529 NH1 ARG A 31 -17.339 8.165 6.770 1.00 0.00 N ATOM 530 NH2 ARG A 31 -19.226 9.252 7.372 1.00 0.00 N ATOM 0 H ARG A 31 -12.901 10.008 4.819 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.942 10.299 2.833 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.149 11.759 5.412 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.568 12.254 4.510 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.711 10.222 4.915 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -15.232 9.315 5.164 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.269 9.756 7.431 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -15.419 11.480 7.151 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.792 11.276 7.439 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.341 8.170 6.558 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -17.866 7.293 6.723 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.713 10.110 7.633 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.737 8.371 7.320 1.00 0.00 H new ATOM 544 N ASP A 32 -12.727 12.753 2.838 1.00 0.00 N ATOM 545 CA ASP A 32 -12.317 13.939 2.004 1.00 0.00 C ATOM 546 C ASP A 32 -12.081 13.491 0.560 1.00 0.00 C ATOM 547 O ASP A 32 -12.641 14.057 -0.360 1.00 0.00 O ATOM 548 CB ASP A 32 -11.021 14.494 2.615 1.00 0.00 C ATOM 549 CG ASP A 32 -11.323 15.106 3.984 1.00 0.00 C ATOM 550 OD1 ASP A 32 -12.122 16.027 4.037 1.00 0.00 O ATOM 551 OD2 ASP A 32 -10.750 14.644 4.957 1.00 0.00 O ATOM 0 H ASP A 32 -12.088 12.504 3.594 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.091 14.706 1.996 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.284 13.697 2.716 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -10.589 15.247 1.956 1.00 0.00 H new ATOM 556 N ALA A 33 -11.278 12.469 0.347 1.00 0.00 N ATOM 557 CA ALA A 33 -11.055 11.997 -1.064 1.00 0.00 C ATOM 558 C ALA A 33 -12.353 11.363 -1.579 1.00 0.00 C ATOM 559 O ALA A 33 -12.757 11.593 -2.703 1.00 0.00 O ATOM 560 CB ALA A 33 -9.934 10.949 -1.022 1.00 0.00 C ATOM 0 H ALA A 33 -10.778 11.952 1.070 1.00 0.00 H new ATOM 0 HA ALA A 33 -10.777 12.818 -1.725 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.742 10.581 -2.030 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.027 11.402 -0.622 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.236 10.118 -0.384 1.00 0.00 H new ATOM 566 N GLN A 34 -13.022 10.575 -0.758 1.00 0.00 N ATOM 567 CA GLN A 34 -14.306 9.946 -1.220 1.00 0.00 C ATOM 568 C GLN A 34 -15.340 11.035 -1.568 1.00 0.00 C ATOM 569 O GLN A 34 -16.145 10.857 -2.463 1.00 0.00 O ATOM 570 CB GLN A 34 -14.823 9.081 -0.058 1.00 0.00 C ATOM 571 CG GLN A 34 -14.189 7.691 -0.134 1.00 0.00 C ATOM 572 CD GLN A 34 -14.521 6.907 1.141 1.00 0.00 C ATOM 573 OE1 GLN A 34 -14.412 7.433 2.231 1.00 0.00 O ATOM 574 NE2 GLN A 34 -14.924 5.662 1.058 1.00 0.00 N ATOM 0 H GLN A 34 -12.739 10.345 0.195 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.143 9.345 -2.115 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.580 9.551 0.895 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.909 9.000 -0.106 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -14.561 7.157 -1.009 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -13.109 7.778 -0.249 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -15.017 5.216 0.145 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.144 5.140 1.906 1.00 0.00 H new ATOM 583 N LYS A 35 -15.333 12.163 -0.874 1.00 0.00 N ATOM 584 CA LYS A 35 -16.333 13.242 -1.194 1.00 0.00 C ATOM 585 C LYS A 35 -15.746 14.276 -2.175 1.00 0.00 C ATOM 586 O LYS A 35 -16.475 14.878 -2.942 1.00 0.00 O ATOM 587 CB LYS A 35 -16.680 13.914 0.141 1.00 0.00 C ATOM 588 CG LYS A 35 -17.578 12.985 0.962 1.00 0.00 C ATOM 589 CD LYS A 35 -19.045 13.340 0.709 1.00 0.00 C ATOM 590 CE LYS A 35 -19.921 12.689 1.782 1.00 0.00 C ATOM 591 NZ LYS A 35 -21.316 13.065 1.419 1.00 0.00 N ATOM 0 H LYS A 35 -14.688 12.377 -0.113 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.215 12.820 -1.675 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -15.769 14.139 0.695 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.187 14.862 -0.038 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -17.392 11.946 0.689 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.347 13.082 2.023 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.176 14.422 0.725 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -19.348 12.997 -0.280 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -19.794 11.607 1.792 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -19.661 13.050 2.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -21.977 12.655 2.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -21.409 14.101 1.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -21.538 12.702 0.470 1.00 0.00 H new ATOM 605 N ASP A 36 -14.444 14.497 -2.166 1.00 0.00 N ATOM 606 CA ASP A 36 -13.844 15.509 -3.117 1.00 0.00 C ATOM 607 C ASP A 36 -14.255 15.195 -4.567 1.00 0.00 C ATOM 608 O ASP A 36 -14.477 16.094 -5.356 1.00 0.00 O ATOM 609 CB ASP A 36 -12.318 15.404 -2.971 1.00 0.00 C ATOM 610 CG ASP A 36 -11.836 16.402 -1.917 1.00 0.00 C ATOM 611 OD1 ASP A 36 -12.148 17.573 -2.052 1.00 0.00 O ATOM 612 OD2 ASP A 36 -11.163 15.977 -0.992 1.00 0.00 O ATOM 0 H ASP A 36 -13.778 14.029 -1.552 1.00 0.00 H new ATOM 0 HA ASP A 36 -14.196 16.514 -2.884 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.039 14.391 -2.682 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -11.836 15.607 -3.927 1.00 0.00 H new ATOM 617 N LYS A 37 -14.358 13.928 -4.929 1.00 0.00 N ATOM 618 CA LYS A 37 -14.759 13.584 -6.346 1.00 0.00 C ATOM 619 C LYS A 37 -16.090 14.268 -6.709 1.00 0.00 C ATOM 620 O LYS A 37 -16.263 14.734 -7.819 1.00 0.00 O ATOM 621 CB LYS A 37 -14.923 12.057 -6.399 1.00 0.00 C ATOM 622 CG LYS A 37 -14.861 11.588 -7.854 1.00 0.00 C ATOM 623 CD LYS A 37 -13.411 11.278 -8.231 1.00 0.00 C ATOM 624 CE LYS A 37 -13.347 10.823 -9.691 1.00 0.00 C ATOM 625 NZ LYS A 37 -12.054 11.354 -10.202 1.00 0.00 N ATOM 0 H LYS A 37 -14.186 13.130 -4.318 1.00 0.00 H new ATOM 0 HA LYS A 37 -14.007 13.927 -7.056 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.137 11.576 -5.817 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -15.874 11.767 -5.952 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -15.480 10.701 -7.988 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -15.262 12.358 -8.513 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.790 12.162 -8.087 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -13.013 10.500 -7.579 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -13.386 9.736 -9.768 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.188 11.213 -10.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -11.705 10.741 -10.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -12.195 12.317 -10.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -11.358 11.375 -9.430 1.00 0.00 H new ATOM 639 N SER A 38 -17.029 14.334 -5.787 1.00 0.00 N ATOM 640 CA SER A 38 -18.337 14.989 -6.094 1.00 0.00 C ATOM 641 C SER A 38 -18.545 16.212 -5.185 1.00 0.00 C ATOM 642 O SER A 38 -19.633 16.433 -4.685 1.00 0.00 O ATOM 643 CB SER A 38 -19.391 13.922 -5.807 1.00 0.00 C ATOM 644 OG SER A 38 -19.648 13.184 -6.994 1.00 0.00 O ATOM 0 H SER A 38 -16.942 13.963 -4.841 1.00 0.00 H new ATOM 0 HA SER A 38 -18.389 15.346 -7.123 1.00 0.00 H new ATOM 0 HB2 SER A 38 -19.044 13.255 -5.018 1.00 0.00 H new ATOM 0 HB3 SER A 38 -20.309 14.388 -5.449 1.00 0.00 H new ATOM 0 HG SER A 38 -20.323 12.497 -6.812 1.00 0.00 H new ATOM 650 N SER A 39 -17.517 17.006 -4.964 1.00 0.00 N ATOM 651 CA SER A 39 -17.672 18.206 -4.087 1.00 0.00 C ATOM 652 C SER A 39 -17.253 19.478 -4.842 1.00 0.00 C ATOM 653 O SER A 39 -18.038 20.396 -4.992 1.00 0.00 O ATOM 654 CB SER A 39 -16.739 17.953 -2.904 1.00 0.00 C ATOM 655 OG SER A 39 -17.493 17.450 -1.810 1.00 0.00 O ATOM 0 H SER A 39 -16.584 16.871 -5.353 1.00 0.00 H new ATOM 0 HA SER A 39 -18.704 18.354 -3.769 1.00 0.00 H new ATOM 0 HB2 SER A 39 -15.963 17.240 -3.184 1.00 0.00 H new ATOM 0 HB3 SER A 39 -16.235 18.877 -2.619 1.00 0.00 H new ATOM 0 HG SER A 39 -17.419 16.473 -1.784 1.00 0.00 H new ATOM 661 N LYS A 40 -16.026 19.544 -5.319 1.00 0.00 N ATOM 662 CA LYS A 40 -15.579 20.771 -6.064 1.00 0.00 C ATOM 663 C LYS A 40 -15.676 20.543 -7.582 1.00 0.00 C ATOM 664 O LYS A 40 -16.089 21.422 -8.314 1.00 0.00 O ATOM 665 CB LYS A 40 -14.123 21.008 -5.648 1.00 0.00 C ATOM 666 CG LYS A 40 -13.796 22.499 -5.760 1.00 0.00 C ATOM 667 CD LYS A 40 -12.527 22.805 -4.963 1.00 0.00 C ATOM 668 CE LYS A 40 -12.336 24.322 -4.868 1.00 0.00 C ATOM 669 NZ LYS A 40 -10.864 24.518 -4.772 1.00 0.00 N ATOM 0 H LYS A 40 -15.323 18.811 -5.226 1.00 0.00 H new ATOM 0 HA LYS A 40 -16.206 21.632 -5.830 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -13.966 20.666 -4.625 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -13.453 20.429 -6.284 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -13.657 22.774 -6.806 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -14.628 23.094 -5.382 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -12.599 22.374 -3.965 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -11.663 22.349 -5.446 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -12.745 24.827 -5.743 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -12.847 24.731 -3.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -10.653 25.534 -4.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -10.503 24.032 -3.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.406 24.125 -5.619 1.00 0.00 H new ATOM 683 N LEU A 41 -15.298 19.373 -8.069 1.00 0.00 N ATOM 684 CA LEU A 41 -15.372 19.101 -9.544 1.00 0.00 C ATOM 685 C LEU A 41 -14.615 20.185 -10.334 1.00 0.00 C ATOM 686 O LEU A 41 -15.219 21.003 -11.002 1.00 0.00 O ATOM 687 CB LEU A 41 -16.864 19.121 -9.890 1.00 0.00 C ATOM 688 CG LEU A 41 -17.109 18.289 -11.150 1.00 0.00 C ATOM 689 CD1 LEU A 41 -18.610 18.057 -11.326 1.00 0.00 C ATOM 690 CD2 LEU A 41 -16.564 19.039 -12.369 1.00 0.00 C ATOM 0 H LEU A 41 -14.943 18.600 -7.506 1.00 0.00 H new ATOM 0 HA LEU A 41 -14.912 18.147 -9.803 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -17.446 18.722 -9.059 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -17.197 20.147 -10.049 1.00 0.00 H new ATOM 0 HG LEU A 41 -16.602 17.329 -11.055 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -18.784 17.464 -12.224 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -19.000 17.525 -10.459 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -19.118 19.017 -11.421 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -16.738 18.447 -13.268 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -17.072 19.999 -12.463 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -15.494 19.205 -12.245 1.00 0.00 H new ATOM 702 N ALA A 42 -13.299 20.197 -10.265 1.00 0.00 N ATOM 703 CA ALA A 42 -12.520 21.229 -11.016 1.00 0.00 C ATOM 704 C ALA A 42 -11.198 20.631 -11.525 1.00 0.00 C ATOM 705 O ALA A 42 -10.991 20.509 -12.717 1.00 0.00 O ATOM 706 CB ALA A 42 -12.252 22.338 -9.998 1.00 0.00 C ATOM 0 H ALA A 42 -12.739 19.539 -9.723 1.00 0.00 H new ATOM 0 HA ALA A 42 -13.057 21.598 -11.890 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -11.682 23.137 -10.472 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -13.200 22.735 -9.634 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -11.683 21.934 -9.161 1.00 0.00 H new ATOM 712 N ALA A 43 -10.300 20.259 -10.634 1.00 0.00 N ATOM 713 CA ALA A 43 -8.998 19.674 -11.083 1.00 0.00 C ATOM 714 C ALA A 43 -8.469 18.672 -10.043 1.00 0.00 C ATOM 715 O ALA A 43 -9.109 18.420 -9.040 1.00 0.00 O ATOM 716 CB ALA A 43 -8.050 20.869 -11.206 1.00 0.00 C ATOM 0 H ALA A 43 -10.416 20.336 -9.624 1.00 0.00 H new ATOM 0 HA ALA A 43 -9.096 19.129 -12.022 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.069 20.523 -11.532 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.447 21.575 -11.935 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.958 21.361 -10.238 1.00 0.00 H new ATOM 722 N LYS A 44 -7.300 18.098 -10.268 1.00 0.00 N ATOM 723 CA LYS A 44 -6.731 17.113 -9.289 1.00 0.00 C ATOM 724 C LYS A 44 -7.746 16.000 -8.975 1.00 0.00 C ATOM 725 O LYS A 44 -8.474 16.081 -8.002 1.00 0.00 O ATOM 726 CB LYS A 44 -6.420 17.927 -8.030 1.00 0.00 C ATOM 727 CG LYS A 44 -5.614 17.069 -7.052 1.00 0.00 C ATOM 728 CD LYS A 44 -4.755 17.972 -6.163 1.00 0.00 C ATOM 729 CE LYS A 44 -3.346 18.086 -6.752 1.00 0.00 C ATOM 730 NZ LYS A 44 -3.325 19.403 -7.448 1.00 0.00 N ATOM 0 H LYS A 44 -6.719 18.272 -11.088 1.00 0.00 H new ATOM 0 HA LYS A 44 -5.844 16.620 -9.686 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -5.857 18.823 -8.293 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.346 18.259 -7.561 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -6.287 16.471 -6.438 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -4.980 16.373 -7.601 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -5.208 18.960 -6.086 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -4.706 17.564 -5.153 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.587 18.040 -5.971 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -3.141 17.270 -7.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -2.381 19.829 -7.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -3.548 19.267 -8.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.032 20.034 -7.019 1.00 0.00 H new ATOM 744 N SER A 45 -7.801 14.961 -9.784 1.00 0.00 N ATOM 745 CA SER A 45 -8.768 13.854 -9.516 1.00 0.00 C ATOM 746 C SER A 45 -8.013 12.558 -9.198 1.00 0.00 C ATOM 747 O SER A 45 -8.201 11.972 -8.148 1.00 0.00 O ATOM 748 CB SER A 45 -9.577 13.706 -10.805 1.00 0.00 C ATOM 749 OG SER A 45 -10.509 14.774 -10.899 1.00 0.00 O ATOM 0 H SER A 45 -7.219 14.837 -10.612 1.00 0.00 H new ATOM 0 HA SER A 45 -9.409 14.065 -8.660 1.00 0.00 H new ATOM 0 HB2 SER A 45 -8.912 13.712 -11.668 1.00 0.00 H new ATOM 0 HB3 SER A 45 -10.100 12.750 -10.812 1.00 0.00 H new ATOM 0 HG SER A 45 -11.028 14.683 -11.725 1.00 0.00 H new ATOM 755 N ASN A 46 -7.153 12.106 -10.088 1.00 0.00 N ATOM 756 CA ASN A 46 -6.382 10.838 -9.806 1.00 0.00 C ATOM 757 C ASN A 46 -5.601 10.986 -8.488 1.00 0.00 C ATOM 758 O ASN A 46 -5.521 10.057 -7.707 1.00 0.00 O ATOM 759 CB ASN A 46 -5.407 10.640 -10.978 1.00 0.00 C ATOM 760 CG ASN A 46 -6.123 9.907 -12.120 1.00 0.00 C ATOM 761 OD1 ASN A 46 -6.247 10.437 -13.206 1.00 0.00 O ATOM 762 ND2 ASN A 46 -6.603 8.702 -11.926 1.00 0.00 N ATOM 0 H ASN A 46 -6.952 12.550 -10.984 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.051 9.983 -9.708 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.038 11.605 -11.326 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.540 10.067 -10.651 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -7.078 8.214 -12.685 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -6.501 8.253 -11.016 1.00 0.00 H new ATOM 769 N GLU A 47 -5.036 12.151 -8.227 1.00 0.00 N ATOM 770 CA GLU A 47 -4.275 12.338 -6.939 1.00 0.00 C ATOM 771 C GLU A 47 -5.197 12.068 -5.734 1.00 0.00 C ATOM 772 O GLU A 47 -4.760 11.540 -4.728 1.00 0.00 O ATOM 773 CB GLU A 47 -3.792 13.797 -6.916 1.00 0.00 C ATOM 774 CG GLU A 47 -2.763 14.013 -8.028 1.00 0.00 C ATOM 775 CD GLU A 47 -1.741 15.058 -7.582 1.00 0.00 C ATOM 776 OE1 GLU A 47 -1.274 14.961 -6.459 1.00 0.00 O ATOM 777 OE2 GLU A 47 -1.441 15.938 -8.372 1.00 0.00 O ATOM 0 H GLU A 47 -5.068 12.967 -8.839 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.435 11.646 -6.878 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.636 14.473 -7.051 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.350 14.029 -5.947 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.261 13.074 -8.260 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.261 14.342 -8.940 1.00 0.00 H new ATOM 784 N GLN A 48 -6.472 12.417 -5.822 1.00 0.00 N ATOM 785 CA GLN A 48 -7.399 12.158 -4.658 1.00 0.00 C ATOM 786 C GLN A 48 -7.418 10.654 -4.339 1.00 0.00 C ATOM 787 O GLN A 48 -7.310 10.262 -3.191 1.00 0.00 O ATOM 788 CB GLN A 48 -8.798 12.635 -5.096 1.00 0.00 C ATOM 789 CG GLN A 48 -9.830 12.342 -4.004 1.00 0.00 C ATOM 790 CD GLN A 48 -10.669 11.121 -4.406 1.00 0.00 C ATOM 791 OE1 GLN A 48 -10.305 10.000 -4.110 1.00 0.00 O ATOM 792 NE2 GLN A 48 -11.781 11.285 -5.080 1.00 0.00 N ATOM 0 H GLN A 48 -6.902 12.861 -6.633 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.075 12.685 -3.760 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.775 13.704 -5.306 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.086 12.135 -6.021 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.328 12.155 -3.055 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -10.476 13.208 -3.857 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -12.091 12.224 -5.331 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -12.336 10.474 -5.353 1.00 0.00 H new ATOM 801 N LEU A 49 -7.547 9.809 -5.342 1.00 0.00 N ATOM 802 CA LEU A 49 -7.558 8.327 -5.062 1.00 0.00 C ATOM 803 C LEU A 49 -6.212 7.898 -4.467 1.00 0.00 C ATOM 804 O LEU A 49 -6.163 7.064 -3.583 1.00 0.00 O ATOM 805 CB LEU A 49 -7.788 7.616 -6.402 1.00 0.00 C ATOM 806 CG LEU A 49 -9.199 7.926 -6.915 1.00 0.00 C ATOM 807 CD1 LEU A 49 -9.398 7.273 -8.284 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.239 7.373 -5.932 1.00 0.00 C ATOM 0 H LEU A 49 -7.643 10.072 -6.323 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.341 8.072 -4.348 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.046 7.943 -7.130 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.663 6.540 -6.280 1.00 0.00 H new ATOM 0 HG LEU A 49 -9.322 9.006 -7.003 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -10.401 7.493 -8.650 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -8.662 7.666 -8.985 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.273 6.194 -8.194 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.241 7.595 -6.299 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.116 6.294 -5.842 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.100 7.837 -4.956 1.00 0.00 H new ATOM 820 N TRP A 50 -5.113 8.466 -4.933 1.00 0.00 N ATOM 821 CA TRP A 50 -3.777 8.073 -4.357 1.00 0.00 C ATOM 822 C TRP A 50 -3.764 8.370 -2.845 1.00 0.00 C ATOM 823 O TRP A 50 -3.178 7.634 -2.074 1.00 0.00 O ATOM 824 CB TRP A 50 -2.696 8.900 -5.097 1.00 0.00 C ATOM 825 CG TRP A 50 -2.777 8.689 -6.595 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.548 7.765 -7.233 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.073 9.415 -7.647 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.356 7.883 -8.597 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.461 8.882 -8.900 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.144 10.472 -7.640 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -1.952 9.379 -10.096 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -0.628 10.973 -8.848 1.00 0.00 C ATOM 833 CH2 TRP A 50 -1.034 10.423 -10.073 1.00 0.00 C ATOM 0 H TRP A 50 -5.083 9.169 -5.671 1.00 0.00 H new ATOM 0 HA TRP A 50 -3.583 7.008 -4.488 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -2.824 9.958 -4.868 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -1.707 8.614 -4.739 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.204 7.055 -6.751 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -3.821 7.300 -9.293 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -0.826 10.901 -6.701 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.269 8.956 -11.038 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 0.084 11.785 -8.833 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -0.634 10.810 -10.998 1.00 0.00 H new ATOM 844 N GLU A 51 -4.432 9.417 -2.401 1.00 0.00 N ATOM 845 CA GLU A 51 -4.461 9.690 -0.923 1.00 0.00 C ATOM 846 C GLU A 51 -5.270 8.587 -0.217 1.00 0.00 C ATOM 847 O GLU A 51 -4.956 8.214 0.899 1.00 0.00 O ATOM 848 CB GLU A 51 -5.134 11.058 -0.730 1.00 0.00 C ATOM 849 CG GLU A 51 -4.297 12.140 -1.414 1.00 0.00 C ATOM 850 CD GLU A 51 -4.416 13.449 -0.630 1.00 0.00 C ATOM 851 OE1 GLU A 51 -3.678 13.612 0.328 1.00 0.00 O ATOM 852 OE2 GLU A 51 -5.241 14.267 -1.003 1.00 0.00 O ATOM 0 H GLU A 51 -4.946 10.079 -2.983 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.457 9.698 -0.499 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.140 11.042 -1.149 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.235 11.279 0.333 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.254 11.829 -1.467 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -4.638 12.285 -2.439 1.00 0.00 H new ATOM 859 N ILE A 52 -6.299 8.046 -0.854 1.00 0.00 N ATOM 860 CA ILE A 52 -7.088 6.955 -0.184 1.00 0.00 C ATOM 861 C ILE A 52 -6.242 5.675 -0.122 1.00 0.00 C ATOM 862 O ILE A 52 -6.054 5.117 0.943 1.00 0.00 O ATOM 863 CB ILE A 52 -8.369 6.737 -1.015 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.166 8.057 -1.042 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.209 5.616 -0.373 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.596 7.839 -1.570 1.00 0.00 C ATOM 0 H ILE A 52 -6.617 8.309 -1.787 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.353 7.225 0.838 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.118 6.444 -2.034 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.208 8.479 -0.038 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.651 8.782 -1.672 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.115 5.460 -0.958 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.628 4.694 -0.350 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.479 5.900 0.644 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.130 8.789 -1.576 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.553 7.441 -2.584 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.118 7.133 -0.925 1.00 0.00 H new ATOM 878 N MET A 53 -5.712 5.204 -1.240 1.00 0.00 N ATOM 879 CA MET A 53 -4.865 3.956 -1.173 1.00 0.00 C ATOM 880 C MET A 53 -3.658 4.195 -0.240 1.00 0.00 C ATOM 881 O MET A 53 -3.220 3.287 0.441 1.00 0.00 O ATOM 882 CB MET A 53 -4.398 3.611 -2.607 1.00 0.00 C ATOM 883 CG MET A 53 -3.540 4.734 -3.185 1.00 0.00 C ATOM 884 SD MET A 53 -1.804 4.458 -2.764 1.00 0.00 S ATOM 885 CE MET A 53 -1.176 5.964 -3.527 1.00 0.00 C ATOM 0 H MET A 53 -5.824 5.615 -2.167 1.00 0.00 H new ATOM 0 HA MET A 53 -5.439 3.122 -0.769 1.00 0.00 H new ATOM 0 HB2 MET A 53 -3.828 2.682 -2.595 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.265 3.445 -3.246 1.00 0.00 H new ATOM 0 HG2 MET A 53 -3.659 4.774 -4.268 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.870 5.695 -2.792 1.00 0.00 H new ATOM 0 HE1 MET A 53 -0.093 5.895 -3.632 1.00 0.00 H new ATOM 0 HE2 MET A 53 -1.629 6.090 -4.511 1.00 0.00 H new ATOM 0 HE3 MET A 53 -1.426 6.821 -2.901 1.00 0.00 H new ATOM 895 N GLN A 54 -3.124 5.409 -0.183 1.00 0.00 N ATOM 896 CA GLN A 54 -1.958 5.662 0.738 1.00 0.00 C ATOM 897 C GLN A 54 -2.385 5.395 2.188 1.00 0.00 C ATOM 898 O GLN A 54 -1.635 4.831 2.962 1.00 0.00 O ATOM 899 CB GLN A 54 -1.559 7.140 0.568 1.00 0.00 C ATOM 900 CG GLN A 54 -0.507 7.269 -0.542 1.00 0.00 C ATOM 901 CD GLN A 54 0.871 7.538 0.076 1.00 0.00 C ATOM 902 OE1 GLN A 54 1.592 6.613 0.397 1.00 0.00 O ATOM 903 NE2 GLN A 54 1.277 8.771 0.260 1.00 0.00 N ATOM 0 H GLN A 54 -3.440 6.215 -0.723 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.119 5.008 0.502 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.437 7.737 0.321 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.162 7.529 1.505 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -0.477 6.355 -1.135 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.777 8.080 -1.219 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.676 9.551 -0.007 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.193 8.950 0.670 1.00 0.00 H new ATOM 912 N LEU A 55 -3.592 5.781 2.564 1.00 0.00 N ATOM 913 CA LEU A 55 -4.056 5.521 3.977 1.00 0.00 C ATOM 914 C LEU A 55 -3.919 4.024 4.312 1.00 0.00 C ATOM 915 O LEU A 55 -3.619 3.664 5.435 1.00 0.00 O ATOM 916 CB LEU A 55 -5.535 5.941 4.042 1.00 0.00 C ATOM 917 CG LEU A 55 -5.633 7.449 4.281 1.00 0.00 C ATOM 918 CD1 LEU A 55 -7.059 7.923 3.985 1.00 0.00 C ATOM 919 CD2 LEU A 55 -5.290 7.759 5.741 1.00 0.00 C ATOM 0 H LEU A 55 -4.266 6.257 1.964 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.456 6.080 4.695 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.039 5.677 3.112 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -6.041 5.402 4.843 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.933 7.965 3.624 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.128 8.997 4.156 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.307 7.704 2.947 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.758 7.406 4.642 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.360 8.833 5.911 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.990 7.242 6.397 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.276 7.423 5.956 1.00 0.00 H new ATOM 931 N HIS A 56 -4.127 3.142 3.346 1.00 0.00 N ATOM 932 CA HIS A 56 -3.991 1.671 3.637 1.00 0.00 C ATOM 933 C HIS A 56 -2.572 1.369 4.152 1.00 0.00 C ATOM 934 O HIS A 56 -2.399 0.577 5.059 1.00 0.00 O ATOM 935 CB HIS A 56 -4.245 0.936 2.313 1.00 0.00 C ATOM 936 CG HIS A 56 -4.774 -0.441 2.597 1.00 0.00 C ATOM 937 ND1 HIS A 56 -6.132 -0.715 2.643 1.00 0.00 N ATOM 938 CD2 HIS A 56 -4.143 -1.631 2.856 1.00 0.00 C ATOM 939 CE1 HIS A 56 -6.273 -2.024 2.921 1.00 0.00 C ATOM 940 NE2 HIS A 56 -5.091 -2.630 3.060 1.00 0.00 N ATOM 0 H HIS A 56 -4.381 3.376 2.386 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.698 1.350 4.402 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -4.959 1.493 1.707 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.321 0.871 1.738 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.887 -0.046 2.493 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -3.073 -1.772 2.896 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.225 -2.523 3.020 1.00 0.00 H new ATOM 948 N HIS A 57 -1.553 2.003 3.595 1.00 0.00 N ATOM 949 CA HIS A 57 -0.152 1.740 4.091 1.00 0.00 C ATOM 950 C HIS A 57 -0.069 2.110 5.578 1.00 0.00 C ATOM 951 O HIS A 57 0.414 1.340 6.386 1.00 0.00 O ATOM 952 CB HIS A 57 0.793 2.640 3.274 1.00 0.00 C ATOM 953 CG HIS A 57 1.258 1.914 2.040 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.322 2.368 1.275 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.814 0.770 1.425 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.481 1.509 0.250 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.588 0.516 0.296 1.00 0.00 N ATOM 0 H HIS A 57 -1.628 2.678 2.834 1.00 0.00 H new ATOM 0 HA HIS A 57 0.121 0.691 3.976 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.280 3.560 2.993 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.651 2.927 3.882 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.010 0.160 1.765 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.237 1.610 -0.515 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.494 -0.262 -0.357 1.00 0.00 H new ATOM 965 N GLN A 58 -0.553 3.279 5.949 1.00 0.00 N ATOM 966 CA GLN A 58 -0.511 3.673 7.402 1.00 0.00 C ATOM 967 C GLN A 58 -1.347 2.679 8.225 1.00 0.00 C ATOM 968 O GLN A 58 -0.968 2.313 9.322 1.00 0.00 O ATOM 969 CB GLN A 58 -1.114 5.084 7.499 1.00 0.00 C ATOM 970 CG GLN A 58 -0.726 5.714 8.839 1.00 0.00 C ATOM 971 CD GLN A 58 0.527 6.579 8.654 1.00 0.00 C ATOM 972 OE1 GLN A 58 1.623 6.141 8.937 1.00 0.00 O ATOM 973 NE2 GLN A 58 0.416 7.800 8.186 1.00 0.00 N ATOM 0 H GLN A 58 -0.969 3.967 5.321 1.00 0.00 H new ATOM 0 HA GLN A 58 0.508 3.663 7.789 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.754 5.702 6.677 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.199 5.034 7.409 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.547 6.322 9.219 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.537 4.935 9.578 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -0.503 8.173 7.947 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.248 8.376 8.062 1.00 0.00 H new ATOM 982 N ARG A 59 -2.476 2.229 7.704 1.00 0.00 N ATOM 983 CA ARG A 59 -3.311 1.244 8.483 1.00 0.00 C ATOM 984 C ARG A 59 -2.499 -0.035 8.728 1.00 0.00 C ATOM 985 O ARG A 59 -2.480 -0.554 9.829 1.00 0.00 O ATOM 986 CB ARG A 59 -4.559 0.930 7.636 1.00 0.00 C ATOM 987 CG ARG A 59 -5.779 0.804 8.552 1.00 0.00 C ATOM 988 CD ARG A 59 -6.299 2.199 8.912 1.00 0.00 C ATOM 989 NE ARG A 59 -7.785 2.101 8.780 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.365 1.982 7.595 1.00 0.00 C ATOM 991 NH1 ARG A 59 -7.659 1.949 6.487 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.667 1.896 7.519 1.00 0.00 N ATOM 0 H ARG A 59 -2.848 2.495 6.792 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.602 1.654 9.450 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.722 1.720 6.902 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.411 0.004 7.080 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.561 0.230 8.055 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.511 0.260 9.458 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -6.010 2.479 9.925 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.892 2.957 8.243 1.00 0.00 H new ATOM 0 HE ARG A 59 -8.364 2.126 9.619 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -6.642 2.016 6.528 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -8.128 1.857 5.586 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -10.230 1.921 8.369 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.120 1.804 6.610 1.00 0.00 H new ATOM 1006 N SER A 60 -1.809 -0.544 7.721 1.00 0.00 N ATOM 1007 CA SER A 60 -0.989 -1.785 7.943 1.00 0.00 C ATOM 1008 C SER A 60 0.158 -1.464 8.909 1.00 0.00 C ATOM 1009 O SER A 60 0.473 -2.252 9.777 1.00 0.00 O ATOM 1010 CB SER A 60 -0.435 -2.210 6.575 1.00 0.00 C ATOM 1011 OG SER A 60 0.623 -1.336 6.205 1.00 0.00 O ATOM 0 H SER A 60 -1.780 -0.161 6.776 1.00 0.00 H new ATOM 0 HA SER A 60 -1.586 -2.588 8.376 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.075 -3.238 6.619 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.225 -2.181 5.825 1.00 0.00 H new ATOM 0 HG SER A 60 0.317 -0.407 6.269 1.00 0.00 H new ATOM 1017 N ARG A 61 0.779 -0.305 8.781 1.00 0.00 N ATOM 1018 CA ARG A 61 1.895 0.045 9.729 1.00 0.00 C ATOM 1019 C ARG A 61 1.338 0.133 11.159 1.00 0.00 C ATOM 1020 O ARG A 61 1.966 -0.316 12.096 1.00 0.00 O ATOM 1021 CB ARG A 61 2.446 1.410 9.288 1.00 0.00 C ATOM 1022 CG ARG A 61 3.791 1.663 9.973 1.00 0.00 C ATOM 1023 CD ARG A 61 4.458 2.891 9.349 1.00 0.00 C ATOM 1024 NE ARG A 61 5.695 3.111 10.159 1.00 0.00 N ATOM 1025 CZ ARG A 61 5.634 3.609 11.386 1.00 0.00 C ATOM 1026 NH1 ARG A 61 4.487 3.931 11.938 1.00 0.00 N ATOM 1027 NH2 ARG A 61 6.737 3.784 12.067 1.00 0.00 N ATOM 0 H ARG A 61 0.566 0.400 8.075 1.00 0.00 H new ATOM 0 HA ARG A 61 2.682 -0.709 9.715 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.567 1.432 8.205 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.740 2.200 9.546 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.643 1.820 11.042 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.436 0.791 9.865 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.698 2.720 8.300 1.00 0.00 H new ATOM 0 HD3 ARG A 61 3.801 3.760 9.388 1.00 0.00 H new ATOM 0 HE ARG A 61 6.603 2.873 9.760 1.00 0.00 H new ATOM 0 HH11 ARG A 61 3.618 3.800 11.421 1.00 0.00 H new ATOM 0 HH12 ARG A 61 4.465 4.313 12.884 1.00 0.00 H new ATOM 0 HH21 ARG A 61 7.636 3.538 11.653 1.00 0.00 H new ATOM 0 HH22 ARG A 61 6.698 4.167 13.012 1.00 0.00 H new ATOM 1041 N TYR A 62 0.157 0.699 11.336 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.422 0.793 12.725 1.00 0.00 C ATOM 1043 C TYR A 62 -0.640 -0.623 13.284 1.00 0.00 C ATOM 1044 O TYR A 62 -0.206 -0.933 14.379 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.767 1.533 12.591 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.440 1.633 13.942 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -3.202 0.561 14.422 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -2.302 2.793 14.713 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.826 0.649 15.670 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.926 2.881 15.963 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.688 1.808 16.441 1.00 0.00 C ATOM 1052 OH TYR A 62 -4.303 1.894 17.674 1.00 0.00 O ATOM 0 H TYR A 62 -0.421 1.093 10.593 1.00 0.00 H new ATOM 0 HA TYR A 62 0.244 1.324 13.406 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.604 2.530 12.182 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.414 1.004 11.891 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.308 -0.335 13.828 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.714 3.620 14.344 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.415 -0.178 16.039 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.820 3.776 16.558 1.00 0.00 H new ATOM 0 HH TYR A 62 -4.105 2.765 18.078 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.294 -1.490 12.536 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.512 -2.888 13.049 1.00 0.00 C ATOM 1064 C ILE A 63 -0.170 -3.644 13.055 1.00 0.00 C ATOM 1065 O ILE A 63 0.106 -4.407 13.963 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.523 -3.559 12.100 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.857 -2.805 12.179 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.740 -5.015 12.520 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.852 -3.396 11.176 1.00 0.00 C ATOM 0 H ILE A 63 -1.679 -1.296 11.612 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.897 -2.891 14.069 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.139 -3.533 11.080 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.263 -2.871 13.189 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.700 -1.747 11.968 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.456 -5.485 11.846 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.792 -5.552 12.475 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.127 -5.046 13.539 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.796 -2.855 11.239 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.449 -3.306 10.167 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.020 -4.448 11.407 1.00 0.00 H new ATOM 1081 N TYR A 64 0.674 -3.427 12.067 1.00 0.00 N ATOM 1082 CA TYR A 64 2.002 -4.133 12.063 1.00 0.00 C ATOM 1083 C TYR A 64 2.844 -3.620 13.239 1.00 0.00 C ATOM 1084 O TYR A 64 3.500 -4.387 13.917 1.00 0.00 O ATOM 1085 CB TYR A 64 2.690 -3.788 10.732 1.00 0.00 C ATOM 1086 CG TYR A 64 3.860 -4.715 10.514 1.00 0.00 C ATOM 1087 CD1 TYR A 64 5.002 -4.612 11.318 1.00 0.00 C ATOM 1088 CD2 TYR A 64 3.800 -5.684 9.507 1.00 0.00 C ATOM 1089 CE1 TYR A 64 6.083 -5.477 11.113 1.00 0.00 C ATOM 1090 CE2 TYR A 64 4.880 -6.549 9.302 1.00 0.00 C ATOM 1091 CZ TYR A 64 6.022 -6.446 10.105 1.00 0.00 C ATOM 1092 OH TYR A 64 7.087 -7.300 9.903 1.00 0.00 O ATOM 0 H TYR A 64 0.506 -2.804 11.277 1.00 0.00 H new ATOM 0 HA TYR A 64 1.883 -5.212 12.164 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.981 -3.881 9.909 1.00 0.00 H new ATOM 0 HB3 TYR A 64 3.030 -2.753 10.744 1.00 0.00 H new ATOM 0 HD1 TYR A 64 5.049 -3.865 12.096 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.919 -5.764 8.887 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.964 -5.397 11.732 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.833 -7.297 8.524 1.00 0.00 H new ATOM 0 HH TYR A 64 6.881 -7.912 9.166 1.00 0.00 H new ATOM 1102 N THR A 65 2.830 -2.327 13.494 1.00 0.00 N ATOM 1103 CA THR A 65 3.644 -1.792 14.642 1.00 0.00 C ATOM 1104 C THR A 65 3.170 -2.418 15.962 1.00 0.00 C ATOM 1105 O THR A 65 3.976 -2.759 16.807 1.00 0.00 O ATOM 1106 CB THR A 65 3.434 -0.267 14.672 1.00 0.00 C ATOM 1107 OG1 THR A 65 3.834 0.288 13.427 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.274 0.351 15.793 1.00 0.00 C ATOM 0 H THR A 65 2.301 -1.631 12.969 1.00 0.00 H new ATOM 0 HA THR A 65 4.699 -2.036 14.517 1.00 0.00 H new ATOM 0 HB THR A 65 2.380 -0.053 14.850 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.066 0.314 12.819 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.121 1.430 15.809 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.971 -0.073 16.750 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.328 0.136 15.618 1.00 0.00 H new ATOM 1116 N LEU A 66 1.874 -2.555 16.166 1.00 0.00 N ATOM 1117 CA LEU A 66 1.396 -3.144 17.465 1.00 0.00 C ATOM 1118 C LEU A 66 1.414 -4.692 17.462 1.00 0.00 C ATOM 1119 O LEU A 66 1.682 -5.297 18.483 1.00 0.00 O ATOM 1120 CB LEU A 66 -0.023 -2.584 17.719 1.00 0.00 C ATOM 1121 CG LEU A 66 -1.048 -3.182 16.743 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.563 -4.523 17.283 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -2.223 -2.205 16.588 1.00 0.00 C ATOM 0 H LEU A 66 1.143 -2.291 15.506 1.00 0.00 H new ATOM 0 HA LEU A 66 2.072 -2.861 18.271 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.324 -2.803 18.743 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -0.011 -1.499 17.616 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.575 -3.347 15.775 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.289 -4.941 16.586 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.728 -5.215 17.396 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.038 -4.367 18.252 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.955 -2.623 15.897 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.692 -2.043 17.559 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.857 -1.255 16.199 1.00 0.00 H new ATOM 1135 N TYR A 67 1.120 -5.344 16.351 1.00 0.00 N ATOM 1136 CA TYR A 67 1.118 -6.858 16.358 1.00 0.00 C ATOM 1137 C TYR A 67 2.519 -7.440 16.080 1.00 0.00 C ATOM 1138 O TYR A 67 2.850 -8.496 16.586 1.00 0.00 O ATOM 1139 CB TYR A 67 0.124 -7.308 15.268 1.00 0.00 C ATOM 1140 CG TYR A 67 0.037 -8.825 15.256 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.999 -9.572 14.564 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -0.994 -9.482 15.944 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.930 -10.971 14.559 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.062 -10.883 15.940 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.099 -11.626 15.245 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.164 -13.004 15.240 1.00 0.00 O ATOM 0 H TYR A 67 0.886 -4.908 15.459 1.00 0.00 H new ATOM 0 HA TYR A 67 0.825 -7.223 17.342 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.860 -6.878 15.458 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.448 -6.944 14.293 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.794 -9.069 14.034 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.737 -8.908 16.478 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.672 -11.545 14.025 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.855 -11.388 16.472 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.938 -13.297 15.765 1.00 0.00 H new ATOM 1156 N TYR A 68 3.331 -6.797 15.266 1.00 0.00 N ATOM 1157 CA TYR A 68 4.686 -7.382 14.963 1.00 0.00 C ATOM 1158 C TYR A 68 5.823 -6.765 15.812 1.00 0.00 C ATOM 1159 O TYR A 68 6.955 -7.202 15.706 1.00 0.00 O ATOM 1160 CB TYR A 68 4.928 -7.130 13.466 1.00 0.00 C ATOM 1161 CG TYR A 68 4.397 -8.296 12.662 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.855 -9.592 12.930 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.446 -8.085 11.651 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.366 -10.676 12.191 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.959 -9.171 10.913 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.418 -10.465 11.183 1.00 0.00 C ATOM 1167 OH TYR A 68 2.937 -11.534 10.454 1.00 0.00 O ATOM 0 H TYR A 68 3.122 -5.911 14.806 1.00 0.00 H new ATOM 0 HA TYR A 68 4.694 -8.443 15.213 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.435 -6.208 13.158 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.993 -7.000 13.277 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.586 -9.756 13.708 1.00 0.00 H new ATOM 0 HD2 TYR A 68 3.091 -7.087 11.443 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.720 -11.675 12.399 1.00 0.00 H new ATOM 0 HE2 TYR A 68 2.228 -9.010 10.134 1.00 0.00 H new ATOM 0 HH TYR A 68 2.286 -11.214 9.795 1.00 0.00 H new ATOM 1177 N LYS A 69 5.564 -5.774 16.650 1.00 0.00 N ATOM 1178 CA LYS A 69 6.678 -5.193 17.470 1.00 0.00 C ATOM 1179 C LYS A 69 6.236 -4.969 18.927 1.00 0.00 C ATOM 1180 O LYS A 69 6.846 -5.492 19.842 1.00 0.00 O ATOM 1181 CB LYS A 69 7.026 -3.861 16.803 1.00 0.00 C ATOM 1182 CG LYS A 69 7.671 -4.117 15.433 1.00 0.00 C ATOM 1183 CD LYS A 69 6.729 -3.641 14.324 1.00 0.00 C ATOM 1184 CE LYS A 69 7.102 -2.213 13.916 1.00 0.00 C ATOM 1185 NZ LYS A 69 6.538 -2.042 12.548 1.00 0.00 N ATOM 0 H LYS A 69 4.646 -5.354 16.796 1.00 0.00 H new ATOM 0 HA LYS A 69 7.535 -5.865 17.508 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.126 -3.257 16.684 1.00 0.00 H new ATOM 0 HB3 LYS A 69 7.709 -3.294 17.436 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.624 -3.592 15.365 1.00 0.00 H new ATOM 0 HG3 LYS A 69 7.883 -5.179 15.313 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.798 -4.306 13.463 1.00 0.00 H new ATOM 0 HD3 LYS A 69 5.696 -3.674 14.671 1.00 0.00 H new ATOM 0 HE2 LYS A 69 6.684 -1.483 14.609 1.00 0.00 H new ATOM 0 HE3 LYS A 69 8.183 -2.072 13.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 7.136 -1.386 12.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 6.509 -2.963 12.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 5.574 -1.657 12.615 1.00 0.00 H new ATOM 1199 N ARG A 70 5.190 -4.200 19.161 1.00 0.00 N ATOM 1200 CA ARG A 70 4.744 -3.968 20.585 1.00 0.00 C ATOM 1201 C ARG A 70 4.156 -5.257 21.189 1.00 0.00 C ATOM 1202 O ARG A 70 4.211 -5.456 22.388 1.00 0.00 O ATOM 1203 CB ARG A 70 3.667 -2.872 20.549 1.00 0.00 C ATOM 1204 CG ARG A 70 4.229 -1.618 19.877 1.00 0.00 C ATOM 1205 CD ARG A 70 3.604 -0.373 20.514 1.00 0.00 C ATOM 1206 NE ARG A 70 4.456 -0.082 21.707 1.00 0.00 N ATOM 1207 CZ ARG A 70 5.658 0.460 21.578 1.00 0.00 C ATOM 1208 NH1 ARG A 70 6.152 0.759 20.399 1.00 0.00 N ATOM 1209 NH2 ARG A 70 6.374 0.704 22.646 1.00 0.00 N ATOM 0 H ARG A 70 4.635 -3.731 18.445 1.00 0.00 H new ATOM 0 HA ARG A 70 5.591 -3.669 21.203 1.00 0.00 H new ATOM 0 HB2 ARG A 70 2.792 -3.227 20.005 1.00 0.00 H new ATOM 0 HB3 ARG A 70 3.339 -2.638 21.562 1.00 0.00 H new ATOM 0 HG2 ARG A 70 5.313 -1.589 19.985 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.016 -1.639 18.808 1.00 0.00 H new ATOM 0 HD2 ARG A 70 3.599 0.466 19.818 1.00 0.00 H new ATOM 0 HD3 ARG A 70 2.569 -0.554 20.803 1.00 0.00 H new ATOM 0 HE ARG A 70 4.105 -0.305 22.638 1.00 0.00 H new ATOM 0 HH11 ARG A 70 5.608 0.575 19.556 1.00 0.00 H new ATOM 0 HH12 ARG A 70 7.080 1.176 20.326 1.00 0.00 H new ATOM 0 HH21 ARG A 70 6.006 0.477 23.570 1.00 0.00 H new ATOM 0 HH22 ARG A 70 7.300 1.121 22.555 1.00 0.00 H new ATOM 1223 N LYS A 71 3.583 -6.136 20.382 1.00 0.00 N ATOM 1224 CA LYS A 71 2.988 -7.399 20.928 1.00 0.00 C ATOM 1225 C LYS A 71 1.873 -7.064 21.928 1.00 0.00 C ATOM 1226 O LYS A 71 1.784 -7.658 22.986 1.00 0.00 O ATOM 1227 CB LYS A 71 4.133 -8.152 21.621 1.00 0.00 C ATOM 1228 CG LYS A 71 3.759 -9.629 21.763 1.00 0.00 C ATOM 1229 CD LYS A 71 5.027 -10.485 21.702 1.00 0.00 C ATOM 1230 CE LYS A 71 4.697 -11.843 21.079 1.00 0.00 C ATOM 1231 NZ LYS A 71 4.649 -11.593 19.612 1.00 0.00 N ATOM 0 H LYS A 71 3.505 -6.027 19.371 1.00 0.00 H new ATOM 0 HA LYS A 71 2.544 -8.008 20.140 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.051 -8.052 21.042 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.326 -7.719 22.602 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.241 -9.795 22.707 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.073 -9.919 20.968 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.792 -9.979 21.113 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.435 -10.622 22.704 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.455 -12.586 21.328 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.744 -12.224 21.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 3.803 -12.046 19.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 4.611 -10.569 19.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 5.500 -11.990 19.164 1.00 0.00 H new ATOM 1245 N ALA A 72 1.009 -6.128 21.593 1.00 0.00 N ATOM 1246 CA ALA A 72 -0.110 -5.773 22.518 1.00 0.00 C ATOM 1247 C ALA A 72 -1.454 -6.192 21.896 1.00 0.00 C ATOM 1248 O ALA A 72 -2.453 -5.516 22.058 1.00 0.00 O ATOM 1249 CB ALA A 72 -0.040 -4.253 22.673 1.00 0.00 C ATOM 0 H ALA A 72 1.034 -5.599 20.721 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.028 -6.278 23.480 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.834 -3.918 23.341 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.927 -3.974 23.091 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.163 -3.782 21.698 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.489 -7.303 21.182 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.771 -7.755 20.552 1.00 0.00 C ATOM 1257 C ILE A 73 -2.734 -9.276 20.312 1.00 0.00 C ATOM 1258 O ILE A 73 -1.674 -9.875 20.322 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.851 -6.988 19.222 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -4.135 -7.375 18.479 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.638 -7.322 18.346 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.288 -6.508 17.227 1.00 0.00 C ATOM 0 H ILE A 73 -0.687 -7.909 21.012 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.639 -7.559 21.182 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.857 -5.919 19.433 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.103 -8.429 18.202 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.998 -7.244 19.132 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.705 -6.773 17.407 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.724 -7.038 18.867 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.621 -8.392 18.140 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.202 -6.786 16.701 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.340 -5.458 17.516 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.431 -6.662 16.571 1.00 0.00 H new ATOM 1274 N SER A 74 -3.868 -9.906 20.095 1.00 0.00 N ATOM 1275 CA SER A 74 -3.860 -11.382 19.855 1.00 0.00 C ATOM 1276 C SER A 74 -4.202 -11.680 18.387 1.00 0.00 C ATOM 1277 O SER A 74 -4.965 -10.963 17.771 1.00 0.00 O ATOM 1278 CB SER A 74 -4.935 -11.951 20.784 1.00 0.00 C ATOM 1279 OG SER A 74 -6.208 -11.824 20.165 1.00 0.00 O ATOM 0 H SER A 74 -4.787 -9.465 20.074 1.00 0.00 H new ATOM 0 HA SER A 74 -2.883 -11.824 20.052 1.00 0.00 H new ATOM 0 HB2 SER A 74 -4.727 -12.999 21.001 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.927 -11.421 21.736 1.00 0.00 H new ATOM 0 HG SER A 74 -6.898 -12.189 20.758 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.638 -12.735 17.818 1.00 0.00 N ATOM 1286 CA LYS A 75 -3.931 -13.080 16.372 1.00 0.00 C ATOM 1287 C LYS A 75 -5.443 -13.005 16.064 1.00 0.00 C ATOM 1288 O LYS A 75 -5.826 -12.662 14.964 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.434 -14.518 16.159 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.332 -14.806 14.659 1.00 0.00 C ATOM 1291 CD LYS A 75 -2.741 -16.201 14.445 1.00 0.00 C ATOM 1292 CE LYS A 75 -2.299 -16.352 12.988 1.00 0.00 C ATOM 1293 NZ LYS A 75 -2.658 -17.750 12.620 1.00 0.00 N ATOM 0 H LYS A 75 -2.992 -13.368 18.288 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.435 -12.371 15.710 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.462 -14.652 16.633 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.118 -15.224 16.630 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.318 -14.743 14.198 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.705 -14.056 14.176 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.892 -16.353 15.111 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.481 -16.962 14.692 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.805 -15.632 12.345 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.228 -16.178 12.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.385 -17.930 11.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.156 -18.413 13.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.684 -17.884 12.726 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.304 -13.310 17.019 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.782 -13.228 16.733 1.00 0.00 C ATOM 1309 C ASP A 76 -8.150 -11.781 16.380 1.00 0.00 C ATOM 1310 O ASP A 76 -8.774 -11.531 15.365 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.514 -13.671 18.010 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.339 -15.179 18.202 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -8.730 -15.918 17.314 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -7.819 -15.567 19.235 1.00 0.00 O ATOM 0 H ASP A 76 -6.054 -13.606 17.963 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.062 -13.865 15.894 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.118 -13.136 18.873 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.573 -13.423 17.939 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.752 -10.820 17.193 1.00 0.00 N ATOM 1320 CA LEU A 77 -8.078 -9.390 16.856 1.00 0.00 C ATOM 1321 C LEU A 77 -7.306 -9.002 15.588 1.00 0.00 C ATOM 1322 O LEU A 77 -7.852 -8.398 14.685 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.626 -8.524 18.046 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.927 -7.049 17.754 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.439 -6.817 17.797 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -7.240 -6.160 18.801 1.00 0.00 C ATOM 0 H LEU A 77 -7.227 -10.960 18.056 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.144 -9.248 16.677 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -8.142 -8.838 18.954 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.559 -8.660 18.223 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.548 -6.795 16.764 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.652 -5.768 17.589 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.924 -7.441 17.047 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.819 -7.076 18.785 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.457 -5.113 18.588 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.612 -6.413 19.794 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.163 -6.321 18.765 1.00 0.00 H new ATOM 1338 N TYR A 78 -6.038 -9.360 15.506 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.245 -9.017 14.273 1.00 0.00 C ATOM 1340 C TYR A 78 -5.894 -9.679 13.041 1.00 0.00 C ATOM 1341 O TYR A 78 -5.966 -9.081 11.982 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.816 -9.554 14.505 1.00 0.00 C ATOM 1343 CG TYR A 78 -2.956 -9.326 13.277 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -2.962 -8.082 12.632 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.150 -10.360 12.788 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.165 -7.875 11.501 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.352 -10.153 11.657 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.359 -8.910 11.014 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.572 -8.705 9.899 1.00 0.00 O ATOM 0 H TYR A 78 -5.526 -9.867 16.228 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.221 -7.943 14.091 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.370 -9.056 15.366 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.854 -10.618 14.737 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.583 -7.282 13.008 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.144 -11.319 13.284 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.172 -6.916 11.004 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.731 -10.952 11.281 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.074 -9.524 9.695 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.389 -10.898 13.171 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.050 -11.559 11.990 1.00 0.00 C ATOM 1361 C ASP A 79 -8.418 -10.904 11.751 1.00 0.00 C ATOM 1362 O ASP A 79 -8.790 -10.634 10.624 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.221 -13.043 12.348 1.00 0.00 C ATOM 1364 CG ASP A 79 -7.811 -13.792 11.152 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -8.944 -13.506 10.800 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -7.121 -14.638 10.607 1.00 0.00 O ATOM 0 H ASP A 79 -6.364 -11.453 14.027 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.456 -11.453 11.082 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.259 -13.475 12.622 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -7.875 -13.146 13.214 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.167 -10.628 12.804 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.511 -9.966 12.615 1.00 0.00 C ATOM 1373 C TRP A 80 -10.333 -8.630 11.871 1.00 0.00 C ATOM 1374 O TRP A 80 -11.148 -8.272 11.041 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.079 -9.722 14.025 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.449 -9.128 13.928 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.585 -9.826 13.704 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.846 -7.731 14.055 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.653 -8.948 13.682 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.249 -7.644 13.895 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -12.133 -6.542 14.291 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.919 -6.423 13.964 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.804 -5.310 14.362 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -14.195 -5.251 14.198 1.00 0.00 C ATOM 0 H TRP A 80 -8.912 -10.828 13.771 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.184 -10.588 12.025 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.119 -10.661 14.578 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.422 -9.053 14.580 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.648 -10.895 13.565 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.621 -9.229 13.527 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -11.061 -6.576 14.419 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.991 -6.383 13.837 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -12.245 -4.404 14.544 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.706 -4.301 14.252 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.271 -7.897 12.147 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.061 -6.595 11.423 1.00 0.00 C ATOM 1397 C LEU A 81 -8.726 -6.890 9.953 1.00 0.00 C ATOM 1398 O LEU A 81 -9.304 -6.309 9.054 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.877 -5.888 12.104 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.227 -5.572 13.561 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.953 -5.194 14.316 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -9.207 -4.401 13.608 1.00 0.00 C ATOM 0 H LEU A 81 -8.553 -8.139 12.830 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.952 -5.967 11.457 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.991 -6.522 12.063 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.636 -4.968 11.571 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.683 -6.447 14.024 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -7.198 -4.968 15.354 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.250 -6.026 14.282 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.501 -4.318 13.851 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.456 -4.176 14.645 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.750 -3.525 13.147 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -10.115 -4.665 13.066 1.00 0.00 H new ATOM 1414 N ILE A 82 -7.806 -7.803 9.699 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.456 -8.134 8.266 1.00 0.00 C ATOM 1416 C ILE A 82 -8.728 -8.564 7.497 1.00 0.00 C ATOM 1417 O ILE A 82 -8.837 -8.329 6.308 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.426 -9.291 8.315 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.107 -8.793 8.938 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.148 -9.823 6.900 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.507 -7.661 8.093 1.00 0.00 C ATOM 0 H ILE A 82 -7.290 -8.326 10.407 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.039 -7.270 7.749 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.839 -10.095 8.924 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.288 -8.440 9.953 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.397 -9.617 9.009 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.423 -10.635 6.953 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.075 -10.192 6.462 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -5.749 -9.019 6.281 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.576 -7.322 8.548 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.307 -8.026 7.086 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.211 -6.830 8.045 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.689 -9.191 8.156 1.00 0.00 N ATOM 1434 CA LYS A 83 -10.936 -9.620 7.428 1.00 0.00 C ATOM 1435 C LYS A 83 -12.023 -8.520 7.436 1.00 0.00 C ATOM 1436 O LYS A 83 -12.954 -8.583 6.654 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.446 -10.872 8.155 1.00 0.00 C ATOM 1438 CG LYS A 83 -12.110 -11.812 7.147 1.00 0.00 C ATOM 1439 CD LYS A 83 -12.140 -13.233 7.716 1.00 0.00 C ATOM 1440 CE LYS A 83 -10.712 -13.777 7.805 1.00 0.00 C ATOM 1441 NZ LYS A 83 -10.836 -15.230 7.501 1.00 0.00 N ATOM 0 H LYS A 83 -9.663 -9.420 9.150 1.00 0.00 H new ATOM 0 HA LYS A 83 -10.710 -9.817 6.380 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.619 -11.379 8.652 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.159 -10.590 8.930 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -13.124 -11.474 6.931 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.562 -11.798 6.205 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.602 -13.231 8.703 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.747 -13.878 7.081 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -10.054 -13.279 7.093 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -10.289 -13.615 8.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -9.897 -15.675 7.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -11.463 -15.679 8.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -11.235 -15.353 6.549 1.00 0.00 H new ATOM 1455 N GLU A 84 -11.933 -7.519 8.296 1.00 0.00 N ATOM 1456 CA GLU A 84 -12.994 -6.450 8.305 1.00 0.00 C ATOM 1457 C GLU A 84 -12.505 -5.137 7.649 1.00 0.00 C ATOM 1458 O GLU A 84 -13.042 -4.081 7.919 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.306 -6.209 9.775 1.00 0.00 C ATOM 1460 CG GLU A 84 -13.926 -7.459 10.390 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.283 -7.736 9.741 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.271 -7.218 10.235 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.312 -8.461 8.761 1.00 0.00 O ATOM 0 H GLU A 84 -11.185 -7.399 8.979 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.865 -6.768 7.732 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.394 -5.945 10.310 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.990 -5.367 9.876 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.263 -8.313 10.248 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.047 -7.325 11.465 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.499 -5.194 6.789 1.00 0.00 N ATOM 1471 CA LYS A 85 -10.960 -3.970 6.084 1.00 0.00 C ATOM 1472 C LYS A 85 -10.099 -3.107 7.014 1.00 0.00 C ATOM 1473 O LYS A 85 -10.487 -2.024 7.407 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.163 -3.173 5.547 1.00 0.00 C ATOM 1475 CG LYS A 85 -11.707 -2.276 4.394 1.00 0.00 C ATOM 1476 CD LYS A 85 -11.376 -3.138 3.176 1.00 0.00 C ATOM 1477 CE LYS A 85 -11.737 -2.377 1.897 1.00 0.00 C ATOM 1478 NZ LYS A 85 -10.641 -2.695 0.938 1.00 0.00 N ATOM 0 H LYS A 85 -11.019 -6.059 6.542 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.309 -4.276 5.265 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -12.941 -3.855 5.205 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.597 -2.568 6.343 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -12.491 -1.561 4.144 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -10.832 -1.699 4.693 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -10.316 -3.391 3.174 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -11.928 -4.077 3.221 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -12.705 -2.693 1.509 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -11.802 -1.305 2.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -10.817 -2.209 0.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -9.732 -2.376 1.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -10.607 -3.722 0.777 1.00 0.00 H new ATOM 1492 N TYR A 86 -8.916 -3.579 7.356 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.010 -2.795 8.242 1.00 0.00 C ATOM 1494 C TYR A 86 -6.594 -2.813 7.651 1.00 0.00 C ATOM 1495 O TYR A 86 -6.058 -1.790 7.273 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.033 -3.522 9.586 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.323 -3.226 10.307 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.529 -3.791 9.867 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.308 -2.386 11.427 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.718 -3.509 10.556 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.495 -2.109 12.112 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.699 -2.670 11.677 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.871 -2.394 12.351 1.00 0.00 O ATOM 0 H TYR A 86 -8.545 -4.480 7.053 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.318 -1.754 8.345 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -7.931 -4.596 9.430 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.185 -3.207 10.195 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.542 -4.439 9.003 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.378 -1.951 11.762 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.650 -3.940 10.221 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.482 -1.462 12.977 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.683 -2.299 13.308 1.00 0.00 H new ATOM 1513 N ALA A 87 -5.993 -3.978 7.557 1.00 0.00 N ATOM 1514 CA ALA A 87 -4.623 -4.078 6.976 1.00 0.00 C ATOM 1515 C ALA A 87 -4.616 -5.150 5.877 1.00 0.00 C ATOM 1516 O ALA A 87 -5.527 -5.954 5.795 1.00 0.00 O ATOM 1517 CB ALA A 87 -3.725 -4.494 8.142 1.00 0.00 C ATOM 0 H ALA A 87 -6.398 -4.864 7.860 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.285 -3.145 6.525 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -2.697 -4.589 7.793 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -3.774 -3.739 8.926 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.064 -5.451 8.538 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.608 -5.176 5.031 1.00 0.00 N ATOM 1524 CA ASP A 88 -3.576 -6.206 3.948 1.00 0.00 C ATOM 1525 C ASP A 88 -2.438 -7.206 4.192 1.00 0.00 C ATOM 1526 O ASP A 88 -1.278 -6.883 4.015 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.336 -5.428 2.654 1.00 0.00 C ATOM 1528 CG ASP A 88 -3.993 -6.163 1.485 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.699 -7.334 1.307 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.781 -5.545 0.789 1.00 0.00 O ATOM 0 H ASP A 88 -2.816 -4.534 5.046 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.501 -6.782 3.909 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -3.746 -4.422 2.741 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.266 -5.321 2.475 1.00 0.00 H new ATOM 1535 N LYS A 89 -2.754 -8.424 4.592 1.00 0.00 N ATOM 1536 CA LYS A 89 -1.663 -9.436 4.835 1.00 0.00 C ATOM 1537 C LYS A 89 -0.847 -9.646 3.548 1.00 0.00 C ATOM 1538 O LYS A 89 0.362 -9.773 3.594 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.354 -10.748 5.238 1.00 0.00 C ATOM 1540 CG LYS A 89 -2.549 -10.779 6.755 1.00 0.00 C ATOM 1541 CD LYS A 89 -2.495 -12.227 7.247 1.00 0.00 C ATOM 1542 CE LYS A 89 -3.439 -12.398 8.438 1.00 0.00 C ATOM 1543 NZ LYS A 89 -3.287 -13.822 8.848 1.00 0.00 N ATOM 0 H LYS A 89 -3.704 -8.757 4.758 1.00 0.00 H new ATOM 0 HA LYS A 89 -0.981 -9.097 5.615 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.317 -10.833 4.735 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -1.753 -11.600 4.921 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -1.774 -10.188 7.244 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.506 -10.330 7.019 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -2.780 -12.906 6.443 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -1.477 -12.486 7.537 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -3.175 -11.723 9.252 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -4.469 -12.175 8.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -3.905 -14.017 9.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -3.552 -14.442 8.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -2.298 -14.003 9.113 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.496 -9.680 2.398 1.00 0.00 N ATOM 1558 CA LEU A 90 -0.728 -9.881 1.117 1.00 0.00 C ATOM 1559 C LEU A 90 0.282 -8.738 0.923 1.00 0.00 C ATOM 1560 O LEU A 90 1.395 -8.968 0.490 1.00 0.00 O ATOM 1561 CB LEU A 90 -1.758 -9.882 -0.025 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.078 -10.310 -1.325 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -0.869 -11.826 -1.319 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -1.963 -9.925 -2.513 1.00 0.00 C ATOM 0 H LEU A 90 -2.505 -9.579 2.292 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.170 -10.817 1.137 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -2.577 -10.562 0.210 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.191 -8.888 -0.139 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.113 -9.810 -1.410 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.384 -12.130 -2.247 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.240 -12.103 -0.473 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -1.834 -12.326 -1.233 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -1.479 -10.230 -3.441 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -2.927 -10.425 -2.425 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.114 -8.845 -2.520 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.084 -7.512 1.250 1.00 0.00 N ATOM 1577 CA LEU A 91 0.899 -6.382 1.083 1.00 0.00 C ATOM 1578 C LEU A 91 2.007 -6.537 2.130 1.00 0.00 C ATOM 1579 O LEU A 91 3.179 -6.485 1.806 1.00 0.00 O ATOM 1580 CB LEU A 91 0.124 -5.068 1.296 1.00 0.00 C ATOM 1581 CG LEU A 91 1.074 -3.869 1.161 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.703 -3.847 -0.239 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.287 -2.576 1.386 1.00 0.00 C ATOM 0 H LEU A 91 -0.999 -7.249 1.617 1.00 0.00 H new ATOM 0 HA LEU A 91 1.358 -6.384 0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.681 -4.989 0.565 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.340 -5.066 2.282 1.00 0.00 H new ATOM 0 HG LEU A 91 1.867 -3.955 1.904 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.375 -2.993 -0.323 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.265 -4.767 -0.400 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.917 -3.766 -0.990 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.957 -1.721 1.291 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.507 -2.499 0.643 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.150 -2.585 2.384 1.00 0.00 H new ATOM 1595 N ILE A 92 1.650 -6.759 3.382 1.00 0.00 N ATOM 1596 CA ILE A 92 2.716 -6.955 4.430 1.00 0.00 C ATOM 1597 C ILE A 92 3.549 -8.197 4.056 1.00 0.00 C ATOM 1598 O ILE A 92 4.757 -8.201 4.208 1.00 0.00 O ATOM 1599 CB ILE A 92 1.985 -7.146 5.780 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.306 -5.825 6.170 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.985 -7.546 6.871 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.553 -5.985 7.499 1.00 0.00 C ATOM 0 H ILE A 92 0.688 -6.812 3.718 1.00 0.00 H new ATOM 0 HA ILE A 92 3.395 -6.106 4.499 1.00 0.00 H new ATOM 0 HB ILE A 92 1.240 -7.935 5.679 1.00 0.00 H new ATOM 0 HG12 ILE A 92 2.053 -5.037 6.260 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.613 -5.519 5.386 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.459 -7.678 7.816 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.472 -8.481 6.593 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.737 -6.764 6.980 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.077 -5.041 7.763 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.208 -6.759 7.395 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.255 -6.269 8.283 1.00 0.00 H new ATOM 1614 N ALA A 93 2.921 -9.240 3.538 1.00 0.00 N ATOM 1615 CA ALA A 93 3.713 -10.452 3.130 1.00 0.00 C ATOM 1616 C ALA A 93 4.593 -10.094 1.922 1.00 0.00 C ATOM 1617 O ALA A 93 5.730 -10.519 1.837 1.00 0.00 O ATOM 1618 CB ALA A 93 2.700 -11.543 2.750 1.00 0.00 C ATOM 0 H ALA A 93 1.915 -9.301 3.384 1.00 0.00 H new ATOM 0 HA ALA A 93 4.361 -10.799 3.935 1.00 0.00 H new ATOM 0 HB1 ALA A 93 3.233 -12.444 2.446 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.068 -11.767 3.609 1.00 0.00 H new ATOM 0 HB3 ALA A 93 2.080 -11.192 1.925 1.00 0.00 H new ATOM 1624 N LYS A 94 4.087 -9.303 0.986 1.00 0.00 N ATOM 1625 CA LYS A 94 4.931 -8.921 -0.206 1.00 0.00 C ATOM 1626 C LYS A 94 6.217 -8.230 0.278 1.00 0.00 C ATOM 1627 O LYS A 94 7.292 -8.496 -0.227 1.00 0.00 O ATOM 1628 CB LYS A 94 4.103 -7.934 -1.052 1.00 0.00 C ATOM 1629 CG LYS A 94 3.160 -8.695 -1.987 1.00 0.00 C ATOM 1630 CD LYS A 94 3.970 -9.533 -2.978 1.00 0.00 C ATOM 1631 CE LYS A 94 3.216 -9.615 -4.313 1.00 0.00 C ATOM 1632 NZ LYS A 94 3.115 -11.070 -4.614 1.00 0.00 N ATOM 0 H LYS A 94 3.144 -8.914 0.997 1.00 0.00 H new ATOM 0 HA LYS A 94 5.204 -9.800 -0.790 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.527 -7.279 -0.398 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.768 -7.298 -1.635 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.501 -9.340 -1.406 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.524 -7.993 -2.526 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.953 -9.087 -3.130 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.132 -10.534 -2.577 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.229 -9.159 -4.237 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.752 -9.086 -5.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.611 -11.204 -5.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 4.070 -11.476 -4.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.594 -11.547 -3.851 1.00 0.00 H new ATOM 1646 N TRP A 95 6.119 -7.357 1.264 1.00 0.00 N ATOM 1647 CA TRP A 95 7.361 -6.674 1.773 1.00 0.00 C ATOM 1648 C TRP A 95 8.258 -7.702 2.479 1.00 0.00 C ATOM 1649 O TRP A 95 9.465 -7.681 2.330 1.00 0.00 O ATOM 1650 CB TRP A 95 6.904 -5.594 2.769 1.00 0.00 C ATOM 1651 CG TRP A 95 6.561 -4.332 2.035 1.00 0.00 C ATOM 1652 CD1 TRP A 95 7.277 -3.799 1.016 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.434 -3.433 2.254 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.659 -2.635 0.595 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.521 -2.367 1.327 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.356 -3.441 3.157 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.571 -1.345 1.296 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.399 -2.414 3.130 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.507 -1.368 2.201 1.00 0.00 C ATOM 0 H TRP A 95 5.251 -7.093 1.729 1.00 0.00 H new ATOM 0 HA TRP A 95 7.931 -6.228 0.958 1.00 0.00 H new ATOM 0 HB2 TRP A 95 6.037 -5.946 3.328 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.694 -5.399 3.495 1.00 0.00 H new ATOM 0 HD1 TRP A 95 8.183 -4.215 0.600 1.00 0.00 H new ATOM 0 HE1 TRP A 95 7.003 -2.047 -0.164 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.264 -4.242 3.876 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.658 -0.543 0.578 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.575 -2.429 3.828 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.768 -0.581 2.186 1.00 0.00 H new ATOM 1670 N ARG A 96 7.678 -8.609 3.240 1.00 0.00 N ATOM 1671 CA ARG A 96 8.518 -9.643 3.942 1.00 0.00 C ATOM 1672 C ARG A 96 9.181 -10.576 2.915 1.00 0.00 C ATOM 1673 O ARG A 96 10.305 -11.003 3.105 1.00 0.00 O ATOM 1674 CB ARG A 96 7.569 -10.440 4.854 1.00 0.00 C ATOM 1675 CG ARG A 96 7.277 -9.632 6.127 1.00 0.00 C ATOM 1676 CD ARG A 96 5.776 -9.683 6.446 1.00 0.00 C ATOM 1677 NE ARG A 96 5.694 -10.190 7.850 1.00 0.00 N ATOM 1678 CZ ARG A 96 5.899 -11.467 8.133 1.00 0.00 C ATOM 1679 NH1 ARG A 96 6.175 -12.342 7.191 1.00 0.00 N ATOM 1680 NH2 ARG A 96 5.826 -11.874 9.373 1.00 0.00 N ATOM 0 H ARG A 96 6.674 -8.678 3.404 1.00 0.00 H new ATOM 0 HA ARG A 96 9.314 -9.174 4.521 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.639 -10.657 4.328 1.00 0.00 H new ATOM 0 HB3 ARG A 96 8.018 -11.398 5.115 1.00 0.00 H new ATOM 0 HG2 ARG A 96 7.849 -10.035 6.963 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.594 -8.598 5.992 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.320 -8.697 6.355 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.249 -10.343 5.757 1.00 0.00 H new ATOM 0 HE ARG A 96 5.476 -9.539 8.605 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.235 -12.042 6.218 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.329 -13.321 7.433 1.00 0.00 H new ATOM 0 HH21 ARG A 96 5.612 -11.209 10.116 1.00 0.00 H new ATOM 0 HH22 ARG A 96 5.983 -12.857 9.597 1.00 0.00 H new ATOM 1694 N LYS A 97 8.504 -10.898 1.827 1.00 0.00 N ATOM 1695 CA LYS A 97 9.129 -11.810 0.796 1.00 0.00 C ATOM 1696 C LYS A 97 10.499 -11.264 0.354 1.00 0.00 C ATOM 1697 O LYS A 97 10.936 -10.231 0.826 1.00 0.00 O ATOM 1698 CB LYS A 97 8.175 -11.830 -0.410 1.00 0.00 C ATOM 1699 CG LYS A 97 7.158 -12.960 -0.255 1.00 0.00 C ATOM 1700 CD LYS A 97 7.862 -14.312 -0.408 1.00 0.00 C ATOM 1701 CE LYS A 97 7.253 -15.323 0.566 1.00 0.00 C ATOM 1702 NZ LYS A 97 6.239 -16.065 -0.233 1.00 0.00 N ATOM 0 H LYS A 97 7.561 -10.576 1.609 1.00 0.00 H new ATOM 0 HA LYS A 97 9.281 -12.808 1.207 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.658 -10.874 -0.491 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.743 -11.965 -1.331 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.677 -12.898 0.721 1.00 0.00 H new ATOM 0 HG3 LYS A 97 6.373 -12.861 -1.004 1.00 0.00 H new ATOM 0 HD2 LYS A 97 7.761 -14.672 -1.432 1.00 0.00 H new ATOM 0 HD3 LYS A 97 8.929 -14.202 -0.213 1.00 0.00 H new ATOM 0 HE2 LYS A 97 8.013 -15.996 0.962 1.00 0.00 H new ATOM 0 HE3 LYS A 97 6.794 -14.823 1.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 5.777 -16.778 0.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 5.525 -15.399 -0.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 6.706 -16.537 -1.034 1.00 0.00 H new ATOM 1716 N THR A 98 11.172 -11.940 -0.554 1.00 0.00 N ATOM 1717 CA THR A 98 12.502 -11.440 -1.023 1.00 0.00 C ATOM 1718 C THR A 98 12.363 -10.856 -2.434 1.00 0.00 C ATOM 1719 O THR A 98 11.629 -11.381 -3.252 1.00 0.00 O ATOM 1720 CB THR A 98 13.430 -12.659 -1.031 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.655 -13.845 -1.142 1.00 0.00 O ATOM 1722 CG2 THR A 98 14.236 -12.692 0.268 1.00 0.00 C ATOM 0 H THR A 98 10.857 -12.809 -0.985 1.00 0.00 H new ATOM 0 HA THR A 98 12.895 -10.653 -0.380 1.00 0.00 H new ATOM 0 HB THR A 98 14.111 -12.593 -1.879 1.00 0.00 H new ATOM 0 HG1 THR A 98 12.163 -13.836 -1.989 1.00 0.00 H new ATOM 0 HG21 THR A 98 14.897 -13.559 0.264 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.831 -11.782 0.350 1.00 0.00 H new ATOM 0 HG23 THR A 98 13.555 -12.758 1.117 1.00 0.00 H new ATOM 1730 N GLY A 99 13.045 -9.767 -2.729 1.00 0.00 N ATOM 1731 CA GLY A 99 12.924 -9.160 -4.086 1.00 0.00 C ATOM 1732 C GLY A 99 11.945 -7.966 -4.062 1.00 0.00 C ATOM 1733 O GLY A 99 11.989 -7.124 -4.940 1.00 0.00 O ATOM 0 H GLY A 99 13.673 -9.281 -2.089 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.903 -8.827 -4.430 1.00 0.00 H new ATOM 0 HA3 GLY A 99 12.574 -9.910 -4.796 1.00 0.00 H new ATOM 1737 N TYR A 100 11.062 -7.870 -3.077 1.00 0.00 N ATOM 1738 CA TYR A 100 10.107 -6.709 -3.045 1.00 0.00 C ATOM 1739 C TYR A 100 10.691 -5.561 -2.203 1.00 0.00 C ATOM 1740 O TYR A 100 10.075 -5.109 -1.253 1.00 0.00 O ATOM 1741 CB TYR A 100 8.812 -7.234 -2.403 1.00 0.00 C ATOM 1742 CG TYR A 100 8.161 -8.250 -3.309 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.649 -7.858 -4.552 1.00 0.00 C ATOM 1744 CD2 TYR A 100 8.060 -9.584 -2.901 1.00 0.00 C ATOM 1745 CE1 TYR A 100 7.038 -8.801 -5.386 1.00 0.00 C ATOM 1746 CE2 TYR A 100 7.447 -10.528 -3.732 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.937 -10.137 -4.976 1.00 0.00 C ATOM 1748 OH TYR A 100 6.332 -11.067 -5.796 1.00 0.00 O ATOM 0 H TYR A 100 10.967 -8.536 -2.310 1.00 0.00 H new ATOM 0 HA TYR A 100 9.924 -6.319 -4.046 1.00 0.00 H new ATOM 0 HB2 TYR A 100 9.033 -7.686 -1.436 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.126 -6.407 -2.219 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.726 -6.828 -4.867 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.456 -9.886 -1.943 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.644 -8.499 -6.345 1.00 0.00 H new ATOM 0 HE2 TYR A 100 7.367 -11.557 -3.414 1.00 0.00 H new ATOM 0 HH TYR A 100 6.347 -11.945 -5.361 1.00 0.00 H new ATOM 1758 N GLU A 101 11.866 -5.072 -2.545 1.00 0.00 N ATOM 1759 CA GLU A 101 12.460 -3.936 -1.750 1.00 0.00 C ATOM 1760 C GLU A 101 11.733 -2.626 -2.097 1.00 0.00 C ATOM 1761 O GLU A 101 11.486 -1.806 -1.233 1.00 0.00 O ATOM 1762 CB GLU A 101 13.942 -3.846 -2.144 1.00 0.00 C ATOM 1763 CG GLU A 101 14.647 -2.826 -1.248 1.00 0.00 C ATOM 1764 CD GLU A 101 16.131 -2.761 -1.615 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.432 -2.296 -2.702 1.00 0.00 O ATOM 1766 OE2 GLU A 101 16.940 -3.178 -0.803 1.00 0.00 O ATOM 0 H GLU A 101 12.432 -5.402 -3.326 1.00 0.00 H new ATOM 0 HA GLU A 101 12.356 -4.103 -0.678 1.00 0.00 H new ATOM 0 HB2 GLU A 101 14.416 -4.823 -2.044 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.034 -3.552 -3.190 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.189 -1.844 -1.367 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.533 -3.106 -0.201 1.00 0.00 H new ATOM 1773 N LYS A 102 11.382 -2.424 -3.352 1.00 0.00 N ATOM 1774 CA LYS A 102 10.665 -1.171 -3.739 1.00 0.00 C ATOM 1775 C LYS A 102 9.222 -1.509 -4.154 1.00 0.00 C ATOM 1776 O LYS A 102 8.933 -1.678 -5.324 1.00 0.00 O ATOM 1777 CB LYS A 102 11.460 -0.606 -4.923 1.00 0.00 C ATOM 1778 CG LYS A 102 12.831 -0.105 -4.437 1.00 0.00 C ATOM 1779 CD LYS A 102 12.939 1.414 -4.637 1.00 0.00 C ATOM 1780 CE LYS A 102 13.869 1.718 -5.816 1.00 0.00 C ATOM 1781 NZ LYS A 102 14.689 2.881 -5.372 1.00 0.00 N ATOM 0 H LYS A 102 11.563 -3.073 -4.117 1.00 0.00 H new ATOM 0 HA LYS A 102 10.602 -0.452 -2.923 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.592 -1.375 -5.684 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.908 0.211 -5.387 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.964 -0.351 -3.384 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.627 -0.609 -4.986 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.952 1.837 -4.823 1.00 0.00 H new ATOM 0 HD3 LYS A 102 13.321 1.883 -3.730 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.498 0.860 -6.054 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.301 1.956 -6.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.351 3.148 -6.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 14.065 3.685 -5.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 15.224 2.623 -4.518 1.00 0.00 H new ATOM 1795 N LEU A 103 8.317 -1.624 -3.202 1.00 0.00 N ATOM 1796 CA LEU A 103 6.903 -1.966 -3.540 1.00 0.00 C ATOM 1797 C LEU A 103 5.955 -0.851 -3.041 1.00 0.00 C ATOM 1798 O LEU A 103 6.108 -0.348 -1.944 1.00 0.00 O ATOM 1799 CB LEU A 103 6.670 -3.314 -2.817 1.00 0.00 C ATOM 1800 CG LEU A 103 5.180 -3.568 -2.539 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.417 -3.676 -3.863 1.00 0.00 C ATOM 1802 CD2 LEU A 103 5.030 -4.868 -1.747 1.00 0.00 C ATOM 0 H LEU A 103 8.503 -1.494 -2.208 1.00 0.00 H new ATOM 0 HA LEU A 103 6.710 -2.049 -4.610 1.00 0.00 H new ATOM 0 HB2 LEU A 103 7.069 -4.126 -3.426 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.221 -3.321 -1.876 1.00 0.00 H new ATOM 0 HG LEU A 103 4.770 -2.740 -1.961 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.361 -3.856 -3.661 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.526 -2.747 -4.423 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.820 -4.502 -4.449 1.00 0.00 H new ATOM 0 HD21 LEU A 103 3.974 -5.053 -1.547 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.440 -5.696 -2.325 1.00 0.00 H new ATOM 0 HD23 LEU A 103 5.568 -4.783 -0.803 1.00 0.00 H new ATOM 1814 N CYS A 104 4.976 -0.465 -3.841 1.00 0.00 N ATOM 1815 CA CYS A 104 4.031 0.613 -3.398 1.00 0.00 C ATOM 1816 C CYS A 104 2.601 0.075 -3.147 1.00 0.00 C ATOM 1817 O CYS A 104 1.960 0.495 -2.205 1.00 0.00 O ATOM 1818 CB CYS A 104 4.072 1.702 -4.488 1.00 0.00 C ATOM 1819 SG CYS A 104 3.551 1.083 -6.118 1.00 0.00 S ATOM 0 H CYS A 104 4.796 -0.848 -4.769 1.00 0.00 H new ATOM 0 HA CYS A 104 4.337 1.024 -2.436 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.426 2.529 -4.194 1.00 0.00 H new ATOM 0 HB3 CYS A 104 5.084 2.099 -4.561 1.00 0.00 H new ATOM 1824 N CYS A 105 2.089 -0.844 -3.942 1.00 0.00 N ATOM 1825 CA CYS A 105 0.704 -1.372 -3.666 1.00 0.00 C ATOM 1826 C CYS A 105 0.666 -2.894 -3.905 1.00 0.00 C ATOM 1827 O CYS A 105 1.695 -3.520 -4.074 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.258 -0.680 -4.647 1.00 0.00 C ATOM 1829 SG CYS A 105 0.093 1.096 -4.830 1.00 0.00 S ATOM 0 H CYS A 105 2.558 -1.245 -4.754 1.00 0.00 H new ATOM 0 HA CYS A 105 0.420 -1.173 -2.633 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.188 -1.163 -5.621 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.283 -0.811 -4.299 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.511 -3.497 -3.934 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.589 -4.981 -4.178 1.00 0.00 C ATOM 1836 C LEU A 106 -0.893 -5.270 -5.659 1.00 0.00 C ATOM 1837 O LEU A 106 -0.339 -6.187 -6.234 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.720 -5.506 -3.288 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.162 -5.910 -1.922 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.319 -6.364 -1.029 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.147 -7.059 -2.082 1.00 0.00 C ATOM 0 H LEU A 106 -1.408 -3.030 -3.801 1.00 0.00 H new ATOM 0 HA LEU A 106 0.357 -5.468 -3.943 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.485 -4.739 -3.166 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.200 -6.362 -3.762 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.656 -5.058 -1.469 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -1.932 -6.654 -0.052 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.029 -5.546 -0.910 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.821 -7.216 -1.488 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.244 -7.338 -1.103 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.640 -7.919 -2.535 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.674 -6.733 -2.721 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.736 -4.476 -6.299 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.021 -4.704 -7.756 1.00 0.00 C ATOM 1855 C ARG A 107 -1.228 -3.682 -8.602 1.00 0.00 C ATOM 1856 O ARG A 107 -1.675 -3.248 -9.645 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.530 -4.491 -7.925 1.00 0.00 C ATOM 1858 CG ARG A 107 -3.954 -4.928 -9.329 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.371 -5.504 -9.278 1.00 0.00 C ATOM 1860 NE ARG A 107 -5.955 -5.210 -10.623 1.00 0.00 N ATOM 1861 CZ ARG A 107 -6.360 -3.992 -10.946 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -6.262 -2.990 -10.101 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -6.870 -3.773 -12.131 1.00 0.00 N ATOM 0 H ARG A 107 -2.231 -3.690 -5.877 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.726 -5.701 -8.083 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.075 -5.064 -7.174 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.780 -3.442 -7.769 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.919 -4.079 -10.012 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.260 -5.675 -9.714 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.355 -6.576 -9.080 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.957 -5.042 -8.483 1.00 0.00 H new ATOM 0 HE ARG A 107 -6.043 -5.963 -11.305 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -5.867 -3.142 -9.173 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -6.581 -2.060 -10.373 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -6.954 -4.539 -12.800 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -7.184 -2.837 -12.386 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.058 -3.285 -8.142 1.00 0.00 N ATOM 1878 CA CYS A 108 0.775 -2.286 -8.880 1.00 0.00 C ATOM 1879 C CYS A 108 2.208 -2.864 -9.079 1.00 0.00 C ATOM 1880 O CYS A 108 3.131 -2.132 -9.369 1.00 0.00 O ATOM 1881 CB CYS A 108 0.782 -1.123 -7.879 1.00 0.00 C ATOM 1882 SG CYS A 108 0.895 0.516 -8.628 1.00 0.00 S ATOM 0 H CYS A 108 0.356 -3.620 -7.272 1.00 0.00 H new ATOM 0 HA CYS A 108 0.417 -2.012 -9.872 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.127 -1.172 -7.280 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.621 -1.254 -7.196 1.00 0.00 H new ATOM 1887 N ILE A 109 2.400 -4.177 -8.907 1.00 0.00 N ATOM 1888 CA ILE A 109 3.764 -4.800 -9.059 1.00 0.00 C ATOM 1889 C ILE A 109 3.629 -6.320 -9.311 1.00 0.00 C ATOM 1890 O ILE A 109 4.391 -7.104 -8.774 1.00 0.00 O ATOM 1891 CB ILE A 109 4.470 -4.596 -7.701 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.575 -5.132 -6.560 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.765 -3.112 -7.467 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.362 -6.114 -5.683 1.00 0.00 C ATOM 0 H ILE A 109 1.659 -4.836 -8.667 1.00 0.00 H new ATOM 0 HA ILE A 109 4.309 -4.355 -9.891 1.00 0.00 H new ATOM 0 HB ILE A 109 5.412 -5.144 -7.714 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.212 -4.303 -5.953 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.699 -5.628 -6.978 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.263 -2.987 -6.505 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.412 -2.740 -8.261 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.831 -2.551 -7.468 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.720 -6.483 -4.884 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.703 -6.952 -6.291 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.223 -5.605 -5.250 1.00 0.00 H new ATOM 1906 N GLN A 110 2.657 -6.750 -10.092 1.00 0.00 N ATOM 1907 CA GLN A 110 2.489 -8.224 -10.322 1.00 0.00 C ATOM 1908 C GLN A 110 2.992 -8.627 -11.713 1.00 0.00 C ATOM 1909 O GLN A 110 2.340 -8.376 -12.707 1.00 0.00 O ATOM 1910 CB GLN A 110 0.982 -8.488 -10.200 1.00 0.00 C ATOM 1911 CG GLN A 110 0.748 -9.784 -9.419 1.00 0.00 C ATOM 1912 CD GLN A 110 -0.552 -9.666 -8.612 1.00 0.00 C ATOM 1913 OE1 GLN A 110 -0.567 -9.942 -7.429 1.00 0.00 O ATOM 1914 NE2 GLN A 110 -1.653 -9.264 -9.200 1.00 0.00 N ATOM 0 H GLN A 110 1.984 -6.153 -10.572 1.00 0.00 H new ATOM 0 HA GLN A 110 3.066 -8.806 -9.604 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.496 -7.654 -9.693 1.00 0.00 H new ATOM 0 HB3 GLN A 110 0.535 -8.563 -11.191 1.00 0.00 H new ATOM 0 HG2 GLN A 110 0.688 -10.629 -10.105 1.00 0.00 H new ATOM 0 HG3 GLN A 110 1.588 -9.975 -8.751 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -1.645 -9.031 -10.193 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -2.517 -9.184 -8.664 1.00 0.00 H new ATOM 1923 N LYS A 111 4.144 -9.264 -11.794 1.00 0.00 N ATOM 1924 CA LYS A 111 4.677 -9.690 -13.123 1.00 0.00 C ATOM 1925 C LYS A 111 4.754 -11.224 -13.186 1.00 0.00 C ATOM 1926 O LYS A 111 4.476 -11.899 -12.212 1.00 0.00 O ATOM 1927 CB LYS A 111 6.078 -9.075 -13.207 1.00 0.00 C ATOM 1928 CG LYS A 111 6.274 -8.420 -14.578 1.00 0.00 C ATOM 1929 CD LYS A 111 7.755 -8.083 -14.780 1.00 0.00 C ATOM 1930 CE LYS A 111 7.885 -6.726 -15.475 1.00 0.00 C ATOM 1931 NZ LYS A 111 9.334 -6.389 -15.394 1.00 0.00 N ATOM 0 H LYS A 111 4.732 -9.504 -10.996 1.00 0.00 H new ATOM 0 HA LYS A 111 4.044 -9.366 -13.949 1.00 0.00 H new ATOM 0 HB2 LYS A 111 6.208 -8.335 -12.418 1.00 0.00 H new ATOM 0 HB3 LYS A 111 6.833 -9.845 -13.050 1.00 0.00 H new ATOM 0 HG2 LYS A 111 5.933 -9.092 -15.365 1.00 0.00 H new ATOM 0 HG3 LYS A 111 5.672 -7.514 -14.649 1.00 0.00 H new ATOM 0 HD2 LYS A 111 8.267 -8.060 -13.818 1.00 0.00 H new ATOM 0 HD3 LYS A 111 8.236 -8.857 -15.379 1.00 0.00 H new ATOM 0 HE2 LYS A 111 7.549 -6.779 -16.511 1.00 0.00 H new ATOM 0 HE3 LYS A 111 7.276 -5.969 -14.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 9.580 -5.727 -16.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 9.537 -5.948 -14.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 9.898 -7.257 -15.494 1.00 0.00 H new ATOM 1945 N ASN A 112 5.128 -11.785 -14.318 1.00 0.00 N ATOM 1946 CA ASN A 112 5.214 -13.279 -14.419 1.00 0.00 C ATOM 1947 C ASN A 112 5.992 -13.702 -15.678 1.00 0.00 C ATOM 1948 O ASN A 112 6.954 -14.445 -15.596 1.00 0.00 O ATOM 1949 CB ASN A 112 3.762 -13.751 -14.509 1.00 0.00 C ATOM 1950 CG ASN A 112 3.276 -14.198 -13.125 1.00 0.00 C ATOM 1951 OD1 ASN A 112 4.061 -14.654 -12.316 1.00 0.00 O ATOM 1952 ND2 ASN A 112 2.009 -14.088 -12.808 1.00 0.00 N ATOM 0 H ASN A 112 5.375 -11.277 -15.167 1.00 0.00 H new ATOM 0 HA ASN A 112 5.741 -13.712 -13.569 1.00 0.00 H new ATOM 0 HB2 ASN A 112 3.130 -12.946 -14.884 1.00 0.00 H new ATOM 0 HB3 ASN A 112 3.681 -14.576 -15.217 1.00 0.00 H new ATOM 0 HD21 ASN A 112 1.686 -14.384 -11.887 1.00 0.00 H new ATOM 0 HD22 ASN A 112 1.346 -13.706 -13.482 1.00 0.00 H new ATOM 1959 N GLU A 113 5.586 -13.238 -16.842 1.00 0.00 N ATOM 1960 CA GLU A 113 6.303 -13.620 -18.094 1.00 0.00 C ATOM 1961 C GLU A 113 6.394 -12.399 -19.035 1.00 0.00 C ATOM 1962 O GLU A 113 6.258 -11.272 -18.594 1.00 0.00 O ATOM 1963 CB GLU A 113 5.450 -14.749 -18.692 1.00 0.00 C ATOM 1964 CG GLU A 113 4.055 -14.224 -19.043 1.00 0.00 C ATOM 1965 CD GLU A 113 3.308 -15.269 -19.872 1.00 0.00 C ATOM 1966 OE1 GLU A 113 3.925 -15.851 -20.749 1.00 0.00 O ATOM 1967 OE2 GLU A 113 2.132 -15.470 -19.616 1.00 0.00 O ATOM 0 H GLU A 113 4.790 -12.613 -16.972 1.00 0.00 H new ATOM 0 HA GLU A 113 7.329 -13.947 -17.926 1.00 0.00 H new ATOM 0 HB2 GLU A 113 5.933 -15.147 -19.585 1.00 0.00 H new ATOM 0 HB3 GLU A 113 5.370 -15.571 -17.980 1.00 0.00 H new ATOM 0 HG2 GLU A 113 3.499 -14.002 -18.132 1.00 0.00 H new ATOM 0 HG3 GLU A 113 4.136 -13.292 -19.602 1.00 0.00 H new ATOM 1974 N THR A 114 6.623 -12.599 -20.320 1.00 0.00 N ATOM 1975 CA THR A 114 6.717 -11.422 -21.254 1.00 0.00 C ATOM 1976 C THR A 114 5.335 -11.074 -21.835 1.00 0.00 C ATOM 1977 O THR A 114 5.029 -9.914 -22.042 1.00 0.00 O ATOM 1978 CB THR A 114 7.678 -11.840 -22.374 1.00 0.00 C ATOM 1979 OG1 THR A 114 7.491 -13.217 -22.668 1.00 0.00 O ATOM 1980 CG2 THR A 114 9.121 -11.605 -21.926 1.00 0.00 C ATOM 0 H THR A 114 6.747 -13.513 -20.756 1.00 0.00 H new ATOM 0 HA THR A 114 7.075 -10.535 -20.732 1.00 0.00 H new ATOM 0 HB THR A 114 7.475 -11.247 -23.266 1.00 0.00 H new ATOM 0 HG1 THR A 114 8.103 -13.485 -23.385 1.00 0.00 H new ATOM 0 HG21 THR A 114 9.802 -11.903 -22.723 1.00 0.00 H new ATOM 0 HG22 THR A 114 9.265 -10.548 -21.701 1.00 0.00 H new ATOM 0 HG23 THR A 114 9.326 -12.197 -21.034 1.00 0.00 H new ATOM 1988 N ASN A 115 4.496 -12.057 -22.103 1.00 0.00 N ATOM 1989 CA ASN A 115 3.144 -11.747 -22.671 1.00 0.00 C ATOM 1990 C ASN A 115 2.041 -12.055 -21.640 1.00 0.00 C ATOM 1991 O ASN A 115 2.279 -12.729 -20.658 1.00 0.00 O ATOM 1992 CB ASN A 115 3.003 -12.635 -23.919 1.00 0.00 C ATOM 1993 CG ASN A 115 2.986 -14.122 -23.529 1.00 0.00 C ATOM 1994 OD1 ASN A 115 2.065 -14.578 -22.881 1.00 0.00 O ATOM 1995 ND2 ASN A 115 3.972 -14.906 -23.895 1.00 0.00 N ATOM 0 H ASN A 115 4.690 -13.047 -21.954 1.00 0.00 H new ATOM 0 HA ASN A 115 3.043 -10.692 -22.925 1.00 0.00 H new ATOM 0 HB2 ASN A 115 2.085 -12.382 -24.449 1.00 0.00 H new ATOM 0 HB3 ASN A 115 3.829 -12.443 -24.603 1.00 0.00 H new ATOM 0 HD21 ASN A 115 3.963 -15.892 -23.635 1.00 0.00 H new ATOM 0 HD22 ASN A 115 4.748 -14.529 -24.439 1.00 0.00 H new ATOM 2002 N ASN A 116 0.832 -11.566 -21.853 1.00 0.00 N ATOM 2003 CA ASN A 116 -0.281 -11.831 -20.881 1.00 0.00 C ATOM 2004 C ASN A 116 0.139 -11.432 -19.454 1.00 0.00 C ATOM 2005 O ASN A 116 1.201 -10.874 -19.253 1.00 0.00 O ATOM 2006 CB ASN A 116 -0.547 -13.340 -20.960 1.00 0.00 C ATOM 2007 CG ASN A 116 -1.733 -13.604 -21.896 1.00 0.00 C ATOM 2008 OD1 ASN A 116 -2.682 -14.261 -21.514 1.00 0.00 O ATOM 2009 ND2 ASN A 116 -1.726 -13.121 -23.115 1.00 0.00 N ATOM 0 H ASN A 116 0.573 -10.996 -22.658 1.00 0.00 H new ATOM 0 HA ASN A 116 -1.172 -11.251 -21.122 1.00 0.00 H new ATOM 0 HB2 ASN A 116 0.340 -13.857 -21.325 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -0.760 -13.735 -19.966 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -2.514 -13.297 -23.738 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -0.932 -12.569 -23.440 1.00 0.00 H new ATOM 2016 N GLY A 117 -0.685 -11.710 -18.463 1.00 0.00 N ATOM 2017 CA GLY A 117 -0.322 -11.340 -17.062 1.00 0.00 C ATOM 2018 C GLY A 117 -0.878 -9.946 -16.739 1.00 0.00 C ATOM 2019 O GLY A 117 -1.521 -9.328 -17.568 1.00 0.00 O ATOM 0 H GLY A 117 -1.587 -12.175 -18.569 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -0.725 -12.074 -16.365 1.00 0.00 H new ATOM 0 HA3 GLY A 117 0.761 -11.348 -16.942 1.00 0.00 H new ATOM 2023 N SER A 118 -0.642 -9.442 -15.544 1.00 0.00 N ATOM 2024 CA SER A 118 -1.166 -8.089 -15.187 1.00 0.00 C ATOM 2025 C SER A 118 -0.189 -7.363 -14.247 1.00 0.00 C ATOM 2026 O SER A 118 -0.208 -7.574 -13.050 1.00 0.00 O ATOM 2027 CB SER A 118 -2.492 -8.354 -14.476 1.00 0.00 C ATOM 2028 OG SER A 118 -3.381 -9.014 -15.369 1.00 0.00 O ATOM 0 H SER A 118 -0.112 -9.910 -14.809 1.00 0.00 H new ATOM 0 HA SER A 118 -1.290 -7.454 -16.064 1.00 0.00 H new ATOM 0 HB2 SER A 118 -2.327 -8.967 -13.590 1.00 0.00 H new ATOM 0 HB3 SER A 118 -2.930 -7.415 -14.137 1.00 0.00 H new ATOM 0 HG SER A 118 -4.232 -9.187 -14.915 1.00 0.00 H new ATOM 2034 N THR A 119 0.664 -6.508 -14.778 1.00 0.00 N ATOM 2035 CA THR A 119 1.630 -5.777 -13.904 1.00 0.00 C ATOM 2036 C THR A 119 1.499 -4.262 -14.120 1.00 0.00 C ATOM 2037 O THR A 119 0.814 -3.819 -15.023 1.00 0.00 O ATOM 2038 CB THR A 119 3.019 -6.247 -14.350 1.00 0.00 C ATOM 2039 OG1 THR A 119 2.935 -7.576 -14.849 1.00 0.00 O ATOM 2040 CG2 THR A 119 3.993 -6.201 -13.164 1.00 0.00 C ATOM 0 H THR A 119 0.728 -6.291 -15.773 1.00 0.00 H new ATOM 0 HA THR A 119 1.449 -5.975 -12.848 1.00 0.00 H new ATOM 0 HB THR A 119 3.384 -5.587 -15.137 1.00 0.00 H new ATOM 0 HG1 THR A 119 2.447 -8.136 -14.209 1.00 0.00 H new ATOM 0 HG21 THR A 119 4.978 -6.536 -13.489 1.00 0.00 H new ATOM 0 HG22 THR A 119 4.063 -5.180 -12.790 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.631 -6.854 -12.370 1.00 0.00 H new ATOM 2048 N CYS A 120 2.164 -3.463 -13.312 1.00 0.00 N ATOM 2049 CA CYS A 120 2.088 -1.982 -13.495 1.00 0.00 C ATOM 2050 C CYS A 120 3.413 -1.475 -14.088 1.00 0.00 C ATOM 2051 O CYS A 120 4.439 -2.112 -13.936 1.00 0.00 O ATOM 2052 CB CYS A 120 1.868 -1.403 -12.101 1.00 0.00 C ATOM 2053 SG CYS A 120 1.639 0.383 -12.238 1.00 0.00 S ATOM 0 H CYS A 120 2.752 -3.775 -12.539 1.00 0.00 H new ATOM 0 HA CYS A 120 1.287 -1.688 -14.173 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.994 -1.860 -11.637 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.722 -1.625 -11.461 1.00 0.00 H new ATOM 2058 N ILE A 121 3.407 -0.347 -14.768 1.00 0.00 N ATOM 2059 CA ILE A 121 4.691 0.165 -15.365 1.00 0.00 C ATOM 2060 C ILE A 121 5.641 0.677 -14.262 1.00 0.00 C ATOM 2061 O ILE A 121 6.842 0.514 -14.366 1.00 0.00 O ATOM 2062 CB ILE A 121 4.294 1.288 -16.357 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.481 1.618 -17.288 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.826 2.549 -15.612 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.637 2.290 -16.527 1.00 0.00 C ATOM 0 H ILE A 121 2.585 0.233 -14.934 1.00 0.00 H new ATOM 0 HA ILE A 121 5.235 -0.624 -15.884 1.00 0.00 H new ATOM 0 HB ILE A 121 3.460 0.930 -16.961 1.00 0.00 H new ATOM 0 HG12 ILE A 121 5.839 0.702 -17.758 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.143 2.276 -18.089 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.554 3.319 -16.334 1.00 0.00 H new ATOM 0 HG22 ILE A 121 2.960 2.307 -14.996 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.632 2.916 -14.976 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.451 2.505 -17.219 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.286 3.220 -16.079 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.994 1.622 -15.743 1.00 0.00 H new ATOM 2077 N CYS A 122 5.130 1.302 -13.215 1.00 0.00 N ATOM 2078 CA CYS A 122 6.061 1.821 -12.143 1.00 0.00 C ATOM 2079 C CYS A 122 6.966 0.692 -11.603 1.00 0.00 C ATOM 2080 O CYS A 122 8.109 0.932 -11.262 1.00 0.00 O ATOM 2081 CB CYS A 122 5.180 2.482 -11.043 1.00 0.00 C ATOM 2082 SG CYS A 122 4.484 1.266 -9.875 1.00 0.00 S ATOM 0 H CYS A 122 4.137 1.472 -13.057 1.00 0.00 H new ATOM 0 HA CYS A 122 6.746 2.568 -12.542 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.778 3.208 -10.492 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.367 3.032 -11.516 1.00 0.00 H new ATOM 2087 N ARG A 123 6.487 -0.539 -11.554 1.00 0.00 N ATOM 2088 CA ARG A 123 7.376 -1.659 -11.067 1.00 0.00 C ATOM 2089 C ARG A 123 8.631 -1.740 -11.958 1.00 0.00 C ATOM 2090 O ARG A 123 9.713 -2.025 -11.479 1.00 0.00 O ATOM 2091 CB ARG A 123 6.568 -2.962 -11.184 1.00 0.00 C ATOM 2092 CG ARG A 123 6.983 -3.921 -10.067 1.00 0.00 C ATOM 2093 CD ARG A 123 8.391 -4.451 -10.345 1.00 0.00 C ATOM 2094 NE ARG A 123 8.485 -5.723 -9.563 1.00 0.00 N ATOM 2095 CZ ARG A 123 8.640 -5.711 -8.249 1.00 0.00 C ATOM 2096 NH1 ARG A 123 8.720 -4.585 -7.578 1.00 0.00 N ATOM 2097 NH2 ARG A 123 8.718 -6.844 -7.597 1.00 0.00 N ATOM 0 H ARG A 123 5.542 -0.813 -11.823 1.00 0.00 H new ATOM 0 HA ARG A 123 7.692 -1.492 -10.037 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.501 -2.748 -11.117 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.740 -3.423 -12.157 1.00 0.00 H new ATOM 0 HG2 ARG A 123 6.960 -3.408 -9.106 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.277 -4.749 -10.004 1.00 0.00 H new ATOM 0 HD2 ARG A 123 8.543 -4.630 -11.409 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.151 -3.736 -10.030 1.00 0.00 H new ATOM 0 HE ARG A 123 8.429 -6.616 -10.052 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.663 -3.693 -8.070 1.00 0.00 H new ATOM 0 HH12 ARG A 123 8.839 -4.602 -6.565 1.00 0.00 H new ATOM 0 HH21 ARG A 123 8.659 -7.728 -8.102 1.00 0.00 H new ATOM 0 HH22 ARG A 123 8.838 -6.842 -6.584 1.00 0.00 H new ATOM 2111 N VAL A 124 8.500 -1.479 -13.247 1.00 0.00 N ATOM 2112 CA VAL A 124 9.703 -1.532 -14.146 1.00 0.00 C ATOM 2113 C VAL A 124 10.511 -0.229 -14.000 1.00 0.00 C ATOM 2114 O VAL A 124 9.966 0.843 -14.174 1.00 0.00 O ATOM 2115 CB VAL A 124 9.170 -1.659 -15.584 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.345 -1.769 -16.559 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.289 -2.909 -15.702 1.00 0.00 C ATOM 0 H VAL A 124 7.623 -1.235 -13.707 1.00 0.00 H new ATOM 0 HA VAL A 124 10.355 -2.368 -13.893 1.00 0.00 H new ATOM 0 HB VAL A 124 8.578 -0.776 -15.826 1.00 0.00 H new ATOM 0 HG11 VAL A 124 9.966 -1.859 -17.577 1.00 0.00 H new ATOM 0 HG12 VAL A 124 10.967 -0.877 -16.481 1.00 0.00 H new ATOM 0 HG13 VAL A 124 10.940 -2.649 -16.314 1.00 0.00 H new ATOM 0 HG21 VAL A 124 7.914 -2.995 -16.722 1.00 0.00 H new ATOM 0 HG22 VAL A 124 8.877 -3.793 -15.456 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.449 -2.829 -15.012 1.00 0.00 H new ATOM 2127 N PRO A 125 11.786 -0.347 -13.692 1.00 0.00 N ATOM 2128 CA PRO A 125 12.636 0.865 -13.542 1.00 0.00 C ATOM 2129 C PRO A 125 12.767 1.605 -14.883 1.00 0.00 C ATOM 2130 O PRO A 125 12.396 1.083 -15.918 1.00 0.00 O ATOM 2131 CB PRO A 125 13.982 0.307 -13.076 1.00 0.00 C ATOM 2132 CG PRO A 125 13.985 -1.108 -13.549 1.00 0.00 C ATOM 2133 CD PRO A 125 12.559 -1.578 -13.461 1.00 0.00 C ATOM 0 HA PRO A 125 12.225 1.594 -12.844 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.813 0.869 -13.501 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.081 0.363 -11.992 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.356 -1.177 -14.572 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.638 -1.725 -12.931 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.339 -2.339 -14.210 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.338 -2.016 -12.487 1.00 0.00 H new ATOM 2141 N ARG A 126 13.281 2.820 -14.875 1.00 0.00 N ATOM 2142 CA ARG A 126 13.416 3.582 -16.168 1.00 0.00 C ATOM 2143 C ARG A 126 14.586 3.036 -17.004 1.00 0.00 C ATOM 2144 O ARG A 126 14.502 2.981 -18.217 1.00 0.00 O ATOM 2145 CB ARG A 126 13.675 5.050 -15.791 1.00 0.00 C ATOM 2146 CG ARG A 126 12.958 5.968 -16.782 1.00 0.00 C ATOM 2147 CD ARG A 126 13.579 5.805 -18.172 1.00 0.00 C ATOM 2148 NE ARG A 126 13.599 7.184 -18.749 1.00 0.00 N ATOM 2149 CZ ARG A 126 14.436 8.107 -18.300 1.00 0.00 C ATOM 2150 NH1 ARG A 126 15.281 7.849 -17.327 1.00 0.00 N ATOM 2151 NH2 ARG A 126 14.424 9.302 -18.832 1.00 0.00 N ATOM 0 H ARG A 126 13.608 3.311 -14.043 1.00 0.00 H new ATOM 0 HA ARG A 126 12.513 3.481 -16.770 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.321 5.244 -14.778 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.746 5.255 -15.799 1.00 0.00 H new ATOM 0 HG2 ARG A 126 11.896 5.725 -16.816 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.037 7.005 -16.456 1.00 0.00 H new ATOM 0 HD2 ARG A 126 14.584 5.389 -18.109 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.991 5.127 -18.790 1.00 0.00 H new ATOM 0 HE ARG A 126 12.955 7.419 -19.504 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.301 6.922 -16.902 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.917 8.576 -16.997 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.773 9.518 -19.587 1.00 0.00 H new ATOM 0 HH22 ARG A 126 15.066 10.018 -18.492 1.00 0.00 H new ATOM 2165 N ALA A 127 15.677 2.634 -16.378 1.00 0.00 N ATOM 2166 CA ALA A 127 16.840 2.099 -17.179 1.00 0.00 C ATOM 2167 C ALA A 127 16.391 0.895 -18.021 1.00 0.00 C ATOM 2168 O ALA A 127 16.784 0.759 -19.166 1.00 0.00 O ATOM 2169 CB ALA A 127 17.917 1.669 -16.171 1.00 0.00 C ATOM 0 H ALA A 127 15.813 2.652 -15.367 1.00 0.00 H new ATOM 0 HA ALA A 127 17.226 2.857 -17.861 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.780 1.274 -16.707 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.222 2.529 -15.575 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.514 0.898 -15.514 1.00 0.00 H new ATOM 2175 N GLN A 128 15.566 0.024 -17.474 1.00 0.00 N ATOM 2176 CA GLN A 128 15.099 -1.159 -18.280 1.00 0.00 C ATOM 2177 C GLN A 128 14.185 -0.672 -19.415 1.00 0.00 C ATOM 2178 O GLN A 128 14.281 -1.143 -20.533 1.00 0.00 O ATOM 2179 CB GLN A 128 14.324 -2.076 -17.320 1.00 0.00 C ATOM 2180 CG GLN A 128 13.846 -3.324 -18.070 1.00 0.00 C ATOM 2181 CD GLN A 128 13.958 -4.550 -17.155 1.00 0.00 C ATOM 2182 OE1 GLN A 128 13.032 -4.865 -16.435 1.00 0.00 O ATOM 2183 NE2 GLN A 128 15.059 -5.264 -17.149 1.00 0.00 N ATOM 0 H GLN A 128 15.202 0.078 -16.523 1.00 0.00 H new ATOM 0 HA GLN A 128 15.936 -1.696 -18.727 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.961 -2.364 -16.484 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.471 -1.542 -16.902 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.814 -3.193 -18.394 1.00 0.00 H new ATOM 0 HG3 GLN A 128 14.445 -3.472 -18.968 1.00 0.00 H new ATOM 0 HE21 GLN A 128 15.839 -5.003 -17.752 1.00 0.00 H new ATOM 0 HE22 GLN A 128 15.135 -6.080 -16.541 1.00 0.00 H new ATOM 2192 N LEU A 129 13.307 0.274 -19.143 1.00 0.00 N ATOM 2193 CA LEU A 129 12.403 0.783 -20.235 1.00 0.00 C ATOM 2194 C LEU A 129 13.242 1.430 -21.348 1.00 0.00 C ATOM 2195 O LEU A 129 12.935 1.283 -22.517 1.00 0.00 O ATOM 2196 CB LEU A 129 11.473 1.828 -19.599 1.00 0.00 C ATOM 2197 CG LEU A 129 10.210 1.140 -19.081 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.454 2.091 -18.152 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.315 0.766 -20.265 1.00 0.00 C ATOM 0 H LEU A 129 13.178 0.709 -18.229 1.00 0.00 H new ATOM 0 HA LEU A 129 11.827 -0.030 -20.677 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.985 2.336 -18.781 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.210 2.590 -20.332 1.00 0.00 H new ATOM 0 HG LEU A 129 10.485 0.240 -18.532 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.554 1.600 -17.783 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.092 2.360 -17.310 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.177 2.992 -18.700 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.413 0.275 -19.899 1.00 0.00 H new ATOM 0 HD22 LEU A 129 9.040 1.668 -20.813 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.853 0.089 -20.928 1.00 0.00 H new ATOM 2211 N GLU A 130 14.299 2.145 -21.005 1.00 0.00 N ATOM 2212 CA GLU A 130 15.140 2.788 -22.078 1.00 0.00 C ATOM 2213 C GLU A 130 15.709 1.711 -23.014 1.00 0.00 C ATOM 2214 O GLU A 130 15.746 1.894 -24.217 1.00 0.00 O ATOM 2215 CB GLU A 130 16.284 3.529 -21.367 1.00 0.00 C ATOM 2216 CG GLU A 130 15.727 4.763 -20.654 1.00 0.00 C ATOM 2217 CD GLU A 130 16.786 5.866 -20.640 1.00 0.00 C ATOM 2218 OE1 GLU A 130 16.933 6.533 -21.650 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.433 6.025 -19.617 1.00 0.00 O ATOM 0 H GLU A 130 14.610 2.308 -20.048 1.00 0.00 H new ATOM 0 HA GLU A 130 14.547 3.476 -22.680 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.768 2.868 -20.648 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.044 3.826 -22.090 1.00 0.00 H new ATOM 0 HG2 GLU A 130 14.828 5.114 -21.161 1.00 0.00 H new ATOM 0 HG3 GLU A 130 15.439 4.508 -19.634 1.00 0.00 H new ATOM 2226 N GLU A 131 16.141 0.584 -22.481 1.00 0.00 N ATOM 2227 CA GLU A 131 16.693 -0.494 -23.378 1.00 0.00 C ATOM 2228 C GLU A 131 15.586 -1.017 -24.306 1.00 0.00 C ATOM 2229 O GLU A 131 15.827 -1.291 -25.466 1.00 0.00 O ATOM 2230 CB GLU A 131 17.200 -1.621 -22.464 1.00 0.00 C ATOM 2231 CG GLU A 131 18.192 -2.496 -23.234 1.00 0.00 C ATOM 2232 CD GLU A 131 19.140 -3.182 -22.250 1.00 0.00 C ATOM 2233 OE1 GLU A 131 20.156 -2.589 -21.926 1.00 0.00 O ATOM 2234 OE2 GLU A 131 18.834 -4.288 -21.835 1.00 0.00 O ATOM 0 H GLU A 131 16.136 0.366 -21.485 1.00 0.00 H new ATOM 0 HA GLU A 131 17.500 -0.112 -24.003 1.00 0.00 H new ATOM 0 HB2 GLU A 131 17.680 -1.199 -21.581 1.00 0.00 H new ATOM 0 HB3 GLU A 131 16.362 -2.224 -22.114 1.00 0.00 H new ATOM 0 HG2 GLU A 131 17.656 -3.243 -23.819 1.00 0.00 H new ATOM 0 HG3 GLU A 131 18.760 -1.887 -23.938 1.00 0.00 H new ATOM 2241 N GLU A 132 14.373 -1.157 -23.808 1.00 0.00 N ATOM 2242 CA GLU A 132 13.260 -1.665 -24.688 1.00 0.00 C ATOM 2243 C GLU A 132 13.050 -0.709 -25.875 1.00 0.00 C ATOM 2244 O GLU A 132 12.820 -1.147 -26.986 1.00 0.00 O ATOM 2245 CB GLU A 132 11.992 -1.713 -23.820 1.00 0.00 C ATOM 2246 CG GLU A 132 12.127 -2.827 -22.780 1.00 0.00 C ATOM 2247 CD GLU A 132 11.732 -4.164 -23.410 1.00 0.00 C ATOM 2248 OE1 GLU A 132 10.543 -4.393 -23.568 1.00 0.00 O ATOM 2249 OE2 GLU A 132 12.623 -4.936 -23.724 1.00 0.00 O ATOM 0 H GLU A 132 14.108 -0.945 -22.846 1.00 0.00 H new ATOM 0 HA GLU A 132 13.497 -2.651 -25.089 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.842 -0.754 -23.324 1.00 0.00 H new ATOM 0 HB3 GLU A 132 11.117 -1.889 -24.445 1.00 0.00 H new ATOM 0 HG2 GLU A 132 13.152 -2.874 -22.413 1.00 0.00 H new ATOM 0 HG3 GLU A 132 11.491 -2.616 -21.921 1.00 0.00 H new ATOM 2256 N ALA A 133 13.126 0.590 -25.654 1.00 0.00 N ATOM 2257 CA ALA A 133 12.924 1.548 -26.801 1.00 0.00 C ATOM 2258 C ALA A 133 14.010 1.326 -27.863 1.00 0.00 C ATOM 2259 O ALA A 133 13.718 1.271 -29.043 1.00 0.00 O ATOM 2260 CB ALA A 133 13.026 2.968 -26.222 1.00 0.00 C ATOM 0 H ALA A 133 13.315 1.022 -24.749 1.00 0.00 H new ATOM 0 HA ALA A 133 11.955 1.394 -27.276 1.00 0.00 H new ATOM 0 HB1 ALA A 133 12.886 3.697 -27.020 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.256 3.108 -25.463 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.009 3.108 -25.772 1.00 0.00 H new ATOM 2266 N ARG A 134 15.259 1.190 -27.461 1.00 0.00 N ATOM 2267 CA ARG A 134 16.346 0.962 -28.482 1.00 0.00 C ATOM 2268 C ARG A 134 16.073 -0.342 -29.251 1.00 0.00 C ATOM 2269 O ARG A 134 16.288 -0.414 -30.447 1.00 0.00 O ATOM 2270 CB ARG A 134 17.669 0.854 -27.708 1.00 0.00 C ATOM 2271 CG ARG A 134 18.835 1.173 -28.645 1.00 0.00 C ATOM 2272 CD ARG A 134 20.107 1.387 -27.822 1.00 0.00 C ATOM 2273 NE ARG A 134 20.807 0.066 -27.843 1.00 0.00 N ATOM 2274 CZ ARG A 134 21.388 -0.388 -28.942 1.00 0.00 C ATOM 2275 NH1 ARG A 134 21.376 0.304 -30.059 1.00 0.00 N ATOM 2276 NH2 ARG A 134 21.988 -1.550 -28.923 1.00 0.00 N ATOM 0 H ARG A 134 15.570 1.226 -26.490 1.00 0.00 H new ATOM 0 HA ARG A 134 16.385 1.777 -29.205 1.00 0.00 H new ATOM 0 HB2 ARG A 134 17.667 1.545 -26.865 1.00 0.00 H new ATOM 0 HB3 ARG A 134 17.782 -0.150 -27.298 1.00 0.00 H new ATOM 0 HG2 ARG A 134 18.980 0.357 -29.353 1.00 0.00 H new ATOM 0 HG3 ARG A 134 18.612 2.066 -29.229 1.00 0.00 H new ATOM 0 HD2 ARG A 134 20.730 2.171 -28.254 1.00 0.00 H new ATOM 0 HD3 ARG A 134 19.871 1.693 -26.803 1.00 0.00 H new ATOM 0 HE ARG A 134 20.837 -0.497 -26.993 1.00 0.00 H new ATOM 0 HH11 ARG A 134 20.912 1.212 -30.092 1.00 0.00 H new ATOM 0 HH12 ARG A 134 21.831 -0.067 -30.893 1.00 0.00 H new ATOM 0 HH21 ARG A 134 22.006 -2.101 -28.065 1.00 0.00 H new ATOM 0 HH22 ARG A 134 22.438 -1.906 -29.767 1.00 0.00 H new ATOM 2290 N LYS A 135 15.601 -1.375 -28.579 1.00 0.00 N ATOM 2291 CA LYS A 135 15.320 -2.669 -29.300 1.00 0.00 C ATOM 2292 C LYS A 135 14.240 -2.465 -30.378 1.00 0.00 C ATOM 2293 O LYS A 135 14.287 -3.091 -31.420 1.00 0.00 O ATOM 2294 CB LYS A 135 14.823 -3.668 -28.242 1.00 0.00 C ATOM 2295 CG LYS A 135 15.965 -4.001 -27.278 1.00 0.00 C ATOM 2296 CD LYS A 135 15.859 -5.465 -26.844 1.00 0.00 C ATOM 2297 CE LYS A 135 14.671 -5.632 -25.895 1.00 0.00 C ATOM 2298 NZ LYS A 135 14.479 -7.104 -25.776 1.00 0.00 N ATOM 0 H LYS A 135 15.401 -1.380 -27.579 1.00 0.00 H new ATOM 0 HA LYS A 135 16.218 -3.034 -29.799 1.00 0.00 H new ATOM 0 HB2 LYS A 135 13.982 -3.245 -27.693 1.00 0.00 H new ATOM 0 HB3 LYS A 135 14.464 -4.577 -28.725 1.00 0.00 H new ATOM 0 HG2 LYS A 135 16.926 -3.823 -27.761 1.00 0.00 H new ATOM 0 HG3 LYS A 135 15.921 -3.348 -26.406 1.00 0.00 H new ATOM 0 HD2 LYS A 135 15.734 -6.106 -27.717 1.00 0.00 H new ATOM 0 HD3 LYS A 135 16.779 -5.776 -26.350 1.00 0.00 H new ATOM 0 HE2 LYS A 135 14.875 -5.180 -24.924 1.00 0.00 H new ATOM 0 HE3 LYS A 135 13.778 -5.148 -26.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 13.680 -7.300 -25.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 14.280 -7.505 -26.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 15.343 -7.537 -25.390 1.00 0.00 H new ATOM 2312 N LYS A 136 13.268 -1.599 -30.147 1.00 0.00 N ATOM 2313 CA LYS A 136 12.204 -1.384 -31.186 1.00 0.00 C ATOM 2314 C LYS A 136 12.427 -0.076 -31.978 1.00 0.00 C ATOM 2315 O LYS A 136 11.512 0.416 -32.612 1.00 0.00 O ATOM 2316 CB LYS A 136 10.883 -1.317 -30.413 1.00 0.00 C ATOM 2317 CG LYS A 136 10.644 -2.645 -29.691 1.00 0.00 C ATOM 2318 CD LYS A 136 9.774 -2.404 -28.455 1.00 0.00 C ATOM 2319 CE LYS A 136 10.118 -3.436 -27.379 1.00 0.00 C ATOM 2320 NZ LYS A 136 9.061 -3.278 -26.342 1.00 0.00 N ATOM 0 H LYS A 136 13.169 -1.043 -29.298 1.00 0.00 H new ATOM 0 HA LYS A 136 12.215 -2.188 -31.922 1.00 0.00 H new ATOM 0 HB2 LYS A 136 10.912 -0.500 -29.692 1.00 0.00 H new ATOM 0 HB3 LYS A 136 10.060 -1.110 -31.097 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.155 -3.353 -30.361 1.00 0.00 H new ATOM 0 HG3 LYS A 136 11.596 -3.089 -29.398 1.00 0.00 H new ATOM 0 HD2 LYS A 136 9.938 -1.396 -28.073 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.719 -2.477 -28.720 1.00 0.00 H new ATOM 0 HE2 LYS A 136 10.122 -4.446 -27.788 1.00 0.00 H new ATOM 0 HE3 LYS A 136 11.109 -3.257 -26.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 9.424 -3.605 -25.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 8.792 -2.276 -26.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 8.228 -3.842 -26.606 1.00 0.00 H new ATOM 2334 N GLY A 137 13.622 0.495 -31.965 1.00 0.00 N ATOM 2335 CA GLY A 137 13.863 1.757 -32.735 1.00 0.00 C ATOM 2336 C GLY A 137 12.855 2.840 -32.317 1.00 0.00 C ATOM 2337 O GLY A 137 12.284 3.512 -33.156 1.00 0.00 O ATOM 0 H GLY A 137 14.430 0.138 -31.456 1.00 0.00 H new ATOM 0 HA2 GLY A 137 14.879 2.110 -32.559 1.00 0.00 H new ATOM 0 HA3 GLY A 137 13.774 1.561 -33.804 1.00 0.00 H new ATOM 2341 N THR A 138 12.630 3.019 -31.031 1.00 0.00 N ATOM 2342 CA THR A 138 11.660 4.062 -30.581 1.00 0.00 C ATOM 2343 C THR A 138 12.193 4.772 -29.323 1.00 0.00 C ATOM 2344 O THR A 138 13.367 4.684 -29.015 1.00 0.00 O ATOM 2345 CB THR A 138 10.364 3.298 -30.279 1.00 0.00 C ATOM 2346 OG1 THR A 138 9.367 4.217 -29.853 1.00 0.00 O ATOM 2347 CG2 THR A 138 10.606 2.262 -29.178 1.00 0.00 C ATOM 0 H THR A 138 13.076 2.489 -30.282 1.00 0.00 H new ATOM 0 HA THR A 138 11.501 4.836 -31.332 1.00 0.00 H new ATOM 0 HB THR A 138 10.033 2.784 -31.182 1.00 0.00 H new ATOM 0 HG1 THR A 138 8.537 3.733 -29.661 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.679 1.726 -28.972 1.00 0.00 H new ATOM 0 HG22 THR A 138 11.369 1.555 -29.505 1.00 0.00 H new ATOM 0 HG23 THR A 138 10.942 2.766 -28.272 1.00 0.00 H new ATOM 2355 N GLN A 139 11.348 5.476 -28.597 1.00 0.00 N ATOM 2356 CA GLN A 139 11.825 6.182 -27.370 1.00 0.00 C ATOM 2357 C GLN A 139 10.800 6.030 -26.237 1.00 0.00 C ATOM 2358 O GLN A 139 9.607 6.000 -26.478 1.00 0.00 O ATOM 2359 CB GLN A 139 11.954 7.649 -27.782 1.00 0.00 C ATOM 2360 CG GLN A 139 13.340 7.889 -28.385 1.00 0.00 C ATOM 2361 CD GLN A 139 13.270 9.054 -29.381 1.00 0.00 C ATOM 2362 OE1 GLN A 139 13.909 10.069 -29.184 1.00 0.00 O ATOM 2363 NE2 GLN A 139 12.518 8.956 -30.450 1.00 0.00 N ATOM 0 H GLN A 139 10.356 5.588 -28.804 1.00 0.00 H new ATOM 0 HA GLN A 139 12.768 5.777 -27.001 1.00 0.00 H new ATOM 0 HB2 GLN A 139 11.181 7.904 -28.507 1.00 0.00 H new ATOM 0 HB3 GLN A 139 11.805 8.295 -26.917 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.058 8.114 -27.596 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.691 6.988 -28.887 1.00 0.00 H new ATOM 0 HE21 GLN A 139 11.980 8.106 -30.619 1.00 0.00 H new ATOM 0 HE22 GLN A 139 12.471 9.730 -31.113 1.00 0.00 H new ATOM 2372 N VAL A 140 11.249 5.934 -25.000 1.00 0.00 N ATOM 2373 CA VAL A 140 10.290 5.787 -23.864 1.00 0.00 C ATOM 2374 C VAL A 140 10.645 6.776 -22.741 1.00 0.00 C ATOM 2375 O VAL A 140 11.753 7.275 -22.684 1.00 0.00 O ATOM 2376 CB VAL A 140 10.447 4.336 -23.387 1.00 0.00 C ATOM 2377 CG1 VAL A 140 11.898 4.077 -22.954 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.506 4.086 -22.204 1.00 0.00 C ATOM 0 H VAL A 140 12.234 5.952 -24.736 1.00 0.00 H new ATOM 0 HA VAL A 140 9.263 6.001 -24.159 1.00 0.00 H new ATOM 0 HB VAL A 140 10.196 3.661 -24.205 1.00 0.00 H new ATOM 0 HG11 VAL A 140 11.999 3.045 -22.617 1.00 0.00 H new ATOM 0 HG12 VAL A 140 12.566 4.250 -23.798 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.160 4.752 -22.139 1.00 0.00 H new ATOM 0 HG21 VAL A 140 9.615 3.056 -21.863 1.00 0.00 H new ATOM 0 HG22 VAL A 140 9.756 4.766 -21.390 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.476 4.257 -22.516 1.00 0.00 H new ATOM 2388 N SER A 141 9.719 7.065 -21.849 1.00 0.00 N ATOM 2389 CA SER A 141 10.027 8.024 -20.739 1.00 0.00 C ATOM 2390 C SER A 141 8.920 8.007 -19.666 1.00 0.00 C ATOM 2391 O SER A 141 8.058 8.865 -19.649 1.00 0.00 O ATOM 2392 CB SER A 141 10.092 9.389 -21.417 1.00 0.00 C ATOM 2393 OG SER A 141 10.321 10.393 -20.438 1.00 0.00 O ATOM 0 H SER A 141 8.774 6.681 -21.844 1.00 0.00 H new ATOM 0 HA SER A 141 10.953 7.767 -20.225 1.00 0.00 H new ATOM 0 HB2 SER A 141 10.890 9.401 -22.159 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.161 9.588 -21.947 1.00 0.00 H new ATOM 0 HG SER A 141 10.364 11.270 -20.873 1.00 0.00 H new ATOM 2399 N PHE A 142 8.939 7.040 -18.771 1.00 0.00 N ATOM 2400 CA PHE A 142 7.886 6.985 -17.706 1.00 0.00 C ATOM 2401 C PHE A 142 8.386 7.686 -16.426 1.00 0.00 C ATOM 2402 O PHE A 142 9.573 7.847 -16.218 1.00 0.00 O ATOM 2403 CB PHE A 142 7.629 5.482 -17.457 1.00 0.00 C ATOM 2404 CG PHE A 142 6.840 5.274 -16.175 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.459 5.509 -16.136 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.504 4.853 -15.020 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.750 5.322 -14.939 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.801 4.667 -13.836 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.428 4.900 -13.785 1.00 0.00 C ATOM 0 H PHE A 142 9.633 6.294 -18.734 1.00 0.00 H new ATOM 0 HA PHE A 142 6.971 7.497 -18.004 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.082 5.058 -18.299 1.00 0.00 H new ATOM 0 HB3 PHE A 142 8.579 4.952 -17.395 1.00 0.00 H new ATOM 0 HD1 PHE A 142 4.941 5.834 -17.026 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.568 4.671 -15.048 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.686 5.502 -14.906 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.322 4.339 -12.949 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.888 4.756 -12.861 1.00 0.00 H new ATOM 2419 N HIS A 143 7.476 8.083 -15.563 1.00 0.00 N ATOM 2420 CA HIS A 143 7.873 8.748 -14.287 1.00 0.00 C ATOM 2421 C HIS A 143 7.037 8.164 -13.140 1.00 0.00 C ATOM 2422 O HIS A 143 7.564 7.572 -12.218 1.00 0.00 O ATOM 2423 CB HIS A 143 7.554 10.230 -14.492 1.00 0.00 C ATOM 2424 CG HIS A 143 8.527 10.821 -15.475 1.00 0.00 C ATOM 2425 ND1 HIS A 143 8.123 11.671 -16.493 1.00 0.00 N ATOM 2426 CD2 HIS A 143 9.887 10.697 -15.608 1.00 0.00 C ATOM 2427 CE1 HIS A 143 9.221 12.022 -17.188 1.00 0.00 C ATOM 2428 NE2 HIS A 143 10.323 11.455 -16.690 1.00 0.00 N ATOM 0 H HIS A 143 6.471 7.972 -15.693 1.00 0.00 H new ATOM 0 HA HIS A 143 8.924 8.601 -14.038 1.00 0.00 H new ATOM 0 HB2 HIS A 143 6.534 10.346 -14.859 1.00 0.00 H new ATOM 0 HB3 HIS A 143 7.613 10.761 -13.542 1.00 0.00 H new ATOM 0 HD2 HIS A 143 10.523 10.101 -14.970 1.00 0.00 H new ATOM 0 HE1 HIS A 143 9.212 12.681 -18.043 1.00 0.00 H new ATOM 0 HE2 HIS A 143 11.279 11.556 -17.030 1.00 0.00 H new ATOM 2436 N GLN A 144 5.732 8.312 -13.204 1.00 0.00 N ATOM 2437 CA GLN A 144 4.851 7.754 -12.138 1.00 0.00 C ATOM 2438 C GLN A 144 3.629 7.084 -12.786 1.00 0.00 C ATOM 2439 O GLN A 144 3.224 7.458 -13.872 1.00 0.00 O ATOM 2440 CB GLN A 144 4.428 8.958 -11.286 1.00 0.00 C ATOM 2441 CG GLN A 144 3.727 10.008 -12.159 1.00 0.00 C ATOM 2442 CD GLN A 144 4.730 11.098 -12.559 1.00 0.00 C ATOM 2443 OE1 GLN A 144 5.603 11.443 -11.787 1.00 0.00 O ATOM 2444 NE2 GLN A 144 4.648 11.660 -13.741 1.00 0.00 N ATOM 0 H GLN A 144 5.242 8.799 -13.955 1.00 0.00 H new ATOM 0 HA GLN A 144 5.352 7.000 -11.531 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.759 8.632 -10.490 1.00 0.00 H new ATOM 0 HB3 GLN A 144 5.302 9.398 -10.807 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.312 9.537 -13.050 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.892 10.450 -11.615 1.00 0.00 H new ATOM 0 HE21 GLN A 144 3.917 11.374 -14.392 1.00 0.00 H new ATOM 0 HE22 GLN A 144 5.315 12.383 -14.009 1.00 0.00 H new ATOM 2453 N CYS A 145 3.039 6.098 -12.141 1.00 0.00 N ATOM 2454 CA CYS A 145 1.844 5.424 -12.757 1.00 0.00 C ATOM 2455 C CYS A 145 0.535 6.047 -12.240 1.00 0.00 C ATOM 2456 O CYS A 145 0.499 6.627 -11.172 1.00 0.00 O ATOM 2457 CB CYS A 145 1.940 3.924 -12.403 1.00 0.00 C ATOM 2458 SG CYS A 145 1.726 3.638 -10.619 1.00 0.00 S ATOM 0 H CYS A 145 3.327 5.736 -11.232 1.00 0.00 H new ATOM 0 HA CYS A 145 1.837 5.555 -13.839 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.179 3.371 -12.954 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.908 3.537 -12.720 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.540 5.938 -12.999 1.00 0.00 N ATOM 2464 CA VAL A 146 -1.846 6.541 -12.541 1.00 0.00 C ATOM 2465 C VAL A 146 -2.488 5.712 -11.412 1.00 0.00 C ATOM 2466 O VAL A 146 -3.250 6.245 -10.628 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.773 6.595 -13.776 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -3.084 5.180 -14.282 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -4.081 7.293 -13.395 1.00 0.00 C ATOM 0 H VAL A 146 -0.571 5.465 -13.902 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.679 7.538 -12.133 1.00 0.00 H new ATOM 0 HB VAL A 146 -2.269 7.148 -14.569 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -3.738 5.240 -15.152 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -2.156 4.681 -14.560 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -3.579 4.613 -13.494 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -4.738 7.333 -14.264 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -4.570 6.737 -12.595 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.867 8.306 -13.055 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.201 4.419 -11.308 1.00 0.00 N ATOM 2480 CA HIS A 147 -2.825 3.596 -10.197 1.00 0.00 C ATOM 2481 C HIS A 147 -2.617 4.311 -8.843 1.00 0.00 C ATOM 2482 O HIS A 147 -3.539 4.452 -8.063 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.109 2.226 -10.195 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.336 1.490 -11.503 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.323 1.854 -12.419 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.705 0.397 -12.062 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -3.252 0.998 -13.455 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.286 0.094 -13.289 1.00 0.00 N ATOM 0 H HIS A 147 -1.575 3.908 -11.930 1.00 0.00 H new ATOM 0 HA HIS A 147 -3.897 3.470 -10.351 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.040 2.371 -10.036 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.476 1.622 -9.365 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -0.883 -0.142 -11.614 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.900 1.038 -14.318 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -2.028 -0.659 -13.926 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.414 4.773 -8.574 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.141 5.486 -7.297 1.00 0.00 C ATOM 2498 C CYS A 148 -0.176 6.665 -7.535 1.00 0.00 C ATOM 2499 O CYS A 148 0.259 6.896 -8.647 1.00 0.00 O ATOM 2500 CB CYS A 148 -0.495 4.420 -6.414 1.00 0.00 C ATOM 2501 SG CYS A 148 1.069 3.844 -7.135 1.00 0.00 S ATOM 0 H CYS A 148 -0.609 4.682 -9.194 1.00 0.00 H new ATOM 0 HA CYS A 148 -2.037 5.913 -6.847 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -0.314 4.827 -5.419 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.177 3.578 -6.295 1.00 0.00 H new ATOM 2506 N GLY A 149 0.192 7.386 -6.495 1.00 0.00 N ATOM 2507 CA GLY A 149 1.156 8.511 -6.663 1.00 0.00 C ATOM 2508 C GLY A 149 2.572 7.952 -6.448 1.00 0.00 C ATOM 2509 O GLY A 149 3.265 8.340 -5.528 1.00 0.00 O ATOM 0 H GLY A 149 -0.137 7.238 -5.541 1.00 0.00 H new ATOM 0 HA2 GLY A 149 1.064 8.947 -7.658 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.946 9.305 -5.946 1.00 0.00 H new ATOM 2513 N CYS A 150 2.996 7.024 -7.283 1.00 0.00 N ATOM 2514 CA CYS A 150 4.353 6.417 -7.123 1.00 0.00 C ATOM 2515 C CYS A 150 5.295 6.968 -8.203 1.00 0.00 C ATOM 2516 O CYS A 150 4.909 7.101 -9.347 1.00 0.00 O ATOM 2517 CB CYS A 150 4.107 4.906 -7.295 1.00 0.00 C ATOM 2518 SG CYS A 150 5.660 3.974 -7.363 1.00 0.00 S ATOM 0 H CYS A 150 2.455 6.664 -8.069 1.00 0.00 H new ATOM 0 HA CYS A 150 4.824 6.641 -6.166 1.00 0.00 H new ATOM 0 HB2 CYS A 150 3.500 4.540 -6.467 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.539 4.732 -8.209 1.00 0.00 H new ATOM 2523 N ARG A 151 6.529 7.276 -7.857 1.00 0.00 N ATOM 2524 CA ARG A 151 7.480 7.807 -8.891 1.00 0.00 C ATOM 2525 C ARG A 151 8.278 6.647 -9.506 1.00 0.00 C ATOM 2526 O ARG A 151 9.494 6.637 -9.472 1.00 0.00 O ATOM 2527 CB ARG A 151 8.415 8.777 -8.153 1.00 0.00 C ATOM 2528 CG ARG A 151 9.075 9.717 -9.163 1.00 0.00 C ATOM 2529 CD ARG A 151 8.088 10.820 -9.556 1.00 0.00 C ATOM 2530 NE ARG A 151 8.931 12.037 -9.757 1.00 0.00 N ATOM 2531 CZ ARG A 151 9.723 12.160 -10.811 1.00 0.00 C ATOM 2532 NH1 ARG A 151 9.801 11.216 -11.723 1.00 0.00 N ATOM 2533 NH2 ARG A 151 10.448 13.239 -10.955 1.00 0.00 N ATOM 0 H ARG A 151 6.913 7.184 -6.917 1.00 0.00 H new ATOM 0 HA ARG A 151 6.957 8.311 -9.703 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.852 9.353 -7.418 1.00 0.00 H new ATOM 0 HB3 ARG A 151 9.176 8.220 -7.607 1.00 0.00 H new ATOM 0 HG2 ARG A 151 9.975 10.156 -8.733 1.00 0.00 H new ATOM 0 HG3 ARG A 151 9.384 9.159 -10.047 1.00 0.00 H new ATOM 0 HD2 ARG A 151 7.547 10.560 -10.466 1.00 0.00 H new ATOM 0 HD3 ARG A 151 7.343 10.980 -8.776 1.00 0.00 H new ATOM 0 HE ARG A 151 8.896 12.788 -9.068 1.00 0.00 H new ATOM 0 HH11 ARG A 151 9.244 10.367 -11.627 1.00 0.00 H new ATOM 0 HH12 ARG A 151 10.418 11.333 -12.527 1.00 0.00 H new ATOM 0 HH21 ARG A 151 10.402 13.981 -10.257 1.00 0.00 H new ATOM 0 HH22 ARG A 151 11.060 13.338 -11.765 1.00 0.00 H new ATOM 2547 N GLY A 152 7.602 5.663 -10.068 1.00 0.00 N ATOM 2548 CA GLY A 152 8.321 4.512 -10.677 1.00 0.00 C ATOM 2549 C GLY A 152 9.132 3.780 -9.601 1.00 0.00 C ATOM 2550 O GLY A 152 10.241 4.170 -9.287 1.00 0.00 O ATOM 0 H GLY A 152 6.585 5.617 -10.126 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.608 3.828 -11.137 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.983 4.862 -11.469 1.00 0.00 H new ATOM 2554 N CYS A 153 8.593 2.719 -9.034 1.00 0.00 N ATOM 2555 CA CYS A 153 9.354 1.971 -7.982 1.00 0.00 C ATOM 2556 C CYS A 153 9.911 0.655 -8.556 1.00 0.00 C ATOM 2557 O CYS A 153 9.188 -0.124 -9.148 1.00 0.00 O ATOM 2558 CB CYS A 153 8.362 1.722 -6.822 1.00 0.00 C ATOM 2559 SG CYS A 153 7.044 0.564 -7.302 1.00 0.00 S ATOM 0 H CYS A 153 7.670 2.345 -9.253 1.00 0.00 H new ATOM 0 HA CYS A 153 10.216 2.536 -7.627 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.900 1.324 -5.962 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.920 2.669 -6.512 1.00 0.00 H new ATOM 2564 N ALA A 154 11.192 0.403 -8.389 1.00 0.00 N ATOM 2565 CA ALA A 154 11.788 -0.856 -8.927 1.00 0.00 C ATOM 2566 C ALA A 154 12.766 -1.448 -7.904 1.00 0.00 C ATOM 2567 O ALA A 154 13.473 -0.720 -7.233 1.00 0.00 O ATOM 2568 CB ALA A 154 12.527 -0.434 -10.195 1.00 0.00 C ATOM 0 H ALA A 154 11.845 1.017 -7.903 1.00 0.00 H new ATOM 0 HA ALA A 154 11.037 -1.619 -9.132 1.00 0.00 H new ATOM 0 HB1 ALA A 154 12.994 -1.307 -10.651 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.821 0.008 -10.898 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.294 0.298 -9.942 1.00 0.00 H new ATOM 2574 N SER A 155 12.819 -2.758 -7.776 1.00 0.00 N ATOM 2575 CA SER A 155 13.759 -3.370 -6.788 1.00 0.00 C ATOM 2576 C SER A 155 14.896 -4.103 -7.521 1.00 0.00 C ATOM 2577 O SER A 155 16.057 -3.795 -7.328 1.00 0.00 O ATOM 2578 CB SER A 155 12.915 -4.356 -5.981 1.00 0.00 C ATOM 2579 OG SER A 155 11.575 -3.885 -5.921 1.00 0.00 O ATOM 0 H SER A 155 12.256 -3.420 -8.310 1.00 0.00 H new ATOM 0 HA SER A 155 14.224 -2.621 -6.147 1.00 0.00 H new ATOM 0 HB2 SER A 155 12.946 -5.343 -6.443 1.00 0.00 H new ATOM 0 HB3 SER A 155 13.321 -4.462 -4.975 1.00 0.00 H new ATOM 0 HG SER A 155 11.048 -4.472 -5.340 1.00 0.00 H new ATOM 2585 N THR A 156 14.577 -5.069 -8.360 1.00 0.00 N ATOM 2586 CA THR A 156 15.654 -5.809 -9.094 1.00 0.00 C ATOM 2587 C THR A 156 15.091 -6.481 -10.361 1.00 0.00 C ATOM 2588 O THR A 156 15.457 -7.595 -10.685 1.00 0.00 O ATOM 2589 CB THR A 156 16.166 -6.861 -8.104 1.00 0.00 C ATOM 2590 OG1 THR A 156 17.186 -7.632 -8.723 1.00 0.00 O ATOM 2591 CG2 THR A 156 15.019 -7.782 -7.677 1.00 0.00 C ATOM 0 H THR A 156 13.625 -5.372 -8.564 1.00 0.00 H new ATOM 0 HA THR A 156 16.449 -5.142 -9.426 1.00 0.00 H new ATOM 0 HB THR A 156 16.566 -6.359 -7.223 1.00 0.00 H new ATOM 0 HG1 THR A 156 16.881 -7.930 -9.605 1.00 0.00 H new ATOM 0 HG21 THR A 156 15.393 -8.526 -6.974 1.00 0.00 H new ATOM 0 HG22 THR A 156 14.237 -7.192 -7.200 1.00 0.00 H new ATOM 0 HG23 THR A 156 14.610 -8.284 -8.554 1.00 0.00 H new ATOM 2599 N ASP A 157 14.205 -5.818 -11.077 1.00 0.00 N ATOM 2600 CA ASP A 157 13.632 -6.431 -12.313 1.00 0.00 C ATOM 2601 C ASP A 157 13.368 -5.354 -13.370 1.00 0.00 C ATOM 2602 O ASP A 157 12.406 -5.496 -14.106 1.00 0.00 O ATOM 2603 CB ASP A 157 12.319 -7.073 -11.862 1.00 0.00 C ATOM 2604 CG ASP A 157 12.612 -8.166 -10.834 1.00 0.00 C ATOM 2605 OD1 ASP A 157 12.772 -7.832 -9.671 1.00 0.00 O ATOM 2606 OD2 ASP A 157 12.673 -9.321 -11.225 1.00 0.00 O ATOM 2607 OXT ASP A 157 14.135 -4.407 -13.425 1.00 0.00 O ATOM 0 H ASP A 157 13.859 -4.884 -10.855 1.00 0.00 H new ATOM 0 HA ASP A 157 14.309 -7.156 -12.765 1.00 0.00 H new ATOM 0 HB2 ASP A 157 11.663 -6.318 -11.429 1.00 0.00 H new ATOM 0 HB3 ASP A 157 11.796 -7.496 -12.719 1.00 0.00 H new TER 2612 ASP A 157 HETATM 2613 ZN ZN A1000 1.386 1.623 -6.672 1.00 0.00 ZN HETATM 2614 ZN ZN A1001 5.113 1.753 -7.694 1.00 0.00 ZN HETATM 2615 ZN ZN A1002 2.222 1.408 -10.280 1.00 0.00 ZN