USER MOD reduce.3.24.130724 H: found=0, std=0, add=608, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 615 hydrogens (4 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 NoAdj : A 178 ASNHD21 : A 178 ASN OD1 : A 246 CACA :(metal ligand) USER MOD NoAdj : A 178 ASNHD22 : A 178 ASN OD1 : A 246 CACA :(metal ligand) USER MOD NoAdj : A 217 ASNHD21 : A 217 ASN OD1 : A 247 CACA :(metal ligand) USER MOD NoAdj : A 217 ASNHD22 : A 217 ASN OD1 : A 247 CACA :(metal ligand) USER MOD Set 1.1: A 222 TYR OH : rot 30:sc= -0.0421 USER MOD Set 1.2: A 239 LYS NZ :NH3+ 150:sc= 0.762 (180deg=0) USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 SER OG : rot -45:sc= 1.15 USER MOD Single : A 167 LYS NZ :NH3+ -171:sc= 0.457 (180deg=0.416) USER MOD Single : A 169 SER OG : rot 44:sc= 0.227 USER MOD Single : A 173 THR OG1 : rot 180:sc= 0 USER MOD Single : A 177 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 191 TYR OH : rot -16:sc= -2.15! USER MOD Single : A 193 TYR OH : rot -11:sc= -2.51! USER MOD Single : A 194 ASN :FLIP amide:sc= -0.0308 F(o=-0.96,f=-0.031) USER MOD Single : A 196 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 SER OG : rot -42:sc= 0.103 USER MOD Single : A 198 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 199 SER OG : rot 180:sc= 0 USER MOD Single : A 207 SER OG : rot 180:sc= 0 USER MOD Single : A 209 ASN : amide:sc= -1.57! C(o=-1.6!,f=-2.8!) USER MOD Single : A 210 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 213 GLN :FLIP amide:sc= -5.11 F(o=-6.5,f=-5.1) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 223 THR OG1 : rot 87:sc= 0.614! USER MOD Single : A 225 TYR OH : rot 180:sc= -0.0676 USER MOD Single : A 229 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 230 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 236 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 238 GLN : amide:sc= 0 X(o=0,f=-0.059) USER MOD Single : A 240 SER OG : rot 180:sc= 0 USER MOD Single : A 245 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 159 13.708 5.271 -15.369 -0.10 0.02 N ATOM 2 CA LYS A 159 14.602 5.078 -14.198 0.22 0.02 C ATOM 3 C LYS A 159 15.353 6.362 -13.859 0.48 0.02 C ATOM 4 O LYS A 159 15.721 7.131 -14.748 -0.48 0.02 O ATOM 5 CB LYS A 159 15.589 3.952 -14.518 -0.20 0.02 C ATOM 6 CG LYS A 159 15.624 2.857 -13.464 -0.20 0.02 C ATOM 7 CD LYS A 159 15.588 1.472 -14.092 -0.20 0.02 C ATOM 8 CE LYS A 159 14.696 0.525 -13.305 0.30 5.02 C ATOM 9 NZ LYS A 159 15.295 -0.834 -13.189 -0.81 0.02 N ATOM 0 HA LYS A 159 14.001 4.813 -13.328 0.22 0.02 H new ATOM 0 HB2 LYS A 159 15.325 3.511 -15.479 -0.20 0.02 H new ATOM 0 HB3 LYS A 159 16.588 4.375 -14.624 -0.20 0.02 H new ATOM 0 HG2 LYS A 159 16.526 2.960 -12.861 -0.20 0.02 H new ATOM 0 HG3 LYS A 159 14.775 2.973 -12.790 -0.20 0.02 H new ATOM 0 HD2 LYS A 159 15.226 1.546 -15.118 -0.20 0.02 H new ATOM 0 HD3 LYS A 159 16.599 1.067 -14.139 -0.20 0.02 H new ATOM 0 HE2 LYS A 159 14.524 0.932 -12.309 0.30 5.02 H new ATOM 0 HE3 LYS A 159 13.724 0.453 -13.792 0.30 5.02 H new ATOM 0 HZ1 LYS A 159 14.657 -1.450 -12.646 -0.81 0.02 H new ATOM 0 HZ2 LYS A 159 15.436 -1.233 -14.139 -0.81 0.02 H new ATOM 0 HZ3 LYS A 159 16.211 -0.769 -12.701 -0.81 0.02 H new ATOM 25 N ASP A 160 15.575 6.589 -12.569 -0.36 0.02 N ATOM 26 CA ASP A 160 16.282 7.782 -12.111 1.00 0.01 C ATOM 27 C ASP A 160 17.242 7.443 -10.973 0.48 0.02 C ATOM 28 O ASP A 160 18.446 7.300 -11.186 -0.48 0.02 O ATOM 29 CB ASP A 160 15.288 8.859 -11.658 -0.45 0.01 C ATOM 30 CG ASP A 160 13.984 8.279 -11.137 0.49 0.01 C ATOM 31 OD1 ASP A 160 13.961 7.815 -9.977 -0.62 0.01 O ATOM 32 OD2 ASP A 160 12.987 8.290 -11.890 -0.62 0.01 O ATOM 0 H ASP A 160 15.276 5.963 -11.821 -0.36 0.02 H new ATOM 0 HA ASP A 160 16.862 8.170 -12.948 1.00 0.01 H new ATOM 0 HB2 ASP A 160 15.748 9.465 -10.877 -0.45 0.01 H new ATOM 0 HB3 ASP A 160 15.075 9.525 -12.495 -0.45 0.01 H new ATOM 37 N VAL A 161 16.701 7.312 -9.767 -0.36 0.01 N ATOM 38 CA VAL A 161 17.505 6.986 -8.596 1.00 0.01 C ATOM 39 C VAL A 161 16.659 6.281 -7.542 0.48 0.01 C ATOM 40 O VAL A 161 15.465 6.559 -7.405 -0.48 0.01 O ATOM 41 CB VAL A 161 18.141 8.248 -7.979 -0.10 0.01 C ATOM 42 CG1 VAL A 161 17.068 9.227 -7.529 -0.30 0.02 C ATOM 43 CG2 VAL A 161 19.055 7.876 -6.821 -0.30 0.02 C ATOM 0 H VAL A 161 15.706 7.427 -9.575 -0.36 0.01 H new ATOM 0 HA VAL A 161 18.302 6.320 -8.927 1.00 0.01 H new ATOM 0 HB VAL A 161 18.744 8.736 -8.745 -0.10 0.01 H new ATOM 0 HG11 VAL A 161 17.539 10.110 -7.097 -0.30 0.02 H new ATOM 0 HG12 VAL A 161 16.462 9.522 -8.386 -0.30 0.02 H new ATOM 0 HG13 VAL A 161 16.433 8.752 -6.781 -0.30 0.02 H new ATOM 0 HG21 VAL A 161 19.494 8.780 -6.399 -0.30 0.02 H new ATOM 0 HG22 VAL A 161 18.478 7.360 -6.053 -0.30 0.02 H new ATOM 0 HG23 VAL A 161 19.849 7.221 -7.180 -0.30 0.02 H new ATOM 53 N ASP A 162 17.281 5.360 -6.804 -0.36 0.01 N ATOM 54 CA ASP A 162 16.582 4.607 -5.765 1.00 0.01 C ATOM 55 C ASP A 162 15.246 4.089 -6.286 0.48 0.01 C ATOM 56 O ASP A 162 14.243 4.799 -6.252 -0.48 0.02 O ATOM 57 CB ASP A 162 16.356 5.484 -4.533 -0.45 0.01 C ATOM 58 CG ASP A 162 17.647 5.806 -3.807 0.49 0.02 C ATOM 59 OD1 ASP A 162 18.335 4.859 -3.371 -0.62 0.02 O ATOM 60 OD2 ASP A 162 17.970 7.005 -3.673 -0.62 0.02 O ATOM 0 H ASP A 162 18.267 5.119 -6.907 -0.36 0.01 H new ATOM 0 HA ASP A 162 17.202 3.756 -5.484 1.00 0.01 H new ATOM 0 HB2 ASP A 162 15.871 6.412 -4.835 -0.45 0.01 H new ATOM 0 HB3 ASP A 162 15.675 4.977 -3.850 -0.45 0.01 H new ATOM 65 N GLU A 163 15.234 2.854 -6.776 -0.36 0.02 N ATOM 66 CA GLU A 163 14.011 2.274 -7.305 1.00 0.02 C ATOM 67 C GLU A 163 13.457 1.226 -6.352 0.48 0.02 C ATOM 68 O GLU A 163 12.417 1.429 -5.726 -0.48 0.02 O ATOM 69 CB GLU A 163 14.262 1.667 -8.687 -0.20 0.01 C ATOM 70 CG GLU A 163 15.178 2.508 -9.564 -0.45 0.01 C ATOM 71 CD GLU A 163 14.643 3.909 -9.802 0.49 0.01 C ATOM 72 OE1 GLU A 163 14.326 4.606 -8.812 -0.62 0.01 O ATOM 73 OE2 GLU A 163 14.540 4.311 -10.980 -0.62 0.01 O ATOM 0 H GLU A 163 16.050 2.243 -6.817 -0.36 0.02 H new ATOM 0 HA GLU A 163 13.270 3.067 -7.406 1.00 0.02 H new ATOM 0 HB2 GLU A 163 14.699 0.676 -8.565 -0.20 0.01 H new ATOM 0 HB3 GLU A 163 13.307 1.534 -9.195 -0.20 0.01 H new ATOM 0 HG2 GLU A 163 16.161 2.574 -9.097 -0.45 0.01 H new ATOM 0 HG3 GLU A 163 15.314 2.008 -10.523 -0.45 0.01 H new ATOM 80 N CYS A 164 14.165 0.114 -6.233 -0.36 0.02 N ATOM 81 CA CYS A 164 13.750 -0.955 -5.340 1.00 0.02 C ATOM 82 C CYS A 164 14.494 -0.860 -4.012 0.48 0.02 C ATOM 83 O CYS A 164 14.091 -1.463 -3.018 -0.48 0.02 O ATOM 84 CB CYS A 164 13.992 -2.312 -5.989 0.20 0.02 C ATOM 85 SG CYS A 164 12.490 -3.073 -6.683 -0.20 0.02 S ATOM 0 H CYS A 164 15.029 -0.071 -6.743 -0.36 0.02 H new ATOM 0 HA CYS A 164 12.683 -0.849 -5.146 1.00 0.02 H new ATOM 0 HB2 CYS A 164 14.730 -2.198 -6.783 0.20 0.02 H new ATOM 0 HB3 CYS A 164 14.421 -2.987 -5.249 0.20 0.02 H new ATOM 90 N SER A 165 15.574 -0.084 -4.001 -0.36 0.02 N ATOM 91 CA SER A 165 16.365 0.111 -2.796 1.00 0.02 C ATOM 92 C SER A 165 15.946 1.399 -2.091 0.48 0.02 C ATOM 93 O SER A 165 16.687 1.937 -1.268 -0.48 0.02 O ATOM 94 CB SER A 165 17.855 0.165 -3.142 0.08 0.02 C ATOM 95 OG SER A 165 18.643 0.353 -1.979 -0.68 0.02 O ATOM 0 H SER A 165 15.920 0.420 -4.817 -0.36 0.02 H new ATOM 0 HA SER A 165 16.190 -0.731 -2.126 1.00 0.02 H new ATOM 0 HB2 SER A 165 18.150 -0.759 -3.639 0.08 0.02 H new ATOM 0 HB3 SER A 165 18.039 0.978 -3.845 0.08 0.02 H new ATOM 0 HG SER A 165 18.245 1.056 -1.425 -0.68 0.02 H new ATOM 101 N LEU A 166 14.750 1.892 -2.421 -0.36 0.02 N ATOM 102 CA LEU A 166 14.234 3.116 -1.820 1.00 0.02 C ATOM 103 C LEU A 166 13.756 2.857 -0.395 0.48 0.02 C ATOM 104 O LEU A 166 13.723 3.765 0.436 -0.48 0.02 O ATOM 105 CB LEU A 166 13.089 3.680 -2.666 -0.20 0.02 C ATOM 106 CG LEU A 166 13.024 5.211 -2.736 -0.10 0.02 C ATOM 107 CD1 LEU A 166 12.755 5.674 -4.162 -0.30 0.02 C ATOM 108 CD2 LEU A 166 11.959 5.745 -1.788 -0.30 0.02 C ATOM 0 H LEU A 166 14.124 1.460 -3.101 -0.36 0.02 H new ATOM 0 HA LEU A 166 15.041 3.848 -1.785 1.00 0.02 H new ATOM 0 HB2 LEU A 166 13.180 3.289 -3.679 -0.20 0.02 H new ATOM 0 HB3 LEU A 166 12.145 3.310 -2.265 -0.20 0.02 H new ATOM 0 HG LEU A 166 13.990 5.609 -2.426 -0.10 0.02 H new ATOM 0 HD11 LEU A 166 12.713 6.763 -4.189 -0.30 0.02 H new ATOM 0 HD12 LEU A 166 13.555 5.326 -4.815 -0.30 0.02 H new ATOM 0 HD13 LEU A 166 11.804 5.265 -4.504 -0.30 0.02 H new ATOM 0 HD21 LEU A 166 11.928 6.833 -1.852 -0.30 0.02 H new ATOM 0 HD22 LEU A 166 10.987 5.337 -2.066 -0.30 0.02 H new ATOM 0 HD23 LEU A 166 12.199 5.448 -0.767 -0.30 0.02 H new ATOM 120 N LYS A 167 13.389 1.608 -0.120 -0.36 0.02 N ATOM 121 CA LYS A 167 12.915 1.221 1.203 1.00 0.02 C ATOM 122 C LYS A 167 13.519 -0.120 1.618 0.48 0.02 C ATOM 123 O LYS A 167 14.105 -0.824 0.797 -0.48 0.02 O ATOM 124 CB LYS A 167 11.387 1.135 1.213 -0.20 0.02 C ATOM 125 CG LYS A 167 10.710 2.417 1.669 -0.20 0.02 C ATOM 126 CD LYS A 167 9.225 2.206 1.915 -0.20 0.02 C ATOM 127 CE LYS A 167 8.494 1.826 0.636 0.30 5.02 C ATOM 128 NZ LYS A 167 7.298 2.683 0.405 -0.81 0.02 N ATOM 0 H LYS A 167 13.411 0.846 -0.798 -0.36 0.02 H new ATOM 0 HA LYS A 167 13.231 1.980 1.918 1.00 0.02 H new ATOM 0 HB2 LYS A 167 11.039 0.886 0.211 -0.20 0.02 H new ATOM 0 HB3 LYS A 167 11.081 0.319 1.868 -0.20 0.02 H new ATOM 0 HG2 LYS A 167 11.184 2.775 2.583 -0.20 0.02 H new ATOM 0 HG3 LYS A 167 10.848 3.191 0.914 -0.20 0.02 H new ATOM 0 HD2 LYS A 167 9.087 1.423 2.660 -0.20 0.02 H new ATOM 0 HD3 LYS A 167 8.791 3.117 2.326 -0.20 0.02 H new ATOM 0 HE2 LYS A 167 9.174 1.916 -0.211 0.30 5.02 H new ATOM 0 HE3 LYS A 167 8.187 0.781 0.690 0.30 5.02 H new ATOM 0 HZ1 LYS A 167 6.744 2.299 -0.387 -0.81 0.02 H new ATOM 0 HZ2 LYS A 167 6.711 2.698 1.263 -0.81 0.02 H new ATOM 0 HZ3 LYS A 167 7.603 3.651 0.177 -0.81 0.02 H new ATOM 142 N PRO A 168 13.384 -0.492 2.903 -0.36 0.02 N ATOM 143 CA PRO A 168 13.922 -1.755 3.420 1.00 0.02 C ATOM 144 C PRO A 168 13.611 -2.940 2.511 0.48 0.02 C ATOM 145 O PRO A 168 14.430 -3.845 2.351 -0.48 0.02 O ATOM 146 CB PRO A 168 13.212 -1.907 4.764 -0.20 0.02 C ATOM 147 CG PRO A 168 12.948 -0.510 5.208 -0.20 0.02 C ATOM 148 CD PRO A 168 12.700 0.288 3.954 0.06 0.02 C ATOM 0 HA PRO A 168 15.010 -1.739 3.492 1.00 0.02 H new ATOM 0 HB2 PRO A 168 12.286 -2.472 4.662 -0.20 0.02 H new ATOM 0 HB3 PRO A 168 13.834 -2.441 5.483 -0.20 0.02 H new ATOM 0 HG2 PRO A 168 12.085 -0.469 5.873 -0.20 0.02 H new ATOM 0 HG3 PRO A 168 13.797 -0.110 5.763 -0.20 0.02 H new ATOM 0 HD2 PRO A 168 11.634 0.390 3.748 0.06 0.02 H new ATOM 0 HD3 PRO A 168 13.107 1.296 4.034 0.06 0.02 H new ATOM 156 N SER A 169 12.422 -2.929 1.916 -0.36 0.02 N ATOM 157 CA SER A 169 12.004 -4.003 1.021 1.00 0.02 C ATOM 158 C SER A 169 10.869 -3.542 0.112 0.48 0.02 C ATOM 159 O SER A 169 9.715 -3.468 0.533 -0.48 0.02 O ATOM 160 CB SER A 169 11.562 -5.224 1.828 0.08 0.02 C ATOM 161 OG SER A 169 10.666 -4.856 2.862 -0.68 0.02 O ATOM 0 H SER A 169 11.731 -2.188 2.037 -0.36 0.02 H new ATOM 0 HA SER A 169 12.856 -4.276 0.399 1.00 0.02 H new ATOM 0 HB2 SER A 169 11.082 -5.946 1.167 0.08 0.02 H new ATOM 0 HB3 SER A 169 12.435 -5.715 2.257 0.08 0.02 H new ATOM 0 HG SER A 169 10.008 -4.219 2.513 -0.68 0.02 H new ATOM 167 N ILE A 170 11.204 -3.230 -1.137 -0.36 0.02 N ATOM 168 CA ILE A 170 10.209 -2.774 -2.101 1.00 0.02 C ATOM 169 C ILE A 170 9.775 -3.892 -3.034 0.48 0.02 C ATOM 170 O ILE A 170 8.709 -4.483 -2.861 -0.48 0.02 O ATOM 171 CB ILE A 170 10.738 -1.622 -2.972 -0.10 0.02 C ATOM 172 CG1 ILE A 170 11.283 -0.483 -2.102 -0.20 0.02 C ATOM 173 CG2 ILE A 170 9.648 -1.118 -3.903 -0.30 0.02 C ATOM 174 CD1 ILE A 170 10.632 0.856 -2.381 -0.30 0.02 C ATOM 0 H ILE A 170 12.154 -3.285 -1.504 -0.36 0.02 H new ATOM 0 HA ILE A 170 9.362 -2.431 -1.507 1.00 0.02 H new ATOM 0 HB ILE A 170 11.560 -2.001 -3.579 -0.10 0.02 H new ATOM 0 HG12 ILE A 170 11.137 -0.737 -1.052 -0.20 0.02 H new ATOM 0 HG13 ILE A 170 12.358 -0.396 -2.263 -0.20 0.02 H new ATOM 0 HG21 ILE A 170 10.038 -0.303 -4.513 -0.30 0.02 H new ATOM 0 HG22 ILE A 170 9.319 -1.930 -4.551 -0.30 0.02 H new ATOM 0 HG23 ILE A 170 8.804 -0.759 -3.314 -0.30 0.02 H new ATOM 0 HD11 ILE A 170 11.066 1.614 -1.730 -0.30 0.02 H new ATOM 0 HD12 ILE A 170 10.800 1.132 -3.422 -0.30 0.02 H new ATOM 0 HD13 ILE A 170 9.561 0.786 -2.192 -0.30 0.02 H new ATOM 186 N CYS A 171 10.597 -4.155 -4.048 -0.36 0.02 N ATOM 187 CA CYS A 171 10.279 -5.172 -5.025 1.00 0.02 C ATOM 188 C CYS A 171 11.503 -5.999 -5.408 0.48 0.02 C ATOM 189 O CYS A 171 11.548 -6.581 -6.492 -0.48 0.02 O ATOM 190 CB CYS A 171 9.667 -4.513 -6.265 0.20 0.02 C ATOM 191 SG CYS A 171 8.101 -5.268 -6.802 -0.20 0.02 S ATOM 0 H CYS A 171 11.483 -3.675 -4.207 -0.36 0.02 H new ATOM 0 HA CYS A 171 9.558 -5.857 -4.579 1.00 0.02 H new ATOM 0 HB2 CYS A 171 9.497 -3.457 -6.057 0.20 0.02 H new ATOM 0 HB3 CYS A 171 10.384 -4.565 -7.084 0.20 0.02 H new ATOM 196 N GLY A 172 12.494 -6.052 -4.515 -0.36 0.02 N ATOM 197 CA GLY A 172 13.705 -6.817 -4.788 -0.10 0.02 C ATOM 198 C GLY A 172 14.184 -6.641 -6.215 0.48 0.02 C ATOM 199 O GLY A 172 14.282 -7.612 -6.964 -0.48 0.02 O ATOM 0 H GLY A 172 12.480 -5.581 -3.611 -0.36 0.02 H new ATOM 0 HA2 GLY A 172 14.492 -6.505 -4.101 -0.10 0.02 H new ATOM 0 HA3 GLY A 172 13.516 -7.873 -4.598 -0.10 0.02 H new ATOM 203 N THR A 173 14.474 -5.389 -6.575 -0.36 0.02 N ATOM 204 CA THR A 173 14.935 -5.017 -7.899 1.00 0.02 C ATOM 205 C THR A 173 14.590 -6.064 -8.959 0.48 0.02 C ATOM 206 O THR A 173 15.437 -6.463 -9.758 -0.48 0.02 O ATOM 207 CB THR A 173 16.428 -4.740 -7.853 0.18 0.02 C ATOM 208 OG1 THR A 173 17.138 -5.855 -7.346 -0.68 0.02 O ATOM 209 CG2 THR A 173 16.786 -3.532 -7.005 -0.30 0.02 C ATOM 0 H THR A 173 14.391 -4.597 -5.938 -0.36 0.02 H new ATOM 0 HA THR A 173 14.410 -4.110 -8.198 1.00 0.02 H new ATOM 0 HB THR A 173 16.714 -4.537 -8.885 0.18 0.02 H new ATOM 0 HG1 THR A 173 18.097 -5.652 -7.328 -0.68 0.02 H new ATOM 0 HG21 THR A 173 17.867 -3.389 -7.014 -0.30 0.02 H new ATOM 0 HG22 THR A 173 16.299 -2.645 -7.411 -0.30 0.02 H new ATOM 0 HG23 THR A 173 16.450 -3.694 -5.981 -0.30 0.02 H new ATOM 217 N ALA A 174 13.326 -6.486 -8.959 -0.36 0.02 N ATOM 218 CA ALA A 174 12.837 -7.468 -9.919 1.00 0.02 C ATOM 219 C ALA A 174 12.547 -6.788 -11.248 0.48 0.02 C ATOM 220 O ALA A 174 13.231 -7.012 -12.247 -0.48 0.02 O ATOM 221 CB ALA A 174 11.578 -8.148 -9.382 -0.30 0.02 C ATOM 0 H ALA A 174 12.620 -6.159 -8.299 -0.36 0.02 H new ATOM 0 HA ALA A 174 13.602 -8.229 -10.072 1.00 0.02 H new ATOM 0 HB1 ALA A 174 11.222 -8.879 -10.108 -0.30 0.02 H new ATOM 0 HB2 ALA A 174 11.809 -8.651 -8.443 -0.30 0.02 H new ATOM 0 HB3 ALA A 174 10.804 -7.399 -9.212 -0.30 0.02 H new ATOM 227 N VAL A 175 11.534 -5.940 -11.229 -0.36 0.02 N ATOM 228 CA VAL A 175 11.120 -5.179 -12.399 1.00 0.02 C ATOM 229 C VAL A 175 10.349 -3.942 -11.955 0.48 0.02 C ATOM 230 O VAL A 175 9.456 -3.462 -12.654 -0.48 0.02 O ATOM 231 CB VAL A 175 10.232 -6.015 -13.340 -0.10 0.02 C ATOM 232 CG1 VAL A 175 9.961 -5.260 -14.632 -0.30 0.02 C ATOM 233 CG2 VAL A 175 10.872 -7.365 -13.629 -0.30 0.02 C ATOM 0 H VAL A 175 10.971 -5.758 -10.398 -0.36 0.02 H new ATOM 0 HA VAL A 175 12.019 -4.893 -12.945 1.00 0.02 H new ATOM 0 HB VAL A 175 9.279 -6.192 -12.841 -0.10 0.02 H new ATOM 0 HG11 VAL A 175 9.332 -5.867 -15.283 -0.30 0.02 H new ATOM 0 HG12 VAL A 175 9.451 -4.323 -14.406 -0.30 0.02 H new ATOM 0 HG13 VAL A 175 10.905 -5.048 -15.134 -0.30 0.02 H new ATOM 0 HG21 VAL A 175 10.227 -7.938 -14.295 -0.30 0.02 H new ATOM 0 HG22 VAL A 175 11.842 -7.214 -14.103 -0.30 0.02 H new ATOM 0 HG23 VAL A 175 11.006 -7.911 -12.695 -0.30 0.02 H new ATOM 243 N CYS A 176 10.693 -3.447 -10.769 -0.36 0.02 N ATOM 244 CA CYS A 176 10.040 -2.292 -10.194 1.00 0.02 C ATOM 245 C CYS A 176 10.329 -1.018 -10.975 0.48 0.02 C ATOM 246 O CYS A 176 11.471 -0.564 -11.050 -0.48 0.02 O ATOM 247 CB CYS A 176 10.484 -2.125 -8.744 0.20 0.02 C ATOM 248 SG CYS A 176 12.288 -2.182 -8.495 -0.20 0.02 S ATOM 0 H CYS A 176 11.432 -3.840 -10.186 -0.36 0.02 H new ATOM 0 HA CYS A 176 8.964 -2.462 -10.240 1.00 0.02 H new ATOM 0 HB2 CYS A 176 10.108 -1.173 -8.370 0.20 0.02 H new ATOM 0 HB3 CYS A 176 10.022 -2.908 -8.143 0.20 0.02 H new ATOM 253 N LYS A 177 9.275 -0.430 -11.529 -0.36 0.02 N ATOM 254 CA LYS A 177 9.400 0.813 -12.276 1.00 0.02 C ATOM 255 C LYS A 177 9.221 1.983 -11.320 0.48 0.02 C ATOM 256 O LYS A 177 8.108 2.468 -11.116 -0.48 0.02 O ATOM 257 CB LYS A 177 8.362 0.876 -13.399 -0.20 0.02 C ATOM 258 CG LYS A 177 8.955 1.232 -14.753 -0.20 0.02 C ATOM 259 CD LYS A 177 8.312 0.431 -15.874 -0.20 0.02 C ATOM 260 CE LYS A 177 9.353 -0.108 -16.842 0.30 5.02 C ATOM 261 NZ LYS A 177 9.924 0.967 -17.699 -0.81 0.02 N ATOM 0 H LYS A 177 8.324 -0.795 -11.474 -0.36 0.02 H new ATOM 0 HA LYS A 177 10.388 0.862 -12.733 1.00 0.02 H new ATOM 0 HB2 LYS A 177 7.860 -0.089 -13.473 -0.20 0.02 H new ATOM 0 HB3 LYS A 177 7.601 1.612 -13.139 -0.20 0.02 H new ATOM 0 HG2 LYS A 177 8.819 2.297 -14.942 -0.20 0.02 H new ATOM 0 HG3 LYS A 177 10.029 1.045 -14.741 -0.20 0.02 H new ATOM 0 HD2 LYS A 177 7.744 -0.397 -15.451 -0.20 0.02 H new ATOM 0 HD3 LYS A 177 7.604 1.061 -16.413 -0.20 0.02 H new ATOM 0 HE2 LYS A 177 10.154 -0.590 -16.282 0.30 5.02 H new ATOM 0 HE3 LYS A 177 8.900 -0.873 -17.473 0.30 5.02 H new ATOM 0 HZ1 LYS A 177 10.629 0.558 -18.345 -0.81 0.02 H new ATOM 0 HZ2 LYS A 177 9.163 1.410 -18.253 -0.81 0.02 H new ATOM 0 HZ3 LYS A 177 10.379 1.685 -17.099 -0.81 0.02 H new ATOM 275 N ASN A 178 10.318 2.405 -10.706 -0.36 0.02 N ATOM 276 CA ASN A 178 10.277 3.489 -9.738 1.00 0.01 C ATOM 277 C ASN A 178 10.353 4.858 -10.392 0.48 0.02 C ATOM 278 O ASN A 178 10.680 4.991 -11.571 -0.48 0.02 O ATOM 279 CB ASN A 178 11.406 3.337 -8.726 -0.20 0.01 C ATOM 280 CG ASN A 178 11.105 4.036 -7.415 0.48 0.01 C ATOM 281 OD1 ASN A 178 11.215 5.258 -7.310 -0.48 0.01 O ATOM 282 ND2 ASN A 178 10.723 3.262 -6.405 -0.52 0.01 N ATOM 0 H ASN A 178 11.246 2.012 -10.862 -0.36 0.02 H new ATOM 0 HA ASN A 178 9.315 3.423 -9.230 1.00 0.01 H new ATOM 0 HB2 ASN A 178 11.581 2.278 -8.538 -0.20 0.01 H new ATOM 0 HB3 ASN A 178 12.326 3.742 -9.148 -0.20 0.01 H new ATOM 0 HD21 ASN A 178 10.507 3.676 -5.498 -0.52 0.01 H new ATOM 0 HD22 ASN A 178 10.645 2.254 -6.536 -0.52 0.01 H new ATOM 289 N ILE A 179 10.043 5.873 -9.595 -0.36 0.01 N ATOM 290 CA ILE A 179 10.061 7.252 -10.047 1.00 0.01 C ATOM 291 C ILE A 179 10.536 8.164 -8.913 0.48 0.01 C ATOM 292 O ILE A 179 10.705 7.705 -7.780 -0.48 0.01 O ATOM 293 CB ILE A 179 8.661 7.677 -10.537 -0.10 0.01 C ATOM 294 CG1 ILE A 179 7.626 7.495 -9.423 -0.20 0.02 C ATOM 295 CG2 ILE A 179 8.278 6.863 -11.766 -0.30 0.02 C ATOM 296 CD1 ILE A 179 6.192 7.541 -9.912 -0.30 5.62 C ATOM 0 H ILE A 179 9.773 5.760 -8.618 -0.36 0.01 H new ATOM 0 HA ILE A 179 10.755 7.342 -10.883 1.00 0.01 H new ATOM 0 HB ILE A 179 8.684 8.733 -10.808 -0.10 0.01 H new ATOM 0 HG12 ILE A 179 7.802 6.540 -8.928 -0.20 0.02 H new ATOM 0 HG13 ILE A 179 7.771 8.273 -8.674 -0.20 0.02 H new ATOM 0 HG21 ILE A 179 7.289 7.166 -12.109 -0.30 0.02 H new ATOM 0 HG22 ILE A 179 9.006 7.036 -12.559 -0.30 0.02 H new ATOM 0 HG23 ILE A 179 8.265 5.803 -11.511 -0.30 0.02 H new ATOM 0 HD11 ILE A 179 5.515 7.405 -9.068 -0.30 5.62 H new ATOM 0 HD12 ILE A 179 5.998 8.506 -10.381 -0.30 5.62 H new ATOM 0 HD13 ILE A 179 6.030 6.745 -10.639 -0.30 5.62 H new ATOM 308 N PRO A 180 10.785 9.459 -9.198 -0.36 0.01 N ATOM 309 CA PRO A 180 11.266 10.418 -8.198 1.00 0.01 C ATOM 310 C PRO A 180 10.668 10.221 -6.806 0.48 0.01 C ATOM 311 O PRO A 180 11.321 10.504 -5.801 -0.48 0.02 O ATOM 312 CB PRO A 180 10.836 11.752 -8.793 -0.20 0.01 C ATOM 313 CG PRO A 180 10.968 11.550 -10.263 -0.20 0.02 C ATOM 314 CD PRO A 180 10.644 10.098 -10.525 0.06 0.01 C ATOM 0 HA PRO A 180 12.338 10.318 -8.025 1.00 0.01 H new ATOM 0 HB2 PRO A 180 9.812 12.002 -8.515 -0.20 0.01 H new ATOM 0 HB3 PRO A 180 11.469 12.568 -8.444 -0.20 0.01 H new ATOM 0 HG2 PRO A 180 10.287 12.204 -10.808 -0.20 0.02 H new ATOM 0 HG3 PRO A 180 11.977 11.789 -10.599 -0.20 0.02 H new ATOM 0 HD2 PRO A 180 9.636 9.978 -10.921 0.06 0.01 H new ATOM 0 HD3 PRO A 180 11.327 9.661 -11.254 0.06 0.01 H new ATOM 322 N GLY A 181 9.434 9.741 -6.746 -0.36 0.02 N ATOM 323 CA GLY A 181 8.796 9.528 -5.456 -0.10 0.02 C ATOM 324 C GLY A 181 7.625 8.565 -5.511 0.48 0.02 C ATOM 325 O GLY A 181 6.537 8.874 -5.025 -0.48 0.02 O ATOM 0 H GLY A 181 8.865 9.496 -7.557 -0.36 0.02 H new ATOM 0 HA2 GLY A 181 9.536 9.148 -4.752 -0.10 0.02 H new ATOM 0 HA3 GLY A 181 8.450 10.486 -5.068 -0.10 0.02 H new ATOM 329 N ASP A 182 7.850 7.391 -6.087 -0.36 0.02 N ATOM 330 CA ASP A 182 6.814 6.371 -6.188 1.00 0.02 C ATOM 331 C ASP A 182 7.424 5.079 -6.702 0.48 0.02 C ATOM 332 O ASP A 182 8.646 4.945 -6.742 -0.48 0.02 O ATOM 333 CB ASP A 182 5.681 6.834 -7.104 -0.45 0.02 C ATOM 334 CG ASP A 182 4.340 6.858 -6.397 0.49 0.02 C ATOM 335 OD1 ASP A 182 3.949 5.816 -5.830 -0.62 0.02 O ATOM 336 OD2 ASP A 182 3.680 7.919 -6.411 -0.62 0.02 O ATOM 0 H ASP A 182 8.746 7.121 -6.493 -0.36 0.02 H new ATOM 0 HA ASP A 182 6.391 6.198 -5.199 1.00 0.02 H new ATOM 0 HB2 ASP A 182 5.907 7.831 -7.482 -0.45 0.02 H new ATOM 0 HB3 ASP A 182 5.622 6.172 -7.968 -0.45 0.02 H new ATOM 341 N PHE A 183 6.590 4.124 -7.090 -0.36 0.02 N ATOM 342 CA PHE A 183 7.116 2.861 -7.583 1.00 0.02 C ATOM 343 C PHE A 183 6.070 1.998 -8.282 0.48 0.02 C ATOM 344 O PHE A 183 4.868 2.117 -8.046 -0.48 0.02 O ATOM 345 CB PHE A 183 7.770 2.083 -6.427 -0.16 0.02 C ATOM 346 CG PHE A 183 7.001 0.869 -5.965 0.03 0.02 C ATOM 347 CD1 PHE A 183 5.649 0.955 -5.663 -0.16 0.02 C ATOM 348 CD2 PHE A 183 7.634 -0.357 -5.836 -0.16 0.02 C ATOM 349 CE1 PHE A 183 4.945 -0.161 -5.242 -0.15 0.02 C ATOM 350 CE2 PHE A 183 6.936 -1.474 -5.414 -0.15 0.02 C ATOM 351 CZ PHE A 183 5.591 -1.376 -5.118 -0.15 0.02 C ATOM 0 H PHE A 183 5.573 4.196 -7.074 -0.36 0.02 H new ATOM 0 HA PHE A 183 7.862 3.104 -8.340 1.00 0.02 H new ATOM 0 HB2 PHE A 183 8.766 1.768 -6.738 -0.16 0.02 H new ATOM 0 HB3 PHE A 183 7.899 2.758 -5.581 -0.16 0.02 H new ATOM 0 HD1 PHE A 183 5.140 1.903 -5.757 -0.16 0.02 H new ATOM 0 HD2 PHE A 183 8.685 -0.441 -6.068 -0.16 0.02 H new ATOM 0 HE1 PHE A 183 3.893 -0.082 -5.011 -0.15 0.02 H new ATOM 0 HE2 PHE A 183 7.443 -2.423 -5.316 -0.15 0.02 H new ATOM 0 HZ PHE A 183 5.045 -2.248 -4.790 -0.15 0.02 H new ATOM 361 N GLU A 184 6.576 1.101 -9.119 -0.36 0.02 N ATOM 362 CA GLU A 184 5.760 0.150 -9.857 1.00 0.02 C ATOM 363 C GLU A 184 6.478 -1.193 -9.854 0.48 0.02 C ATOM 364 O GLU A 184 7.513 -1.328 -9.203 -0.48 0.02 O ATOM 365 CB GLU A 184 5.522 0.638 -11.285 -0.20 0.02 C ATOM 366 CG GLU A 184 4.763 1.953 -11.352 -0.45 0.02 C ATOM 367 CD GLU A 184 5.335 2.905 -12.384 0.49 0.02 C ATOM 368 OE1 GLU A 184 4.970 2.783 -13.572 -0.62 0.02 O ATOM 369 OE2 GLU A 184 6.148 3.774 -12.003 -0.62 0.02 O ATOM 0 H GLU A 184 7.575 1.014 -9.305 -0.36 0.02 H new ATOM 0 HA GLU A 184 4.784 0.048 -9.383 1.00 0.02 H new ATOM 0 HB2 GLU A 184 6.483 0.755 -11.786 -0.20 0.02 H new ATOM 0 HB3 GLU A 184 4.967 -0.123 -11.834 -0.20 0.02 H new ATOM 0 HG2 GLU A 184 3.718 1.753 -11.588 -0.45 0.02 H new ATOM 0 HG3 GLU A 184 4.783 2.430 -10.372 -0.45 0.02 H new ATOM 376 N CYS A 185 5.952 -2.189 -10.558 -0.36 0.02 N ATOM 377 CA CYS A 185 6.605 -3.495 -10.574 1.00 0.02 C ATOM 378 C CYS A 185 5.907 -4.491 -11.486 0.48 0.02 C ATOM 379 O CYS A 185 4.761 -4.293 -11.891 -0.48 0.02 O ATOM 380 CB CYS A 185 6.657 -4.064 -9.159 0.20 0.02 C ATOM 381 SG CYS A 185 8.134 -5.069 -8.818 -0.20 0.02 S ATOM 0 H CYS A 185 5.098 -2.123 -11.112 -0.36 0.02 H new ATOM 0 HA CYS A 185 7.611 -3.341 -10.964 1.00 0.02 H new ATOM 0 HB2 CYS A 185 6.618 -3.241 -8.446 0.20 0.02 H new ATOM 0 HB3 CYS A 185 5.769 -4.673 -8.991 0.20 0.02 H new ATOM 386 N GLU A 186 6.612 -5.580 -11.779 -0.36 0.02 N ATOM 387 CA GLU A 186 6.076 -6.643 -12.614 1.00 0.02 C ATOM 388 C GLU A 186 5.088 -7.489 -11.817 0.48 0.02 C ATOM 389 O GLU A 186 4.405 -8.349 -12.374 -0.48 0.02 O ATOM 390 CB GLU A 186 7.206 -7.522 -13.149 -0.20 0.02 C ATOM 391 CG GLU A 186 6.724 -8.743 -13.917 -0.45 0.02 C ATOM 392 CD GLU A 186 7.543 -9.008 -15.165 0.49 0.02 C ATOM 393 OE1 GLU A 186 8.700 -9.458 -15.031 -0.62 0.02 O ATOM 394 OE2 GLU A 186 7.026 -8.767 -16.276 -0.62 0.02 O ATOM 0 H GLU A 186 7.562 -5.747 -11.447 -0.36 0.02 H new ATOM 0 HA GLU A 186 5.555 -6.192 -13.459 1.00 0.02 H new ATOM 0 HB2 GLU A 186 7.842 -6.923 -13.800 -0.20 0.02 H new ATOM 0 HB3 GLU A 186 7.824 -7.851 -12.314 -0.20 0.02 H new ATOM 0 HG2 GLU A 186 6.767 -9.617 -13.267 -0.45 0.02 H new ATOM 0 HG3 GLU A 186 5.679 -8.603 -14.195 -0.45 0.02 H new ATOM 401 N CYS A 187 5.007 -7.233 -10.511 -0.36 0.02 N ATOM 402 CA CYS A 187 4.089 -7.969 -9.658 1.00 0.02 C ATOM 403 C CYS A 187 2.660 -7.605 -10.045 0.48 0.02 C ATOM 404 O CYS A 187 2.312 -6.431 -10.072 -0.48 0.02 O ATOM 405 CB CYS A 187 4.365 -7.667 -8.172 0.20 0.02 C ATOM 406 SG CYS A 187 5.609 -8.761 -7.400 -0.20 0.02 S ATOM 0 H CYS A 187 5.563 -6.527 -10.029 -0.36 0.02 H new ATOM 0 HA CYS A 187 4.233 -9.040 -9.798 1.00 0.02 H new ATOM 0 HB2 CYS A 187 4.700 -6.634 -8.079 0.20 0.02 H new ATOM 0 HB3 CYS A 187 3.431 -7.750 -7.617 0.20 0.02 H new ATOM 411 N PRO A 188 1.827 -8.615 -10.395 -0.36 0.02 N ATOM 412 CA PRO A 188 0.438 -8.410 -10.826 1.00 0.02 C ATOM 413 C PRO A 188 -0.264 -7.282 -10.081 0.48 0.02 C ATOM 414 O PRO A 188 -1.112 -7.531 -9.224 -0.48 0.02 O ATOM 415 CB PRO A 188 -0.211 -9.750 -10.496 -0.20 0.02 C ATOM 416 CG PRO A 188 0.878 -10.758 -10.664 -0.20 0.02 C ATOM 417 CD PRO A 188 2.190 -10.044 -10.429 0.06 0.02 C ATOM 0 HA PRO A 188 0.376 -8.119 -11.874 1.00 0.02 H new ATOM 0 HB2 PRO A 188 -0.604 -9.759 -9.479 -0.20 0.02 H new ATOM 0 HB3 PRO A 188 -1.048 -9.958 -11.163 -0.20 0.02 H new ATOM 0 HG2 PRO A 188 0.755 -11.579 -9.957 -0.20 0.02 H new ATOM 0 HG3 PRO A 188 0.850 -11.192 -11.664 -0.20 0.02 H new ATOM 0 HD2 PRO A 188 2.652 -10.359 -9.494 0.06 0.02 H new ATOM 0 HD3 PRO A 188 2.905 -10.254 -11.224 0.06 0.02 H new ATOM 425 N GLU A 189 0.147 -6.045 -10.373 -0.36 0.02 N ATOM 426 CA GLU A 189 -0.363 -4.859 -9.719 1.00 0.02 C ATOM 427 C GLU A 189 0.566 -4.499 -8.585 0.48 0.02 C ATOM 428 O GLU A 189 1.452 -5.281 -8.257 -0.48 0.02 O ATOM 429 CB GLU A 189 -1.793 -5.033 -9.222 -0.20 0.02 C ATOM 430 CG GLU A 189 -2.629 -3.822 -9.523 -0.45 0.02 C ATOM 431 CD GLU A 189 -4.113 -4.123 -9.582 0.49 0.02 C ATOM 432 OE1 GLU A 189 -4.473 -5.276 -9.899 -0.62 0.02 O ATOM 433 OE2 GLU A 189 -4.916 -3.206 -9.310 -0.62 0.02 O ATOM 0 H GLU A 189 0.853 -5.847 -11.082 -0.36 0.02 H new ATOM 0 HA GLU A 189 -0.397 -4.049 -10.448 1.00 0.02 H new ATOM 0 HB2 GLU A 189 -2.239 -5.910 -9.691 -0.20 0.02 H new ATOM 0 HB3 GLU A 189 -1.787 -5.215 -8.147 -0.20 0.02 H new ATOM 0 HG2 GLU A 189 -2.448 -3.065 -8.760 -0.45 0.02 H new ATOM 0 HG3 GLU A 189 -2.312 -3.397 -10.476 -0.45 0.02 H new ATOM 440 N GLY A 190 0.416 -3.304 -8.024 -0.36 0.02 N ATOM 441 CA GLY A 190 1.294 -2.846 -6.954 -0.10 0.02 C ATOM 442 C GLY A 190 1.784 -3.918 -5.983 0.48 0.02 C ATOM 443 O GLY A 190 2.454 -3.588 -5.015 -0.48 0.02 O ATOM 0 H GLY A 190 -0.306 -2.635 -8.293 -0.36 0.02 H new ATOM 0 HA2 GLY A 190 2.164 -2.368 -7.405 -0.10 0.02 H new ATOM 0 HA3 GLY A 190 0.769 -2.080 -6.383 -0.10 0.02 H new ATOM 447 N TYR A 191 1.514 -5.197 -6.243 -0.36 0.02 N ATOM 448 CA TYR A 191 1.993 -6.252 -5.377 1.00 0.02 C ATOM 449 C TYR A 191 3.481 -6.069 -5.144 0.48 0.02 C ATOM 450 O TYR A 191 4.230 -5.702 -6.049 -0.48 0.02 O ATOM 451 CB TYR A 191 1.728 -7.624 -6.005 -0.20 0.02 C ATOM 452 CG TYR A 191 0.298 -8.107 -5.911 1.00 0.02 C ATOM 453 CD1 TYR A 191 -0.739 -7.410 -6.521 -0.14 0.02 C ATOM 454 CD2 TYR A 191 -0.011 -9.279 -5.232 -0.14 0.02 C ATOM 455 CE1 TYR A 191 -2.041 -7.864 -6.451 -0.14 0.02 C ATOM 456 CE2 TYR A 191 -1.310 -9.742 -5.162 -0.14 0.02 C ATOM 457 CZ TYR A 191 -2.321 -9.031 -5.771 0.20 0.02 C ATOM 458 OH TYR A 191 -3.615 -9.493 -5.707 -0.60 0.02 O ATOM 0 H TYR A 191 0.969 -5.517 -7.043 -0.36 0.02 H new ATOM 0 HA TYR A 191 1.463 -6.201 -4.426 1.00 0.02 H new ATOM 0 HB2 TYR A 191 2.014 -7.587 -7.056 -0.20 0.02 H new ATOM 0 HB3 TYR A 191 2.375 -8.358 -5.524 -0.20 0.02 H new ATOM 0 HD1 TYR A 191 -0.522 -6.499 -7.058 -0.14 0.02 H new ATOM 0 HD2 TYR A 191 0.778 -9.837 -4.751 -0.14 0.02 H new ATOM 0 HE1 TYR A 191 -2.836 -7.308 -6.926 -0.14 0.02 H new ATOM 0 HE2 TYR A 191 -1.532 -10.657 -4.633 -0.14 0.02 H new ATOM 0 HH TYR A 191 -4.232 -8.774 -5.959 -0.60 0.02 H new ATOM 468 N ARG A 192 3.883 -6.298 -3.921 -0.36 0.02 N ATOM 469 CA ARG A 192 5.283 -6.134 -3.526 1.00 0.02 C ATOM 470 C ARG A 192 6.062 -7.433 -3.702 0.48 0.02 C ATOM 471 O ARG A 192 5.607 -8.504 -3.315 -0.48 0.02 O ATOM 472 CB ARG A 192 5.379 -5.674 -2.070 -0.20 0.02 C ATOM 473 CG ARG A 192 4.711 -4.335 -1.806 -0.20 0.02 C ATOM 474 CD ARG A 192 5.704 -3.186 -1.864 -0.10 0.02 C ATOM 475 NE ARG A 192 5.606 -2.322 -0.689 -0.60 0.02 N ATOM 476 CZ ARG A 192 6.033 -1.061 -0.655 0.60 0.02 C ATOM 477 NH1 ARG A 192 6.599 -0.514 -1.724 -0.60 0.02 N ATOM 478 NH2 ARG A 192 5.894 -0.345 0.452 -0.60 0.02 N ATOM 0 H ARG A 192 3.266 -6.601 -3.167 -0.36 0.02 H new ATOM 0 HA ARG A 192 5.721 -5.375 -4.174 1.00 0.02 H new ATOM 0 HB2 ARG A 192 4.924 -6.429 -1.429 -0.20 0.02 H new ATOM 0 HB3 ARG A 192 6.430 -5.607 -1.788 -0.20 0.02 H new ATOM 0 HG2 ARG A 192 3.923 -4.171 -2.541 -0.20 0.02 H new ATOM 0 HG3 ARG A 192 4.234 -4.354 -0.826 -0.20 0.02 H new ATOM 0 HD2 ARG A 192 6.716 -3.584 -1.939 -0.10 0.02 H new ATOM 0 HD3 ARG A 192 5.526 -2.597 -2.764 -0.10 0.02 H new ATOM 0 HE ARG A 192 5.185 -2.708 0.156 -0.60 0.02 H new ATOM 0 HH11 ARG A 192 6.709 -1.060 -2.578 -0.60 0.02 H new ATOM 0 HH12 ARG A 192 6.924 0.452 -1.691 -0.60 0.02 H new ATOM 0 HH21 ARG A 192 5.460 -0.760 1.277 -0.60 0.02 H new ATOM 0 HH22 ARG A 192 6.221 0.621 0.479 -0.60 0.02 H new ATOM 492 N TYR A 193 7.242 -7.318 -4.303 -0.36 0.02 N ATOM 493 CA TYR A 193 8.111 -8.454 -4.569 1.00 0.02 C ATOM 494 C TYR A 193 9.180 -8.611 -3.499 0.48 0.02 C ATOM 495 O TYR A 193 9.552 -7.654 -2.820 -0.48 0.02 O ATOM 496 CB TYR A 193 8.778 -8.242 -5.919 -0.20 0.02 C ATOM 497 CG TYR A 193 9.490 -9.456 -6.436 1.00 0.02 C ATOM 498 CD1 TYR A 193 8.786 -10.485 -7.029 -0.14 0.02 C ATOM 499 CD2 TYR A 193 10.866 -9.563 -6.338 -0.14 0.02 C ATOM 500 CE1 TYR A 193 9.433 -11.600 -7.516 -0.14 0.02 C ATOM 501 CE2 TYR A 193 11.528 -10.670 -6.827 -0.14 0.02 C ATOM 502 CZ TYR A 193 10.807 -11.688 -7.416 0.20 0.02 C ATOM 503 OH TYR A 193 11.464 -12.787 -7.919 -0.60 0.02 O ATOM 0 H TYR A 193 7.623 -6.427 -4.621 -0.36 0.02 H new ATOM 0 HA TYR A 193 7.507 -9.361 -4.568 1.00 0.02 H new ATOM 0 HB2 TYR A 193 8.023 -7.938 -6.644 -0.20 0.02 H new ATOM 0 HB3 TYR A 193 9.490 -7.421 -5.838 -0.20 0.02 H new ATOM 0 HD1 TYR A 193 7.712 -10.415 -7.113 -0.14 0.02 H new ATOM 0 HD2 TYR A 193 11.430 -8.768 -5.872 -0.14 0.02 H new ATOM 0 HE1 TYR A 193 8.869 -12.400 -7.973 -0.14 0.02 H new ATOM 0 HE2 TYR A 193 12.603 -10.739 -6.749 -0.14 0.02 H new ATOM 0 HH TYR A 193 10.812 -13.481 -8.150 -0.60 0.02 H new ATOM 513 N ASN A 194 9.667 -9.836 -3.363 -0.36 0.02 N ATOM 514 CA ASN A 194 10.695 -10.153 -2.386 1.00 0.02 C ATOM 515 C ASN A 194 11.855 -10.885 -3.044 0.48 0.02 C ATOM 516 O ASN A 194 11.668 -11.957 -3.620 -0.48 0.02 O ATOM 517 CB ASN A 194 10.106 -11.023 -1.280 -0.20 0.02 C ATOM 518 CG ASN A 194 9.874 -10.252 0.004 0.48 0.02 C ATOM 519 OD1 ASN A 194 10.892 -9.525 0.448 -0.48 0.02 O flip ATOM 520 ND2 ASN A 194 8.793 -10.308 0.589 -0.52 0.02 N flip ATOM 0 H ASN A 194 9.362 -10.632 -3.923 -0.36 0.02 H new ATOM 0 HA ASN A 194 11.066 -9.220 -1.961 1.00 0.02 H new ATOM 0 HB2 ASN A 194 9.162 -11.448 -1.620 -0.20 0.02 H new ATOM 0 HB3 ASN A 194 10.778 -11.858 -1.082 -0.20 0.02 H new ATOM 0 HD21 ASN A 194 8.038 -10.880 0.211 -0.52 0.02 H new ATOM 0 HD22 ASN A 194 8.652 -9.782 1.452 -0.52 0.02 H new ATOM 527 N LEU A 195 13.053 -10.314 -2.951 -0.36 0.02 N ATOM 528 CA LEU A 195 14.237 -10.934 -3.533 1.00 0.02 C ATOM 529 C LEU A 195 14.670 -12.143 -2.707 0.48 0.02 C ATOM 530 O LEU A 195 15.392 -13.014 -3.193 -0.48 0.02 O ATOM 531 CB LEU A 195 15.382 -9.922 -3.619 -0.20 0.02 C ATOM 532 CG LEU A 195 16.610 -10.397 -4.402 -0.10 0.02 C ATOM 533 CD1 LEU A 195 17.098 -9.309 -5.347 -0.30 0.02 C ATOM 534 CD2 LEU A 195 17.721 -10.816 -3.451 -0.30 0.02 C ATOM 0 H LEU A 195 13.228 -9.426 -2.480 -0.36 0.02 H new ATOM 0 HA LEU A 195 13.987 -11.270 -4.540 1.00 0.02 H new ATOM 0 HB2 LEU A 195 15.006 -9.009 -4.081 -0.20 0.02 H new ATOM 0 HB3 LEU A 195 15.693 -9.662 -2.607 -0.20 0.02 H new ATOM 0 HG LEU A 195 16.322 -11.263 -4.997 -0.10 0.02 H new ATOM 0 HD11 LEU A 195 17.971 -9.666 -5.894 -0.30 0.02 H new ATOM 0 HD12 LEU A 195 16.306 -9.058 -6.052 -0.30 0.02 H new ATOM 0 HD13 LEU A 195 17.367 -8.422 -4.773 -0.30 0.02 H new ATOM 0 HD21 LEU A 195 18.585 -11.150 -4.025 -0.30 0.02 H new ATOM 0 HD22 LEU A 195 18.006 -9.968 -2.828 -0.30 0.02 H new ATOM 0 HD23 LEU A 195 17.370 -11.630 -2.817 -0.30 0.02 H new ATOM 546 N LYS A 196 14.214 -12.193 -1.458 -0.36 0.02 N ATOM 547 CA LYS A 196 14.540 -13.295 -0.565 1.00 0.02 C ATOM 548 C LYS A 196 13.926 -14.579 -1.084 0.48 0.02 C ATOM 549 O LYS A 196 14.549 -15.641 -1.062 -0.48 0.02 O ATOM 550 CB LYS A 196 14.015 -13.011 0.840 -0.20 0.02 C ATOM 551 CG LYS A 196 14.714 -11.853 1.519 -0.20 0.02 C ATOM 552 CD LYS A 196 14.159 -10.517 1.056 -0.20 0.02 C ATOM 553 CE LYS A 196 14.244 -9.468 2.153 0.30 5.02 C ATOM 554 NZ LYS A 196 13.141 -9.610 3.143 -0.81 0.02 N ATOM 0 H LYS A 196 13.616 -11.479 -1.043 -0.36 0.02 H new ATOM 0 HA LYS A 196 15.624 -13.402 -0.525 1.00 0.02 H new ATOM 0 HB2 LYS A 196 12.947 -12.800 0.785 -0.20 0.02 H new ATOM 0 HB3 LYS A 196 14.132 -13.906 1.452 -0.20 0.02 H new ATOM 0 HG2 LYS A 196 14.599 -11.941 2.599 -0.20 0.02 H new ATOM 0 HG3 LYS A 196 15.782 -11.897 1.307 -0.20 0.02 H new ATOM 0 HD2 LYS A 196 14.712 -10.176 0.181 -0.20 0.02 H new ATOM 0 HD3 LYS A 196 13.121 -10.640 0.749 -0.20 0.02 H new ATOM 0 HE2 LYS A 196 15.203 -9.553 2.663 0.30 5.02 H new ATOM 0 HE3 LYS A 196 14.207 -8.474 1.708 0.30 5.02 H new ATOM 0 HZ1 LYS A 196 13.234 -8.877 3.874 -0.81 0.02 H new ATOM 0 HZ2 LYS A 196 12.226 -9.503 2.661 -0.81 0.02 H new ATOM 0 HZ3 LYS A 196 13.191 -10.549 3.586 -0.81 0.02 H new ATOM 568 N SER A 197 12.697 -14.462 -1.560 -0.36 0.02 N ATOM 569 CA SER A 197 11.972 -15.599 -2.105 1.00 0.02 C ATOM 570 C SER A 197 11.808 -15.465 -3.618 0.48 0.02 C ATOM 571 O SER A 197 11.327 -16.384 -4.276 -0.48 0.02 O ATOM 572 CB SER A 197 10.600 -15.725 -1.439 0.08 0.02 C ATOM 573 OG SER A 197 10.035 -17.003 -1.673 -0.68 0.02 O ATOM 0 H SER A 197 12.177 -13.585 -1.580 -0.36 0.02 H new ATOM 0 HA SER A 197 12.550 -16.500 -1.899 1.00 0.02 H new ATOM 0 HB2 SER A 197 10.696 -15.557 -0.366 0.08 0.02 H new ATOM 0 HB3 SER A 197 9.933 -14.953 -1.824 0.08 0.02 H new ATOM 0 HG SER A 197 10.192 -17.264 -2.604 -0.68 0.02 H new ATOM 579 N LYS A 198 12.150 -14.287 -4.148 -0.36 0.02 N ATOM 580 CA LYS A 198 12.003 -13.994 -5.577 1.00 0.02 C ATOM 581 C LYS A 198 10.586 -14.322 -6.016 0.48 0.02 C ATOM 582 O LYS A 198 10.339 -14.827 -7.112 -0.48 0.02 O ATOM 583 CB LYS A 198 13.026 -14.755 -6.427 -0.20 0.02 C ATOM 584 CG LYS A 198 14.008 -15.568 -5.612 -0.20 0.02 C ATOM 585 CD LYS A 198 13.543 -17.001 -5.493 -0.20 0.02 C ATOM 586 CE LYS A 198 14.165 -17.697 -4.294 0.30 5.02 C ATOM 587 NZ LYS A 198 14.360 -19.153 -4.538 -0.81 0.02 N ATOM 0 H LYS A 198 12.534 -13.515 -3.603 -0.36 0.02 H new ATOM 0 HA LYS A 198 12.195 -12.932 -5.730 1.00 0.02 H new ATOM 0 HB2 LYS A 198 12.496 -15.419 -7.110 -0.20 0.02 H new ATOM 0 HB3 LYS A 198 13.578 -14.043 -7.040 -0.20 0.02 H new ATOM 0 HG2 LYS A 198 14.991 -15.537 -6.081 -0.20 0.02 H new ATOM 0 HG3 LYS A 198 14.114 -15.131 -4.619 -0.20 0.02 H new ATOM 0 HD2 LYS A 198 12.457 -17.025 -5.404 -0.20 0.02 H new ATOM 0 HD3 LYS A 198 13.800 -17.544 -6.403 -0.20 0.02 H new ATOM 0 HE2 LYS A 198 15.125 -17.235 -4.064 0.30 5.02 H new ATOM 0 HE3 LYS A 198 13.527 -17.557 -3.421 0.30 5.02 H new ATOM 0 HZ1 LYS A 198 14.786 -19.592 -3.697 -0.81 0.02 H new ATOM 0 HZ2 LYS A 198 13.441 -19.599 -4.733 -0.81 0.02 H new ATOM 0 HZ3 LYS A 198 14.989 -19.287 -5.355 -0.81 0.02 H new ATOM 601 N SER A 199 9.675 -14.018 -5.119 -0.36 0.02 N ATOM 602 CA SER A 199 8.254 -14.252 -5.335 1.00 0.02 C ATOM 603 C SER A 199 7.466 -12.959 -5.199 0.48 0.02 C ATOM 604 O SER A 199 7.907 -12.021 -4.535 -0.48 0.02 O ATOM 605 CB SER A 199 7.729 -15.288 -4.339 0.08 0.02 C ATOM 606 OG SER A 199 6.449 -15.760 -4.720 -0.68 0.02 O ATOM 0 H SER A 199 9.893 -13.600 -4.215 -0.36 0.02 H new ATOM 0 HA SER A 199 8.124 -14.633 -6.348 1.00 0.02 H new ATOM 0 HB2 SER A 199 8.425 -16.125 -4.279 0.08 0.02 H new ATOM 0 HB3 SER A 199 7.675 -14.846 -3.344 0.08 0.02 H new ATOM 0 HG SER A 199 6.137 -16.422 -4.068 -0.68 0.02 H new ATOM 612 N CYS A 200 6.286 -12.919 -5.808 -0.36 0.02 N ATOM 613 CA CYS A 200 5.436 -11.744 -5.721 1.00 0.02 C ATOM 614 C CYS A 200 4.550 -11.861 -4.490 0.48 0.02 C ATOM 615 O CYS A 200 4.066 -12.948 -4.172 -0.48 0.02 O ATOM 616 CB CYS A 200 4.575 -11.597 -6.977 0.20 0.02 C ATOM 617 SG CYS A 200 5.329 -10.572 -8.282 -0.20 0.02 S ATOM 0 H CYS A 200 5.901 -13.683 -6.363 -0.36 0.02 H new ATOM 0 HA CYS A 200 6.065 -10.857 -5.641 1.00 0.02 H new ATOM 0 HB2 CYS A 200 4.370 -12.588 -7.382 0.20 0.02 H new ATOM 0 HB3 CYS A 200 3.615 -11.162 -6.698 0.20 0.02 H new ATOM 622 N GLU A 201 4.346 -10.757 -3.789 -0.36 0.02 N ATOM 623 CA GLU A 201 3.525 -10.779 -2.588 1.00 0.02 C ATOM 624 C GLU A 201 2.762 -9.474 -2.385 0.48 0.02 C ATOM 625 O GLU A 201 3.357 -8.399 -2.318 -0.48 0.02 O ATOM 626 CB GLU A 201 4.394 -11.070 -1.364 -0.20 0.02 C ATOM 627 CG GLU A 201 5.190 -12.360 -1.480 -0.45 0.02 C ATOM 628 CD GLU A 201 5.820 -12.778 -0.166 0.49 0.02 C ATOM 629 OE1 GLU A 201 5.072 -12.984 0.813 -0.62 0.02 O ATOM 630 OE2 GLU A 201 7.062 -12.898 -0.115 -0.62 0.02 O ATOM 0 H GLU A 201 4.733 -9.844 -4.027 -0.36 0.02 H new ATOM 0 HA GLU A 201 2.788 -11.572 -2.714 1.00 0.02 H new ATOM 0 HB2 GLU A 201 5.083 -10.239 -1.211 -0.20 0.02 H new ATOM 0 HB3 GLU A 201 3.758 -11.123 -0.481 -0.20 0.02 H new ATOM 0 HG2 GLU A 201 4.535 -13.156 -1.834 -0.45 0.02 H new ATOM 0 HG3 GLU A 201 5.972 -12.234 -2.229 -0.45 0.02 H new ATOM 637 N ASP A 202 1.438 -9.605 -2.285 -0.36 0.02 N ATOM 638 CA ASP A 202 0.529 -8.481 -2.073 1.00 0.02 C ATOM 639 C ASP A 202 1.236 -7.302 -1.423 0.48 0.02 C ATOM 640 O ASP A 202 2.131 -7.467 -0.594 -0.48 0.02 O ATOM 641 CB ASP A 202 -0.657 -8.909 -1.211 -0.45 0.02 C ATOM 642 CG ASP A 202 -1.701 -7.818 -1.103 0.49 0.02 C ATOM 643 OD1 ASP A 202 -2.056 -7.235 -2.149 -0.62 0.02 O ATOM 644 OD2 ASP A 202 -2.165 -7.548 0.025 -0.62 0.02 O ATOM 0 H ASP A 202 0.963 -10.505 -2.350 -0.36 0.02 H new ATOM 0 HA ASP A 202 0.170 -8.164 -3.052 1.00 0.02 H new ATOM 0 HB2 ASP A 202 -1.110 -9.804 -1.637 -0.45 0.02 H new ATOM 0 HB3 ASP A 202 -0.304 -9.174 -0.214 -0.45 0.02 H new ATOM 649 N ILE A 203 0.836 -6.116 -1.829 -0.36 0.02 N ATOM 650 CA ILE A 203 1.430 -4.892 -1.333 1.00 0.02 C ATOM 651 C ILE A 203 0.814 -4.430 -0.011 0.48 0.02 C ATOM 652 O ILE A 203 -0.266 -4.883 0.388 -0.48 0.02 O ATOM 653 CB ILE A 203 1.293 -3.797 -2.397 -0.10 0.02 C ATOM 654 CG1 ILE A 203 2.060 -2.534 -2.022 -0.20 0.02 C ATOM 655 CG2 ILE A 203 -0.163 -3.486 -2.639 -0.30 0.02 C ATOM 656 CD1 ILE A 203 2.584 -1.804 -3.230 -0.30 0.02 C ATOM 0 H ILE A 203 0.091 -5.973 -2.511 -0.36 0.02 H new ATOM 0 HA ILE A 203 2.483 -5.092 -1.132 1.00 0.02 H new ATOM 0 HB ILE A 203 1.734 -4.176 -3.319 -0.10 0.02 H new ATOM 0 HG12 ILE A 203 1.408 -1.871 -1.454 -0.20 0.02 H new ATOM 0 HG13 ILE A 203 2.893 -2.797 -1.370 -0.20 0.02 H new ATOM 0 HG21 ILE A 203 -0.248 -2.707 -3.397 -0.30 0.02 H new ATOM 0 HG22 ILE A 203 -0.675 -4.385 -2.984 -0.30 0.02 H new ATOM 0 HG23 ILE A 203 -0.620 -3.141 -1.712 -0.30 0.02 H new ATOM 0 HD11 ILE A 203 3.123 -0.912 -2.911 -0.30 0.02 H new ATOM 0 HD12 ILE A 203 3.259 -2.456 -3.785 -0.30 0.02 H new ATOM 0 HD13 ILE A 203 1.751 -1.515 -3.870 -0.30 0.02 H new ATOM 668 N ASP A 204 1.519 -3.498 0.633 -0.36 0.02 N ATOM 669 CA ASP A 204 1.093 -2.910 1.898 1.00 0.02 C ATOM 670 C ASP A 204 0.493 -1.527 1.655 0.48 0.02 C ATOM 671 O ASP A 204 0.965 -0.521 2.186 -0.48 0.02 O ATOM 672 CB ASP A 204 2.278 -2.814 2.861 -0.45 0.02 C ATOM 673 CG ASP A 204 2.265 -3.913 3.906 0.49 0.02 C ATOM 674 OD1 ASP A 204 1.164 -4.277 4.370 -0.62 0.02 O ATOM 675 OD2 ASP A 204 3.355 -4.408 4.261 -0.62 0.02 O ATOM 0 H ASP A 204 2.405 -3.130 0.287 -0.36 0.02 H new ATOM 0 HA ASP A 204 0.332 -3.549 2.346 1.00 0.02 H new ATOM 0 HB2 ASP A 204 3.208 -2.866 2.295 -0.45 0.02 H new ATOM 0 HB3 ASP A 204 2.261 -1.844 3.358 -0.45 0.02 H new ATOM 680 N GLU A 205 -0.544 -1.496 0.829 -0.36 0.02 N ATOM 681 CA GLU A 205 -1.227 -0.262 0.472 1.00 0.02 C ATOM 682 C GLU A 205 -1.694 0.528 1.694 0.48 0.02 C ATOM 683 O GLU A 205 -1.785 1.751 1.645 -0.48 0.02 O ATOM 684 CB GLU A 205 -2.420 -0.580 -0.419 -0.20 0.02 C ATOM 685 CG GLU A 205 -2.023 -1.009 -1.820 -0.45 0.02 C ATOM 686 CD GLU A 205 -2.826 -2.193 -2.318 0.49 0.02 C ATOM 687 OE1 GLU A 205 -2.806 -3.254 -1.653 -0.62 0.02 O ATOM 688 OE2 GLU A 205 -3.479 -2.056 -3.371 -0.62 0.02 O ATOM 0 H GLU A 205 -0.935 -2.328 0.387 -0.36 0.02 H new ATOM 0 HA GLU A 205 -0.510 0.363 -0.060 1.00 0.02 H new ATOM 0 HB2 GLU A 205 -3.009 -1.372 0.043 -0.20 0.02 H new ATOM 0 HB3 GLU A 205 -3.062 0.299 -0.483 -0.20 0.02 H new ATOM 0 HG2 GLU A 205 -2.157 -0.171 -2.504 -0.45 0.02 H new ATOM 0 HG3 GLU A 205 -0.963 -1.263 -1.831 -0.45 0.02 H new ATOM 695 N CYS A 206 -1.999 -0.166 2.785 -0.36 0.02 N ATOM 696 CA CYS A 206 -2.465 0.511 3.993 1.00 0.02 C ATOM 697 C CYS A 206 -1.333 0.730 4.988 0.48 0.02 C ATOM 698 O CYS A 206 -1.335 1.708 5.736 -0.48 0.02 O ATOM 699 CB CYS A 206 -3.619 -0.262 4.639 0.20 0.02 C ATOM 700 SG CYS A 206 -3.132 -1.535 5.851 -0.20 0.02 S ATOM 0 H CYS A 206 -1.934 -1.181 2.860 -0.36 0.02 H new ATOM 0 HA CYS A 206 -2.833 1.493 3.697 1.00 0.02 H new ATOM 0 HB2 CYS A 206 -4.279 0.451 5.133 0.20 0.02 H new ATOM 0 HB3 CYS A 206 -4.199 -0.740 3.850 0.20 0.02 H new ATOM 705 N SER A 207 -0.364 -0.175 4.990 -0.36 0.02 N ATOM 706 CA SER A 207 0.773 -0.061 5.892 1.00 0.02 C ATOM 707 C SER A 207 1.506 1.255 5.653 0.48 0.02 C ATOM 708 O SER A 207 2.266 1.720 6.502 -0.48 0.02 O ATOM 709 CB SER A 207 1.731 -1.239 5.701 0.08 0.02 C ATOM 710 OG SER A 207 2.218 -1.708 6.947 -0.68 0.02 O ATOM 0 H SER A 207 -0.342 -0.992 4.380 -0.36 0.02 H new ATOM 0 HA SER A 207 0.403 -0.078 6.917 1.00 0.02 H new ATOM 0 HB2 SER A 207 1.219 -2.048 5.180 0.08 0.02 H new ATOM 0 HB3 SER A 207 2.567 -0.934 5.072 0.08 0.02 H new ATOM 0 HG SER A 207 2.826 -2.462 6.798 -0.68 0.02 H new ATOM 716 N GLU A 208 1.296 1.830 4.471 -0.36 0.02 N ATOM 717 CA GLU A 208 1.955 3.067 4.087 1.00 0.02 C ATOM 718 C GLU A 208 1.301 4.287 4.730 0.48 0.02 C ATOM 719 O GLU A 208 1.946 4.996 5.502 -0.48 0.02 O ATOM 720 CB GLU A 208 1.914 3.204 2.566 -0.20 0.02 C ATOM 721 CG GLU A 208 3.046 2.481 1.855 -0.45 0.02 C ATOM 722 CD GLU A 208 4.046 3.435 1.229 0.49 0.02 C ATOM 723 OE1 GLU A 208 3.709 4.058 0.201 -0.62 0.02 O ATOM 724 OE2 GLU A 208 5.166 3.557 1.768 -0.62 0.02 O ATOM 0 H GLU A 208 0.669 1.452 3.761 -0.36 0.02 H new ATOM 0 HA GLU A 208 2.986 3.024 4.439 1.00 0.02 H new ATOM 0 HB2 GLU A 208 0.962 2.817 2.201 -0.20 0.02 H new ATOM 0 HB3 GLU A 208 1.950 4.262 2.305 -0.20 0.02 H new ATOM 0 HG2 GLU A 208 3.562 1.834 2.565 -0.45 0.02 H new ATOM 0 HG3 GLU A 208 2.631 1.836 1.080 -0.45 0.02 H new ATOM 731 N ASN A 209 0.021 4.525 4.422 -0.36 0.02 N ATOM 732 CA ASN A 209 -0.725 5.663 4.978 1.00 0.02 C ATOM 733 C ASN A 209 -1.880 6.045 4.054 0.48 0.02 C ATOM 734 O ASN A 209 -1.918 7.154 3.520 -0.48 0.02 O ATOM 735 CB ASN A 209 0.181 6.887 5.188 -0.20 0.02 C ATOM 736 CG ASN A 209 1.099 7.148 4.007 0.48 0.02 C ATOM 737 OD1 ASN A 209 2.313 6.965 4.098 -0.48 0.02 O ATOM 738 ND2 ASN A 209 0.524 7.582 2.892 -0.52 0.02 N ATOM 0 H ASN A 209 -0.524 3.942 3.787 -0.36 0.02 H new ATOM 0 HA ASN A 209 -1.115 5.352 5.947 1.00 0.02 H new ATOM 0 HB2 ASN A 209 -0.439 7.767 5.362 -0.20 0.02 H new ATOM 0 HB3 ASN A 209 0.783 6.739 6.085 -0.20 0.02 H new ATOM 0 HD21 ASN A 209 1.092 7.777 2.068 -0.52 0.02 H new ATOM 0 HD22 ASN A 209 -0.486 7.720 2.860 -0.52 0.02 H new ATOM 745 N MET A 210 -2.821 5.124 3.858 -0.36 0.02 N ATOM 746 CA MET A 210 -3.965 5.386 2.984 1.00 0.02 C ATOM 747 C MET A 210 -5.276 5.019 3.633 0.48 0.02 C ATOM 748 O MET A 210 -6.304 5.633 3.346 -0.48 0.02 O ATOM 749 CB MET A 210 -3.821 4.634 1.656 -0.20 0.02 C ATOM 750 CG MET A 210 -2.403 4.612 1.105 -0.11 5.02 C ATOM 751 SD MET A 210 -2.199 5.664 -0.346 -0.17 0.02 S ATOM 752 CE MET A 210 -1.701 4.453 -1.569 -0.21 5.02 C ATOM 0 H MET A 210 -2.816 4.199 4.287 -0.36 0.02 H new ATOM 0 HA MET A 210 -3.973 6.459 2.794 1.00 0.02 H new ATOM 0 HB2 MET A 210 -4.162 3.608 1.793 -0.20 0.02 H new ATOM 0 HB3 MET A 210 -4.479 5.093 0.918 -0.20 0.02 H new ATOM 0 HG2 MET A 210 -1.711 4.936 1.883 -0.11 5.02 H new ATOM 0 HG3 MET A 210 -2.135 3.588 0.846 -0.11 5.02 H new ATOM 0 HE1 MET A 210 -1.536 4.949 -2.526 -0.21 5.02 H new ATOM 0 HE2 MET A 210 -0.779 3.969 -1.247 -0.21 5.02 H new ATOM 0 HE3 MET A 210 -2.485 3.704 -1.679 -0.21 5.02 H new ATOM 762 N CYS A 211 -5.263 4.017 4.485 -0.36 0.02 N ATOM 763 CA CYS A 211 -6.499 3.602 5.122 1.00 0.02 C ATOM 764 C CYS A 211 -6.639 4.130 6.527 0.48 0.02 C ATOM 765 O CYS A 211 -5.690 4.136 7.310 -0.48 0.02 O ATOM 766 CB CYS A 211 -6.650 2.082 5.117 0.20 0.02 C ATOM 767 SG CYS A 211 -7.185 1.400 3.522 -0.20 0.02 S ATOM 0 H CYS A 211 -4.434 3.485 4.750 -0.36 0.02 H new ATOM 0 HA CYS A 211 -7.301 4.038 4.527 1.00 0.02 H new ATOM 0 HB2 CYS A 211 -5.696 1.631 5.392 0.20 0.02 H new ATOM 0 HB3 CYS A 211 -7.371 1.796 5.883 0.20 0.02 H new ATOM 772 N ALA A 212 -7.856 4.560 6.839 -0.36 0.02 N ATOM 773 CA ALA A 212 -8.159 5.077 8.149 1.00 0.02 C ATOM 774 C ALA A 212 -8.876 4.021 8.990 0.48 0.02 C ATOM 775 O ALA A 212 -9.278 2.981 8.471 -0.48 0.02 O ATOM 776 CB ALA A 212 -8.994 6.345 8.043 -0.30 0.02 C ATOM 0 H ALA A 212 -8.645 4.557 6.193 -0.36 0.02 H new ATOM 0 HA ALA A 212 -7.222 5.328 8.647 1.00 0.02 H new ATOM 0 HB1 ALA A 212 -9.213 6.721 9.042 -0.30 0.02 H new ATOM 0 HB2 ALA A 212 -8.440 7.100 7.485 -0.30 0.02 H new ATOM 0 HB3 ALA A 212 -9.928 6.124 7.526 -0.30 0.02 H new ATOM 782 N GLN A 213 -9.043 4.297 10.282 -0.36 0.02 N ATOM 783 CA GLN A 213 -9.721 3.371 11.193 1.00 0.02 C ATOM 784 C GLN A 213 -9.142 1.956 11.098 0.48 0.02 C ATOM 785 O GLN A 213 -8.300 1.570 11.908 -0.48 0.02 O ATOM 786 CB GLN A 213 -11.228 3.365 10.929 -0.20 0.02 C ATOM 787 CG GLN A 213 -12.063 3.373 12.202 -0.20 0.02 C ATOM 788 CD GLN A 213 -11.640 4.457 13.177 0.48 0.02 C ATOM 789 OE1 GLN A 213 -11.716 4.155 14.467 -0.48 0.02 O flip ATOM 790 NE2 GLN A 213 -11.250 5.553 12.774 -0.52 0.02 N flip ATOM 0 H GLN A 213 -8.718 5.157 10.725 -0.36 0.02 H new ATOM 0 HA GLN A 213 -9.550 3.722 12.210 1.00 0.02 H new ATOM 0 HB2 GLN A 213 -11.488 4.236 10.327 -0.20 0.02 H new ATOM 0 HB3 GLN A 213 -11.483 2.483 10.341 -0.20 0.02 H new ATOM 0 HG2 GLN A 213 -13.112 3.514 11.942 -0.20 0.02 H new ATOM 0 HG3 GLN A 213 -11.983 2.401 12.689 -0.20 0.02 H new ATOM 0 HE21 GLN A 213 -11.207 5.743 11.773 -0.52 0.02 H new ATOM 0 HE22 GLN A 213 -10.969 6.271 13.441 -0.52 0.02 H new ATOM 799 N LEU A 214 -9.593 1.188 10.109 -0.36 0.02 N ATOM 800 CA LEU A 214 -9.118 -0.173 9.913 1.00 0.02 C ATOM 801 C LEU A 214 -8.773 -0.405 8.467 0.48 0.02 C ATOM 802 O LEU A 214 -9.532 -0.020 7.585 -0.48 0.02 O ATOM 803 CB LEU A 214 -10.187 -1.166 10.321 -0.20 0.02 C ATOM 804 CG LEU A 214 -10.514 -1.158 11.799 -0.10 0.02 C ATOM 805 CD1 LEU A 214 -9.240 -1.372 12.600 -0.30 0.02 C ATOM 806 CD2 LEU A 214 -11.194 0.145 12.180 -0.30 0.02 C ATOM 0 H LEU A 214 -10.291 1.490 9.429 -0.36 0.02 H new ATOM 0 HA LEU A 214 -8.230 -0.312 10.529 1.00 0.02 H new ATOM 0 HB2 LEU A 214 -11.096 -0.954 9.759 -0.20 0.02 H new ATOM 0 HB3 LEU A 214 -9.863 -2.168 10.038 -0.20 0.02 H new ATOM 0 HG LEU A 214 -11.205 -1.970 12.025 -0.10 0.02 H new ATOM 0 HD11 LEU A 214 -9.474 -1.366 13.665 -0.30 0.02 H new ATOM 0 HD12 LEU A 214 -8.798 -2.331 12.331 -0.30 0.02 H new ATOM 0 HD13 LEU A 214 -8.533 -0.572 12.380 -0.30 0.02 H new ATOM 0 HD21 LEU A 214 -11.424 0.138 13.245 -0.30 0.02 H new ATOM 0 HD22 LEU A 214 -10.530 0.980 11.958 -0.30 0.02 H new ATOM 0 HD23 LEU A 214 -12.117 0.254 11.611 -0.30 0.02 H new ATOM 818 N CYS A 215 -7.619 -0.995 8.201 -0.36 0.02 N ATOM 819 CA CYS A 215 -7.228 -1.203 6.832 1.00 0.02 C ATOM 820 C CYS A 215 -7.111 -2.676 6.434 0.48 0.02 C ATOM 821 O CYS A 215 -6.093 -3.320 6.683 -0.48 0.02 O ATOM 822 CB CYS A 215 -5.904 -0.496 6.569 0.20 0.02 C ATOM 823 SG CYS A 215 -4.450 -1.257 7.374 -0.20 0.02 S ATOM 0 H CYS A 215 -6.956 -1.328 8.901 -0.36 0.02 H new ATOM 0 HA CYS A 215 -8.025 -0.784 6.218 1.00 0.02 H new ATOM 0 HB2 CYS A 215 -5.732 -0.468 5.493 0.20 0.02 H new ATOM 0 HB3 CYS A 215 -5.988 0.537 6.906 0.20 0.02 H new ATOM 828 N VAL A 216 -8.121 -3.185 5.736 -0.36 0.02 N ATOM 829 CA VAL A 216 -8.057 -4.546 5.228 1.00 0.02 C ATOM 830 C VAL A 216 -7.616 -4.466 3.789 0.48 0.02 C ATOM 831 O VAL A 216 -8.427 -4.328 2.875 -0.48 0.02 O ATOM 832 CB VAL A 216 -9.388 -5.318 5.292 -0.10 0.02 C ATOM 833 CG1 VAL A 216 -9.495 -6.347 4.158 -0.30 0.02 C ATOM 834 CG2 VAL A 216 -9.552 -6.009 6.638 -0.30 0.02 C ATOM 0 H VAL A 216 -8.980 -2.683 5.513 -0.36 0.02 H new ATOM 0 HA VAL A 216 -7.363 -5.096 5.864 1.00 0.02 H new ATOM 0 HB VAL A 216 -10.190 -4.590 5.170 -0.10 0.02 H new ATOM 0 HG11 VAL A 216 -10.446 -6.874 4.233 -0.30 0.02 H new ATOM 0 HG12 VAL A 216 -9.438 -5.836 3.197 -0.30 0.02 H new ATOM 0 HG13 VAL A 216 -8.677 -7.063 4.238 -0.30 0.02 H new ATOM 0 HG21 VAL A 216 -10.500 -6.547 6.658 -0.30 0.02 H new ATOM 0 HG22 VAL A 216 -8.732 -6.712 6.788 -0.30 0.02 H new ATOM 0 HG23 VAL A 216 -9.541 -5.264 7.433 -0.30 0.02 H new ATOM 844 N ASN A 217 -6.334 -4.532 3.594 -0.36 0.02 N ATOM 845 CA ASN A 217 -5.800 -4.458 2.265 1.00 0.02 C ATOM 846 C ASN A 217 -5.791 -5.850 1.650 0.48 0.02 C ATOM 847 O ASN A 217 -4.979 -6.686 2.048 -0.48 0.02 O ATOM 848 CB ASN A 217 -4.397 -3.869 2.284 -0.20 0.02 C ATOM 849 CG ASN A 217 -3.741 -3.930 0.927 0.48 0.02 C ATOM 850 OD1 ASN A 217 -4.397 -4.184 -0.083 -0.48 0.02 O ATOM 851 ND2 ASN A 217 -2.446 -3.686 0.897 -0.52 0.02 N ATOM 0 H ASN A 217 -5.639 -4.637 4.334 -0.36 0.02 H new ATOM 0 HA ASN A 217 -6.428 -3.803 1.660 1.00 0.02 H new ATOM 0 HB2 ASN A 217 -4.443 -2.833 2.618 -0.20 0.02 H new ATOM 0 HB3 ASN A 217 -3.786 -4.410 3.007 -0.20 0.02 H new ATOM 0 HD21 ASN A 217 -1.944 -3.703 0.009 -0.52 0.02 H new ATOM 0 HD22 ASN A 217 -1.946 -3.480 1.762 -0.52 0.02 H new ATOM 858 N TYR A 218 -6.696 -6.134 0.705 -0.36 0.02 N ATOM 859 CA TYR A 218 -6.725 -7.466 0.128 1.00 0.02 C ATOM 860 C TYR A 218 -5.753 -7.580 -1.023 0.48 0.02 C ATOM 861 O TYR A 218 -5.195 -6.576 -1.486 -0.48 0.02 O ATOM 862 CB TYR A 218 -8.150 -7.880 -0.290 -0.20 0.02 C ATOM 863 CG TYR A 218 -8.919 -6.885 -1.134 1.00 0.02 C ATOM 864 CD1 TYR A 218 -8.739 -6.818 -2.513 -0.14 0.02 C ATOM 865 CD2 TYR A 218 -9.862 -6.044 -0.556 -0.14 0.02 C ATOM 866 CE1 TYR A 218 -9.475 -5.939 -3.287 -0.14 0.02 C ATOM 867 CE2 TYR A 218 -10.597 -5.159 -1.321 -0.14 0.02 C ATOM 868 CZ TYR A 218 -10.402 -5.111 -2.686 0.20 0.02 C ATOM 869 OH TYR A 218 -11.136 -4.235 -3.453 -0.60 0.02 O ATOM 0 H TYR A 218 -7.390 -5.481 0.340 -0.36 0.02 H new ATOM 0 HA TYR A 218 -6.407 -8.164 0.902 1.00 0.02 H new ATOM 0 HB2 TYR A 218 -8.086 -8.818 -0.841 -0.20 0.02 H new ATOM 0 HB3 TYR A 218 -8.727 -8.080 0.613 -0.20 0.02 H new ATOM 0 HD1 TYR A 218 -8.013 -7.463 -2.986 -0.14 0.02 H new ATOM 0 HD2 TYR A 218 -10.023 -6.083 0.511 -0.14 0.02 H new ATOM 0 HE1 TYR A 218 -9.325 -5.901 -4.356 -0.14 0.02 H new ATOM 0 HE2 TYR A 218 -11.321 -4.508 -0.853 -0.14 0.02 H new ATOM 0 HH TYR A 218 -11.744 -3.726 -2.877 -0.60 0.02 H new ATOM 879 N PRO A 219 -5.486 -8.814 -1.477 -0.36 0.02 N ATOM 880 CA PRO A 219 -4.547 -9.041 -2.552 1.00 0.02 C ATOM 881 C PRO A 219 -4.832 -8.143 -3.748 0.48 0.02 C ATOM 882 O PRO A 219 -5.743 -8.407 -4.532 -0.48 0.02 O ATOM 883 CB PRO A 219 -4.734 -10.522 -2.922 -0.20 0.02 C ATOM 884 CG PRO A 219 -5.929 -10.983 -2.154 -0.20 0.02 C ATOM 885 CD PRO A 219 -6.028 -10.080 -0.961 0.06 0.02 C ATOM 0 HA PRO A 219 -3.525 -8.811 -2.251 1.00 0.02 H new ATOM 0 HB2 PRO A 219 -4.888 -10.641 -3.994 -0.20 0.02 H new ATOM 0 HB3 PRO A 219 -3.851 -11.105 -2.660 -0.20 0.02 H new ATOM 0 HG2 PRO A 219 -6.831 -10.924 -2.763 -0.20 0.02 H new ATOM 0 HG3 PRO A 219 -5.818 -12.023 -1.848 -0.20 0.02 H new ATOM 0 HD2 PRO A 219 -7.057 -9.972 -0.618 0.06 0.02 H new ATOM 0 HD3 PRO A 219 -5.449 -10.456 -0.118 0.06 0.02 H new ATOM 893 N GLY A 220 -4.042 -7.085 -3.888 -0.36 0.02 N ATOM 894 CA GLY A 220 -4.220 -6.172 -4.994 -0.10 0.02 C ATOM 895 C GLY A 220 -4.902 -4.881 -4.592 0.48 0.02 C ATOM 896 O GLY A 220 -4.279 -3.824 -4.580 -0.48 0.02 O ATOM 0 H GLY A 220 -3.281 -6.845 -3.253 -0.36 0.02 H new ATOM 0 HA2 GLY A 220 -3.247 -5.942 -5.429 -0.10 0.02 H new ATOM 0 HA3 GLY A 220 -4.809 -6.661 -5.770 -0.10 0.02 H new ATOM 900 N GLY A 221 -6.189 -4.965 -4.280 -0.36 0.02 N ATOM 901 CA GLY A 221 -6.943 -3.784 -3.894 -0.10 0.02 C ATOM 902 C GLY A 221 -7.186 -3.668 -2.408 0.48 0.02 C ATOM 903 O GLY A 221 -7.969 -4.421 -1.829 -0.48 0.02 O ATOM 0 H GLY A 221 -6.727 -5.832 -4.287 -0.36 0.02 H new ATOM 0 HA2 GLY A 221 -6.409 -2.897 -4.235 -0.10 0.02 H new ATOM 0 HA3 GLY A 221 -7.904 -3.795 -4.409 -0.10 0.02 H new ATOM 907 N TYR A 222 -6.501 -2.755 -1.760 -0.36 0.02 N ATOM 908 CA TYR A 222 -6.668 -2.602 -0.337 1.00 0.02 C ATOM 909 C TYR A 222 -8.076 -2.121 0.023 0.48 0.02 C ATOM 910 O TYR A 222 -8.903 -1.878 -0.855 -0.48 0.02 O ATOM 911 CB TYR A 222 -5.642 -1.627 0.194 -0.20 0.02 C ATOM 912 CG TYR A 222 -5.815 -0.256 -0.382 1.00 0.02 C ATOM 913 CD1 TYR A 222 -5.210 0.091 -1.574 -0.14 0.02 C ATOM 914 CD2 TYR A 222 -6.588 0.680 0.268 -0.14 0.02 C ATOM 915 CE1 TYR A 222 -5.367 1.354 -2.109 -0.14 0.02 C ATOM 916 CE2 TYR A 222 -6.756 1.949 -0.251 -0.14 0.02 C ATOM 917 CZ TYR A 222 -6.141 2.283 -1.442 0.20 0.02 C ATOM 918 OH TYR A 222 -6.303 3.545 -1.967 -0.60 0.02 O ATOM 0 H TYR A 222 -5.832 -2.116 -2.189 -0.36 0.02 H new ATOM 0 HA TYR A 222 -6.525 -3.580 0.123 1.00 0.02 H new ATOM 0 HB2 TYR A 222 -5.720 -1.576 1.280 -0.20 0.02 H new ATOM 0 HB3 TYR A 222 -4.642 -1.993 -0.037 -0.20 0.02 H new ATOM 0 HD1 TYR A 222 -4.605 -0.636 -2.095 -0.14 0.02 H new ATOM 0 HD2 TYR A 222 -7.070 0.418 1.198 -0.14 0.02 H new ATOM 0 HE1 TYR A 222 -4.888 1.613 -3.042 -0.14 0.02 H new ATOM 0 HE2 TYR A 222 -7.363 2.674 0.270 -0.14 0.02 H new ATOM 0 HH TYR A 222 -6.250 3.502 -2.945 -0.60 0.02 H new ATOM 928 N THR A 223 -8.333 -1.974 1.325 -0.36 0.02 N ATOM 929 CA THR A 223 -9.633 -1.507 1.803 1.00 0.02 C ATOM 930 C THR A 223 -9.519 -0.892 3.192 0.48 0.02 C ATOM 931 O THR A 223 -8.661 -1.269 3.985 -0.48 0.02 O ATOM 932 CB THR A 223 -10.644 -2.661 1.797 0.18 0.02 C ATOM 933 OG1 THR A 223 -11.107 -2.907 0.484 -0.68 0.02 O ATOM 934 CG2 THR A 223 -11.859 -2.423 2.661 -0.30 0.02 C ATOM 0 H THR A 223 -7.659 -2.172 2.064 -0.36 0.02 H new ATOM 0 HA THR A 223 -9.988 -0.729 1.127 1.00 0.02 H new ATOM 0 HB THR A 223 -10.097 -3.511 2.204 0.18 0.02 H new ATOM 0 HG1 THR A 223 -10.494 -3.523 0.031 -0.68 0.02 H new ATOM 0 HG21 THR A 223 -12.523 -3.285 2.601 -0.30 0.02 H new ATOM 0 HG22 THR A 223 -11.547 -2.277 3.695 -0.30 0.02 H new ATOM 0 HG23 THR A 223 -12.386 -1.535 2.312 -0.30 0.02 H new ATOM 942 N CYS A 224 -10.382 0.081 3.461 -0.36 0.02 N ATOM 943 CA CYS A 224 -10.377 0.779 4.739 1.00 0.02 C ATOM 944 C CYS A 224 -11.758 0.761 5.385 0.48 0.02 C ATOM 945 O CYS A 224 -12.673 1.444 4.926 -0.48 0.02 O ATOM 946 CB CYS A 224 -9.913 2.226 4.546 0.20 0.02 C ATOM 947 SG CYS A 224 -8.841 2.483 3.092 -0.20 0.02 S ATOM 0 H CYS A 224 -11.096 0.404 2.808 -0.36 0.02 H new ATOM 0 HA CYS A 224 -9.684 0.261 5.402 1.00 0.02 H new ATOM 0 HB2 CYS A 224 -10.790 2.867 4.454 0.20 0.02 H new ATOM 0 HB3 CYS A 224 -9.376 2.545 5.439 0.20 0.02 H new ATOM 952 N TYR A 225 -11.900 -0.003 6.467 -0.36 0.02 N ATOM 953 CA TYR A 225 -13.169 -0.074 7.177 1.00 0.02 C ATOM 954 C TYR A 225 -13.124 0.768 8.444 0.48 0.02 C ATOM 955 O TYR A 225 -12.120 0.813 9.151 -0.48 0.02 O ATOM 956 CB TYR A 225 -13.586 -1.515 7.482 -0.20 0.02 C ATOM 957 CG TYR A 225 -12.520 -2.377 8.111 1.00 0.02 C ATOM 958 CD1 TYR A 225 -11.385 -2.747 7.406 -0.14 0.02 C ATOM 959 CD2 TYR A 225 -12.672 -2.848 9.405 -0.14 0.02 C ATOM 960 CE1 TYR A 225 -10.433 -3.561 7.969 -0.14 0.02 C ATOM 961 CE2 TYR A 225 -11.719 -3.665 9.983 -0.14 0.02 C ATOM 962 CZ TYR A 225 -10.600 -4.023 9.258 0.20 0.02 C ATOM 963 OH TYR A 225 -9.648 -4.839 9.823 -0.60 0.02 O ATOM 0 H TYR A 225 -11.157 -0.576 6.866 -0.36 0.02 H new ATOM 0 HA TYR A 225 -13.932 0.338 6.517 1.00 0.02 H new ATOM 0 HB2 TYR A 225 -14.450 -1.493 8.146 -0.20 0.02 H new ATOM 0 HB3 TYR A 225 -13.910 -1.986 6.554 -0.20 0.02 H new ATOM 0 HD1 TYR A 225 -11.247 -2.389 6.396 -0.14 0.02 H new ATOM 0 HD2 TYR A 225 -13.549 -2.572 9.971 -0.14 0.02 H new ATOM 0 HE1 TYR A 225 -9.556 -3.839 7.404 -0.14 0.02 H new ATOM 0 HE2 TYR A 225 -11.849 -4.021 10.994 -0.14 0.02 H new ATOM 0 HH TYR A 225 -9.918 -5.074 10.735 -0.60 0.02 H new ATOM 973 N CYS A 226 -14.213 1.479 8.669 -0.36 0.02 N ATOM 974 CA CYS A 226 -14.346 2.401 9.791 1.00 0.02 C ATOM 975 C CYS A 226 -15.374 1.910 10.808 0.48 0.02 C ATOM 976 O CYS A 226 -15.888 0.800 10.694 -0.48 0.02 O ATOM 977 CB CYS A 226 -14.758 3.746 9.221 0.20 0.02 C ATOM 978 SG CYS A 226 -14.081 4.042 7.555 -0.20 0.02 S ATOM 0 H CYS A 226 -15.041 1.435 8.074 -0.36 0.02 H new ATOM 0 HA CYS A 226 -13.398 2.476 10.323 1.00 0.02 H new ATOM 0 HB2 CYS A 226 -15.846 3.801 9.182 0.20 0.02 H new ATOM 0 HB3 CYS A 226 -14.423 4.538 9.891 0.20 0.02 H new ATOM 983 N ASP A 227 -15.635 2.741 11.815 -0.36 0.02 N ATOM 984 CA ASP A 227 -16.574 2.415 12.883 1.00 0.02 C ATOM 985 C ASP A 227 -16.109 1.201 13.684 0.48 0.02 C ATOM 986 O ASP A 227 -16.915 0.381 14.120 -0.48 0.02 O ATOM 987 CB ASP A 227 -17.997 2.211 12.329 -0.45 0.02 C ATOM 988 CG ASP A 227 -18.247 0.834 11.733 0.49 0.02 C ATOM 989 OD1 ASP A 227 -18.460 -0.123 12.505 -0.62 0.02 O ATOM 990 OD2 ASP A 227 -18.248 0.719 10.489 -0.62 0.02 O ATOM 0 H ASP A 227 -15.201 3.659 11.912 -0.36 0.02 H new ATOM 0 HA ASP A 227 -16.603 3.264 13.566 1.00 0.02 H new ATOM 0 HB2 ASP A 227 -18.714 2.382 13.132 -0.45 0.02 H new ATOM 0 HB3 ASP A 227 -18.188 2.965 11.565 -0.45 0.02 H new ATOM 995 N GLY A 228 -14.800 1.106 13.890 -0.36 0.02 N ATOM 996 CA GLY A 228 -14.249 0.002 14.651 -0.10 0.02 C ATOM 997 C GLY A 228 -14.176 0.300 16.136 0.48 0.02 C ATOM 998 O GLY A 228 -14.677 -0.472 16.954 -0.48 0.02 O ATOM 0 H GLY A 228 -14.111 1.774 13.543 -0.36 0.02 H new ATOM 0 HA2 GLY A 228 -14.861 -0.886 14.492 -0.10 0.02 H new ATOM 0 HA3 GLY A 228 -13.250 -0.228 14.280 -0.10 0.02 H new ATOM 1002 N LYS A 229 -13.546 1.418 16.488 -0.36 0.02 N ATOM 1003 CA LYS A 229 -13.406 1.807 17.887 1.00 0.02 C ATOM 1004 C LYS A 229 -14.274 3.019 18.218 0.48 0.02 C ATOM 1005 O LYS A 229 -14.777 3.145 19.335 -0.48 0.02 O ATOM 1006 CB LYS A 229 -11.941 2.110 18.210 -0.20 0.02 C ATOM 1007 CG LYS A 229 -11.390 3.315 17.463 -0.20 0.02 C ATOM 1008 CD LYS A 229 -10.055 3.002 16.805 -0.20 0.02 C ATOM 1009 CE LYS A 229 -8.893 3.289 17.741 0.30 5.02 C ATOM 1010 NZ LYS A 229 -7.704 2.449 17.425 -0.81 0.02 N ATOM 0 H LYS A 229 -13.125 2.069 15.825 -0.36 0.02 H new ATOM 0 HA LYS A 229 -13.744 0.971 18.500 1.00 0.02 H new ATOM 0 HB2 LYS A 229 -11.842 2.281 19.282 -0.20 0.02 H new ATOM 0 HB3 LYS A 229 -11.336 1.236 17.969 -0.20 0.02 H new ATOM 0 HG2 LYS A 229 -12.105 3.632 16.704 -0.20 0.02 H new ATOM 0 HG3 LYS A 229 -11.269 4.149 18.155 -0.20 0.02 H new ATOM 0 HD2 LYS A 229 -10.032 1.954 16.506 -0.20 0.02 H new ATOM 0 HD3 LYS A 229 -9.948 3.595 15.897 -0.20 0.02 H new ATOM 0 HE2 LYS A 229 -8.622 4.342 17.671 0.30 5.02 H new ATOM 0 HE3 LYS A 229 -9.203 3.107 18.770 0.30 5.02 H new ATOM 0 HZ1 LYS A 229 -6.934 2.675 18.086 -0.81 0.02 H new ATOM 0 HZ2 LYS A 229 -7.955 1.444 17.517 -0.81 0.02 H new ATOM 0 HZ3 LYS A 229 -7.392 2.641 16.451 -0.81 0.02 H new ATOM 1024 N LYS A 230 -14.448 3.910 17.245 -0.36 0.02 N ATOM 1025 CA LYS A 230 -15.259 5.109 17.448 1.00 0.02 C ATOM 1026 C LYS A 230 -16.723 4.861 17.075 0.48 0.02 C ATOM 1027 O LYS A 230 -17.521 5.797 17.016 -0.48 0.02 O ATOM 1028 CB LYS A 230 -14.696 6.276 16.634 -0.20 0.02 C ATOM 1029 CG LYS A 230 -13.684 7.116 17.395 -0.20 0.02 C ATOM 1030 CD LYS A 230 -14.302 8.407 17.909 -0.20 0.02 C ATOM 1031 CE LYS A 230 -14.799 8.258 19.339 0.30 5.02 C ATOM 1032 NZ LYS A 230 -16.286 8.255 19.412 -0.81 0.02 N ATOM 0 H LYS A 230 -14.041 3.826 16.313 -0.36 0.02 H new ATOM 0 HA LYS A 230 -15.220 5.363 18.507 1.00 0.02 H new ATOM 0 HB2 LYS A 230 -14.226 5.885 15.731 -0.20 0.02 H new ATOM 0 HB3 LYS A 230 -15.519 6.915 16.314 -0.20 0.02 H new ATOM 0 HG2 LYS A 230 -13.290 6.541 18.233 -0.20 0.02 H new ATOM 0 HG3 LYS A 230 -12.841 7.349 16.744 -0.20 0.02 H new ATOM 0 HD2 LYS A 230 -13.565 9.209 17.861 -0.20 0.02 H new ATOM 0 HD3 LYS A 230 -15.131 8.697 17.263 -0.20 0.02 H new ATOM 0 HE2 LYS A 230 -14.413 7.331 19.763 0.30 5.02 H new ATOM 0 HE3 LYS A 230 -14.407 9.074 19.946 0.30 5.02 H new ATOM 0 HZ1 LYS A 230 -16.585 8.152 20.403 -0.81 0.02 H new ATOM 0 HZ2 LYS A 230 -16.654 9.150 19.031 -0.81 0.02 H new ATOM 0 HZ3 LYS A 230 -16.659 7.461 18.853 -0.81 0.02 H new ATOM 1046 N GLY A 231 -17.063 3.592 16.839 -0.36 0.02 N ATOM 1047 CA GLY A 231 -18.428 3.218 16.484 -0.10 0.02 C ATOM 1048 C GLY A 231 -19.133 4.253 15.622 0.48 0.02 C ATOM 1049 O GLY A 231 -20.183 4.774 16.000 -0.48 0.02 O ATOM 0 H GLY A 231 -16.411 2.809 16.888 -0.36 0.02 H new ATOM 0 HA2 GLY A 231 -18.410 2.266 15.954 -0.10 0.02 H new ATOM 0 HA3 GLY A 231 -19.003 3.063 17.397 -0.10 0.02 H new ATOM 1053 N PHE A 232 -18.553 4.551 14.466 -0.36 0.02 N ATOM 1054 CA PHE A 232 -19.125 5.528 13.548 1.00 0.02 C ATOM 1055 C PHE A 232 -19.538 4.878 12.224 0.48 0.02 C ATOM 1056 O PHE A 232 -20.136 3.803 12.224 -0.48 0.02 O ATOM 1057 CB PHE A 232 -18.152 6.677 13.333 -0.16 0.02 C ATOM 1058 CG PHE A 232 -16.786 6.302 12.862 0.03 0.02 C ATOM 1059 CD1 PHE A 232 -15.842 5.820 13.748 -0.16 0.02 C ATOM 1060 CD2 PHE A 232 -16.431 6.493 11.543 -0.16 0.02 C ATOM 1061 CE1 PHE A 232 -14.566 5.523 13.322 -0.15 0.02 C ATOM 1062 CE2 PHE A 232 -15.162 6.212 11.113 -0.15 0.02 C ATOM 1063 CZ PHE A 232 -14.222 5.725 11.999 -0.15 0.02 C ATOM 0 H PHE A 232 -17.683 4.128 14.141 -0.36 0.02 H new ATOM 0 HA PHE A 232 -20.033 5.932 13.996 1.00 0.02 H new ATOM 0 HB2 PHE A 232 -18.588 7.365 12.608 -0.16 0.02 H new ATOM 0 HB3 PHE A 232 -18.053 7.223 14.271 -0.16 0.02 H new ATOM 0 HD1 PHE A 232 -16.107 5.675 14.785 -0.16 0.02 H new ATOM 0 HD2 PHE A 232 -17.162 6.868 10.842 -0.16 0.02 H new ATOM 0 HE1 PHE A 232 -13.838 5.134 14.019 -0.15 0.02 H new ATOM 0 HE2 PHE A 232 -14.896 6.372 10.079 -0.15 0.02 H new ATOM 0 HZ PHE A 232 -13.221 5.503 11.659 -0.15 0.02 H new ATOM 1073 N LYS A 233 -19.258 5.536 11.098 -0.36 0.02 N ATOM 1074 CA LYS A 233 -19.646 5.003 9.800 1.00 0.02 C ATOM 1075 C LYS A 233 -18.609 5.299 8.721 0.48 0.02 C ATOM 1076 O LYS A 233 -18.076 6.405 8.637 -0.48 0.02 O ATOM 1077 CB LYS A 233 -20.977 5.616 9.391 -0.20 0.02 C ATOM 1078 CG LYS A 233 -21.571 5.010 8.130 -0.20 0.02 C ATOM 1079 CD LYS A 233 -22.482 3.837 8.453 -0.20 0.02 C ATOM 1080 CE LYS A 233 -23.015 3.182 7.189 0.30 5.02 C ATOM 1081 NZ LYS A 233 -21.999 2.302 6.549 -0.81 0.02 N ATOM 0 H LYS A 233 -18.769 6.430 11.062 -0.36 0.02 H new ATOM 0 HA LYS A 233 -19.726 3.920 9.895 1.00 0.02 H new ATOM 0 HB2 LYS A 233 -21.687 5.497 10.209 -0.20 0.02 H new ATOM 0 HB3 LYS A 233 -20.842 6.687 9.239 -0.20 0.02 H new ATOM 0 HG2 LYS A 233 -22.133 5.771 7.589 -0.20 0.02 H new ATOM 0 HG3 LYS A 233 -20.768 4.678 7.471 -0.20 0.02 H new ATOM 0 HD2 LYS A 233 -21.935 3.101 9.042 -0.20 0.02 H new ATOM 0 HD3 LYS A 233 -23.316 4.180 9.066 -0.20 0.02 H new ATOM 0 HE2 LYS A 233 -23.902 2.597 7.430 0.30 5.02 H new ATOM 0 HE3 LYS A 233 -23.324 3.953 6.483 0.30 5.02 H new ATOM 0 HZ1 LYS A 233 -22.401 1.874 5.691 -0.81 0.02 H new ATOM 0 HZ2 LYS A 233 -21.162 2.865 6.296 -0.81 0.02 H new ATOM 0 HZ3 LYS A 233 -21.723 1.551 7.213 -0.81 0.02 H new ATOM 1095 N LEU A 234 -18.343 4.310 7.879 -0.36 0.02 N ATOM 1096 CA LEU A 234 -17.393 4.475 6.789 1.00 0.02 C ATOM 1097 C LEU A 234 -18.017 5.323 5.683 0.48 0.02 C ATOM 1098 O LEU A 234 -19.002 4.916 5.068 -0.48 0.02 O ATOM 1099 CB LEU A 234 -16.977 3.099 6.244 -0.20 0.02 C ATOM 1100 CG LEU A 234 -16.407 3.082 4.819 -0.10 0.02 C ATOM 1101 CD1 LEU A 234 -15.292 4.105 4.664 -0.30 0.02 C ATOM 1102 CD2 LEU A 234 -15.901 1.691 4.468 -0.30 0.02 C ATOM 0 H LEU A 234 -18.772 3.386 7.930 -0.36 0.02 H new ATOM 0 HA LEU A 234 -16.504 4.985 7.160 1.00 0.02 H new ATOM 0 HB2 LEU A 234 -16.232 2.674 6.917 -0.20 0.02 H new ATOM 0 HB3 LEU A 234 -17.845 2.441 6.274 -0.20 0.02 H new ATOM 0 HG LEU A 234 -17.209 3.349 4.131 -0.10 0.02 H new ATOM 0 HD11 LEU A 234 -14.906 4.071 3.645 -0.30 0.02 H new ATOM 0 HD12 LEU A 234 -15.681 5.102 4.872 -0.30 0.02 H new ATOM 0 HD13 LEU A 234 -14.488 3.876 5.364 -0.30 0.02 H new ATOM 0 HD21 LEU A 234 -15.500 1.695 3.455 -0.30 0.02 H new ATOM 0 HD22 LEU A 234 -15.117 1.402 5.168 -0.30 0.02 H new ATOM 0 HD23 LEU A 234 -16.723 0.978 4.530 -0.30 0.02 H new ATOM 1114 N ALA A 235 -17.475 6.523 5.469 -0.36 0.02 N ATOM 1115 CA ALA A 235 -18.027 7.440 4.470 1.00 0.02 C ATOM 1116 C ALA A 235 -18.275 6.752 3.128 0.48 0.02 C ATOM 1117 O ALA A 235 -18.084 5.544 2.984 -0.48 0.02 O ATOM 1118 CB ALA A 235 -17.101 8.627 4.272 -0.30 0.02 C ATOM 0 H ALA A 235 -16.661 6.881 5.969 -0.36 0.02 H new ATOM 0 HA ALA A 235 -18.989 7.784 4.850 1.00 0.02 H new ATOM 0 HB1 ALA A 235 -17.526 9.299 3.526 -0.30 0.02 H new ATOM 0 HB2 ALA A 235 -16.985 9.159 5.216 -0.30 0.02 H new ATOM 0 HB3 ALA A 235 -16.127 8.276 3.931 -0.30 0.02 H new ATOM 1124 N GLN A 236 -18.732 7.533 2.154 -0.36 0.02 N ATOM 1125 CA GLN A 236 -19.051 7.010 0.829 1.00 0.02 C ATOM 1126 C GLN A 236 -17.823 6.879 -0.070 0.48 0.02 C ATOM 1127 O GLN A 236 -17.960 6.723 -1.284 -0.48 0.02 O ATOM 1128 CB GLN A 236 -20.095 7.902 0.152 -0.20 0.02 C ATOM 1129 CG GLN A 236 -21.521 7.402 0.317 -0.20 0.02 C ATOM 1130 CD GLN A 236 -22.546 8.511 0.186 0.48 0.02 C ATOM 1131 OE1 GLN A 236 -23.372 8.718 1.075 -0.48 0.02 O ATOM 1132 NE2 GLN A 236 -22.499 9.231 -0.929 -0.52 0.02 N ATOM 0 H GLN A 236 -18.890 8.535 2.258 -0.36 0.02 H new ATOM 0 HA GLN A 236 -19.451 6.006 0.973 1.00 0.02 H new ATOM 0 HB2 GLN A 236 -20.022 8.909 0.563 -0.20 0.02 H new ATOM 0 HB3 GLN A 236 -19.865 7.974 -0.911 -0.20 0.02 H new ATOM 0 HG2 GLN A 236 -21.722 6.636 -0.432 -0.20 0.02 H new ATOM 0 HG3 GLN A 236 -21.626 6.929 1.293 -0.20 0.02 H new ATOM 0 HE21 GLN A 236 -21.797 9.025 -1.640 -0.52 0.02 H new ATOM 0 HE22 GLN A 236 -23.165 9.990 -1.074 -0.52 0.02 H new ATOM 1141 N ASP A 237 -16.631 6.933 0.509 -0.36 0.02 N ATOM 1142 CA ASP A 237 -15.408 6.809 -0.280 1.00 0.02 C ATOM 1143 C ASP A 237 -14.811 5.409 -0.151 0.48 0.02 C ATOM 1144 O ASP A 237 -14.023 4.984 -0.995 -0.48 0.02 O ATOM 1145 CB ASP A 237 -14.373 7.856 0.151 -0.45 0.02 C ATOM 1146 CG ASP A 237 -15.008 9.154 0.617 0.49 0.02 C ATOM 1147 OD1 ASP A 237 -16.134 9.457 0.171 -0.62 0.02 O ATOM 1148 OD2 ASP A 237 -14.379 9.865 1.429 -0.62 0.02 O ATOM 0 H ASP A 237 -16.483 7.060 1.510 -0.36 0.02 H new ATOM 0 HA ASP A 237 -15.671 6.981 -1.324 1.00 0.02 H new ATOM 0 HB2 ASP A 237 -13.762 7.446 0.955 -0.45 0.02 H new ATOM 0 HB3 ASP A 237 -13.704 8.064 -0.684 -0.45 0.02 H new ATOM 1153 N GLN A 238 -15.184 4.697 0.915 -0.36 0.02 N ATOM 1154 CA GLN A 238 -14.676 3.345 1.159 1.00 0.02 C ATOM 1155 C GLN A 238 -13.216 3.372 1.620 0.48 0.02 C ATOM 1156 O GLN A 238 -12.666 2.350 2.029 -0.48 0.02 O ATOM 1157 CB GLN A 238 -14.809 2.484 -0.100 -0.20 0.02 C ATOM 1158 CG GLN A 238 -16.153 2.628 -0.797 -0.20 0.02 C ATOM 1159 CD GLN A 238 -16.714 1.299 -1.264 0.48 0.02 C ATOM 1160 OE1 GLN A 238 -16.941 0.392 -0.464 -0.48 0.02 O ATOM 1161 NE2 GLN A 238 -16.939 1.178 -2.567 -0.52 0.02 N ATOM 0 H GLN A 238 -15.836 5.034 1.623 -0.36 0.02 H new ATOM 0 HA GLN A 238 -15.278 2.907 1.955 1.00 0.02 H new ATOM 0 HB2 GLN A 238 -14.016 2.752 -0.799 -0.20 0.02 H new ATOM 0 HB3 GLN A 238 -14.658 1.438 0.168 -0.20 0.02 H new ATOM 0 HG2 GLN A 238 -16.862 3.098 -0.116 -0.20 0.02 H new ATOM 0 HG3 GLN A 238 -16.044 3.293 -1.654 -0.20 0.02 H new ATOM 0 HE21 GLN A 238 -16.736 1.956 -3.194 -0.52 0.02 H new ATOM 0 HE22 GLN A 238 -17.315 0.307 -2.941 -0.52 0.02 H new ATOM 1170 N LYS A 239 -12.598 4.548 1.549 -0.36 0.02 N ATOM 1171 CA LYS A 239 -11.210 4.708 1.957 1.00 0.02 C ATOM 1172 C LYS A 239 -11.113 5.574 3.209 0.48 0.02 C ATOM 1173 O LYS A 239 -10.309 5.306 4.101 -0.48 0.02 O ATOM 1174 CB LYS A 239 -10.392 5.331 0.824 -0.20 0.02 C ATOM 1175 CG LYS A 239 -10.643 4.688 -0.530 -0.20 0.02 C ATOM 1176 CD LYS A 239 -10.118 5.553 -1.665 -0.20 0.02 C ATOM 1177 CE LYS A 239 -8.762 5.070 -2.153 0.30 5.02 C ATOM 1178 NZ LYS A 239 -7.651 5.912 -1.631 -0.81 0.02 N ATOM 0 H LYS A 239 -13.039 5.404 1.212 -0.36 0.02 H new ATOM 0 HA LYS A 239 -10.805 3.722 2.185 1.00 0.02 H new ATOM 0 HB2 LYS A 239 -10.624 6.394 0.761 -0.20 0.02 H new ATOM 0 HB3 LYS A 239 -9.332 5.250 1.065 -0.20 0.02 H new ATOM 0 HG2 LYS A 239 -10.162 3.710 -0.564 -0.20 0.02 H new ATOM 0 HG3 LYS A 239 -11.712 4.522 -0.662 -0.20 0.02 H new ATOM 0 HD2 LYS A 239 -10.829 5.541 -2.491 -0.20 0.02 H new ATOM 0 HD3 LYS A 239 -10.038 6.587 -1.329 -0.20 0.02 H new ATOM 0 HE2 LYS A 239 -8.611 4.036 -1.841 0.30 5.02 H new ATOM 0 HE3 LYS A 239 -8.744 5.080 -3.243 0.30 5.02 H new ATOM 0 HZ1 LYS A 239 -6.793 5.332 -1.531 -0.81 0.02 H new ATOM 0 HZ2 LYS A 239 -7.466 6.692 -2.293 -0.81 0.02 H new ATOM 0 HZ3 LYS A 239 -7.916 6.301 -0.703 -0.81 0.02 H new ATOM 1192 N SER A 240 -11.942 6.613 3.268 -0.36 0.02 N ATOM 1193 CA SER A 240 -11.956 7.519 4.411 1.00 0.02 C ATOM 1194 C SER A 240 -12.830 6.962 5.529 0.48 0.02 C ATOM 1195 O SER A 240 -13.373 5.865 5.413 -0.48 0.02 O ATOM 1196 CB SER A 240 -12.461 8.900 3.989 0.08 0.02 C ATOM 1197 OG SER A 240 -11.381 9.788 3.753 -0.68 0.02 O ATOM 0 H SER A 240 -12.613 6.848 2.537 -0.36 0.02 H new ATOM 0 HA SER A 240 -10.936 7.615 4.783 1.00 0.02 H new ATOM 0 HB2 SER A 240 -13.065 8.809 3.086 0.08 0.02 H new ATOM 0 HB3 SER A 240 -13.108 9.307 4.766 0.08 0.02 H new ATOM 0 HG SER A 240 -11.730 10.663 3.483 -0.68 0.02 H new ATOM 1203 N CYS A 241 -12.951 7.718 6.615 -0.36 0.02 N ATOM 1204 CA CYS A 241 -13.748 7.291 7.760 1.00 0.02 C ATOM 1205 C CYS A 241 -14.373 8.495 8.461 0.48 0.02 C ATOM 1206 O CYS A 241 -13.663 9.366 8.964 -0.48 0.02 O ATOM 1207 CB CYS A 241 -12.860 6.472 8.704 0.20 0.02 C ATOM 1208 SG CYS A 241 -12.306 4.925 7.947 -0.20 0.02 S ATOM 0 H CYS A 241 -12.507 8.630 6.727 -0.36 0.02 H new ATOM 0 HA CYS A 241 -14.573 6.661 7.426 1.00 0.02 H new ATOM 0 HB2 CYS A 241 -11.992 7.066 8.991 0.20 0.02 H new ATOM 0 HB3 CYS A 241 -13.411 6.251 9.618 0.20 0.02 H new ATOM 1213 N GLU A 242 -15.710 8.559 8.461 -0.36 0.02 N ATOM 1214 CA GLU A 242 -16.413 9.688 9.070 1.00 0.02 C ATOM 1215 C GLU A 242 -17.475 9.255 10.085 0.48 0.02 C ATOM 1216 O GLU A 242 -18.276 8.360 9.828 -0.48 0.02 O ATOM 1217 CB GLU A 242 -17.063 10.544 7.982 -0.20 0.02 C ATOM 1218 CG GLU A 242 -17.694 11.822 8.511 -0.45 0.02 C ATOM 1219 CD GLU A 242 -18.985 12.173 7.798 0.49 0.02 C ATOM 1220 OE1 GLU A 242 -20.050 11.675 8.219 -0.62 0.02 O ATOM 1221 OE2 GLU A 242 -18.931 12.947 6.820 -0.62 0.02 O ATOM 0 H GLU A 242 -16.318 7.850 8.051 -0.36 0.02 H new ATOM 0 HA GLU A 242 -15.667 10.267 9.614 1.00 0.02 H new ATOM 0 HB2 GLU A 242 -16.311 10.801 7.236 -0.20 0.02 H new ATOM 0 HB3 GLU A 242 -17.827 9.954 7.475 -0.20 0.02 H new ATOM 0 HG2 GLU A 242 -17.891 11.711 9.577 -0.45 0.02 H new ATOM 0 HG3 GLU A 242 -16.987 12.644 8.401 -0.45 0.02 H new ATOM 1228 N VAL A 243 -17.482 9.926 11.236 -0.36 0.02 N ATOM 1229 CA VAL A 243 -18.446 9.644 12.299 1.00 0.02 C ATOM 1230 C VAL A 243 -19.591 10.653 12.279 0.48 0.02 C ATOM 1231 O VAL A 243 -19.367 11.863 12.288 -0.48 0.02 O ATOM 1232 CB VAL A 243 -17.767 9.671 13.685 -0.10 0.02 C ATOM 1233 CG1 VAL A 243 -16.997 10.968 13.880 -0.30 0.02 C ATOM 1234 CG2 VAL A 243 -18.790 9.476 14.798 -0.30 0.02 C ATOM 0 H VAL A 243 -16.825 10.675 11.457 -0.36 0.02 H new ATOM 0 HA VAL A 243 -18.845 8.646 12.118 1.00 0.02 H new ATOM 0 HB VAL A 243 -17.059 8.843 13.731 -0.10 0.02 H new ATOM 0 HG11 VAL A 243 -16.526 10.967 14.863 -0.30 0.02 H new ATOM 0 HG12 VAL A 243 -16.230 11.055 13.110 -0.30 0.02 H new ATOM 0 HG13 VAL A 243 -17.682 11.812 13.807 -0.30 0.02 H new ATOM 0 HG21 VAL A 243 -18.286 9.499 15.764 -0.30 0.02 H new ATOM 0 HG22 VAL A 243 -19.530 10.275 14.756 -0.30 0.02 H new ATOM 0 HG23 VAL A 243 -19.287 8.514 14.671 -0.30 0.02 H new ATOM 1244 N VAL A 244 -20.819 10.145 12.249 -0.36 0.02 N ATOM 1245 CA VAL A 244 -21.996 10.991 12.226 1.00 0.02 C ATOM 1246 C VAL A 244 -22.633 11.080 13.609 0.48 0.02 C ATOM 1247 O VAL A 244 -23.258 10.131 14.081 -0.48 0.02 O ATOM 1248 CB VAL A 244 -23.034 10.466 11.218 -0.10 0.02 C ATOM 1249 CG1 VAL A 244 -22.450 10.440 9.814 -0.30 0.02 C ATOM 1250 CG2 VAL A 244 -23.536 9.086 11.620 -0.30 0.02 C ATOM 0 H VAL A 244 -21.020 9.145 12.240 -0.36 0.02 H new ATOM 0 HA VAL A 244 -21.674 11.986 11.919 1.00 0.02 H new ATOM 0 HB VAL A 244 -23.885 11.147 11.223 -0.10 0.02 H new ATOM 0 HG11 VAL A 244 -23.199 10.066 9.115 -0.30 0.02 H new ATOM 0 HG12 VAL A 244 -22.155 11.448 9.524 -0.30 0.02 H new ATOM 0 HG13 VAL A 244 -21.578 9.787 9.795 -0.30 0.02 H new ATOM 0 HG21 VAL A 244 -24.268 8.739 10.891 -0.30 0.02 H new ATOM 0 HG22 VAL A 244 -22.698 8.389 11.653 -0.30 0.02 H new ATOM 0 HG23 VAL A 244 -24.002 9.141 12.604 -0.30 0.02 H new ATOM 1260 N SER A 245 -22.469 12.226 14.254 -0.36 0.02 N ATOM 1261 CA SER A 245 -23.029 12.436 15.583 1.00 0.02 C ATOM 1262 C SER A 245 -23.590 13.848 15.721 0.14 0.02 C ATOM 1263 O SER A 245 -24.644 14.003 16.371 -0.57 0.02 O ATOM 1264 CB SER A 245 -21.963 12.190 16.653 0.08 0.02 C ATOM 1265 OG SER A 245 -20.978 13.208 16.635 -0.68 0.02 O ATOM 1266 OXT SER A 245 -22.969 14.786 15.177 -0.57 0.02 O ATOM 0 H SER A 245 -21.954 13.023 13.881 -0.36 0.02 H new ATOM 0 HA SER A 245 -23.844 11.726 15.723 1.00 0.02 H new ATOM 0 HB2 SER A 245 -22.432 12.151 17.636 0.08 0.02 H new ATOM 0 HB3 SER A 245 -21.492 11.221 16.486 0.08 0.02 H new ATOM 0 HG SER A 245 -20.310 13.029 17.329 -0.68 0.02 H new TER 1272 SER A 245 HETATM 1273 CA CA A 246 13.044 6.599 -8.115 2.00 0.02 CA HETATM 1274 CA CA A 247 -2.685 -5.525 -0.731 2.00 0.02 CA HETATM 1275 O HOH A 248 13.975 8.839 -7.875 -0.83 4.02 O HETATM 1278 O HOH A 249 -4.640 -4.605 -1.838 -0.83 4.02 O