USER MOD reduce.3.24.130724 H: found=0, std=0, add=539, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 531 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 189 TYR OH : rot -32:sc= 1.21 USER MOD Set 1.2: A 193 GLN : amide:sc= 0.843 K(o=2,f=-0.23) USER MOD Set 2.1: A 171 CYS SG : rot -129:sc= 0.459 USER MOD Set 2.2: A 177 CYS SG : rot -145:sc= 0.436 USER MOD Set 2.3: A 187 CYS SG : rot 52:sc= -0.868 USER MOD Set 2.4: A 190 CYS SG : rot 114:sc= -1.46 USER MOD Set 3.1: A 162 THR OG1 : rot 78:sc= 1.87 USER MOD Set 3.2: A 169 TYR OH : rot 5:sc= 1.21 USER MOD Set 4.1: A 143 SER OG : rot 99:sc= 1.25 USER MOD Set 4.2: A 146 HIS : no HE2:sc= 0.624 K(o=1.9,f=-6.9!) USER MOD Set 5.1: A 135 CYS SG : rot -145:sc= 0.298 USER MOD Set 5.2: A 138 CYS SG : rot 101:sc= 1.12 USER MOD Set 5.3: A 151 SER OG : rot 36:sc= 0.225 USER MOD Set 5.4: A 152 CYS SG : rot -73:sc= 0.48 USER MOD Set 5.5: A 155 CYS SG : rot 96:sc= 0.153 USER MOD Set 5.6: A 200 MET CE :methyl 171:sc= -0.379 (180deg=-0.711) USER MOD Single : A 133 HIS : no HE2:sc= 0.267 K(o=0.27,f=-4.2!) USER MOD Single : A 142 SER OG : rot 120:sc= 0.978 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 TYR OH : rot -177:sc= 1.03 USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 LYS NZ :NH3+ 166:sc= -0.0105 (180deg=-0.211) USER MOD Single : A 160 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0249) USER MOD Single : A 165 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0468) USER MOD Single : A 168 THR OG1 : rot 15:sc= 0.547 USER MOD Single : A 170 THR OG1 : rot 180:sc= -0.0978 USER MOD Single : A 174 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 175 LYS NZ :NH3+ -165:sc= 0.681 (180deg=0.448) USER MOD Single : A 188 GLN : amide:sc= 0.366 K(o=0.37,f=-4.1!) USER MOD Single : A 192 TYR OH : rot 137:sc= 2.17 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0.689 (180deg=0.689) USER MOD Single : A 198 MET CE :methyl 175:sc= -0.0562 (180deg=-0.144) USER MOD Single : A 201 LYS NZ :NH3+ 166:sc= 0.814 (180deg=0.64) USER MOD Single : A 206 GLN : amide:sc= 0.645 K(o=0.65,f=-10!) USER MOD ----------------------------------------------------------------- ATOM 57 N HIS A 133 -2.859 -3.301 15.815 1.00 0.00 N ATOM 58 CA HIS A 133 -3.442 -2.476 14.768 1.00 0.00 C ATOM 59 C HIS A 133 -3.414 -3.198 13.418 1.00 0.00 C ATOM 60 O HIS A 133 -2.351 -3.611 12.956 1.00 0.00 O ATOM 61 CB HIS A 133 -2.678 -1.147 14.713 1.00 0.00 C ATOM 62 CG HIS A 133 -3.347 -0.057 13.909 1.00 0.00 C ATOM 63 ND1 HIS A 133 -3.832 -0.156 12.624 1.00 0.00 N ATOM 64 CD2 HIS A 133 -3.453 1.257 14.280 1.00 0.00 C ATOM 65 CE1 HIS A 133 -4.235 1.067 12.242 1.00 0.00 C ATOM 66 NE2 HIS A 133 -4.018 1.964 13.216 1.00 0.00 N ATOM 0 HA HIS A 133 -4.490 -2.279 14.994 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -2.531 -0.788 15.732 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -1.689 -1.331 14.294 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -3.877 -1.006 12.062 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -3.152 1.674 15.230 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -4.674 1.297 11.282 1.00 0.00 H new ATOM 74 N ILE A 134 -4.582 -3.351 12.791 1.00 0.00 N ATOM 75 CA ILE A 134 -4.735 -4.002 11.494 1.00 0.00 C ATOM 76 C ILE A 134 -4.090 -3.177 10.377 1.00 0.00 C ATOM 77 O ILE A 134 -3.845 -1.984 10.546 1.00 0.00 O ATOM 78 CB ILE A 134 -6.224 -4.244 11.187 1.00 0.00 C ATOM 79 CG1 ILE A 134 -7.096 -2.993 11.421 1.00 0.00 C ATOM 80 CG2 ILE A 134 -6.733 -5.462 11.959 1.00 0.00 C ATOM 81 CD1 ILE A 134 -8.526 -3.149 10.892 1.00 0.00 C ATOM 0 H ILE A 134 -5.464 -3.018 13.181 1.00 0.00 H new ATOM 0 HA ILE A 134 -4.223 -4.963 11.541 1.00 0.00 H new ATOM 0 HB ILE A 134 -6.310 -4.458 10.122 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -7.132 -2.777 12.489 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -6.628 -2.136 10.938 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -7.787 -5.622 11.733 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -6.162 -6.343 11.667 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -6.613 -5.291 13.029 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -9.088 -2.236 11.087 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -8.498 -3.336 9.818 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -9.010 -3.987 11.394 1.00 0.00 H new ATOM 93 N CYS A 135 -3.812 -3.816 9.240 1.00 0.00 N ATOM 94 CA CYS A 135 -3.194 -3.169 8.097 1.00 0.00 C ATOM 95 C CYS A 135 -4.101 -2.047 7.611 1.00 0.00 C ATOM 96 O CYS A 135 -5.232 -2.311 7.211 1.00 0.00 O ATOM 97 CB CYS A 135 -2.945 -4.182 6.973 1.00 0.00 C ATOM 98 SG CYS A 135 -2.219 -3.466 5.472 1.00 0.00 S ATOM 0 H CYS A 135 -4.014 -4.805 9.092 1.00 0.00 H new ATOM 0 HA CYS A 135 -2.230 -2.755 8.394 1.00 0.00 H new ATOM 0 HB2 CYS A 135 -2.284 -4.965 7.345 1.00 0.00 H new ATOM 0 HB3 CYS A 135 -3.890 -4.659 6.714 1.00 0.00 H new ATOM 0 HG CYS A 135 -2.686 -4.083 4.427 1.00 0.00 H new ATOM 103 N ALA A 136 -3.611 -0.809 7.623 1.00 0.00 N ATOM 104 CA ALA A 136 -4.370 0.354 7.185 1.00 0.00 C ATOM 105 C ALA A 136 -5.040 0.138 5.824 1.00 0.00 C ATOM 106 O ALA A 136 -6.158 0.587 5.593 1.00 0.00 O ATOM 107 CB ALA A 136 -3.427 1.558 7.129 1.00 0.00 C ATOM 0 H ALA A 136 -2.668 -0.586 7.940 1.00 0.00 H new ATOM 0 HA ALA A 136 -5.173 0.529 7.901 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -3.980 2.439 6.802 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -3.009 1.739 8.119 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -2.619 1.355 6.426 1.00 0.00 H new ATOM 113 N ILE A 137 -4.322 -0.517 4.912 1.00 0.00 N ATOM 114 CA ILE A 137 -4.747 -0.718 3.535 1.00 0.00 C ATOM 115 C ILE A 137 -5.789 -1.834 3.359 1.00 0.00 C ATOM 116 O ILE A 137 -6.750 -1.620 2.624 1.00 0.00 O ATOM 117 CB ILE A 137 -3.495 -0.928 2.662 1.00 0.00 C ATOM 118 CG1 ILE A 137 -2.609 0.333 2.689 1.00 0.00 C ATOM 119 CG2 ILE A 137 -3.863 -1.246 1.207 1.00 0.00 C ATOM 120 CD1 ILE A 137 -1.158 -0.002 2.347 1.00 0.00 C ATOM 0 H ILE A 137 -3.412 -0.929 5.118 1.00 0.00 H new ATOM 0 HA ILE A 137 -5.275 0.178 3.207 1.00 0.00 H new ATOM 0 HB ILE A 137 -2.952 -1.777 3.076 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -2.993 1.065 1.979 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -2.656 0.792 3.677 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -2.953 -1.387 0.624 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -4.460 -2.157 1.174 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -4.438 -0.420 0.788 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -0.558 0.908 2.374 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -0.768 -0.715 3.073 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -1.111 -0.438 1.349 1.00 0.00 H new ATOM 132 N CYS A 138 -5.589 -3.021 3.954 1.00 0.00 N ATOM 133 CA CYS A 138 -6.464 -4.182 3.724 1.00 0.00 C ATOM 134 C CYS A 138 -7.008 -4.879 4.975 1.00 0.00 C ATOM 135 O CYS A 138 -7.695 -5.893 4.870 1.00 0.00 O ATOM 136 CB CYS A 138 -5.743 -5.181 2.813 1.00 0.00 C ATOM 137 SG CYS A 138 -4.201 -5.890 3.443 1.00 0.00 S ATOM 0 H CYS A 138 -4.823 -3.202 4.603 1.00 0.00 H new ATOM 0 HA CYS A 138 -7.358 -3.781 3.247 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -6.429 -5.999 2.595 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -5.528 -4.685 1.867 1.00 0.00 H new ATOM 0 HG CYS A 138 -4.428 -7.085 3.902 1.00 0.00 H new ATOM 142 N GLY A 139 -6.729 -4.361 6.167 1.00 0.00 N ATOM 143 CA GLY A 139 -7.257 -4.908 7.404 1.00 0.00 C ATOM 144 C GLY A 139 -6.591 -6.203 7.880 1.00 0.00 C ATOM 145 O GLY A 139 -6.957 -6.708 8.938 1.00 0.00 O ATOM 0 H GLY A 139 -6.128 -3.547 6.299 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -7.156 -4.157 8.187 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -8.324 -5.093 7.275 1.00 0.00 H new ATOM 149 N ASP A 140 -5.629 -6.756 7.134 1.00 0.00 N ATOM 150 CA ASP A 140 -4.939 -7.980 7.524 1.00 0.00 C ATOM 151 C ASP A 140 -3.980 -7.714 8.690 1.00 0.00 C ATOM 152 O ASP A 140 -3.793 -6.575 9.107 1.00 0.00 O ATOM 153 CB ASP A 140 -4.205 -8.561 6.310 1.00 0.00 C ATOM 154 CG ASP A 140 -5.178 -9.213 5.333 1.00 0.00 C ATOM 155 OD1 ASP A 140 -5.567 -10.367 5.611 1.00 0.00 O ATOM 156 OD2 ASP A 140 -5.525 -8.540 4.342 1.00 0.00 O ATOM 0 H ASP A 140 -5.311 -6.366 6.247 1.00 0.00 H new ATOM 0 HA ASP A 140 -5.668 -8.713 7.869 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -3.653 -7.769 5.803 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -3.473 -9.297 6.643 1.00 0.00 H new ATOM 161 N ARG A 141 -3.360 -8.773 9.214 1.00 0.00 N ATOM 162 CA ARG A 141 -2.402 -8.679 10.306 1.00 0.00 C ATOM 163 C ARG A 141 -1.193 -7.847 9.864 1.00 0.00 C ATOM 164 O ARG A 141 -0.462 -8.260 8.964 1.00 0.00 O ATOM 165 CB ARG A 141 -1.985 -10.100 10.711 1.00 0.00 C ATOM 166 CG ARG A 141 -0.897 -10.159 11.791 1.00 0.00 C ATOM 167 CD ARG A 141 -1.324 -9.545 13.126 1.00 0.00 C ATOM 168 NE ARG A 141 -0.924 -8.134 13.202 1.00 0.00 N ATOM 169 CZ ARG A 141 -1.678 -7.087 13.563 1.00 0.00 C ATOM 170 NH1 ARG A 141 -2.995 -7.196 13.768 1.00 0.00 N ATOM 171 NH2 ARG A 141 -1.075 -5.905 13.689 1.00 0.00 N ATOM 0 H ARG A 141 -3.513 -9.727 8.886 1.00 0.00 H new ATOM 0 HA ARG A 141 -2.849 -8.182 11.167 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -2.864 -10.635 11.069 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -1.630 -10.627 9.826 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -0.614 -11.199 11.953 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -0.009 -9.640 11.429 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -2.405 -9.628 13.241 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -0.873 -10.101 13.948 1.00 0.00 H new ATOM 0 HE ARG A 141 0.042 -7.926 12.950 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -3.457 -8.098 13.650 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -3.538 -6.377 14.042 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -0.074 -5.822 13.512 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -1.615 -5.084 13.962 1.00 0.00 H new ATOM 185 N SER A 142 -0.965 -6.695 10.496 1.00 0.00 N ATOM 186 CA SER A 142 0.178 -5.855 10.183 1.00 0.00 C ATOM 187 C SER A 142 1.450 -6.492 10.722 1.00 0.00 C ATOM 188 O SER A 142 1.467 -6.968 11.858 1.00 0.00 O ATOM 189 CB SER A 142 0.049 -4.466 10.814 1.00 0.00 C ATOM 190 OG SER A 142 -1.176 -3.870 10.473 1.00 0.00 O ATOM 0 H SER A 142 -1.566 -6.325 11.233 1.00 0.00 H new ATOM 0 HA SER A 142 0.217 -5.756 9.098 1.00 0.00 H new ATOM 0 HB2 SER A 142 0.129 -4.546 11.898 1.00 0.00 H new ATOM 0 HB3 SER A 142 0.871 -3.833 10.480 1.00 0.00 H new ATOM 0 HG SER A 142 -1.684 -3.678 11.288 1.00 0.00 H new ATOM 196 N SER A 143 2.524 -6.420 9.938 1.00 0.00 N ATOM 197 CA SER A 143 3.848 -6.850 10.335 1.00 0.00 C ATOM 198 C SER A 143 4.517 -5.706 11.105 1.00 0.00 C ATOM 199 O SER A 143 5.328 -5.963 11.990 1.00 0.00 O ATOM 200 CB SER A 143 4.631 -7.296 9.094 1.00 0.00 C ATOM 201 OG SER A 143 4.283 -6.521 7.962 1.00 0.00 O ATOM 0 H SER A 143 2.489 -6.051 8.988 1.00 0.00 H new ATOM 0 HA SER A 143 3.811 -7.712 11.001 1.00 0.00 H new ATOM 0 HB2 SER A 143 5.701 -7.206 9.284 1.00 0.00 H new ATOM 0 HB3 SER A 143 4.430 -8.348 8.893 1.00 0.00 H new ATOM 0 HG SER A 143 4.956 -5.822 7.825 1.00 0.00 H new ATOM 207 N GLY A 144 4.180 -4.446 10.796 1.00 0.00 N ATOM 208 CA GLY A 144 4.739 -3.312 11.516 1.00 0.00 C ATOM 209 C GLY A 144 4.255 -1.976 10.961 1.00 0.00 C ATOM 210 O GLY A 144 3.564 -1.926 9.940 1.00 0.00 O ATOM 0 H GLY A 144 3.526 -4.195 10.055 1.00 0.00 H new ATOM 0 HA2 GLY A 144 4.468 -3.384 12.569 1.00 0.00 H new ATOM 0 HA3 GLY A 144 5.827 -3.352 11.463 1.00 0.00 H new ATOM 214 N LYS A 145 4.638 -0.886 11.638 1.00 0.00 N ATOM 215 CA LYS A 145 4.322 0.483 11.244 1.00 0.00 C ATOM 216 C LYS A 145 5.239 0.903 10.095 1.00 0.00 C ATOM 217 O LYS A 145 6.088 1.786 10.217 1.00 0.00 O ATOM 218 CB LYS A 145 4.322 1.428 12.457 1.00 0.00 C ATOM 219 CG LYS A 145 5.641 1.523 13.240 1.00 0.00 C ATOM 220 CD LYS A 145 5.418 2.144 14.627 1.00 0.00 C ATOM 221 CE LYS A 145 4.834 3.560 14.552 1.00 0.00 C ATOM 222 NZ LYS A 145 4.721 4.159 15.892 1.00 0.00 N ATOM 0 H LYS A 145 5.189 -0.938 12.495 1.00 0.00 H new ATOM 0 HA LYS A 145 3.304 0.544 10.861 1.00 0.00 H new ATOM 0 HB2 LYS A 145 4.054 2.427 12.113 1.00 0.00 H new ATOM 0 HB3 LYS A 145 3.538 1.106 13.143 1.00 0.00 H new ATOM 0 HG2 LYS A 145 6.075 0.529 13.349 1.00 0.00 H new ATOM 0 HG3 LYS A 145 6.357 2.124 12.680 1.00 0.00 H new ATOM 0 HD2 LYS A 145 4.745 1.508 15.202 1.00 0.00 H new ATOM 0 HD3 LYS A 145 6.366 2.174 15.164 1.00 0.00 H new ATOM 0 HE2 LYS A 145 5.468 4.185 13.923 1.00 0.00 H new ATOM 0 HE3 LYS A 145 3.852 3.527 14.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 4.323 5.117 15.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 4.097 3.573 16.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 5.663 4.211 16.330 1.00 0.00 H new ATOM 236 N HIS A 146 5.060 0.245 8.953 1.00 0.00 N ATOM 237 CA HIS A 146 5.904 0.452 7.796 1.00 0.00 C ATOM 238 C HIS A 146 5.568 1.803 7.176 1.00 0.00 C ATOM 239 O HIS A 146 4.405 2.157 6.992 1.00 0.00 O ATOM 240 CB HIS A 146 5.711 -0.701 6.812 1.00 0.00 C ATOM 241 CG HIS A 146 5.962 -2.047 7.448 1.00 0.00 C ATOM 242 ND1 HIS A 146 7.049 -2.385 8.224 1.00 0.00 N ATOM 243 CD2 HIS A 146 5.144 -3.143 7.384 1.00 0.00 C ATOM 244 CE1 HIS A 146 6.892 -3.664 8.604 1.00 0.00 C ATOM 245 NE2 HIS A 146 5.751 -4.170 8.110 1.00 0.00 N ATOM 0 H HIS A 146 4.323 -0.446 8.811 1.00 0.00 H new ATOM 0 HA HIS A 146 6.956 0.465 8.080 1.00 0.00 H new ATOM 0 HB2 HIS A 146 4.695 -0.672 6.417 1.00 0.00 H new ATOM 0 HB3 HIS A 146 6.386 -0.570 5.966 1.00 0.00 H new ATOM 0 HD1 HIS A 146 7.830 -1.776 8.466 1.00 0.00 H new ATOM 0 HD2 HIS A 146 4.199 -3.203 6.865 1.00 0.00 H new ATOM 0 HE1 HIS A 146 7.589 -4.210 9.222 1.00 0.00 H new ATOM 253 N TYR A 147 6.615 2.591 6.926 1.00 0.00 N ATOM 254 CA TYR A 147 6.495 3.947 6.415 1.00 0.00 C ATOM 255 C TYR A 147 5.600 4.782 7.341 1.00 0.00 C ATOM 256 O TYR A 147 4.906 5.692 6.887 1.00 0.00 O ATOM 257 CB TYR A 147 6.016 3.929 4.955 1.00 0.00 C ATOM 258 CG TYR A 147 6.562 2.785 4.114 1.00 0.00 C ATOM 259 CD1 TYR A 147 7.942 2.505 4.085 1.00 0.00 C ATOM 260 CD2 TYR A 147 5.665 1.904 3.486 1.00 0.00 C ATOM 261 CE1 TYR A 147 8.414 1.350 3.437 1.00 0.00 C ATOM 262 CE2 TYR A 147 6.141 0.772 2.806 1.00 0.00 C ATOM 263 CZ TYR A 147 7.518 0.512 2.756 1.00 0.00 C ATOM 264 OH TYR A 147 7.982 -0.564 2.064 1.00 0.00 O ATOM 0 H TYR A 147 7.580 2.297 7.076 1.00 0.00 H new ATOM 0 HA TYR A 147 7.473 4.429 6.409 1.00 0.00 H new ATOM 0 HB2 TYR A 147 4.927 3.879 4.946 1.00 0.00 H new ATOM 0 HB3 TYR A 147 6.296 4.872 4.485 1.00 0.00 H new ATOM 0 HD1 TYR A 147 8.639 3.179 4.561 1.00 0.00 H new ATOM 0 HD2 TYR A 147 4.604 2.099 3.527 1.00 0.00 H new ATOM 0 HE1 TYR A 147 9.466 1.108 3.463 1.00 0.00 H new ATOM 0 HE2 TYR A 147 5.447 0.101 2.321 1.00 0.00 H new ATOM 0 HH TYR A 147 7.235 -1.010 1.613 1.00 0.00 H new ATOM 274 N GLY A 148 5.622 4.459 8.641 1.00 0.00 N ATOM 275 CA GLY A 148 4.863 5.142 9.674 1.00 0.00 C ATOM 276 C GLY A 148 3.404 4.697 9.786 1.00 0.00 C ATOM 277 O GLY A 148 2.686 5.267 10.605 1.00 0.00 O ATOM 0 H GLY A 148 6.188 3.692 9.004 1.00 0.00 H new ATOM 0 HA2 GLY A 148 5.354 4.982 10.634 1.00 0.00 H new ATOM 0 HA3 GLY A 148 4.889 6.214 9.478 1.00 0.00 H new ATOM 281 N VAL A 149 2.946 3.708 9.006 1.00 0.00 N ATOM 282 CA VAL A 149 1.559 3.254 9.054 1.00 0.00 C ATOM 283 C VAL A 149 1.521 1.733 9.212 1.00 0.00 C ATOM 284 O VAL A 149 2.214 1.010 8.499 1.00 0.00 O ATOM 285 CB VAL A 149 0.809 3.716 7.793 1.00 0.00 C ATOM 286 CG1 VAL A 149 -0.666 3.306 7.843 1.00 0.00 C ATOM 287 CG2 VAL A 149 0.894 5.237 7.598 1.00 0.00 C ATOM 0 H VAL A 149 3.525 3.207 8.331 1.00 0.00 H new ATOM 0 HA VAL A 149 1.056 3.694 9.915 1.00 0.00 H new ATOM 0 HB VAL A 149 1.297 3.226 6.951 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -1.169 3.647 6.938 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -0.740 2.221 7.913 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -1.140 3.758 8.714 1.00 0.00 H new ATOM 0 HG21 VAL A 149 0.351 5.519 6.696 1.00 0.00 H new ATOM 0 HG22 VAL A 149 0.453 5.739 8.459 1.00 0.00 H new ATOM 0 HG23 VAL A 149 1.938 5.533 7.500 1.00 0.00 H new ATOM 297 N TYR A 150 0.707 1.240 10.152 1.00 0.00 N ATOM 298 CA TYR A 150 0.538 -0.184 10.408 1.00 0.00 C ATOM 299 C TYR A 150 0.141 -0.892 9.114 1.00 0.00 C ATOM 300 O TYR A 150 -0.912 -0.597 8.544 1.00 0.00 O ATOM 301 CB TYR A 150 -0.477 -0.380 11.534 1.00 0.00 C ATOM 302 CG TYR A 150 0.035 0.150 12.860 1.00 0.00 C ATOM 303 CD1 TYR A 150 1.011 -0.578 13.568 1.00 0.00 C ATOM 304 CD2 TYR A 150 -0.382 1.405 13.341 1.00 0.00 C ATOM 305 CE1 TYR A 150 1.574 -0.047 14.741 1.00 0.00 C ATOM 306 CE2 TYR A 150 0.181 1.935 14.514 1.00 0.00 C ATOM 307 CZ TYR A 150 1.170 1.214 15.207 1.00 0.00 C ATOM 308 OH TYR A 150 1.762 1.749 16.312 1.00 0.00 O ATOM 0 H TYR A 150 0.142 1.832 10.761 1.00 0.00 H new ATOM 0 HA TYR A 150 1.475 -0.631 10.740 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -1.407 0.127 11.276 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -0.709 -1.441 11.633 1.00 0.00 H new ATOM 0 HD1 TYR A 150 1.327 -1.546 13.209 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -1.137 1.962 12.807 1.00 0.00 H new ATOM 0 HE1 TYR A 150 2.318 -0.610 15.285 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -0.146 2.896 14.884 1.00 0.00 H new ATOM 0 HH TYR A 150 1.369 2.627 16.501 1.00 0.00 H new ATOM 318 N SER A 151 1.012 -1.781 8.626 1.00 0.00 N ATOM 319 CA SER A 151 0.805 -2.481 7.374 1.00 0.00 C ATOM 320 C SER A 151 1.400 -3.886 7.418 1.00 0.00 C ATOM 321 O SER A 151 2.157 -4.223 8.333 1.00 0.00 O ATOM 322 CB SER A 151 1.389 -1.644 6.237 1.00 0.00 C ATOM 323 OG SER A 151 0.999 -2.178 4.986 1.00 0.00 O ATOM 0 H SER A 151 1.882 -2.030 9.098 1.00 0.00 H new ATOM 0 HA SER A 151 -0.263 -2.610 7.201 1.00 0.00 H new ATOM 0 HB2 SER A 151 1.047 -0.612 6.323 1.00 0.00 H new ATOM 0 HB3 SER A 151 2.476 -1.627 6.310 1.00 0.00 H new ATOM 0 HG SER A 151 0.087 -2.530 5.051 1.00 0.00 H new ATOM 329 N CYS A 152 1.045 -4.690 6.413 1.00 0.00 N ATOM 330 CA CYS A 152 1.472 -6.071 6.242 1.00 0.00 C ATOM 331 C CYS A 152 2.500 -6.172 5.116 1.00 0.00 C ATOM 332 O CYS A 152 2.475 -5.381 4.173 1.00 0.00 O ATOM 333 CB CYS A 152 0.262 -6.978 5.990 1.00 0.00 C ATOM 334 SG CYS A 152 -0.662 -6.719 4.453 1.00 0.00 S ATOM 0 H CYS A 152 0.425 -4.378 5.666 1.00 0.00 H new ATOM 0 HA CYS A 152 1.952 -6.412 7.160 1.00 0.00 H new ATOM 0 HB2 CYS A 152 0.606 -8.012 6.007 1.00 0.00 H new ATOM 0 HB3 CYS A 152 -0.429 -6.858 6.824 1.00 0.00 H new ATOM 0 HG CYS A 152 -1.347 -5.617 4.539 1.00 0.00 H new ATOM 339 N GLU A 153 3.401 -7.152 5.228 1.00 0.00 N ATOM 340 CA GLU A 153 4.487 -7.440 4.296 1.00 0.00 C ATOM 341 C GLU A 153 4.103 -7.266 2.819 1.00 0.00 C ATOM 342 O GLU A 153 4.840 -6.633 2.066 1.00 0.00 O ATOM 343 CB GLU A 153 5.087 -8.826 4.597 1.00 0.00 C ATOM 344 CG GLU A 153 4.192 -10.038 4.281 1.00 0.00 C ATOM 345 CD GLU A 153 2.821 -9.957 4.945 1.00 0.00 C ATOM 346 OE1 GLU A 153 2.779 -10.096 6.186 1.00 0.00 O ATOM 347 OE2 GLU A 153 1.852 -9.689 4.201 1.00 0.00 O ATOM 0 H GLU A 153 3.389 -7.800 6.016 1.00 0.00 H new ATOM 0 HA GLU A 153 5.259 -6.687 4.459 1.00 0.00 H new ATOM 0 HB2 GLU A 153 6.014 -8.928 4.032 1.00 0.00 H new ATOM 0 HB3 GLU A 153 5.352 -8.862 5.654 1.00 0.00 H new ATOM 0 HG2 GLU A 153 4.063 -10.115 3.201 1.00 0.00 H new ATOM 0 HG3 GLU A 153 4.694 -10.948 4.608 1.00 0.00 H new ATOM 354 N GLY A 154 2.963 -7.820 2.394 1.00 0.00 N ATOM 355 CA GLY A 154 2.505 -7.723 1.015 1.00 0.00 C ATOM 356 C GLY A 154 2.360 -6.264 0.581 1.00 0.00 C ATOM 357 O GLY A 154 2.966 -5.830 -0.400 1.00 0.00 O ATOM 0 H GLY A 154 2.335 -8.347 3.001 1.00 0.00 H new ATOM 0 HA2 GLY A 154 3.211 -8.232 0.358 1.00 0.00 H new ATOM 0 HA3 GLY A 154 1.547 -8.233 0.911 1.00 0.00 H new ATOM 361 N CYS A 155 1.568 -5.496 1.333 1.00 0.00 N ATOM 362 CA CYS A 155 1.345 -4.085 1.073 1.00 0.00 C ATOM 363 C CYS A 155 2.666 -3.321 1.156 1.00 0.00 C ATOM 364 O CYS A 155 2.971 -2.511 0.282 1.00 0.00 O ATOM 365 CB CYS A 155 0.335 -3.537 2.080 1.00 0.00 C ATOM 366 SG CYS A 155 -1.364 -4.109 1.845 1.00 0.00 S ATOM 0 H CYS A 155 1.062 -5.847 2.146 1.00 0.00 H new ATOM 0 HA CYS A 155 0.943 -3.958 0.068 1.00 0.00 H new ATOM 0 HB2 CYS A 155 0.659 -3.812 3.084 1.00 0.00 H new ATOM 0 HB3 CYS A 155 0.347 -2.448 2.028 1.00 0.00 H new ATOM 0 HG CYS A 155 -1.588 -5.131 2.616 1.00 0.00 H new ATOM 371 N LYS A 156 3.446 -3.586 2.207 1.00 0.00 N ATOM 372 CA LYS A 156 4.742 -2.970 2.441 1.00 0.00 C ATOM 373 C LYS A 156 5.614 -3.102 1.193 1.00 0.00 C ATOM 374 O LYS A 156 6.100 -2.100 0.664 1.00 0.00 O ATOM 375 CB LYS A 156 5.379 -3.616 3.681 1.00 0.00 C ATOM 376 CG LYS A 156 6.717 -3.016 4.139 1.00 0.00 C ATOM 377 CD LYS A 156 7.941 -3.586 3.405 1.00 0.00 C ATOM 378 CE LYS A 156 9.256 -3.054 3.993 1.00 0.00 C ATOM 379 NZ LYS A 156 9.459 -3.473 5.391 1.00 0.00 N ATOM 0 H LYS A 156 3.182 -4.252 2.933 1.00 0.00 H new ATOM 0 HA LYS A 156 4.634 -1.903 2.637 1.00 0.00 H new ATOM 0 HB2 LYS A 156 4.671 -3.547 4.507 1.00 0.00 H new ATOM 0 HB3 LYS A 156 5.529 -4.676 3.477 1.00 0.00 H new ATOM 0 HG2 LYS A 156 6.688 -1.936 3.992 1.00 0.00 H new ATOM 0 HG3 LYS A 156 6.834 -3.190 5.209 1.00 0.00 H new ATOM 0 HD2 LYS A 156 7.929 -4.674 3.468 1.00 0.00 H new ATOM 0 HD3 LYS A 156 7.884 -3.327 2.348 1.00 0.00 H new ATOM 0 HE2 LYS A 156 10.090 -3.407 3.387 1.00 0.00 H new ATOM 0 HE3 LYS A 156 9.260 -1.965 3.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 10.447 -3.298 5.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 8.825 -2.930 6.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 9.249 -4.487 5.483 1.00 0.00 H new ATOM 393 N GLY A 157 5.812 -4.342 0.738 1.00 0.00 N ATOM 394 CA GLY A 157 6.619 -4.676 -0.423 1.00 0.00 C ATOM 395 C GLY A 157 6.052 -4.042 -1.688 1.00 0.00 C ATOM 396 O GLY A 157 6.780 -3.389 -2.431 1.00 0.00 O ATOM 0 H GLY A 157 5.400 -5.161 1.185 1.00 0.00 H new ATOM 0 HA2 GLY A 157 7.642 -4.334 -0.269 1.00 0.00 H new ATOM 0 HA3 GLY A 157 6.659 -5.759 -0.542 1.00 0.00 H new ATOM 400 N PHE A 158 4.751 -4.228 -1.930 1.00 0.00 N ATOM 401 CA PHE A 158 4.066 -3.664 -3.088 1.00 0.00 C ATOM 402 C PHE A 158 4.327 -2.155 -3.178 1.00 0.00 C ATOM 403 O PHE A 158 4.731 -1.642 -4.226 1.00 0.00 O ATOM 404 CB PHE A 158 2.565 -3.974 -2.995 1.00 0.00 C ATOM 405 CG PHE A 158 1.710 -3.193 -3.974 1.00 0.00 C ATOM 406 CD1 PHE A 158 2.062 -3.171 -5.337 1.00 0.00 C ATOM 407 CD2 PHE A 158 0.717 -2.315 -3.496 1.00 0.00 C ATOM 408 CE1 PHE A 158 1.510 -2.201 -6.188 1.00 0.00 C ATOM 409 CE2 PHE A 158 0.125 -1.385 -4.366 1.00 0.00 C ATOM 410 CZ PHE A 158 0.558 -1.294 -5.696 1.00 0.00 C ATOM 0 H PHE A 158 4.144 -4.778 -1.322 1.00 0.00 H new ATOM 0 HA PHE A 158 4.453 -4.117 -4.000 1.00 0.00 H new ATOM 0 HB2 PHE A 158 2.414 -5.040 -3.167 1.00 0.00 H new ATOM 0 HB3 PHE A 158 2.223 -3.763 -1.982 1.00 0.00 H new ATOM 0 HD1 PHE A 158 2.756 -3.900 -5.728 1.00 0.00 H new ATOM 0 HD2 PHE A 158 0.411 -2.357 -2.461 1.00 0.00 H new ATOM 0 HE1 PHE A 158 1.818 -2.152 -7.222 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -0.664 -0.740 -4.010 1.00 0.00 H new ATOM 0 HZ PHE A 158 0.159 -0.526 -6.342 1.00 0.00 H new ATOM 420 N PHE A 159 4.112 -1.449 -2.067 1.00 0.00 N ATOM 421 CA PHE A 159 4.347 -0.020 -1.987 1.00 0.00 C ATOM 422 C PHE A 159 5.822 0.270 -2.271 1.00 0.00 C ATOM 423 O PHE A 159 6.126 1.112 -3.113 1.00 0.00 O ATOM 424 CB PHE A 159 3.901 0.504 -0.619 1.00 0.00 C ATOM 425 CG PHE A 159 3.980 2.011 -0.469 1.00 0.00 C ATOM 426 CD1 PHE A 159 2.924 2.824 -0.923 1.00 0.00 C ATOM 427 CD2 PHE A 159 5.078 2.601 0.184 1.00 0.00 C ATOM 428 CE1 PHE A 159 2.935 4.206 -0.662 1.00 0.00 C ATOM 429 CE2 PHE A 159 5.049 3.965 0.517 1.00 0.00 C ATOM 430 CZ PHE A 159 3.979 4.771 0.090 1.00 0.00 C ATOM 0 H PHE A 159 3.769 -1.860 -1.199 1.00 0.00 H new ATOM 0 HA PHE A 159 3.758 0.503 -2.740 1.00 0.00 H new ATOM 0 HB2 PHE A 159 2.874 0.187 -0.439 1.00 0.00 H new ATOM 0 HB3 PHE A 159 4.517 0.042 0.152 1.00 0.00 H new ATOM 0 HD1 PHE A 159 2.104 2.386 -1.473 1.00 0.00 H new ATOM 0 HD2 PHE A 159 5.944 2.004 0.429 1.00 0.00 H new ATOM 0 HE1 PHE A 159 2.141 4.833 -1.040 1.00 0.00 H new ATOM 0 HE2 PHE A 159 5.849 4.395 1.101 1.00 0.00 H new ATOM 0 HZ PHE A 159 3.960 5.822 0.339 1.00 0.00 H new ATOM 440 N LYS A 160 6.738 -0.442 -1.601 1.00 0.00 N ATOM 441 CA LYS A 160 8.174 -0.283 -1.806 1.00 0.00 C ATOM 442 C LYS A 160 8.519 -0.329 -3.299 1.00 0.00 C ATOM 443 O LYS A 160 9.137 0.589 -3.834 1.00 0.00 O ATOM 444 CB LYS A 160 8.937 -1.368 -1.025 1.00 0.00 C ATOM 445 CG LYS A 160 10.284 -0.854 -0.511 1.00 0.00 C ATOM 446 CD LYS A 160 10.995 -1.872 0.382 1.00 0.00 C ATOM 447 CE LYS A 160 11.167 -3.261 -0.247 1.00 0.00 C ATOM 448 NZ LYS A 160 11.807 -3.197 -1.572 1.00 0.00 N ATOM 0 H LYS A 160 6.498 -1.144 -0.901 1.00 0.00 H new ATOM 0 HA LYS A 160 8.479 0.693 -1.429 1.00 0.00 H new ATOM 0 HB2 LYS A 160 8.331 -1.705 -0.184 1.00 0.00 H new ATOM 0 HB3 LYS A 160 9.099 -2.233 -1.668 1.00 0.00 H new ATOM 0 HG2 LYS A 160 10.924 -0.609 -1.359 1.00 0.00 H new ATOM 0 HG3 LYS A 160 10.128 0.069 0.048 1.00 0.00 H new ATOM 0 HD2 LYS A 160 11.978 -1.482 0.644 1.00 0.00 H new ATOM 0 HD3 LYS A 160 10.435 -1.975 1.311 1.00 0.00 H new ATOM 0 HE2 LYS A 160 11.767 -3.886 0.415 1.00 0.00 H new ATOM 0 HE3 LYS A 160 10.192 -3.739 -0.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 11.995 -4.161 -1.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 11.175 -2.710 -2.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 12.703 -2.674 -1.500 1.00 0.00 H new ATOM 462 N ARG A 161 8.095 -1.403 -3.970 1.00 0.00 N ATOM 463 CA ARG A 161 8.316 -1.606 -5.389 1.00 0.00 C ATOM 464 C ARG A 161 7.727 -0.444 -6.185 1.00 0.00 C ATOM 465 O ARG A 161 8.427 0.163 -6.994 1.00 0.00 O ATOM 466 CB ARG A 161 7.701 -2.943 -5.812 1.00 0.00 C ATOM 467 CG ARG A 161 8.492 -4.130 -5.243 1.00 0.00 C ATOM 468 CD ARG A 161 7.761 -5.452 -5.492 1.00 0.00 C ATOM 469 NE ARG A 161 7.581 -5.710 -6.928 1.00 0.00 N ATOM 470 CZ ARG A 161 6.952 -6.779 -7.435 1.00 0.00 C ATOM 471 NH1 ARG A 161 6.439 -7.709 -6.622 1.00 0.00 N ATOM 472 NH2 ARG A 161 6.841 -6.912 -8.760 1.00 0.00 N ATOM 0 H ARG A 161 7.580 -2.164 -3.527 1.00 0.00 H new ATOM 0 HA ARG A 161 9.386 -1.638 -5.595 1.00 0.00 H new ATOM 0 HB2 ARG A 161 6.668 -2.995 -5.469 1.00 0.00 H new ATOM 0 HB3 ARG A 161 7.679 -3.007 -6.900 1.00 0.00 H new ATOM 0 HG2 ARG A 161 9.480 -4.166 -5.702 1.00 0.00 H new ATOM 0 HG3 ARG A 161 8.643 -3.991 -4.172 1.00 0.00 H new ATOM 0 HD2 ARG A 161 8.324 -6.270 -5.043 1.00 0.00 H new ATOM 0 HD3 ARG A 161 6.788 -5.428 -5.001 1.00 0.00 H new ATOM 0 HE ARG A 161 7.961 -5.028 -7.584 1.00 0.00 H new ATOM 0 HH11 ARG A 161 6.526 -7.606 -5.611 1.00 0.00 H new ATOM 0 HH12 ARG A 161 5.961 -8.521 -7.013 1.00 0.00 H new ATOM 0 HH21 ARG A 161 7.234 -6.202 -9.378 1.00 0.00 H new ATOM 0 HH22 ARG A 161 6.364 -7.723 -9.153 1.00 0.00 H new ATOM 486 N THR A 162 6.450 -0.130 -5.953 1.00 0.00 N ATOM 487 CA THR A 162 5.759 0.956 -6.635 1.00 0.00 C ATOM 488 C THR A 162 6.555 2.258 -6.552 1.00 0.00 C ATOM 489 O THR A 162 6.770 2.915 -7.567 1.00 0.00 O ATOM 490 CB THR A 162 4.355 1.137 -6.045 1.00 0.00 C ATOM 491 OG1 THR A 162 3.621 -0.055 -6.230 1.00 0.00 O ATOM 492 CG2 THR A 162 3.603 2.285 -6.720 1.00 0.00 C ATOM 0 H THR A 162 5.866 -0.628 -5.281 1.00 0.00 H new ATOM 0 HA THR A 162 5.666 0.695 -7.689 1.00 0.00 H new ATOM 0 HB THR A 162 4.461 1.371 -4.986 1.00 0.00 H new ATOM 0 HG1 THR A 162 3.902 -0.719 -5.566 1.00 0.00 H new ATOM 0 HG21 THR A 162 2.613 2.382 -6.275 1.00 0.00 H new ATOM 0 HG22 THR A 162 4.156 3.214 -6.581 1.00 0.00 H new ATOM 0 HG23 THR A 162 3.504 2.078 -7.786 1.00 0.00 H new ATOM 500 N VAL A 163 6.971 2.634 -5.343 1.00 0.00 N ATOM 501 CA VAL A 163 7.710 3.860 -5.096 1.00 0.00 C ATOM 502 C VAL A 163 9.067 3.814 -5.794 1.00 0.00 C ATOM 503 O VAL A 163 9.403 4.740 -6.526 1.00 0.00 O ATOM 504 CB VAL A 163 7.829 4.080 -3.583 1.00 0.00 C ATOM 505 CG1 VAL A 163 8.792 5.226 -3.247 1.00 0.00 C ATOM 506 CG2 VAL A 163 6.444 4.401 -3.004 1.00 0.00 C ATOM 0 H VAL A 163 6.799 2.085 -4.501 1.00 0.00 H new ATOM 0 HA VAL A 163 7.176 4.713 -5.515 1.00 0.00 H new ATOM 0 HB VAL A 163 8.226 3.165 -3.143 1.00 0.00 H new ATOM 0 HG11 VAL A 163 8.848 5.349 -2.165 1.00 0.00 H new ATOM 0 HG12 VAL A 163 9.783 4.995 -3.638 1.00 0.00 H new ATOM 0 HG13 VAL A 163 8.430 6.150 -3.699 1.00 0.00 H new ATOM 0 HG21 VAL A 163 6.527 4.558 -1.928 1.00 0.00 H new ATOM 0 HG22 VAL A 163 6.054 5.304 -3.473 1.00 0.00 H new ATOM 0 HG23 VAL A 163 5.767 3.569 -3.198 1.00 0.00 H new ATOM 516 N ARG A 164 9.847 2.749 -5.584 1.00 0.00 N ATOM 517 CA ARG A 164 11.161 2.608 -6.208 1.00 0.00 C ATOM 518 C ARG A 164 11.068 2.727 -7.729 1.00 0.00 C ATOM 519 O ARG A 164 11.845 3.446 -8.353 1.00 0.00 O ATOM 520 CB ARG A 164 11.804 1.278 -5.801 1.00 0.00 C ATOM 521 CG ARG A 164 12.286 1.358 -4.350 1.00 0.00 C ATOM 522 CD ARG A 164 12.784 0.003 -3.846 1.00 0.00 C ATOM 523 NE ARG A 164 13.908 -0.488 -4.652 1.00 0.00 N ATOM 524 CZ ARG A 164 15.199 -0.192 -4.442 1.00 0.00 C ATOM 525 NH1 ARG A 164 15.561 0.676 -3.489 1.00 0.00 N ATOM 526 NH2 ARG A 164 16.131 -0.807 -5.171 1.00 0.00 N ATOM 0 H ARG A 164 9.586 1.968 -4.982 1.00 0.00 H new ATOM 0 HA ARG A 164 11.794 3.421 -5.853 1.00 0.00 H new ATOM 0 HB2 ARG A 164 11.084 0.467 -5.911 1.00 0.00 H new ATOM 0 HB3 ARG A 164 12.642 1.052 -6.460 1.00 0.00 H new ATOM 0 HG2 ARG A 164 13.088 2.093 -4.272 1.00 0.00 H new ATOM 0 HG3 ARG A 164 11.472 1.706 -3.714 1.00 0.00 H new ATOM 0 HD2 ARG A 164 13.093 0.092 -2.804 1.00 0.00 H new ATOM 0 HD3 ARG A 164 11.969 -0.720 -3.877 1.00 0.00 H new ATOM 0 HE ARG A 164 13.690 -1.104 -5.435 1.00 0.00 H new ATOM 0 HH11 ARG A 164 14.850 1.123 -2.910 1.00 0.00 H new ATOM 0 HH12 ARG A 164 16.547 0.890 -3.342 1.00 0.00 H new ATOM 0 HH21 ARG A 164 15.858 -1.491 -5.876 1.00 0.00 H new ATOM 0 HH22 ARG A 164 17.117 -0.593 -5.023 1.00 0.00 H new ATOM 540 N LYS A 165 10.104 2.026 -8.320 1.00 0.00 N ATOM 541 CA LYS A 165 9.856 2.066 -9.754 1.00 0.00 C ATOM 542 C LYS A 165 9.216 3.403 -10.161 1.00 0.00 C ATOM 543 O LYS A 165 9.267 3.783 -11.328 1.00 0.00 O ATOM 544 CB LYS A 165 8.933 0.902 -10.126 1.00 0.00 C ATOM 545 CG LYS A 165 9.535 -0.486 -9.867 1.00 0.00 C ATOM 546 CD LYS A 165 10.337 -0.953 -11.087 1.00 0.00 C ATOM 547 CE LYS A 165 11.058 -2.280 -10.823 1.00 0.00 C ATOM 548 NZ LYS A 165 10.114 -3.372 -10.527 1.00 0.00 N ATOM 0 H LYS A 165 9.470 1.410 -7.811 1.00 0.00 H new ATOM 0 HA LYS A 165 10.803 1.974 -10.286 1.00 0.00 H new ATOM 0 HB2 LYS A 165 8.005 0.994 -9.562 1.00 0.00 H new ATOM 0 HB3 LYS A 165 8.673 0.982 -11.182 1.00 0.00 H new ATOM 0 HG2 LYS A 165 10.181 -0.452 -8.990 1.00 0.00 H new ATOM 0 HG3 LYS A 165 8.740 -1.200 -9.650 1.00 0.00 H new ATOM 0 HD2 LYS A 165 9.668 -1.067 -11.940 1.00 0.00 H new ATOM 0 HD3 LYS A 165 11.068 -0.190 -11.355 1.00 0.00 H new ATOM 0 HE2 LYS A 165 11.658 -2.546 -11.693 1.00 0.00 H new ATOM 0 HE3 LYS A 165 11.746 -2.159 -9.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 10.634 -4.270 -10.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 9.631 -3.179 -9.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 9.411 -3.439 -11.290 1.00 0.00 H new ATOM 562 N ASP A 166 8.579 4.085 -9.204 1.00 0.00 N ATOM 563 CA ASP A 166 7.849 5.334 -9.350 1.00 0.00 C ATOM 564 C ASP A 166 6.672 5.142 -10.303 1.00 0.00 C ATOM 565 O ASP A 166 6.466 5.912 -11.238 1.00 0.00 O ATOM 566 CB ASP A 166 8.784 6.490 -9.726 1.00 0.00 C ATOM 567 CG ASP A 166 8.092 7.842 -9.583 1.00 0.00 C ATOM 568 OD1 ASP A 166 7.467 8.048 -8.518 1.00 0.00 O ATOM 569 OD2 ASP A 166 8.222 8.657 -10.522 1.00 0.00 O ATOM 0 H ASP A 166 8.563 3.749 -8.241 1.00 0.00 H new ATOM 0 HA ASP A 166 7.423 5.623 -8.389 1.00 0.00 H new ATOM 0 HB2 ASP A 166 9.669 6.465 -9.090 1.00 0.00 H new ATOM 0 HB3 ASP A 166 9.126 6.363 -10.753 1.00 0.00 H new ATOM 574 N LEU A 167 5.903 4.083 -10.047 1.00 0.00 N ATOM 575 CA LEU A 167 4.760 3.693 -10.859 1.00 0.00 C ATOM 576 C LEU A 167 3.464 4.353 -10.382 1.00 0.00 C ATOM 577 O LEU A 167 3.418 5.085 -9.392 1.00 0.00 O ATOM 578 CB LEU A 167 4.642 2.158 -10.865 1.00 0.00 C ATOM 579 CG LEU A 167 5.802 1.488 -11.614 1.00 0.00 C ATOM 580 CD1 LEU A 167 5.886 0.005 -11.232 1.00 0.00 C ATOM 581 CD2 LEU A 167 5.650 1.603 -13.135 1.00 0.00 C ATOM 0 H LEU A 167 6.064 3.463 -9.253 1.00 0.00 H new ATOM 0 HA LEU A 167 4.922 4.044 -11.878 1.00 0.00 H new ATOM 0 HB2 LEU A 167 4.617 1.794 -9.838 1.00 0.00 H new ATOM 0 HB3 LEU A 167 3.698 1.870 -11.329 1.00 0.00 H new ATOM 0 HG LEU A 167 6.715 2.008 -11.323 1.00 0.00 H new ATOM 0 HD11 LEU A 167 6.712 -0.463 -11.768 1.00 0.00 H new ATOM 0 HD12 LEU A 167 6.053 -0.085 -10.159 1.00 0.00 H new ATOM 0 HD13 LEU A 167 4.953 -0.492 -11.497 1.00 0.00 H new ATOM 0 HD21 LEU A 167 6.494 1.115 -13.623 1.00 0.00 H new ATOM 0 HD22 LEU A 167 4.723 1.121 -13.445 1.00 0.00 H new ATOM 0 HD23 LEU A 167 5.625 2.655 -13.420 1.00 0.00 H new ATOM 593 N THR A 168 2.394 4.072 -11.124 1.00 0.00 N ATOM 594 CA THR A 168 1.014 4.486 -10.938 1.00 0.00 C ATOM 595 C THR A 168 0.218 3.465 -11.754 1.00 0.00 C ATOM 596 O THR A 168 0.788 2.838 -12.650 1.00 0.00 O ATOM 597 CB THR A 168 0.825 5.945 -11.388 1.00 0.00 C ATOM 598 OG1 THR A 168 1.496 6.798 -10.480 1.00 0.00 O ATOM 599 CG2 THR A 168 -0.644 6.379 -11.406 1.00 0.00 C ATOM 0 H THR A 168 2.488 3.488 -11.955 1.00 0.00 H new ATOM 0 HA THR A 168 0.680 4.490 -9.900 1.00 0.00 H new ATOM 0 HB THR A 168 1.222 6.013 -12.401 1.00 0.00 H new ATOM 0 HG1 THR A 168 2.107 6.270 -9.925 1.00 0.00 H new ATOM 0 HG21 THR A 168 -0.713 7.417 -11.732 1.00 0.00 H new ATOM 0 HG22 THR A 168 -1.202 5.745 -12.095 1.00 0.00 H new ATOM 0 HG23 THR A 168 -1.064 6.284 -10.404 1.00 0.00 H new ATOM 607 N TYR A 169 -1.052 3.237 -11.415 1.00 0.00 N ATOM 608 CA TYR A 169 -1.864 2.199 -12.037 1.00 0.00 C ATOM 609 C TYR A 169 -3.314 2.666 -12.137 1.00 0.00 C ATOM 610 O TYR A 169 -3.634 3.823 -11.873 1.00 0.00 O ATOM 611 CB TYR A 169 -1.756 0.914 -11.192 1.00 0.00 C ATOM 612 CG TYR A 169 -0.384 0.599 -10.624 1.00 0.00 C ATOM 613 CD1 TYR A 169 -0.026 1.082 -9.350 1.00 0.00 C ATOM 614 CD2 TYR A 169 0.523 -0.194 -11.350 1.00 0.00 C ATOM 615 CE1 TYR A 169 1.198 0.706 -8.775 1.00 0.00 C ATOM 616 CE2 TYR A 169 1.759 -0.548 -10.781 1.00 0.00 C ATOM 617 CZ TYR A 169 2.091 -0.112 -9.487 1.00 0.00 C ATOM 618 OH TYR A 169 3.252 -0.533 -8.912 1.00 0.00 O ATOM 0 H TYR A 169 -1.544 3.771 -10.699 1.00 0.00 H new ATOM 0 HA TYR A 169 -1.506 1.994 -13.046 1.00 0.00 H new ATOM 0 HB2 TYR A 169 -2.461 0.988 -10.364 1.00 0.00 H new ATOM 0 HB3 TYR A 169 -2.074 0.072 -11.807 1.00 0.00 H new ATOM 0 HD1 TYR A 169 -0.693 1.742 -8.816 1.00 0.00 H new ATOM 0 HD2 TYR A 169 0.270 -0.531 -12.344 1.00 0.00 H new ATOM 0 HE1 TYR A 169 1.454 1.046 -7.783 1.00 0.00 H new ATOM 0 HE2 TYR A 169 2.455 -1.156 -11.340 1.00 0.00 H new ATOM 0 HH TYR A 169 3.276 -0.246 -7.975 1.00 0.00 H new ATOM 628 N THR A 170 -4.200 1.739 -12.490 1.00 0.00 N ATOM 629 CA THR A 170 -5.640 1.944 -12.557 1.00 0.00 C ATOM 630 C THR A 170 -6.308 0.620 -12.159 1.00 0.00 C ATOM 631 O THR A 170 -5.657 -0.424 -12.209 1.00 0.00 O ATOM 632 CB THR A 170 -6.017 2.455 -13.956 1.00 0.00 C ATOM 633 OG1 THR A 170 -5.197 3.564 -14.272 1.00 0.00 O ATOM 634 CG2 THR A 170 -7.476 2.911 -14.049 1.00 0.00 C ATOM 0 H THR A 170 -3.923 0.791 -12.746 1.00 0.00 H new ATOM 0 HA THR A 170 -5.992 2.710 -11.866 1.00 0.00 H new ATOM 0 HB THR A 170 -5.876 1.626 -14.649 1.00 0.00 H new ATOM 0 HG1 THR A 170 -5.428 3.898 -15.164 1.00 0.00 H new ATOM 0 HG21 THR A 170 -7.684 3.261 -15.060 1.00 0.00 H new ATOM 0 HG22 THR A 170 -8.134 2.075 -13.812 1.00 0.00 H new ATOM 0 HG23 THR A 170 -7.650 3.722 -13.341 1.00 0.00 H new ATOM 642 N CYS A 171 -7.579 0.659 -11.748 1.00 0.00 N ATOM 643 CA CYS A 171 -8.381 -0.493 -11.346 1.00 0.00 C ATOM 644 C CYS A 171 -9.750 -0.338 -12.006 1.00 0.00 C ATOM 645 O CYS A 171 -10.073 0.737 -12.510 1.00 0.00 O ATOM 646 CB CYS A 171 -8.504 -0.523 -9.811 1.00 0.00 C ATOM 647 SG CYS A 171 -9.496 -1.848 -9.053 1.00 0.00 S ATOM 0 H CYS A 171 -8.097 1.535 -11.685 1.00 0.00 H new ATOM 0 HA CYS A 171 -7.921 -1.431 -11.658 1.00 0.00 H new ATOM 0 HB2 CYS A 171 -7.497 -0.583 -9.397 1.00 0.00 H new ATOM 0 HB3 CYS A 171 -8.924 0.431 -9.492 1.00 0.00 H new ATOM 0 HG CYS A 171 -10.351 -1.329 -8.222 1.00 0.00 H new ATOM 652 N ARG A 172 -10.549 -1.407 -11.998 1.00 0.00 N ATOM 653 CA ARG A 172 -11.903 -1.414 -12.533 1.00 0.00 C ATOM 654 C ARG A 172 -12.732 -0.333 -11.830 1.00 0.00 C ATOM 655 O ARG A 172 -13.477 0.406 -12.467 1.00 0.00 O ATOM 656 CB ARG A 172 -12.513 -2.802 -12.295 1.00 0.00 C ATOM 657 CG ARG A 172 -11.721 -3.914 -13.005 1.00 0.00 C ATOM 658 CD ARG A 172 -11.869 -5.266 -12.292 1.00 0.00 C ATOM 659 NE ARG A 172 -11.418 -5.221 -10.890 1.00 0.00 N ATOM 660 CZ ARG A 172 -10.146 -5.160 -10.468 1.00 0.00 C ATOM 661 NH1 ARG A 172 -9.126 -5.099 -11.326 1.00 0.00 N ATOM 662 NH2 ARG A 172 -9.869 -5.156 -9.162 1.00 0.00 N ATOM 0 H ARG A 172 -10.263 -2.307 -11.611 1.00 0.00 H new ATOM 0 HA ARG A 172 -11.894 -1.202 -13.602 1.00 0.00 H new ATOM 0 HB2 ARG A 172 -12.542 -3.006 -11.225 1.00 0.00 H new ATOM 0 HB3 ARG A 172 -13.544 -2.810 -12.649 1.00 0.00 H new ATOM 0 HG2 ARG A 172 -12.068 -4.006 -14.034 1.00 0.00 H new ATOM 0 HG3 ARG A 172 -10.667 -3.639 -13.047 1.00 0.00 H new ATOM 0 HD2 ARG A 172 -12.913 -5.577 -12.324 1.00 0.00 H new ATOM 0 HD3 ARG A 172 -11.295 -6.021 -12.830 1.00 0.00 H new ATOM 0 HE ARG A 172 -12.142 -5.238 -10.172 1.00 0.00 H new ATOM 0 HH11 ARG A 172 -9.304 -5.098 -12.330 1.00 0.00 H new ATOM 0 HH12 ARG A 172 -8.168 -5.053 -10.978 1.00 0.00 H new ATOM 0 HH21 ARG A 172 -10.626 -5.199 -8.480 1.00 0.00 H new ATOM 0 HH22 ARG A 172 -8.900 -5.110 -8.846 1.00 0.00 H new ATOM 676 N ASP A 173 -12.581 -0.255 -10.505 1.00 0.00 N ATOM 677 CA ASP A 173 -13.242 0.715 -9.645 1.00 0.00 C ATOM 678 C ASP A 173 -12.302 1.897 -9.402 1.00 0.00 C ATOM 679 O ASP A 173 -11.117 1.842 -9.733 1.00 0.00 O ATOM 680 CB ASP A 173 -13.589 0.061 -8.302 1.00 0.00 C ATOM 681 CG ASP A 173 -14.378 -1.235 -8.462 1.00 0.00 C ATOM 682 OD1 ASP A 173 -15.622 -1.143 -8.506 1.00 0.00 O ATOM 683 OD2 ASP A 173 -13.715 -2.293 -8.538 1.00 0.00 O ATOM 0 H ASP A 173 -11.972 -0.891 -9.989 1.00 0.00 H new ATOM 0 HA ASP A 173 -14.156 1.063 -10.126 1.00 0.00 H new ATOM 0 HB2 ASP A 173 -12.669 -0.144 -7.755 1.00 0.00 H new ATOM 0 HB3 ASP A 173 -14.168 0.762 -7.701 1.00 0.00 H new ATOM 688 N ASN A 174 -12.815 2.952 -8.765 1.00 0.00 N ATOM 689 CA ASN A 174 -12.008 4.106 -8.396 1.00 0.00 C ATOM 690 C ASN A 174 -11.200 3.739 -7.151 1.00 0.00 C ATOM 691 O ASN A 174 -11.312 2.628 -6.638 1.00 0.00 O ATOM 692 CB ASN A 174 -12.917 5.313 -8.120 1.00 0.00 C ATOM 693 CG ASN A 174 -13.756 5.686 -9.338 1.00 0.00 C ATOM 694 OD1 ASN A 174 -14.921 5.316 -9.426 1.00 0.00 O ATOM 695 ND2 ASN A 174 -13.177 6.415 -10.289 1.00 0.00 N ATOM 0 H ASN A 174 -13.796 3.026 -8.494 1.00 0.00 H new ATOM 0 HA ASN A 174 -11.332 4.376 -9.207 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -13.576 5.087 -7.281 1.00 0.00 H new ATOM 0 HB3 ASN A 174 -12.307 6.167 -7.825 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -13.705 6.681 -11.120 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -12.205 6.708 -10.187 1.00 0.00 H new ATOM 702 N LYS A 175 -10.390 4.673 -6.647 1.00 0.00 N ATOM 703 CA LYS A 175 -9.555 4.461 -5.469 1.00 0.00 C ATOM 704 C LYS A 175 -10.328 3.870 -4.283 1.00 0.00 C ATOM 705 O LYS A 175 -9.792 3.063 -3.525 1.00 0.00 O ATOM 706 CB LYS A 175 -8.857 5.775 -5.093 1.00 0.00 C ATOM 707 CG LYS A 175 -9.824 6.859 -4.598 1.00 0.00 C ATOM 708 CD LYS A 175 -9.102 8.206 -4.483 1.00 0.00 C ATOM 709 CE LYS A 175 -9.959 9.234 -3.731 1.00 0.00 C ATOM 710 NZ LYS A 175 -11.296 9.395 -4.331 1.00 0.00 N ATOM 0 H LYS A 175 -10.297 5.605 -7.051 1.00 0.00 H new ATOM 0 HA LYS A 175 -8.803 3.715 -5.724 1.00 0.00 H new ATOM 0 HB2 LYS A 175 -8.118 5.576 -4.317 1.00 0.00 H new ATOM 0 HB3 LYS A 175 -8.315 6.151 -5.961 1.00 0.00 H new ATOM 0 HG2 LYS A 175 -10.665 6.947 -5.286 1.00 0.00 H new ATOM 0 HG3 LYS A 175 -10.234 6.575 -3.629 1.00 0.00 H new ATOM 0 HD2 LYS A 175 -8.154 8.070 -3.963 1.00 0.00 H new ATOM 0 HD3 LYS A 175 -8.869 8.582 -5.479 1.00 0.00 H new ATOM 0 HE2 LYS A 175 -10.065 8.924 -2.691 1.00 0.00 H new ATOM 0 HE3 LYS A 175 -9.447 10.196 -3.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 -11.740 10.260 -3.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 -11.206 9.465 -5.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 -11.886 8.573 -4.090 1.00 0.00 H new ATOM 724 N ASP A 176 -11.595 4.263 -4.127 1.00 0.00 N ATOM 725 CA ASP A 176 -12.479 3.822 -3.053 1.00 0.00 C ATOM 726 C ASP A 176 -13.024 2.426 -3.368 1.00 0.00 C ATOM 727 O ASP A 176 -14.232 2.220 -3.454 1.00 0.00 O ATOM 728 CB ASP A 176 -13.611 4.846 -2.875 1.00 0.00 C ATOM 729 CG ASP A 176 -13.078 6.250 -2.613 1.00 0.00 C ATOM 730 OD1 ASP A 176 -12.831 6.557 -1.428 1.00 0.00 O ATOM 731 OD2 ASP A 176 -12.903 6.983 -3.612 1.00 0.00 O ATOM 0 H ASP A 176 -12.045 4.918 -4.767 1.00 0.00 H new ATOM 0 HA ASP A 176 -11.927 3.757 -2.116 1.00 0.00 H new ATOM 0 HB2 ASP A 176 -14.234 4.856 -3.769 1.00 0.00 H new ATOM 0 HB3 ASP A 176 -14.249 4.540 -2.046 1.00 0.00 H new ATOM 736 N CYS A 177 -12.115 1.472 -3.564 1.00 0.00 N ATOM 737 CA CYS A 177 -12.414 0.092 -3.915 1.00 0.00 C ATOM 738 C CYS A 177 -12.509 -0.770 -2.653 1.00 0.00 C ATOM 739 O CYS A 177 -12.014 -0.394 -1.590 1.00 0.00 O ATOM 740 CB CYS A 177 -11.316 -0.375 -4.872 1.00 0.00 C ATOM 741 SG CYS A 177 -11.539 -1.924 -5.779 1.00 0.00 S ATOM 0 H CYS A 177 -11.114 1.650 -3.479 1.00 0.00 H new ATOM 0 HA CYS A 177 -13.381 0.002 -4.409 1.00 0.00 H new ATOM 0 HB2 CYS A 177 -11.162 0.416 -5.606 1.00 0.00 H new ATOM 0 HB3 CYS A 177 -10.394 -0.461 -4.297 1.00 0.00 H new ATOM 0 HG CYS A 177 -10.390 -2.515 -5.917 1.00 0.00 H new ATOM 746 N LEU A 178 -13.158 -1.932 -2.769 1.00 0.00 N ATOM 747 CA LEU A 178 -13.384 -2.854 -1.663 1.00 0.00 C ATOM 748 C LEU A 178 -12.106 -3.609 -1.281 1.00 0.00 C ATOM 749 O LEU A 178 -12.013 -4.826 -1.464 1.00 0.00 O ATOM 750 CB LEU A 178 -14.521 -3.824 -2.025 1.00 0.00 C ATOM 751 CG LEU A 178 -15.845 -3.140 -2.407 1.00 0.00 C ATOM 752 CD1 LEU A 178 -16.875 -4.217 -2.761 1.00 0.00 C ATOM 753 CD2 LEU A 178 -16.394 -2.268 -1.271 1.00 0.00 C ATOM 0 H LEU A 178 -13.547 -2.260 -3.653 1.00 0.00 H new ATOM 0 HA LEU A 178 -13.678 -2.277 -0.786 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -14.197 -4.450 -2.856 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -14.700 -4.487 -1.178 1.00 0.00 H new ATOM 0 HG LEU A 178 -15.654 -2.488 -3.260 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -17.818 -3.743 -3.034 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.510 -4.808 -3.601 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -17.031 -4.868 -1.901 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -17.329 -1.806 -1.587 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -16.574 -2.887 -0.392 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -15.670 -1.491 -1.026 1.00 0.00 H new ATOM 765 N ILE A 179 -11.117 -2.898 -0.728 1.00 0.00 N ATOM 766 CA ILE A 179 -9.865 -3.498 -0.274 1.00 0.00 C ATOM 767 C ILE A 179 -10.118 -4.250 1.036 1.00 0.00 C ATOM 768 O ILE A 179 -9.713 -3.833 2.118 1.00 0.00 O ATOM 769 CB ILE A 179 -8.730 -2.461 -0.168 1.00 0.00 C ATOM 770 CG1 ILE A 179 -8.646 -1.527 -1.385 1.00 0.00 C ATOM 771 CG2 ILE A 179 -7.385 -3.179 0.001 1.00 0.00 C ATOM 772 CD1 ILE A 179 -8.480 -2.268 -2.711 1.00 0.00 C ATOM 0 H ILE A 179 -11.166 -1.889 -0.584 1.00 0.00 H new ATOM 0 HA ILE A 179 -9.519 -4.216 -1.017 1.00 0.00 H new ATOM 0 HB ILE A 179 -8.956 -1.844 0.701 1.00 0.00 H new ATOM 0 HG12 ILE A 179 -9.549 -0.918 -1.429 1.00 0.00 H new ATOM 0 HG13 ILE A 179 -7.807 -0.844 -1.252 1.00 0.00 H new ATOM 0 HG21 ILE A 179 -6.586 -2.442 0.075 1.00 0.00 H new ATOM 0 HG22 ILE A 179 -7.407 -3.783 0.908 1.00 0.00 H new ATOM 0 HG23 ILE A 179 -7.206 -3.823 -0.860 1.00 0.00 H new ATOM 0 HD11 ILE A 179 -8.428 -1.547 -3.527 1.00 0.00 H new ATOM 0 HD12 ILE A 179 -7.562 -2.856 -2.687 1.00 0.00 H new ATOM 0 HD13 ILE A 179 -9.331 -2.931 -2.867 1.00 0.00 H new ATOM 784 N ASP A 180 -10.817 -5.375 0.915 1.00 0.00 N ATOM 785 CA ASP A 180 -11.148 -6.265 2.014 1.00 0.00 C ATOM 786 C ASP A 180 -9.901 -7.089 2.350 1.00 0.00 C ATOM 787 O ASP A 180 -8.861 -6.931 1.709 1.00 0.00 O ATOM 788 CB ASP A 180 -12.300 -7.188 1.571 1.00 0.00 C ATOM 789 CG ASP A 180 -13.498 -6.434 0.993 1.00 0.00 C ATOM 790 OD1 ASP A 180 -13.935 -5.465 1.649 1.00 0.00 O ATOM 791 OD2 ASP A 180 -13.964 -6.846 -0.094 1.00 0.00 O ATOM 0 H ASP A 180 -11.179 -5.699 0.018 1.00 0.00 H new ATOM 0 HA ASP A 180 -11.462 -5.705 2.895 1.00 0.00 H new ATOM 0 HB2 ASP A 180 -11.927 -7.889 0.824 1.00 0.00 H new ATOM 0 HB3 ASP A 180 -12.630 -7.779 2.425 1.00 0.00 H new ATOM 921 N CYS A 187 -5.282 -4.901 -8.104 1.00 0.00 N ATOM 922 CA CYS A 187 -5.778 -3.734 -7.372 1.00 0.00 C ATOM 923 C CYS A 187 -4.671 -2.836 -6.814 1.00 0.00 C ATOM 924 O CYS A 187 -4.801 -2.197 -5.767 1.00 0.00 O ATOM 925 CB CYS A 187 -6.765 -4.209 -6.304 1.00 0.00 C ATOM 926 SG CYS A 187 -8.002 -2.993 -5.849 1.00 0.00 S ATOM 0 HA CYS A 187 -6.299 -3.083 -8.075 1.00 0.00 H new ATOM 0 HB2 CYS A 187 -7.269 -5.105 -6.665 1.00 0.00 H new ATOM 0 HB3 CYS A 187 -6.207 -4.494 -5.412 1.00 0.00 H new ATOM 0 HG CYS A 187 -8.591 -2.552 -6.920 1.00 0.00 H new ATOM 931 N GLN A 188 -3.593 -2.764 -7.588 1.00 0.00 N ATOM 932 CA GLN A 188 -2.399 -1.977 -7.325 1.00 0.00 C ATOM 933 C GLN A 188 -2.778 -0.516 -7.071 1.00 0.00 C ATOM 934 O GLN A 188 -2.409 0.059 -6.049 1.00 0.00 O ATOM 935 CB GLN A 188 -1.443 -2.095 -8.527 1.00 0.00 C ATOM 936 CG GLN A 188 -0.686 -3.429 -8.624 1.00 0.00 C ATOM 937 CD GLN A 188 -1.585 -4.650 -8.749 1.00 0.00 C ATOM 938 OE1 GLN A 188 -2.643 -4.602 -9.370 1.00 0.00 O ATOM 939 NE2 GLN A 188 -1.178 -5.763 -8.150 1.00 0.00 N ATOM 0 H GLN A 188 -3.528 -3.283 -8.464 1.00 0.00 H new ATOM 0 HA GLN A 188 -1.897 -2.354 -6.434 1.00 0.00 H new ATOM 0 HB2 GLN A 188 -2.016 -1.952 -9.443 1.00 0.00 H new ATOM 0 HB3 GLN A 188 -0.716 -1.284 -8.475 1.00 0.00 H new ATOM 0 HG2 GLN A 188 -0.019 -3.393 -9.485 1.00 0.00 H new ATOM 0 HG3 GLN A 188 -0.059 -3.543 -7.740 1.00 0.00 H new ATOM 0 HE21 GLN A 188 -0.294 -5.774 -7.641 1.00 0.00 H new ATOM 0 HE22 GLN A 188 -1.749 -6.607 -8.199 1.00 0.00 H new ATOM 948 N TYR A 189 -3.516 0.074 -8.015 1.00 0.00 N ATOM 949 CA TYR A 189 -3.963 1.459 -7.963 1.00 0.00 C ATOM 950 C TYR A 189 -4.573 1.805 -6.614 1.00 0.00 C ATOM 951 O TYR A 189 -4.108 2.702 -5.919 1.00 0.00 O ATOM 952 CB TYR A 189 -5.012 1.690 -9.057 1.00 0.00 C ATOM 953 CG TYR A 189 -5.694 3.047 -9.027 1.00 0.00 C ATOM 954 CD1 TYR A 189 -4.935 4.231 -8.952 1.00 0.00 C ATOM 955 CD2 TYR A 189 -7.099 3.125 -9.044 1.00 0.00 C ATOM 956 CE1 TYR A 189 -5.580 5.475 -8.844 1.00 0.00 C ATOM 957 CE2 TYR A 189 -7.741 4.369 -8.953 1.00 0.00 C ATOM 958 CZ TYR A 189 -6.984 5.541 -8.807 1.00 0.00 C ATOM 959 OH TYR A 189 -7.614 6.710 -8.507 1.00 0.00 O ATOM 0 H TYR A 189 -3.824 -0.415 -8.856 1.00 0.00 H new ATOM 0 HA TYR A 189 -3.094 2.099 -8.117 1.00 0.00 H new ATOM 0 HB2 TYR A 189 -4.534 1.564 -10.028 1.00 0.00 H new ATOM 0 HB3 TYR A 189 -5.775 0.916 -8.974 1.00 0.00 H new ATOM 0 HD1 TYR A 189 -3.856 4.183 -8.978 1.00 0.00 H new ATOM 0 HD2 TYR A 189 -7.686 2.222 -9.128 1.00 0.00 H new ATOM 0 HE1 TYR A 189 -4.996 6.382 -8.789 1.00 0.00 H new ATOM 0 HE2 TYR A 189 -8.819 4.424 -8.995 1.00 0.00 H new ATOM 0 HH TYR A 189 -7.063 7.228 -7.883 1.00 0.00 H new ATOM 969 N CYS A 190 -5.644 1.101 -6.264 1.00 0.00 N ATOM 970 CA CYS A 190 -6.374 1.358 -5.045 1.00 0.00 C ATOM 971 C CYS A 190 -5.468 1.176 -3.834 1.00 0.00 C ATOM 972 O CYS A 190 -5.412 2.065 -2.997 1.00 0.00 O ATOM 973 CB CYS A 190 -7.583 0.442 -5.002 1.00 0.00 C ATOM 974 SG CYS A 190 -8.680 0.604 -6.433 1.00 0.00 S ATOM 0 H CYS A 190 -6.024 0.337 -6.823 1.00 0.00 H new ATOM 0 HA CYS A 190 -6.722 2.391 -5.021 1.00 0.00 H new ATOM 0 HB2 CYS A 190 -7.241 -0.591 -4.934 1.00 0.00 H new ATOM 0 HB3 CYS A 190 -8.152 0.650 -4.096 1.00 0.00 H new ATOM 0 HG CYS A 190 -8.663 -0.500 -7.120 1.00 0.00 H new ATOM 979 N ARG A 191 -4.740 0.059 -3.732 1.00 0.00 N ATOM 980 CA ARG A 191 -3.835 -0.137 -2.602 1.00 0.00 C ATOM 981 C ARG A 191 -2.843 1.030 -2.471 1.00 0.00 C ATOM 982 O ARG A 191 -2.631 1.552 -1.375 1.00 0.00 O ATOM 983 CB ARG A 191 -3.134 -1.497 -2.713 1.00 0.00 C ATOM 984 CG ARG A 191 -4.101 -2.605 -2.280 1.00 0.00 C ATOM 985 CD ARG A 191 -3.441 -3.986 -2.270 1.00 0.00 C ATOM 986 NE ARG A 191 -3.805 -4.759 -3.463 1.00 0.00 N ATOM 987 CZ ARG A 191 -3.054 -4.973 -4.551 1.00 0.00 C ATOM 988 NH1 ARG A 191 -1.855 -4.400 -4.699 1.00 0.00 N ATOM 989 NH2 ARG A 191 -3.537 -5.787 -5.491 1.00 0.00 N ATOM 0 H ARG A 191 -4.760 -0.707 -4.405 1.00 0.00 H new ATOM 0 HA ARG A 191 -4.419 -0.145 -1.682 1.00 0.00 H new ATOM 0 HB2 ARG A 191 -2.805 -1.666 -3.738 1.00 0.00 H new ATOM 0 HB3 ARG A 191 -2.243 -1.511 -2.086 1.00 0.00 H new ATOM 0 HG2 ARG A 191 -4.483 -2.381 -1.284 1.00 0.00 H new ATOM 0 HG3 ARG A 191 -4.957 -2.620 -2.954 1.00 0.00 H new ATOM 0 HD2 ARG A 191 -2.358 -3.874 -2.223 1.00 0.00 H new ATOM 0 HD3 ARG A 191 -3.744 -4.530 -1.375 1.00 0.00 H new ATOM 0 HE ARG A 191 -4.734 -5.180 -3.464 1.00 0.00 H new ATOM 0 HH11 ARG A 191 -1.492 -3.783 -3.973 1.00 0.00 H new ATOM 0 HH12 ARG A 191 -1.304 -4.580 -5.538 1.00 0.00 H new ATOM 0 HH21 ARG A 191 -4.451 -6.223 -5.368 1.00 0.00 H new ATOM 0 HH22 ARG A 191 -2.993 -5.973 -6.333 1.00 0.00 H new ATOM 1003 N TYR A 192 -2.259 1.464 -3.589 1.00 0.00 N ATOM 1004 CA TYR A 192 -1.339 2.593 -3.621 1.00 0.00 C ATOM 1005 C TYR A 192 -2.056 3.861 -3.134 1.00 0.00 C ATOM 1006 O TYR A 192 -1.554 4.568 -2.261 1.00 0.00 O ATOM 1007 CB TYR A 192 -0.784 2.721 -5.046 1.00 0.00 C ATOM 1008 CG TYR A 192 0.180 3.859 -5.330 1.00 0.00 C ATOM 1009 CD1 TYR A 192 1.284 4.098 -4.488 1.00 0.00 C ATOM 1010 CD2 TYR A 192 0.114 4.496 -6.584 1.00 0.00 C ATOM 1011 CE1 TYR A 192 2.351 4.899 -4.934 1.00 0.00 C ATOM 1012 CE2 TYR A 192 1.182 5.290 -7.029 1.00 0.00 C ATOM 1013 CZ TYR A 192 2.327 5.442 -6.231 1.00 0.00 C ATOM 1014 OH TYR A 192 3.464 5.959 -6.776 1.00 0.00 O ATOM 0 H TYR A 192 -2.415 1.036 -4.502 1.00 0.00 H new ATOM 0 HA TYR A 192 -0.496 2.440 -2.947 1.00 0.00 H new ATOM 0 HB2 TYR A 192 -0.282 1.786 -5.295 1.00 0.00 H new ATOM 0 HB3 TYR A 192 -1.629 2.820 -5.727 1.00 0.00 H new ATOM 0 HD1 TYR A 192 1.311 3.666 -3.499 1.00 0.00 H new ATOM 0 HD2 TYR A 192 -0.761 4.373 -7.205 1.00 0.00 H new ATOM 0 HE1 TYR A 192 3.188 5.097 -4.281 1.00 0.00 H new ATOM 0 HE2 TYR A 192 1.123 5.785 -7.987 1.00 0.00 H new ATOM 0 HH TYR A 192 3.536 5.676 -7.712 1.00 0.00 H new ATOM 1024 N GLN A 193 -3.246 4.142 -3.672 1.00 0.00 N ATOM 1025 CA GLN A 193 -4.049 5.283 -3.268 1.00 0.00 C ATOM 1026 C GLN A 193 -4.345 5.240 -1.766 1.00 0.00 C ATOM 1027 O GLN A 193 -4.196 6.257 -1.099 1.00 0.00 O ATOM 1028 CB GLN A 193 -5.343 5.325 -4.083 1.00 0.00 C ATOM 1029 CG GLN A 193 -5.123 5.618 -5.574 1.00 0.00 C ATOM 1030 CD GLN A 193 -5.108 7.109 -5.897 1.00 0.00 C ATOM 1031 OE1 GLN A 193 -6.066 7.636 -6.458 1.00 0.00 O ATOM 1032 NE2 GLN A 193 -4.020 7.802 -5.583 1.00 0.00 N ATOM 0 H GLN A 193 -3.676 3.576 -4.404 1.00 0.00 H new ATOM 0 HA GLN A 193 -3.485 6.195 -3.465 1.00 0.00 H new ATOM 0 HB2 GLN A 193 -5.857 4.369 -3.981 1.00 0.00 H new ATOM 0 HB3 GLN A 193 -6.001 6.087 -3.665 1.00 0.00 H new ATOM 0 HG2 GLN A 193 -4.178 5.175 -5.889 1.00 0.00 H new ATOM 0 HG3 GLN A 193 -5.910 5.135 -6.153 1.00 0.00 H new ATOM 0 HE21 GLN A 193 -3.238 7.341 -5.117 1.00 0.00 H new ATOM 0 HE22 GLN A 193 -3.966 8.796 -5.807 1.00 0.00 H new ATOM 1041 N LYS A 194 -4.743 4.086 -1.221 1.00 0.00 N ATOM 1042 CA LYS A 194 -5.005 3.927 0.204 1.00 0.00 C ATOM 1043 C LYS A 194 -3.738 4.281 0.990 1.00 0.00 C ATOM 1044 O LYS A 194 -3.775 5.103 1.904 1.00 0.00 O ATOM 1045 CB LYS A 194 -5.452 2.487 0.516 1.00 0.00 C ATOM 1046 CG LYS A 194 -6.842 2.083 -0.002 1.00 0.00 C ATOM 1047 CD LYS A 194 -7.978 2.996 0.482 1.00 0.00 C ATOM 1048 CE LYS A 194 -9.343 2.302 0.363 1.00 0.00 C ATOM 1049 NZ LYS A 194 -9.614 1.813 -1.001 1.00 0.00 N ATOM 0 H LYS A 194 -4.892 3.235 -1.763 1.00 0.00 H new ATOM 0 HA LYS A 194 -5.812 4.598 0.499 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -4.717 1.801 0.096 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -5.435 2.349 1.597 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -6.827 2.085 -1.092 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -7.052 1.061 0.312 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -7.802 3.280 1.519 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -7.983 3.915 -0.104 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -9.382 1.465 1.060 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -10.128 2.999 0.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -10.547 1.354 -1.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -9.604 2.613 -1.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -8.882 1.127 -1.275 1.00 0.00 H new ATOM 1063 N ALA A 195 -2.609 3.667 0.623 1.00 0.00 N ATOM 1064 CA ALA A 195 -1.325 3.921 1.265 1.00 0.00 C ATOM 1065 C ALA A 195 -1.020 5.423 1.307 1.00 0.00 C ATOM 1066 O ALA A 195 -0.675 5.976 2.354 1.00 0.00 O ATOM 1067 CB ALA A 195 -0.229 3.168 0.513 1.00 0.00 C ATOM 0 H ALA A 195 -2.564 2.980 -0.129 1.00 0.00 H new ATOM 0 HA ALA A 195 -1.366 3.566 2.295 1.00 0.00 H new ATOM 0 HB1 ALA A 195 0.733 3.355 0.989 1.00 0.00 H new ATOM 0 HB2 ALA A 195 -0.442 2.099 0.533 1.00 0.00 H new ATOM 0 HB3 ALA A 195 -0.195 3.512 -0.521 1.00 0.00 H new ATOM 1073 N LEU A 196 -1.155 6.086 0.157 1.00 0.00 N ATOM 1074 CA LEU A 196 -0.922 7.512 0.048 1.00 0.00 C ATOM 1075 C LEU A 196 -1.914 8.293 0.913 1.00 0.00 C ATOM 1076 O LEU A 196 -1.514 9.188 1.651 1.00 0.00 O ATOM 1077 CB LEU A 196 -0.991 7.933 -1.425 1.00 0.00 C ATOM 1078 CG LEU A 196 0.160 7.374 -2.282 1.00 0.00 C ATOM 1079 CD1 LEU A 196 -0.173 7.576 -3.764 1.00 0.00 C ATOM 1080 CD2 LEU A 196 1.499 8.053 -1.966 1.00 0.00 C ATOM 0 H LEU A 196 -1.429 5.642 -0.720 1.00 0.00 H new ATOM 0 HA LEU A 196 0.075 7.745 0.422 1.00 0.00 H new ATOM 0 HB2 LEU A 196 -1.940 7.600 -1.845 1.00 0.00 H new ATOM 0 HB3 LEU A 196 -0.981 9.021 -1.484 1.00 0.00 H new ATOM 0 HG LEU A 196 0.264 6.314 -2.050 1.00 0.00 H new ATOM 0 HD11 LEU A 196 0.638 7.182 -4.376 1.00 0.00 H new ATOM 0 HD12 LEU A 196 -1.097 7.050 -4.004 1.00 0.00 H new ATOM 0 HD13 LEU A 196 -0.297 8.640 -3.967 1.00 0.00 H new ATOM 0 HD21 LEU A 196 2.281 7.626 -2.595 1.00 0.00 H new ATOM 0 HD22 LEU A 196 1.420 9.122 -2.161 1.00 0.00 H new ATOM 0 HD23 LEU A 196 1.749 7.893 -0.917 1.00 0.00 H new ATOM 1092 N ALA A 197 -3.199 7.947 0.841 1.00 0.00 N ATOM 1093 CA ALA A 197 -4.265 8.586 1.603 1.00 0.00 C ATOM 1094 C ALA A 197 -3.947 8.577 3.097 1.00 0.00 C ATOM 1095 O ALA A 197 -4.044 9.613 3.750 1.00 0.00 O ATOM 1096 CB ALA A 197 -5.612 7.918 1.312 1.00 0.00 C ATOM 0 H ALA A 197 -3.533 7.197 0.236 1.00 0.00 H new ATOM 0 HA ALA A 197 -4.336 9.627 1.289 1.00 0.00 H new ATOM 0 HB1 ALA A 197 -6.394 8.409 1.890 1.00 0.00 H new ATOM 0 HB2 ALA A 197 -5.838 8.003 0.249 1.00 0.00 H new ATOM 0 HB3 ALA A 197 -5.563 6.865 1.589 1.00 0.00 H new ATOM 1102 N MET A 198 -3.546 7.422 3.642 1.00 0.00 N ATOM 1103 CA MET A 198 -3.178 7.324 5.049 1.00 0.00 C ATOM 1104 C MET A 198 -1.824 7.981 5.354 1.00 0.00 C ATOM 1105 O MET A 198 -1.422 8.038 6.513 1.00 0.00 O ATOM 1106 CB MET A 198 -3.279 5.871 5.536 1.00 0.00 C ATOM 1107 CG MET A 198 -4.728 5.561 5.937 1.00 0.00 C ATOM 1108 SD MET A 198 -5.957 5.387 4.621 1.00 0.00 S ATOM 1109 CE MET A 198 -5.640 3.677 4.151 1.00 0.00 C ATOM 0 H MET A 198 -3.470 6.546 3.126 1.00 0.00 H new ATOM 0 HA MET A 198 -3.900 7.902 5.625 1.00 0.00 H new ATOM 0 HB2 MET A 198 -2.955 5.190 4.749 1.00 0.00 H new ATOM 0 HB3 MET A 198 -2.615 5.715 6.386 1.00 0.00 H new ATOM 0 HG2 MET A 198 -4.724 4.636 6.514 1.00 0.00 H new ATOM 0 HG3 MET A 198 -5.066 6.353 6.606 1.00 0.00 H new ATOM 0 HE1 MET A 198 -6.370 3.363 3.405 1.00 0.00 H new ATOM 0 HE2 MET A 198 -4.637 3.595 3.733 1.00 0.00 H new ATOM 0 HE3 MET A 198 -5.721 3.037 5.030 1.00 0.00 H new ATOM 1119 N GLY A 199 -1.137 8.520 4.345 1.00 0.00 N ATOM 1120 CA GLY A 199 0.085 9.270 4.532 1.00 0.00 C ATOM 1121 C GLY A 199 1.294 8.379 4.749 1.00 0.00 C ATOM 1122 O GLY A 199 2.169 8.741 5.536 1.00 0.00 O ATOM 0 H GLY A 199 -1.424 8.442 3.369 1.00 0.00 H new ATOM 0 HA2 GLY A 199 0.256 9.901 3.660 1.00 0.00 H new ATOM 0 HA3 GLY A 199 -0.029 9.935 5.388 1.00 0.00 H new ATOM 1126 N MET A 200 1.380 7.247 4.038 1.00 0.00 N ATOM 1127 CA MET A 200 2.582 6.426 4.122 1.00 0.00 C ATOM 1128 C MET A 200 3.773 7.289 3.698 1.00 0.00 C ATOM 1129 O MET A 200 3.729 7.941 2.653 1.00 0.00 O ATOM 1130 CB MET A 200 2.479 5.161 3.259 1.00 0.00 C ATOM 1131 CG MET A 200 1.673 4.079 3.980 1.00 0.00 C ATOM 1132 SD MET A 200 1.819 2.414 3.294 1.00 0.00 S ATOM 1133 CE MET A 200 1.014 1.477 4.606 1.00 0.00 C ATOM 0 H MET A 200 0.653 6.891 3.418 1.00 0.00 H new ATOM 0 HA MET A 200 2.712 6.080 5.147 1.00 0.00 H new ATOM 0 HB2 MET A 200 2.005 5.401 2.308 1.00 0.00 H new ATOM 0 HB3 MET A 200 3.477 4.787 3.032 1.00 0.00 H new ATOM 0 HG2 MET A 200 1.986 4.052 5.024 1.00 0.00 H new ATOM 0 HG3 MET A 200 0.622 4.366 3.970 1.00 0.00 H new ATOM 0 HE1 MET A 200 0.870 0.447 4.281 1.00 0.00 H new ATOM 0 HE2 MET A 200 1.638 1.492 5.499 1.00 0.00 H new ATOM 0 HE3 MET A 200 0.046 1.925 4.832 1.00 0.00 H new ATOM 1143 N LYS A 201 4.821 7.322 4.523 1.00 0.00 N ATOM 1144 CA LYS A 201 5.989 8.149 4.284 1.00 0.00 C ATOM 1145 C LYS A 201 6.759 7.586 3.091 1.00 0.00 C ATOM 1146 O LYS A 201 7.703 6.827 3.267 1.00 0.00 O ATOM 1147 CB LYS A 201 6.850 8.246 5.557 1.00 0.00 C ATOM 1148 CG LYS A 201 6.322 9.301 6.546 1.00 0.00 C ATOM 1149 CD LYS A 201 5.124 8.804 7.365 1.00 0.00 C ATOM 1150 CE LYS A 201 4.391 9.942 8.080 1.00 0.00 C ATOM 1151 NZ LYS A 201 3.604 10.744 7.126 1.00 0.00 N ATOM 0 H LYS A 201 4.877 6.770 5.379 1.00 0.00 H new ATOM 0 HA LYS A 201 5.689 9.168 4.039 1.00 0.00 H new ATOM 0 HB2 LYS A 201 6.877 7.273 6.048 1.00 0.00 H new ATOM 0 HB3 LYS A 201 7.875 8.492 5.281 1.00 0.00 H new ATOM 0 HG2 LYS A 201 7.125 9.590 7.224 1.00 0.00 H new ATOM 0 HG3 LYS A 201 6.033 10.196 5.995 1.00 0.00 H new ATOM 0 HD2 LYS A 201 4.428 8.285 6.706 1.00 0.00 H new ATOM 0 HD3 LYS A 201 5.468 8.078 8.102 1.00 0.00 H new ATOM 0 HE2 LYS A 201 3.733 9.531 8.845 1.00 0.00 H new ATOM 0 HE3 LYS A 201 5.112 10.581 8.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 201 2.939 11.350 7.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 201 4.244 11.338 6.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 201 3.073 10.110 6.495 1.00 0.00 H new ATOM 1165 N ARG A 202 6.327 7.941 1.880 1.00 0.00 N ATOM 1166 CA ARG A 202 6.859 7.477 0.604 1.00 0.00 C ATOM 1167 C ARG A 202 8.385 7.321 0.642 1.00 0.00 C ATOM 1168 O ARG A 202 8.908 6.227 0.451 1.00 0.00 O ATOM 1169 CB ARG A 202 6.367 8.426 -0.503 1.00 0.00 C ATOM 1170 CG ARG A 202 6.322 7.735 -1.869 1.00 0.00 C ATOM 1171 CD ARG A 202 5.658 8.633 -2.917 1.00 0.00 C ATOM 1172 NE ARG A 202 5.427 7.909 -4.176 1.00 0.00 N ATOM 1173 CZ ARG A 202 6.252 7.879 -5.234 1.00 0.00 C ATOM 1174 NH1 ARG A 202 7.462 8.443 -5.181 1.00 0.00 N ATOM 1175 NH2 ARG A 202 5.855 7.284 -6.361 1.00 0.00 N ATOM 0 H ARG A 202 5.554 8.596 1.760 1.00 0.00 H new ATOM 0 HA ARG A 202 6.487 6.476 0.387 1.00 0.00 H new ATOM 0 HB2 ARG A 202 5.373 8.795 -0.250 1.00 0.00 H new ATOM 0 HB3 ARG A 202 7.025 9.293 -0.556 1.00 0.00 H new ATOM 0 HG2 ARG A 202 7.334 7.485 -2.188 1.00 0.00 H new ATOM 0 HG3 ARG A 202 5.773 6.797 -1.788 1.00 0.00 H new ATOM 0 HD2 ARG A 202 4.709 9.005 -2.531 1.00 0.00 H new ATOM 0 HD3 ARG A 202 6.288 9.502 -3.106 1.00 0.00 H new ATOM 0 HE ARG A 202 4.558 7.380 -4.252 1.00 0.00 H new ATOM 0 HH11 ARG A 202 7.772 8.906 -4.327 1.00 0.00 H new ATOM 0 HH12 ARG A 202 8.076 8.411 -5.995 1.00 0.00 H new ATOM 0 HH21 ARG A 202 4.930 6.856 -6.414 1.00 0.00 H new ATOM 0 HH22 ARG A 202 6.476 7.257 -7.170 1.00 0.00 H new ATOM 1189 N GLU A 203 9.101 8.406 0.935 1.00 0.00 N ATOM 1190 CA GLU A 203 10.554 8.437 1.054 1.00 0.00 C ATOM 1191 C GLU A 203 11.124 7.339 1.963 1.00 0.00 C ATOM 1192 O GLU A 203 12.195 6.806 1.681 1.00 0.00 O ATOM 1193 CB GLU A 203 11.003 9.831 1.524 1.00 0.00 C ATOM 1194 CG GLU A 203 10.478 10.312 2.895 1.00 0.00 C ATOM 1195 CD GLU A 203 8.994 10.680 2.945 1.00 0.00 C ATOM 1196 OE1 GLU A 203 8.403 10.882 1.861 1.00 0.00 O ATOM 1197 OE2 GLU A 203 8.467 10.741 4.076 1.00 0.00 O ATOM 0 H GLU A 203 8.670 9.315 1.101 1.00 0.00 H new ATOM 0 HA GLU A 203 10.959 8.231 0.063 1.00 0.00 H new ATOM 0 HB2 GLU A 203 12.092 9.843 1.555 1.00 0.00 H new ATOM 0 HB3 GLU A 203 10.698 10.557 0.771 1.00 0.00 H new ATOM 0 HG2 GLU A 203 10.664 9.529 3.630 1.00 0.00 H new ATOM 0 HG3 GLU A 203 11.060 11.181 3.201 1.00 0.00 H new ATOM 1204 N ALA A 204 10.408 6.976 3.031 1.00 0.00 N ATOM 1205 CA ALA A 204 10.826 5.941 3.974 1.00 0.00 C ATOM 1206 C ALA A 204 11.020 4.582 3.294 1.00 0.00 C ATOM 1207 O ALA A 204 11.659 3.693 3.857 1.00 0.00 O ATOM 1208 CB ALA A 204 9.876 5.853 5.170 1.00 0.00 C ATOM 0 H ALA A 204 9.510 7.400 3.266 1.00 0.00 H new ATOM 0 HA ALA A 204 11.802 6.237 4.359 1.00 0.00 H new ATOM 0 HB1 ALA A 204 10.218 5.073 5.850 1.00 0.00 H new ATOM 0 HB2 ALA A 204 9.860 6.809 5.693 1.00 0.00 H new ATOM 0 HB3 ALA A 204 8.872 5.614 4.820 1.00 0.00 H new ATOM 1214 N VAL A 205 10.527 4.415 2.065 1.00 0.00 N ATOM 1215 CA VAL A 205 10.821 3.239 1.265 1.00 0.00 C ATOM 1216 C VAL A 205 12.341 3.093 1.171 1.00 0.00 C ATOM 1217 O VAL A 205 12.880 2.007 1.385 1.00 0.00 O ATOM 1218 CB VAL A 205 10.146 3.401 -0.103 1.00 0.00 C ATOM 1219 CG1 VAL A 205 10.805 2.584 -1.216 1.00 0.00 C ATOM 1220 CG2 VAL A 205 8.661 3.060 0.080 1.00 0.00 C ATOM 0 H VAL A 205 9.917 5.090 1.604 1.00 0.00 H new ATOM 0 HA VAL A 205 10.430 2.326 1.713 1.00 0.00 H new ATOM 0 HB VAL A 205 10.262 4.431 -0.442 1.00 0.00 H new ATOM 0 HG11 VAL A 205 10.273 2.750 -2.153 1.00 0.00 H new ATOM 0 HG12 VAL A 205 11.844 2.894 -1.329 1.00 0.00 H new ATOM 0 HG13 VAL A 205 10.768 1.525 -0.960 1.00 0.00 H new ATOM 0 HG21 VAL A 205 8.144 3.164 -0.874 1.00 0.00 H new ATOM 0 HG22 VAL A 205 8.564 2.034 0.436 1.00 0.00 H new ATOM 0 HG23 VAL A 205 8.219 3.740 0.808 1.00 0.00 H new ATOM 1230 N GLN A 206 13.028 4.213 0.938 1.00 0.00 N ATOM 1231 CA GLN A 206 14.475 4.295 0.869 1.00 0.00 C ATOM 1232 C GLN A 206 15.059 4.590 2.254 1.00 0.00 C ATOM 1233 O GLN A 206 16.019 5.348 2.362 1.00 0.00 O ATOM 1234 CB GLN A 206 14.858 5.383 -0.149 1.00 0.00 C ATOM 1235 CG GLN A 206 14.323 5.074 -1.553 1.00 0.00 C ATOM 1236 CD GLN A 206 14.943 3.788 -2.094 1.00 0.00 C ATOM 1237 OE1 GLN A 206 14.294 2.748 -2.165 1.00 0.00 O ATOM 1238 NE2 GLN A 206 16.221 3.846 -2.460 1.00 0.00 N ATOM 0 H GLN A 206 12.571 5.113 0.788 1.00 0.00 H new ATOM 0 HA GLN A 206 14.890 3.342 0.541 1.00 0.00 H new ATOM 0 HB2 GLN A 206 14.467 6.344 0.184 1.00 0.00 H new ATOM 0 HB3 GLN A 206 15.943 5.477 -0.188 1.00 0.00 H new ATOM 0 HG2 GLN A 206 13.238 4.975 -1.521 1.00 0.00 H new ATOM 0 HG3 GLN A 206 14.548 5.903 -2.224 1.00 0.00 H new ATOM 0 HE21 GLN A 206 16.732 4.726 -2.389 1.00 0.00 H new ATOM 0 HE22 GLN A 206 16.689 3.011 -2.812 1.00 0.00 H new ATOM 1247 N GLU A 207 14.503 3.998 3.317 1.00 0.00 N ATOM 1248 CA GLU A 207 15.029 4.218 4.665 1.00 0.00 C ATOM 1249 C GLU A 207 16.187 3.244 4.876 1.00 0.00 C ATOM 1250 O GLU A 207 17.350 3.625 4.770 1.00 0.00 O ATOM 1251 CB GLU A 207 13.906 4.077 5.698 1.00 0.00 C ATOM 1252 CG GLU A 207 14.351 4.241 7.157 1.00 0.00 C ATOM 1253 CD GLU A 207 13.188 3.965 8.107 1.00 0.00 C ATOM 1254 OE1 GLU A 207 12.508 2.938 7.885 1.00 0.00 O ATOM 1255 OE2 GLU A 207 12.995 4.786 9.030 1.00 0.00 O ATOM 0 H GLU A 207 13.700 3.371 3.270 1.00 0.00 H new ATOM 0 HA GLU A 207 15.414 5.230 4.790 1.00 0.00 H new ATOM 0 HB2 GLU A 207 13.137 4.819 5.482 1.00 0.00 H new ATOM 0 HB3 GLU A 207 13.445 3.096 5.581 1.00 0.00 H new ATOM 0 HG2 GLU A 207 15.173 3.558 7.371 1.00 0.00 H new ATOM 0 HG3 GLU A 207 14.727 5.252 7.317 1.00 0.00 H new