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= -0.332 USER MOD Set 1.2: A 239 LYS NZ :NH3+ 147:sc= -0.186 (180deg=-1.04) USER MOD Single : A 159 LYS NZ :NH3+ -153:sc= -0.0633 (180deg=-0.487) USER MOD Single : A 165 SER OG : rot -43:sc= 0.00768 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 169 SER OG : rot 53:sc= 0.0958 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 180:sc= -0.4 USER MOD Single : A 193 TYR OH : rot 162:sc= -1.45! USER MOD Single : A 194 ASN : amide:sc= -0.305 K(o=-0.31,f=-2!) USER MOD Single : A 196 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0212) USER MOD Single : A 197 SER OG : rot 180:sc= 0 USER MOD Single : A 198 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 199 SER OG : rot 180:sc= -0.208 USER MOD Single : A 207 SER OG : rot 170:sc= -1.09 USER MOD Single : A 209 ASN : amide:sc= -0.147 K(o=-0.15,f=-1.3!) USER MOD Single : A 210 MET CE :methyl -138:sc= -0.828 (180deg=-3.29!) USER MOD Single : A 213 GLN : amide:sc= -0.674 K(o=-0.67,f=-1.9) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 223 THR OG1 : rot 22:sc= -0.894 USER MOD Single : A 225 TYR OH : rot 180:sc= 0 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=-0.000178 X(o=-0.00018,f=-0.0014) USER MOD Single : A 238 GLN : amide:sc= 0 X(o=0,f=0) 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 13.765 5.471 -15.104 -0.10 0.02 N ATOM 2 CA LYS A 159 14.986 4.760 -14.642 0.22 0.02 C ATOM 3 C LYS A 159 16.135 5.734 -14.400 0.48 0.02 C ATOM 4 O LYS A 159 16.819 6.148 -15.336 -0.48 0.02 O ATOM 5 CB LYS A 159 15.382 3.732 -15.703 -0.20 0.02 C ATOM 6 CG LYS A 159 15.994 2.467 -15.125 -0.20 0.02 C ATOM 7 CD LYS A 159 15.032 1.764 -14.182 -0.20 0.02 C ATOM 8 CE LYS A 159 15.239 0.258 -14.196 0.30 5.02 C ATOM 9 NZ LYS A 159 14.884 -0.339 -15.513 -0.81 0.02 N ATOM 0 HA LYS A 159 14.773 4.263 -13.696 0.22 0.02 H new ATOM 0 HB2 LYS A 159 14.500 3.466 -16.286 -0.20 0.02 H new ATOM 0 HB3 LYS A 159 16.093 4.188 -16.391 -0.20 0.02 H new ATOM 0 HG2 LYS A 159 16.270 1.792 -15.935 -0.20 0.02 H new ATOM 0 HG3 LYS A 159 16.911 2.716 -14.592 -0.20 0.02 H new ATOM 0 HD2 LYS A 159 15.172 2.142 -13.169 -0.20 0.02 H new ATOM 0 HD3 LYS A 159 14.006 1.994 -14.469 -0.20 0.02 H new ATOM 0 HE2 LYS A 159 16.280 0.032 -13.964 0.30 5.02 H new ATOM 0 HE3 LYS A 159 14.632 -0.199 -13.415 0.30 5.02 H new ATOM 0 HZ1 LYS A 159 14.594 -1.329 -15.379 -0.81 0.02 H new ATOM 0 HZ2 LYS A 159 14.100 0.197 -15.937 -0.81 0.02 H new ATOM 0 HZ3 LYS A 159 15.709 -0.302 -16.145 -0.81 0.02 H new ATOM 25 N ASP A 160 16.341 6.097 -13.137 -0.36 0.02 N ATOM 26 CA ASP A 160 17.409 7.025 -12.773 1.00 0.01 C ATOM 27 C ASP A 160 18.279 6.448 -11.657 0.48 0.02 C ATOM 28 O ASP A 160 19.331 5.865 -11.918 -0.48 0.02 O ATOM 29 CB ASP A 160 16.827 8.379 -12.346 -0.45 0.01 C ATOM 30 CG ASP A 160 15.456 8.259 -11.702 0.49 0.01 C ATOM 31 OD1 ASP A 160 15.272 7.359 -10.852 -0.62 0.01 O ATOM 32 OD2 ASP A 160 14.568 9.067 -12.045 -0.62 0.01 O ATOM 0 H ASP A 160 15.784 5.764 -12.350 -0.36 0.02 H new ATOM 0 HA ASP A 160 18.035 7.176 -13.652 1.00 0.01 H new ATOM 0 HB2 ASP A 160 17.511 8.858 -11.645 -0.45 0.01 H new ATOM 0 HB3 ASP A 160 16.757 9.030 -13.218 -0.45 0.01 H new ATOM 37 N VAL A 161 17.834 6.612 -10.414 -0.36 0.01 N ATOM 38 CA VAL A 161 18.569 6.106 -9.263 1.00 0.01 C ATOM 39 C VAL A 161 17.610 5.571 -8.208 0.48 0.01 C ATOM 40 O VAL A 161 16.445 5.976 -8.156 -0.48 0.01 O ATOM 41 CB VAL A 161 19.454 7.199 -8.633 -0.10 0.01 C ATOM 42 CG1 VAL A 161 20.372 6.602 -7.577 -0.30 0.02 C ATOM 43 CG2 VAL A 161 20.260 7.918 -9.704 -0.30 0.02 C ATOM 0 H VAL A 161 16.965 7.093 -10.180 -0.36 0.01 H new ATOM 0 HA VAL A 161 19.210 5.299 -9.619 1.00 0.01 H new ATOM 0 HB VAL A 161 18.806 7.928 -8.147 -0.10 0.01 H new ATOM 0 HG11 VAL A 161 20.989 7.389 -7.144 -0.30 0.02 H new ATOM 0 HG12 VAL A 161 19.772 6.139 -6.794 -0.30 0.02 H new ATOM 0 HG13 VAL A 161 21.014 5.850 -8.036 -0.30 0.02 H new ATOM 0 HG21 VAL A 161 20.879 8.686 -9.240 -0.30 0.02 H new ATOM 0 HG22 VAL A 161 20.898 7.202 -10.221 -0.30 0.02 H new ATOM 0 HG23 VAL A 161 19.582 8.382 -10.420 -0.30 0.02 H new ATOM 53 N ASP A 162 18.101 4.653 -7.374 -0.36 0.01 N ATOM 54 CA ASP A 162 17.283 4.054 -6.321 1.00 0.01 C ATOM 55 C ASP A 162 15.917 3.657 -6.865 0.48 0.01 C ATOM 56 O ASP A 162 14.997 4.473 -6.904 -0.48 0.02 O ATOM 57 CB ASP A 162 17.116 5.034 -5.158 -0.45 0.01 C ATOM 58 CG ASP A 162 18.202 4.879 -4.111 0.49 0.02 C ATOM 59 OD1 ASP A 162 19.362 5.240 -4.401 -0.62 0.02 O ATOM 60 OD2 ASP A 162 17.893 4.396 -3.001 -0.62 0.02 O ATOM 0 H ASP A 162 19.061 4.309 -7.408 -0.36 0.01 H new ATOM 0 HA ASP A 162 17.789 3.158 -5.961 1.00 0.01 H new ATOM 0 HB2 ASP A 162 17.128 6.054 -5.542 -0.45 0.01 H new ATOM 0 HB3 ASP A 162 16.142 4.880 -4.693 -0.45 0.01 H new ATOM 65 N GLU A 163 15.786 2.409 -7.298 -0.36 0.02 N ATOM 66 CA GLU A 163 14.525 1.940 -7.848 1.00 0.02 C ATOM 67 C GLU A 163 13.791 1.055 -6.852 0.48 0.02 C ATOM 68 O GLU A 163 12.780 1.459 -6.277 -0.48 0.02 O ATOM 69 CB GLU A 163 14.764 1.192 -9.160 -0.20 0.01 C ATOM 70 CG GLU A 163 15.697 1.923 -10.112 -0.45 0.01 C ATOM 71 CD GLU A 163 15.248 3.345 -10.401 0.49 0.01 C ATOM 72 OE1 GLU A 163 15.049 4.117 -9.437 -0.62 0.01 O ATOM 73 OE2 GLU A 163 15.094 3.687 -11.592 -0.62 0.01 O ATOM 0 H GLU A 163 16.530 1.712 -7.279 -0.36 0.02 H new ATOM 0 HA GLU A 163 13.897 2.808 -8.051 1.00 0.02 H new ATOM 0 HB2 GLU A 163 15.180 0.209 -8.938 -0.20 0.01 H new ATOM 0 HB3 GLU A 163 13.807 1.028 -9.656 -0.20 0.01 H new ATOM 0 HG2 GLU A 163 16.700 1.943 -9.686 -0.45 0.01 H new ATOM 0 HG3 GLU A 163 15.759 1.369 -11.049 -0.45 0.01 H new ATOM 80 N CYS A 164 14.307 -0.147 -6.642 -0.36 0.02 N ATOM 81 CA CYS A 164 13.700 -1.077 -5.705 1.00 0.02 C ATOM 82 C CYS A 164 14.394 -1.001 -4.348 0.48 0.02 C ATOM 83 O CYS A 164 13.837 -1.410 -3.330 -0.48 0.02 O ATOM 84 CB CYS A 164 13.759 -2.499 -6.256 0.20 0.02 C ATOM 85 SG CYS A 164 12.149 -3.139 -6.829 -0.20 0.02 S ATOM 0 H CYS A 164 15.143 -0.500 -7.108 -0.36 0.02 H new ATOM 0 HA CYS A 164 12.654 -0.799 -5.571 1.00 0.02 H new ATOM 0 HB2 CYS A 164 14.466 -2.528 -7.085 0.20 0.02 H new ATOM 0 HB3 CYS A 164 14.148 -3.162 -5.483 0.20 0.02 H new ATOM 90 N SER A 165 15.611 -0.462 -4.340 -0.36 0.02 N ATOM 91 CA SER A 165 16.373 -0.316 -3.108 1.00 0.02 C ATOM 92 C SER A 165 16.000 0.982 -2.392 0.48 0.02 C ATOM 93 O SER A 165 16.495 1.264 -1.301 -0.48 0.02 O ATOM 94 CB SER A 165 17.874 -0.338 -3.406 0.08 0.02 C ATOM 95 OG SER A 165 18.615 -0.736 -2.265 -0.68 0.02 O ATOM 0 H SER A 165 16.088 -0.120 -5.174 -0.36 0.02 H new ATOM 0 HA SER A 165 16.130 -1.154 -2.455 1.00 0.02 H new ATOM 0 HB2 SER A 165 18.074 -1.022 -4.230 0.08 0.02 H new ATOM 0 HB3 SER A 165 18.199 0.652 -3.727 0.08 0.02 H new ATOM 0 HG SER A 165 18.257 -0.289 -1.470 -0.68 0.02 H new ATOM 101 N LEU A 166 15.119 1.770 -3.012 -0.36 0.02 N ATOM 102 CA LEU A 166 14.676 3.033 -2.432 1.00 0.02 C ATOM 103 C LEU A 166 14.096 2.810 -1.040 0.48 0.02 C ATOM 104 O LEU A 166 14.481 3.476 -0.079 -0.48 0.02 O ATOM 105 CB LEU A 166 13.628 3.689 -3.335 -0.20 0.02 C ATOM 106 CG LEU A 166 13.728 5.214 -3.448 -0.10 0.02 C ATOM 107 CD1 LEU A 166 13.571 5.657 -4.898 -0.30 0.02 C ATOM 108 CD2 LEU A 166 12.684 5.885 -2.566 -0.30 0.02 C ATOM 0 H LEU A 166 14.700 1.553 -3.916 -0.36 0.02 H new ATOM 0 HA LEU A 166 15.538 3.694 -2.348 1.00 0.02 H new ATOM 0 HB2 LEU A 166 13.712 3.260 -4.334 -0.20 0.02 H new ATOM 0 HB3 LEU A 166 12.637 3.432 -2.961 -0.20 0.02 H new ATOM 0 HG LEU A 166 14.716 5.519 -3.103 -0.10 0.02 H new ATOM 0 HD11 LEU A 166 13.645 6.743 -4.957 -0.30 0.02 H new ATOM 0 HD12 LEU A 166 14.358 5.206 -5.503 -0.30 0.02 H new ATOM 0 HD13 LEU A 166 12.598 5.339 -5.272 -0.30 0.02 H new ATOM 0 HD21 LEU A 166 12.770 6.968 -2.659 -0.30 0.02 H new ATOM 0 HD22 LEU A 166 11.688 5.572 -2.879 -0.30 0.02 H new ATOM 0 HD23 LEU A 166 12.845 5.596 -1.527 -0.30 0.02 H new ATOM 120 N LYS A 167 13.169 1.863 -0.942 -0.36 0.02 N ATOM 121 CA LYS A 167 12.532 1.539 0.328 1.00 0.02 C ATOM 122 C LYS A 167 12.883 0.116 0.756 0.48 0.02 C ATOM 123 O LYS A 167 13.166 -0.741 -0.081 -0.48 0.02 O ATOM 124 CB LYS A 167 11.013 1.696 0.219 -0.20 0.02 C ATOM 125 CG LYS A 167 10.397 2.473 1.371 -0.20 0.02 C ATOM 126 CD LYS A 167 9.247 3.349 0.902 -0.20 0.02 C ATOM 127 CE LYS A 167 8.061 2.516 0.443 0.30 5.02 C ATOM 128 NZ LYS A 167 6.774 3.037 0.981 -0.81 0.02 N ATOM 0 H LYS A 167 12.842 1.305 -1.730 -0.36 0.02 H new ATOM 0 HA LYS A 167 12.903 2.232 1.084 1.00 0.02 H new ATOM 0 HB2 LYS A 167 10.775 2.201 -0.717 -0.20 0.02 H new ATOM 0 HB3 LYS A 167 10.556 0.707 0.173 -0.20 0.02 H new ATOM 0 HG2 LYS A 167 10.039 1.777 2.130 -0.20 0.02 H new ATOM 0 HG3 LYS A 167 11.160 3.094 1.841 -0.20 0.02 H new ATOM 0 HD2 LYS A 167 8.937 4.009 1.712 -0.20 0.02 H new ATOM 0 HD3 LYS A 167 9.584 3.986 0.084 -0.20 0.02 H new ATOM 0 HE2 LYS A 167 8.023 2.509 -0.646 0.30 5.02 H new ATOM 0 HE3 LYS A 167 8.197 1.483 0.764 0.30 5.02 H new ATOM 0 HZ1 LYS A 167 5.991 2.441 0.645 -0.81 0.02 H new ATOM 0 HZ2 LYS A 167 6.800 3.020 2.021 -0.81 0.02 H new ATOM 0 HZ3 LYS A 167 6.631 4.014 0.654 -0.81 0.02 H new ATOM 142 N PRO A 168 12.874 -0.152 2.072 -0.36 0.02 N ATOM 143 CA PRO A 168 13.199 -1.477 2.610 1.00 0.02 C ATOM 144 C PRO A 168 12.402 -2.601 1.951 0.48 0.02 C ATOM 145 O PRO A 168 12.812 -3.761 1.988 -0.48 0.02 O ATOM 146 CB PRO A 168 12.828 -1.357 4.090 -0.20 0.02 C ATOM 147 CG PRO A 168 12.960 0.094 4.394 -0.20 0.02 C ATOM 148 CD PRO A 168 12.555 0.816 3.139 0.06 0.02 C ATOM 0 HA PRO A 168 14.242 -1.737 2.431 1.00 0.02 H new ATOM 0 HB2 PRO A 168 11.813 -1.710 4.274 -0.20 0.02 H new ATOM 0 HB3 PRO A 168 13.492 -1.955 4.715 -0.20 0.02 H new ATOM 0 HG2 PRO A 168 12.322 0.377 5.231 -0.20 0.02 H new ATOM 0 HG3 PRO A 168 13.983 0.343 4.675 -0.20 0.02 H new ATOM 0 HD2 PRO A 168 11.495 1.072 3.146 0.06 0.02 H new ATOM 0 HD3 PRO A 168 13.107 1.748 3.015 0.06 0.02 H new ATOM 156 N SER A 169 11.261 -2.261 1.355 -0.36 0.02 N ATOM 157 CA SER A 169 10.422 -3.263 0.703 1.00 0.02 C ATOM 158 C SER A 169 9.696 -2.691 -0.514 0.48 0.02 C ATOM 159 O SER A 169 8.553 -2.245 -0.413 -0.48 0.02 O ATOM 160 CB SER A 169 9.403 -3.821 1.697 0.08 0.02 C ATOM 161 OG SER A 169 8.784 -2.780 2.433 -0.68 0.02 O ATOM 0 H SER A 169 10.899 -1.308 1.310 -0.36 0.02 H new ATOM 0 HA SER A 169 11.075 -4.064 0.357 1.00 0.02 H new ATOM 0 HB2 SER A 169 8.645 -4.393 1.162 0.08 0.02 H new ATOM 0 HB3 SER A 169 9.898 -4.510 2.382 0.08 0.02 H new ATOM 0 HG SER A 169 8.419 -2.114 1.814 -0.68 0.02 H new ATOM 167 N ILE A 170 10.360 -2.725 -1.667 -0.36 0.02 N ATOM 168 CA ILE A 170 9.769 -2.226 -2.907 1.00 0.02 C ATOM 169 C ILE A 170 9.242 -3.368 -3.753 0.48 0.02 C ATOM 170 O ILE A 170 8.043 -3.645 -3.773 -0.48 0.02 O ATOM 171 CB ILE A 170 10.784 -1.444 -3.758 -0.10 0.02 C ATOM 172 CG1 ILE A 170 11.371 -0.292 -2.954 -0.20 0.02 C ATOM 173 CG2 ILE A 170 10.133 -0.927 -5.025 -0.30 0.02 C ATOM 174 CD1 ILE A 170 10.377 0.825 -2.735 -0.30 0.02 C ATOM 0 H ILE A 170 11.306 -3.092 -1.769 -0.36 0.02 H new ATOM 0 HA ILE A 170 8.958 -1.562 -2.609 1.00 0.02 H new ATOM 0 HB ILE A 170 11.591 -2.120 -4.039 -0.10 0.02 H new ATOM 0 HG12 ILE A 170 11.713 -0.664 -1.988 -0.20 0.02 H new ATOM 0 HG13 ILE A 170 12.246 0.101 -3.473 -0.20 0.02 H new ATOM 0 HG21 ILE A 170 10.868 -0.377 -5.613 -0.30 0.02 H new ATOM 0 HG22 ILE A 170 9.756 -1.767 -5.609 -0.30 0.02 H new ATOM 0 HG23 ILE A 170 9.307 -0.265 -4.766 -0.30 0.02 H new ATOM 0 HD11 ILE A 170 10.846 1.621 -2.157 -0.30 0.02 H new ATOM 0 HD12 ILE A 170 10.054 1.219 -3.699 -0.30 0.02 H new ATOM 0 HD13 ILE A 170 9.513 0.442 -2.191 -0.30 0.02 H new ATOM 186 N CYS A 171 10.154 -4.018 -4.467 -0.36 0.02 N ATOM 187 CA CYS A 171 9.788 -5.112 -5.327 1.00 0.02 C ATOM 188 C CYS A 171 10.994 -5.991 -5.646 0.48 0.02 C ATOM 189 O CYS A 171 11.192 -6.404 -6.789 -0.48 0.02 O ATOM 190 CB CYS A 171 9.132 -4.563 -6.598 0.20 0.02 C ATOM 191 SG CYS A 171 7.415 -5.130 -6.830 -0.20 0.02 S ATOM 0 H CYS A 171 11.150 -3.798 -4.460 -0.36 0.02 H new ATOM 0 HA CYS A 171 9.067 -5.747 -4.811 1.00 0.02 H new ATOM 0 HB2 CYS A 171 9.145 -3.474 -6.563 0.20 0.02 H new ATOM 0 HB3 CYS A 171 9.725 -4.862 -7.462 0.20 0.02 H new ATOM 196 N GLY A 172 11.790 -6.277 -4.608 -0.36 0.02 N ATOM 197 CA GLY A 172 12.977 -7.112 -4.757 -0.10 0.02 C ATOM 198 C GLY A 172 13.688 -6.896 -6.075 0.48 0.02 C ATOM 199 O GLY A 172 13.953 -7.850 -6.808 -0.48 0.02 O ATOM 0 H GLY A 172 11.629 -5.940 -3.659 -0.36 0.02 H new ATOM 0 HA2 GLY A 172 13.667 -6.903 -3.939 -0.10 0.02 H new ATOM 0 HA3 GLY A 172 12.690 -8.160 -4.672 -0.10 0.02 H new ATOM 203 N THR A 173 13.991 -5.634 -6.370 -0.36 0.02 N ATOM 204 CA THR A 173 14.668 -5.252 -7.600 1.00 0.02 C ATOM 205 C THR A 173 14.320 -6.202 -8.743 0.48 0.02 C ATOM 206 O THR A 173 15.183 -6.605 -9.524 -0.48 0.02 O ATOM 207 CB THR A 173 16.174 -5.196 -7.369 0.18 0.02 C ATOM 208 OG1 THR A 173 16.463 -5.021 -5.993 -0.68 0.02 O ATOM 209 CG2 THR A 173 16.860 -4.075 -8.127 -0.30 0.02 C ATOM 0 H THR A 173 13.772 -4.847 -5.759 -0.36 0.02 H new ATOM 0 HA THR A 173 14.323 -4.259 -7.890 1.00 0.02 H new ATOM 0 HB THR A 173 16.556 -6.148 -7.738 0.18 0.02 H new ATOM 0 HG1 THR A 173 17.434 -4.989 -5.864 -0.68 0.02 H new ATOM 0 HG21 THR A 173 17.929 -4.094 -7.916 -0.30 0.02 H new ATOM 0 HG22 THR A 173 16.698 -4.207 -9.197 -0.30 0.02 H new ATOM 0 HG23 THR A 173 16.446 -3.117 -7.813 -0.30 0.02 H new ATOM 217 N ALA A 174 13.035 -6.542 -8.831 -0.36 0.02 N ATOM 218 CA ALA A 174 12.538 -7.430 -9.872 1.00 0.02 C ATOM 219 C ALA A 174 12.382 -6.636 -11.170 0.48 0.02 C ATOM 220 O ALA A 174 13.351 -6.056 -11.659 -0.48 0.02 O ATOM 221 CB ALA A 174 11.213 -8.061 -9.427 -0.30 0.02 C ATOM 0 H ALA A 174 12.317 -6.211 -8.187 -0.36 0.02 H new ATOM 0 HA ALA A 174 13.244 -8.241 -10.049 1.00 0.02 H new ATOM 0 HB1 ALA A 174 10.845 -8.725 -10.209 -0.30 0.02 H new ATOM 0 HB2 ALA A 174 11.371 -8.632 -8.512 -0.30 0.02 H new ATOM 0 HB3 ALA A 174 10.480 -7.276 -9.243 -0.30 0.02 H new ATOM 227 N VAL A 175 11.170 -6.569 -11.709 -0.36 0.02 N ATOM 228 CA VAL A 175 10.927 -5.796 -12.915 1.00 0.02 C ATOM 229 C VAL A 175 10.323 -4.452 -12.531 0.48 0.02 C ATOM 230 O VAL A 175 9.511 -3.885 -13.261 -0.48 0.02 O ATOM 231 CB VAL A 175 9.977 -6.526 -13.883 -0.10 0.02 C ATOM 232 CG1 VAL A 175 9.967 -5.841 -15.242 -0.30 0.02 C ATOM 233 CG2 VAL A 175 10.371 -7.989 -14.019 -0.30 0.02 C ATOM 0 H VAL A 175 10.347 -7.038 -11.331 -0.36 0.02 H new ATOM 0 HA VAL A 175 11.880 -5.657 -13.426 1.00 0.02 H new ATOM 0 HB VAL A 175 8.968 -6.482 -13.472 -0.10 0.02 H new ATOM 0 HG11 VAL A 175 9.290 -6.371 -15.912 -0.30 0.02 H new ATOM 0 HG12 VAL A 175 9.631 -4.811 -15.128 -0.30 0.02 H new ATOM 0 HG13 VAL A 175 10.973 -5.850 -15.661 -0.30 0.02 H new ATOM 0 HG21 VAL A 175 9.688 -8.487 -14.707 -0.30 0.02 H new ATOM 0 HG22 VAL A 175 11.388 -8.058 -14.404 -0.30 0.02 H new ATOM 0 HG23 VAL A 175 10.320 -8.472 -13.043 -0.30 0.02 H new ATOM 243 N CYS A 176 10.712 -3.969 -11.351 -0.36 0.02 N ATOM 244 CA CYS A 176 10.210 -2.724 -10.821 1.00 0.02 C ATOM 245 C CYS A 176 10.845 -1.510 -11.482 0.48 0.02 C ATOM 246 O CYS A 176 11.916 -1.057 -11.077 -0.48 0.02 O ATOM 247 CB CYS A 176 10.469 -2.680 -9.317 0.20 0.02 C ATOM 248 SG CYS A 176 12.216 -2.913 -8.847 -0.20 0.02 S ATOM 0 H CYS A 176 11.384 -4.438 -10.744 -0.36 0.02 H new ATOM 0 HA CYS A 176 9.141 -2.683 -11.031 1.00 0.02 H new ATOM 0 HB2 CYS A 176 10.126 -1.721 -8.929 0.20 0.02 H new ATOM 0 HB3 CYS A 176 9.869 -3.452 -8.834 0.20 0.02 H new ATOM 253 N LYS A 177 10.149 -0.954 -12.462 -0.36 0.02 N ATOM 254 CA LYS A 177 10.610 0.245 -13.131 1.00 0.02 C ATOM 255 C LYS A 177 10.280 1.430 -12.239 0.48 0.02 C ATOM 256 O LYS A 177 9.141 1.899 -12.204 -0.48 0.02 O ATOM 257 CB LYS A 177 9.942 0.399 -14.498 -0.20 0.02 C ATOM 258 CG LYS A 177 10.724 1.278 -15.461 -0.20 0.02 C ATOM 259 CD LYS A 177 10.332 2.741 -15.324 -0.20 0.02 C ATOM 260 CE LYS A 177 9.114 3.074 -16.170 0.30 5.02 C ATOM 261 NZ LYS A 177 9.234 4.412 -16.813 -0.81 0.02 N ATOM 0 H LYS A 177 9.262 -1.318 -12.810 -0.36 0.02 H new ATOM 0 HA LYS A 177 11.685 0.187 -13.302 1.00 0.02 H new ATOM 0 HB2 LYS A 177 9.812 -0.588 -14.943 -0.20 0.02 H new ATOM 0 HB3 LYS A 177 8.946 0.820 -14.361 -0.20 0.02 H new ATOM 0 HG2 LYS A 177 11.792 1.167 -15.271 -0.20 0.02 H new ATOM 0 HG3 LYS A 177 10.546 0.947 -16.484 -0.20 0.02 H new ATOM 0 HD2 LYS A 177 10.122 2.966 -14.278 -0.20 0.02 H new ATOM 0 HD3 LYS A 177 11.168 3.372 -15.624 -0.20 0.02 H new ATOM 0 HE2 LYS A 177 8.986 2.312 -16.939 0.30 5.02 H new ATOM 0 HE3 LYS A 177 8.221 3.050 -15.546 0.30 5.02 H new ATOM 0 HZ1 LYS A 177 8.384 4.602 -17.381 -0.81 0.02 H new ATOM 0 HZ2 LYS A 177 9.330 5.143 -16.079 -0.81 0.02 H new ATOM 0 HZ3 LYS A 177 10.072 4.427 -17.429 -0.81 0.02 H new ATOM 275 N ASN A 178 11.268 1.874 -11.478 -0.36 0.02 N ATOM 276 CA ASN A 178 11.071 2.970 -10.546 1.00 0.01 C ATOM 277 C ASN A 178 11.354 4.319 -11.186 0.48 0.02 C ATOM 278 O ASN A 178 12.022 4.413 -12.216 -0.48 0.02 O ATOM 279 CB ASN A 178 11.965 2.779 -9.326 -0.20 0.01 C ATOM 280 CG ASN A 178 11.720 3.818 -8.249 0.48 0.01 C ATOM 281 OD1 ASN A 178 12.145 4.967 -8.371 -0.48 0.01 O ATOM 282 ND2 ASN A 178 11.034 3.417 -7.185 -0.52 0.01 N ATOM 0 H ASN A 178 12.214 1.492 -11.488 -0.36 0.02 H new ATOM 0 HA ASN A 178 10.024 2.961 -10.243 1.00 0.01 H new ATOM 0 HB2 ASN A 178 11.797 1.785 -8.911 -0.20 0.01 H new ATOM 0 HB3 ASN A 178 13.009 2.823 -9.636 -0.20 0.01 H new ATOM 0 HD21 ASN A 178 10.840 4.071 -6.427 -0.52 0.01 H new ATOM 0 HD22 ASN A 178 10.701 2.455 -7.126 -0.52 0.01 H new ATOM 289 N ILE A 179 10.835 5.359 -10.552 -0.36 0.01 N ATOM 290 CA ILE A 179 11.010 6.720 -11.020 1.00 0.01 C ATOM 291 C ILE A 179 11.471 7.606 -9.861 0.48 0.01 C ATOM 292 O ILE A 179 11.557 7.137 -8.723 -0.48 0.01 O ATOM 293 CB ILE A 179 9.697 7.248 -11.634 -0.10 0.01 C ATOM 294 CG1 ILE A 179 8.577 7.252 -10.586 -0.20 0.02 C ATOM 295 CG2 ILE A 179 9.313 6.388 -12.832 -0.30 0.02 C ATOM 296 CD1 ILE A 179 7.183 7.242 -11.181 -0.30 5.62 C ATOM 0 H ILE A 179 10.281 5.281 -9.699 -0.36 0.01 H new ATOM 0 HA ILE A 179 11.774 6.740 -11.797 1.00 0.01 H new ATOM 0 HB ILE A 179 9.846 8.274 -11.969 -0.10 0.01 H new ATOM 0 HG12 ILE A 179 8.693 6.381 -9.941 -0.20 0.02 H new ATOM 0 HG13 ILE A 179 8.686 8.134 -9.954 -0.20 0.02 H new ATOM 0 HG21 ILE A 179 8.385 6.761 -13.265 -0.30 0.02 H new ATOM 0 HG22 ILE A 179 10.105 6.430 -13.579 -0.30 0.02 H new ATOM 0 HG23 ILE A 179 9.173 5.356 -12.509 -0.30 0.02 H new ATOM 0 HD11 ILE A 179 6.445 7.245 -10.379 -0.30 5.62 H new ATOM 0 HD12 ILE A 179 7.047 8.126 -11.803 -0.30 5.62 H new ATOM 0 HD13 ILE A 179 7.053 6.347 -11.789 -0.30 5.62 H new ATOM 308 N PRO A 180 11.798 8.889 -10.121 -0.36 0.01 N ATOM 309 CA PRO A 180 12.272 9.807 -9.080 1.00 0.01 C ATOM 310 C PRO A 180 11.510 9.686 -7.764 0.48 0.01 C ATOM 311 O PRO A 180 12.050 9.986 -6.698 -0.48 0.02 O ATOM 312 CB PRO A 180 12.055 11.175 -9.716 -0.20 0.01 C ATOM 313 CG PRO A 180 12.282 10.934 -11.167 -0.20 0.02 C ATOM 314 CD PRO A 180 11.753 9.549 -11.444 0.06 0.01 C ATOM 0 HA PRO A 180 13.304 9.601 -8.797 1.00 0.01 H new ATOM 0 HB2 PRO A 180 11.049 11.549 -9.526 -0.20 0.01 H new ATOM 0 HB3 PRO A 180 12.751 11.915 -9.320 -0.20 0.01 H new ATOM 0 HG2 PRO A 180 11.764 11.678 -11.772 -0.20 0.02 H new ATOM 0 HG3 PRO A 180 13.341 11.004 -11.413 -0.20 0.02 H new ATOM 0 HD2 PRO A 180 10.739 9.579 -11.843 0.06 0.01 H new ATOM 0 HD3 PRO A 180 12.367 9.024 -12.175 0.06 0.01 H new ATOM 322 N GLY A 181 10.261 9.246 -7.836 -0.36 0.02 N ATOM 323 CA GLY A 181 9.467 9.099 -6.628 -0.10 0.02 C ATOM 324 C GLY A 181 8.279 8.168 -6.796 0.48 0.02 C ATOM 325 O GLY A 181 7.155 8.526 -6.445 -0.48 0.02 O ATOM 0 H GLY A 181 9.785 8.990 -8.701 -0.36 0.02 H new ATOM 0 HA2 GLY A 181 10.104 8.723 -5.827 -0.10 0.02 H new ATOM 0 HA3 GLY A 181 9.109 10.080 -6.316 -0.10 0.02 H new ATOM 329 N ASP A 182 8.521 6.969 -7.319 -0.36 0.02 N ATOM 330 CA ASP A 182 7.454 5.993 -7.510 1.00 0.02 C ATOM 331 C ASP A 182 8.012 4.705 -8.097 0.48 0.02 C ATOM 332 O ASP A 182 9.177 4.649 -8.484 -0.48 0.02 O ATOM 333 CB ASP A 182 6.359 6.561 -8.415 -0.45 0.02 C ATOM 334 CG ASP A 182 5.015 6.639 -7.717 0.49 0.02 C ATOM 335 OD1 ASP A 182 4.852 7.514 -6.841 -0.62 0.02 O ATOM 336 OD2 ASP A 182 4.127 5.825 -8.045 -0.62 0.02 O ATOM 0 H ASP A 182 9.443 6.651 -7.617 -0.36 0.02 H new ATOM 0 HA ASP A 182 7.015 5.770 -6.538 1.00 0.02 H new ATOM 0 HB2 ASP A 182 6.649 7.557 -8.751 -0.45 0.02 H new ATOM 0 HB3 ASP A 182 6.268 5.938 -9.305 -0.45 0.02 H new ATOM 341 N PHE A 183 7.188 3.666 -8.150 -0.36 0.02 N ATOM 342 CA PHE A 183 7.638 2.384 -8.681 1.00 0.02 C ATOM 343 C PHE A 183 6.504 1.560 -9.291 0.48 0.02 C ATOM 344 O PHE A 183 5.349 1.651 -8.874 -0.48 0.02 O ATOM 345 CB PHE A 183 8.321 1.566 -7.570 -0.16 0.02 C ATOM 346 CG PHE A 183 7.390 0.633 -6.827 0.03 0.02 C ATOM 347 CD1 PHE A 183 6.159 1.081 -6.369 -0.16 0.02 C ATOM 348 CD2 PHE A 183 7.740 -0.692 -6.598 -0.16 0.02 C ATOM 349 CE1 PHE A 183 5.298 0.228 -5.699 -0.15 0.02 C ATOM 350 CE2 PHE A 183 6.882 -1.546 -5.926 -0.15 0.02 C ATOM 351 CZ PHE A 183 5.661 -1.084 -5.479 -0.15 0.02 C ATOM 0 H PHE A 183 6.217 3.683 -7.837 -0.36 0.02 H new ATOM 0 HA PHE A 183 8.344 2.607 -9.481 1.00 0.02 H new ATOM 0 HB2 PHE A 183 9.129 0.981 -8.009 -0.16 0.02 H new ATOM 0 HB3 PHE A 183 8.776 2.252 -6.856 -0.16 0.02 H new ATOM 0 HD1 PHE A 183 5.869 2.108 -6.537 -0.16 0.02 H new ATOM 0 HD2 PHE A 183 8.693 -1.060 -6.948 -0.16 0.02 H new ATOM 0 HE1 PHE A 183 4.343 0.590 -5.349 -0.15 0.02 H new ATOM 0 HE2 PHE A 183 7.168 -2.573 -5.752 -0.15 0.02 H new ATOM 0 HZ PHE A 183 4.990 -1.750 -4.957 -0.15 0.02 H new ATOM 361 N GLU A 184 6.872 0.721 -10.253 -0.36 0.02 N ATOM 362 CA GLU A 184 5.932 -0.179 -10.909 1.00 0.02 C ATOM 363 C GLU A 184 6.662 -1.448 -11.313 0.48 0.02 C ATOM 364 O GLU A 184 7.613 -1.406 -12.082 -0.48 0.02 O ATOM 365 CB GLU A 184 5.292 0.458 -12.132 -0.20 0.02 C ATOM 366 CG GLU A 184 4.276 1.535 -11.797 -0.45 0.02 C ATOM 367 CD GLU A 184 3.693 2.194 -13.033 0.49 0.02 C ATOM 368 OE1 GLU A 184 4.479 2.663 -13.882 -0.62 0.02 O ATOM 369 OE2 GLU A 184 2.450 2.242 -13.150 -0.62 0.02 O ATOM 0 H GLU A 184 7.829 0.646 -10.599 -0.36 0.02 H new ATOM 0 HA GLU A 184 5.132 -0.407 -10.205 1.00 0.02 H new ATOM 0 HB2 GLU A 184 6.074 0.890 -12.757 -0.20 0.02 H new ATOM 0 HB3 GLU A 184 4.805 -0.318 -12.722 -0.20 0.02 H new ATOM 0 HG2 GLU A 184 3.469 1.098 -11.209 -0.45 0.02 H new ATOM 0 HG3 GLU A 184 4.749 2.294 -11.174 -0.45 0.02 H new ATOM 376 N CYS A 185 6.225 -2.571 -10.776 -0.36 0.02 N ATOM 377 CA CYS A 185 6.867 -3.851 -11.064 1.00 0.02 C ATOM 378 C CYS A 185 5.911 -4.831 -11.722 0.48 0.02 C ATOM 379 O CYS A 185 4.723 -4.552 -11.886 -0.48 0.02 O ATOM 380 CB CYS A 185 7.430 -4.475 -9.782 0.20 0.02 C ATOM 381 SG CYS A 185 6.673 -3.873 -8.237 -0.20 0.02 S ATOM 0 H CYS A 185 5.431 -2.629 -10.139 -0.36 0.02 H new ATOM 0 HA CYS A 185 7.681 -3.647 -11.760 1.00 0.02 H new ATOM 0 HB2 CYS A 185 7.301 -5.556 -9.835 0.20 0.02 H new ATOM 0 HB3 CYS A 185 8.502 -4.283 -9.743 0.20 0.02 H new ATOM 386 N GLU A 186 6.444 -5.995 -12.075 -0.36 0.02 N ATOM 387 CA GLU A 186 5.650 -7.046 -12.694 1.00 0.02 C ATOM 388 C GLU A 186 4.635 -7.595 -11.697 0.48 0.02 C ATOM 389 O GLU A 186 3.702 -8.305 -12.073 -0.48 0.02 O ATOM 390 CB GLU A 186 6.554 -8.173 -13.199 -0.20 0.02 C ATOM 391 CG GLU A 186 6.158 -8.703 -14.567 -0.45 0.02 C ATOM 392 CD GLU A 186 6.160 -10.218 -14.629 0.49 0.02 C ATOM 393 OE1 GLU A 186 7.230 -10.820 -14.394 -0.62 0.02 O ATOM 394 OE2 GLU A 186 5.094 -10.803 -14.912 -0.62 0.02 O ATOM 0 H GLU A 186 7.427 -6.234 -11.942 -0.36 0.02 H new ATOM 0 HA GLU A 186 5.116 -6.621 -13.544 1.00 0.02 H new ATOM 0 HB2 GLU A 186 7.582 -7.812 -13.242 -0.20 0.02 H new ATOM 0 HB3 GLU A 186 6.534 -8.993 -12.481 -0.20 0.02 H new ATOM 0 HG2 GLU A 186 5.164 -8.334 -14.822 -0.45 0.02 H new ATOM 0 HG3 GLU A 186 6.845 -8.312 -15.317 -0.45 0.02 H new ATOM 401 N CYS A 187 4.819 -7.253 -10.422 -0.36 0.02 N ATOM 402 CA CYS A 187 3.916 -7.702 -9.377 1.00 0.02 C ATOM 403 C CYS A 187 2.549 -7.043 -9.564 0.48 0.02 C ATOM 404 O CYS A 187 2.445 -5.818 -9.495 -0.48 0.02 O ATOM 405 CB CYS A 187 4.496 -7.359 -7.994 0.20 0.02 C ATOM 406 SG CYS A 187 5.202 -8.786 -7.110 -0.20 0.02 S ATOM 0 H CYS A 187 5.586 -6.667 -10.094 -0.36 0.02 H new ATOM 0 HA CYS A 187 3.798 -8.784 -9.441 1.00 0.02 H new ATOM 0 HB2 CYS A 187 5.270 -6.601 -8.114 0.20 0.02 H new ATOM 0 HB3 CYS A 187 3.710 -6.918 -7.381 0.20 0.02 H new ATOM 411 N PRO A 188 1.478 -7.839 -9.818 -0.36 0.02 N ATOM 412 CA PRO A 188 0.123 -7.319 -10.022 1.00 0.02 C ATOM 413 C PRO A 188 -0.125 -6.055 -9.212 0.48 0.02 C ATOM 414 O PRO A 188 0.470 -5.878 -8.156 -0.48 0.02 O ATOM 415 CB PRO A 188 -0.738 -8.474 -9.527 -0.20 0.02 C ATOM 416 CG PRO A 188 0.036 -9.699 -9.897 -0.20 0.02 C ATOM 417 CD PRO A 188 1.500 -9.309 -9.929 0.06 0.02 C ATOM 0 HA PRO A 188 -0.080 -7.027 -11.052 1.00 0.02 H new ATOM 0 HB2 PRO A 188 -0.900 -8.416 -8.451 -0.20 0.02 H new ATOM 0 HB3 PRO A 188 -1.721 -8.467 -9.998 -0.20 0.02 H new ATOM 0 HG2 PRO A 188 -0.135 -10.496 -9.173 -0.20 0.02 H new ATOM 0 HG3 PRO A 188 -0.283 -10.077 -10.868 -0.20 0.02 H new ATOM 0 HD2 PRO A 188 2.053 -9.763 -9.107 0.06 0.02 H new ATOM 0 HD3 PRO A 188 1.980 -9.633 -10.853 0.06 0.02 H new ATOM 425 N GLU A 189 -0.988 -5.165 -9.701 -0.36 0.02 N ATOM 426 CA GLU A 189 -1.258 -3.917 -8.988 1.00 0.02 C ATOM 427 C GLU A 189 0.030 -3.382 -8.395 0.48 0.02 C ATOM 428 O GLU A 189 1.110 -3.657 -8.921 -0.48 0.02 O ATOM 429 CB GLU A 189 -2.317 -4.129 -7.899 -0.20 0.02 C ATOM 430 CG GLU A 189 -3.369 -5.164 -8.262 -0.45 0.02 C ATOM 431 CD GLU A 189 -4.293 -4.694 -9.369 0.49 0.02 C ATOM 432 OE1 GLU A 189 -4.845 -3.579 -9.249 -0.62 0.02 O ATOM 433 OE2 GLU A 189 -4.466 -5.440 -10.356 -0.62 0.02 O ATOM 0 H GLU A 189 -1.504 -5.281 -10.573 -0.36 0.02 H new ATOM 0 HA GLU A 189 -1.653 -3.184 -9.692 1.00 0.02 H new ATOM 0 HB2 GLU A 189 -1.822 -4.435 -6.978 -0.20 0.02 H new ATOM 0 HB3 GLU A 189 -2.810 -3.179 -7.695 -0.20 0.02 H new ATOM 0 HG2 GLU A 189 -2.875 -6.085 -8.573 -0.45 0.02 H new ATOM 0 HG3 GLU A 189 -3.960 -5.402 -7.377 -0.45 0.02 H new ATOM 440 N GLY A 190 -0.050 -2.670 -7.286 -0.36 0.02 N ATOM 441 CA GLY A 190 1.157 -2.203 -6.667 -0.10 0.02 C ATOM 442 C GLY A 190 1.670 -3.266 -5.731 0.48 0.02 C ATOM 443 O GLY A 190 2.197 -2.962 -4.670 -0.48 0.02 O ATOM 0 H GLY A 190 -0.916 -2.413 -6.813 -0.36 0.02 H new ATOM 0 HA2 GLY A 190 1.906 -1.976 -7.426 -0.10 0.02 H new ATOM 0 HA3 GLY A 190 0.967 -1.279 -6.120 -0.10 0.02 H new ATOM 447 N TYR A 191 1.518 -4.530 -6.142 -0.36 0.02 N ATOM 448 CA TYR A 191 1.969 -5.658 -5.336 1.00 0.02 C ATOM 449 C TYR A 191 3.431 -5.523 -4.974 0.48 0.02 C ATOM 450 O TYR A 191 4.266 -5.105 -5.777 -0.48 0.02 O ATOM 451 CB TYR A 191 1.757 -6.985 -6.072 -0.20 0.02 C ATOM 452 CG TYR A 191 0.400 -7.616 -5.853 1.00 0.02 C ATOM 453 CD1 TYR A 191 -0.766 -6.876 -5.990 -0.14 0.02 C ATOM 454 CD2 TYR A 191 0.289 -8.959 -5.516 -0.14 0.02 C ATOM 455 CE1 TYR A 191 -2.005 -7.457 -5.796 -0.14 0.02 C ATOM 456 CE2 TYR A 191 -0.946 -9.547 -5.322 -0.14 0.02 C ATOM 457 CZ TYR A 191 -2.090 -8.792 -5.464 0.20 0.02 C ATOM 458 OH TYR A 191 -3.322 -9.373 -5.273 -0.60 0.02 O ATOM 0 H TYR A 191 1.086 -4.792 -7.028 -0.36 0.02 H new ATOM 0 HA TYR A 191 1.372 -5.654 -4.424 1.00 0.02 H new ATOM 0 HB2 TYR A 191 1.898 -6.820 -7.140 -0.20 0.02 H new ATOM 0 HB3 TYR A 191 2.526 -7.689 -5.754 -0.20 0.02 H new ATOM 0 HD1 TYR A 191 -0.704 -5.830 -6.252 -0.14 0.02 H new ATOM 0 HD2 TYR A 191 1.183 -9.554 -5.404 -0.14 0.02 H new ATOM 0 HE1 TYR A 191 -2.903 -6.867 -5.904 -0.14 0.02 H new ATOM 0 HE2 TYR A 191 -1.014 -10.593 -5.060 -0.14 0.02 H new ATOM 0 HH TYR A 191 -3.206 -10.319 -5.046 -0.60 0.02 H new ATOM 468 N ARG A 192 3.710 -5.902 -3.753 -0.36 0.02 N ATOM 469 CA ARG A 192 5.063 -5.865 -3.214 1.00 0.02 C ATOM 470 C ARG A 192 5.760 -7.208 -3.430 0.48 0.02 C ATOM 471 O ARG A 192 5.179 -8.266 -3.198 -0.48 0.02 O ATOM 472 CB ARG A 192 5.035 -5.523 -1.723 -0.20 0.02 C ATOM 473 CG ARG A 192 5.593 -4.145 -1.405 -0.20 0.02 C ATOM 474 CD ARG A 192 5.171 -3.676 -0.021 -0.10 0.02 C ATOM 475 NE ARG A 192 6.071 -4.163 1.023 -0.60 0.02 N ATOM 476 CZ ARG A 192 5.939 -5.341 1.630 0.60 0.02 C ATOM 477 NH1 ARG A 192 4.945 -6.158 1.307 -0.60 0.02 N ATOM 478 NH2 ARG A 192 6.806 -5.702 2.567 -0.60 0.02 N ATOM 0 H ARG A 192 3.010 -6.247 -3.096 -0.36 0.02 H new ATOM 0 HA ARG A 192 5.621 -5.091 -3.741 1.00 0.02 H new ATOM 0 HB2 ARG A 192 4.007 -5.581 -1.364 -0.20 0.02 H new ATOM 0 HB3 ARG A 192 5.607 -6.273 -1.176 -0.20 0.02 H new ATOM 0 HG2 ARG A 192 6.681 -4.170 -1.465 -0.20 0.02 H new ATOM 0 HG3 ARG A 192 5.248 -3.431 -2.153 -0.20 0.02 H new ATOM 0 HD2 ARG A 192 5.148 -2.586 0.001 -0.10 0.02 H new ATOM 0 HD3 ARG A 192 4.158 -4.021 0.185 -0.10 0.02 H new ATOM 0 HE ARG A 192 6.847 -3.564 1.304 -0.60 0.02 H new ATOM 0 HH11 ARG A 192 4.274 -5.886 0.589 -0.60 0.02 H new ATOM 0 HH12 ARG A 192 4.852 -7.058 1.777 -0.60 0.02 H new ATOM 0 HH21 ARG A 192 7.572 -5.078 2.821 -0.60 0.02 H new ATOM 0 HH22 ARG A 192 6.707 -6.604 3.033 -0.60 0.02 H new ATOM 492 N TYR A 193 7.012 -7.156 -3.864 -0.36 0.02 N ATOM 493 CA TYR A 193 7.804 -8.350 -4.104 1.00 0.02 C ATOM 494 C TYR A 193 8.945 -8.413 -3.098 0.48 0.02 C ATOM 495 O TYR A 193 9.329 -7.395 -2.524 -0.48 0.02 O ATOM 496 CB TYR A 193 8.350 -8.300 -5.527 -0.20 0.02 C ATOM 497 CG TYR A 193 9.125 -9.519 -5.935 1.00 0.02 C ATOM 498 CD1 TYR A 193 10.488 -9.587 -5.718 -0.14 0.02 C ATOM 499 CD2 TYR A 193 8.498 -10.590 -6.549 -0.14 0.02 C ATOM 500 CE1 TYR A 193 11.217 -10.695 -6.105 -0.14 0.02 C ATOM 501 CE2 TYR A 193 9.212 -11.705 -6.937 -0.14 0.02 C ATOM 502 CZ TYR A 193 10.574 -11.753 -6.715 0.20 0.02 C ATOM 503 OH TYR A 193 11.296 -12.855 -7.110 -0.60 0.02 O ATOM 0 H TYR A 193 7.505 -6.285 -4.059 -0.36 0.02 H new ATOM 0 HA TYR A 193 7.188 -9.241 -3.987 1.00 0.02 H new ATOM 0 HB2 TYR A 193 7.518 -8.165 -6.218 -0.20 0.02 H new ATOM 0 HB3 TYR A 193 8.993 -7.425 -5.626 -0.20 0.02 H new ATOM 0 HD1 TYR A 193 10.992 -8.761 -5.238 -0.14 0.02 H new ATOM 0 HD2 TYR A 193 7.433 -10.552 -6.727 -0.14 0.02 H new ATOM 0 HE1 TYR A 193 12.282 -10.733 -5.931 -0.14 0.02 H new ATOM 0 HE2 TYR A 193 8.709 -12.535 -7.411 -0.14 0.02 H new ATOM 0 HH TYR A 193 10.689 -13.612 -7.249 -0.60 0.02 H new ATOM 513 N ASN A 194 9.483 -9.603 -2.882 -0.36 0.02 N ATOM 514 CA ASN A 194 10.578 -9.774 -1.938 1.00 0.02 C ATOM 515 C ASN A 194 11.711 -10.568 -2.566 0.48 0.02 C ATOM 516 O ASN A 194 11.484 -11.634 -3.136 -0.48 0.02 O ATOM 517 CB ASN A 194 10.083 -10.479 -0.673 -0.20 0.02 C ATOM 518 CG ASN A 194 10.189 -9.600 0.558 0.48 0.02 C ATOM 519 OD1 ASN A 194 10.320 -8.381 0.455 -0.48 0.02 O ATOM 520 ND2 ASN A 194 10.135 -10.218 1.732 -0.52 0.02 N ATOM 0 H ASN A 194 9.182 -10.461 -3.344 -0.36 0.02 H new ATOM 0 HA ASN A 194 10.954 -8.787 -1.670 1.00 0.02 H new ATOM 0 HB2 ASN A 194 9.045 -10.782 -0.812 -0.20 0.02 H new ATOM 0 HB3 ASN A 194 10.662 -11.389 -0.517 -0.20 0.02 H new ATOM 0 HD21 ASN A 194 10.203 -9.679 2.595 -0.52 0.02 H new ATOM 0 HD22 ASN A 194 10.026 -11.231 1.770 -0.52 0.02 H new ATOM 527 N LEU A 195 12.929 -10.041 -2.455 -0.36 0.02 N ATOM 528 CA LEU A 195 14.107 -10.700 -3.007 1.00 0.02 C ATOM 529 C LEU A 195 14.545 -11.859 -2.116 0.48 0.02 C ATOM 530 O LEU A 195 15.187 -12.802 -2.578 -0.48 0.02 O ATOM 531 CB LEU A 195 15.253 -9.697 -3.160 -0.20 0.02 C ATOM 532 CG LEU A 195 16.375 -10.134 -4.102 -0.10 0.02 C ATOM 533 CD1 LEU A 195 16.958 -8.933 -4.831 -0.30 0.02 C ATOM 534 CD2 LEU A 195 17.460 -10.870 -3.330 -0.30 0.02 C ATOM 0 H LEU A 195 13.124 -9.157 -1.986 -0.36 0.02 H new ATOM 0 HA LEU A 195 13.847 -11.096 -3.989 1.00 0.02 H new ATOM 0 HB2 LEU A 195 14.844 -8.753 -3.521 -0.20 0.02 H new ATOM 0 HB3 LEU A 195 15.680 -9.504 -2.176 -0.20 0.02 H new ATOM 0 HG LEU A 195 15.958 -10.815 -4.844 -0.10 0.02 H new ATOM 0 HD11 LEU A 195 17.755 -9.263 -5.497 -0.30 0.02 H new ATOM 0 HD12 LEU A 195 16.176 -8.447 -5.414 -0.30 0.02 H new ATOM 0 HD13 LEU A 195 17.361 -8.227 -4.105 -0.30 0.02 H new ATOM 0 HD21 LEU A 195 18.251 -11.174 -4.015 -0.30 0.02 H new ATOM 0 HD22 LEU A 195 17.874 -10.211 -2.567 -0.30 0.02 H new ATOM 0 HD23 LEU A 195 17.033 -11.753 -2.854 -0.30 0.02 H new ATOM 546 N LYS A 196 14.174 -11.790 -0.841 -0.36 0.02 N ATOM 547 CA LYS A 196 14.508 -12.841 0.111 1.00 0.02 C ATOM 548 C LYS A 196 13.745 -14.103 -0.243 0.48 0.02 C ATOM 549 O LYS A 196 14.291 -15.207 -0.245 -0.48 0.02 O ATOM 550 CB LYS A 196 14.148 -12.404 1.529 -0.20 0.02 C ATOM 551 CG LYS A 196 15.063 -11.334 2.088 -0.20 0.02 C ATOM 552 CD LYS A 196 15.008 -10.059 1.261 -0.20 0.02 C ATOM 553 CE LYS A 196 15.704 -8.907 1.968 0.30 5.02 C ATOM 554 NZ LYS A 196 17.144 -9.193 2.219 -0.81 0.02 N ATOM 0 H LYS A 196 13.641 -11.016 -0.444 -0.36 0.02 H new ATOM 0 HA LYS A 196 15.580 -13.035 0.065 1.00 0.02 H new ATOM 0 HB2 LYS A 196 13.123 -12.033 1.536 -0.20 0.02 H new ATOM 0 HB3 LYS A 196 14.177 -13.273 2.186 -0.20 0.02 H new ATOM 0 HG2 LYS A 196 14.779 -11.113 3.117 -0.20 0.02 H new ATOM 0 HG3 LYS A 196 16.087 -11.707 2.113 -0.20 0.02 H new ATOM 0 HD2 LYS A 196 15.479 -10.231 0.293 -0.20 0.02 H new ATOM 0 HD3 LYS A 196 13.969 -9.794 1.067 -0.20 0.02 H new ATOM 0 HE2 LYS A 196 15.614 -8.004 1.364 0.30 5.02 H new ATOM 0 HE3 LYS A 196 15.204 -8.708 2.916 0.30 5.02 H new ATOM 0 HZ1 LYS A 196 17.600 -8.351 2.625 -0.81 0.02 H new ATOM 0 HZ2 LYS A 196 17.229 -9.988 2.884 -0.81 0.02 H new ATOM 0 HZ3 LYS A 196 17.610 -9.440 1.323 -0.81 0.02 H new ATOM 568 N SER A 197 12.474 -13.912 -0.558 -0.36 0.02 N ATOM 569 CA SER A 197 11.599 -15.008 -0.940 1.00 0.02 C ATOM 570 C SER A 197 11.513 -15.095 -2.457 0.48 0.02 C ATOM 571 O SER A 197 11.062 -16.097 -3.007 -0.48 0.02 O ATOM 572 CB SER A 197 10.205 -14.816 -0.341 0.08 0.02 C ATOM 573 OG SER A 197 10.267 -14.700 1.070 -0.68 0.02 O ATOM 0 H SER A 197 12.022 -12.998 -0.556 -0.36 0.02 H new ATOM 0 HA SER A 197 12.013 -15.939 -0.553 1.00 0.02 H new ATOM 0 HB2 SER A 197 9.745 -13.922 -0.762 0.08 0.02 H new ATOM 0 HB3 SER A 197 9.570 -15.660 -0.612 0.08 0.02 H new ATOM 0 HG SER A 197 9.363 -14.576 1.428 -0.68 0.02 H new ATOM 579 N LYS A 198 11.899 -14.002 -3.119 -0.36 0.02 N ATOM 580 CA LYS A 198 11.841 -13.900 -4.575 1.00 0.02 C ATOM 581 C LYS A 198 10.444 -14.256 -5.049 0.48 0.02 C ATOM 582 O LYS A 198 10.249 -14.868 -6.099 -0.48 0.02 O ATOM 583 CB LYS A 198 12.889 -14.788 -5.260 -0.20 0.02 C ATOM 584 CG LYS A 198 13.725 -15.611 -4.301 -0.20 0.02 C ATOM 585 CD LYS A 198 13.124 -16.991 -4.102 -0.20 0.02 C ATOM 586 CE LYS A 198 14.004 -18.080 -4.694 0.30 5.02 C ATOM 587 NZ LYS A 198 13.558 -18.474 -6.058 -0.81 0.02 N ATOM 0 H LYS A 198 12.260 -13.165 -2.660 -0.36 0.02 H new ATOM 0 HA LYS A 198 12.072 -12.871 -4.852 1.00 0.02 H new ATOM 0 HB2 LYS A 198 12.383 -15.460 -5.953 -0.20 0.02 H new ATOM 0 HB3 LYS A 198 13.551 -14.158 -5.854 -0.20 0.02 H new ATOM 0 HG2 LYS A 198 14.740 -15.705 -4.686 -0.20 0.02 H new ATOM 0 HG3 LYS A 198 13.794 -15.099 -3.341 -0.20 0.02 H new ATOM 0 HD2 LYS A 198 12.983 -17.176 -3.037 -0.20 0.02 H new ATOM 0 HD3 LYS A 198 12.138 -17.028 -4.565 -0.20 0.02 H new ATOM 0 HE2 LYS A 198 15.035 -17.730 -4.736 0.30 5.02 H new ATOM 0 HE3 LYS A 198 13.990 -18.953 -4.041 0.30 5.02 H new ATOM 0 HZ1 LYS A 198 14.184 -19.219 -6.426 -0.81 0.02 H new ATOM 0 HZ2 LYS A 198 12.582 -18.832 -6.014 -0.81 0.02 H new ATOM 0 HZ3 LYS A 198 13.596 -17.647 -6.688 -0.81 0.02 H new ATOM 601 N SER A 199 9.484 -13.864 -4.235 -0.36 0.02 N ATOM 602 CA SER A 199 8.077 -14.123 -4.511 1.00 0.02 C ATOM 603 C SER A 199 7.290 -12.826 -4.642 0.48 0.02 C ATOM 604 O SER A 199 7.735 -11.769 -4.195 -0.48 0.02 O ATOM 605 CB SER A 199 7.472 -14.989 -3.405 0.08 0.02 C ATOM 606 OG SER A 199 6.078 -15.158 -3.594 -0.68 0.02 O ATOM 0 H SER A 199 9.652 -13.358 -3.365 -0.36 0.02 H new ATOM 0 HA SER A 199 8.016 -14.655 -5.460 1.00 0.02 H new ATOM 0 HB2 SER A 199 7.961 -15.963 -3.393 0.08 0.02 H new ATOM 0 HB3 SER A 199 7.657 -14.527 -2.435 0.08 0.02 H new ATOM 0 HG SER A 199 5.716 -15.717 -2.875 -0.68 0.02 H new ATOM 612 N CYS A 200 6.111 -12.918 -5.246 -0.36 0.02 N ATOM 613 CA CYS A 200 5.249 -11.758 -5.424 1.00 0.02 C ATOM 614 C CYS A 200 4.135 -11.779 -4.386 0.48 0.02 C ATOM 615 O CYS A 200 3.490 -12.808 -4.184 -0.48 0.02 O ATOM 616 CB CYS A 200 4.650 -11.747 -6.829 0.20 0.02 C ATOM 617 SG CYS A 200 3.764 -10.211 -7.238 -0.20 0.02 S ATOM 0 H CYS A 200 5.730 -13.787 -5.621 -0.36 0.02 H new ATOM 0 HA CYS A 200 5.846 -10.856 -5.294 1.00 0.02 H new ATOM 0 HB2 CYS A 200 5.448 -11.899 -7.555 0.20 0.02 H new ATOM 0 HB3 CYS A 200 3.964 -12.588 -6.928 0.20 0.02 H new ATOM 622 N GLU A 201 3.911 -10.652 -3.716 -0.36 0.02 N ATOM 623 CA GLU A 201 2.873 -10.590 -2.696 1.00 0.02 C ATOM 624 C GLU A 201 2.211 -9.216 -2.617 0.48 0.02 C ATOM 625 O GLU A 201 2.886 -8.188 -2.573 -0.48 0.02 O ATOM 626 CB GLU A 201 3.460 -10.960 -1.331 -0.20 0.02 C ATOM 627 CG GLU A 201 3.203 -12.404 -0.930 -0.45 0.02 C ATOM 628 CD GLU A 201 2.244 -12.524 0.238 0.49 0.02 C ATOM 629 OE1 GLU A 201 2.222 -11.606 1.085 -0.62 0.02 O ATOM 630 OE2 GLU A 201 1.514 -13.535 0.306 -0.62 0.02 O ATOM 0 H GLU A 201 4.426 -9.783 -3.859 -0.36 0.02 H new ATOM 0 HA GLU A 201 2.102 -11.306 -2.979 1.00 0.02 H new ATOM 0 HB2 GLU A 201 4.535 -10.782 -1.347 -0.20 0.02 H new ATOM 0 HB3 GLU A 201 3.039 -10.300 -0.573 -0.20 0.02 H new ATOM 0 HG2 GLU A 201 2.799 -12.948 -1.784 -0.45 0.02 H new ATOM 0 HG3 GLU A 201 4.149 -12.878 -0.669 -0.45 0.02 H new ATOM 637 N ASP A 202 0.878 -9.224 -2.575 -0.36 0.02 N ATOM 638 CA ASP A 202 0.083 -8.012 -2.467 1.00 0.02 C ATOM 639 C ASP A 202 0.800 -6.993 -1.595 0.48 0.02 C ATOM 640 O ASP A 202 1.570 -7.350 -0.704 -0.48 0.02 O ATOM 641 CB ASP A 202 -1.309 -8.329 -1.902 -0.45 0.02 C ATOM 642 CG ASP A 202 -1.347 -8.356 -0.384 0.49 0.02 C ATOM 643 OD1 ASP A 202 -0.848 -9.338 0.206 -0.62 0.02 O ATOM 644 OD2 ASP A 202 -1.876 -7.394 0.213 -0.62 0.02 O ATOM 0 H ASP A 202 0.322 -10.078 -2.615 -0.36 0.02 H new ATOM 0 HA ASP A 202 -0.045 -7.587 -3.462 1.00 0.02 H new ATOM 0 HB2 ASP A 202 -2.019 -7.585 -2.264 -0.45 0.02 H new ATOM 0 HB3 ASP A 202 -1.638 -9.295 -2.284 -0.45 0.02 H new ATOM 649 N ILE A 203 0.574 -5.737 -1.887 -0.36 0.02 N ATOM 650 CA ILE A 203 1.225 -4.663 -1.172 1.00 0.02 C ATOM 651 C ILE A 203 0.510 -4.291 0.128 0.48 0.02 C ATOM 652 O ILE A 203 -0.647 -4.664 0.357 -0.48 0.02 O ATOM 653 CB ILE A 203 1.350 -3.454 -2.101 -0.10 0.02 C ATOM 654 CG1 ILE A 203 2.251 -2.377 -1.518 -0.20 0.02 C ATOM 655 CG2 ILE A 203 -0.011 -2.894 -2.441 -0.30 0.02 C ATOM 656 CD1 ILE A 203 2.960 -1.600 -2.592 -0.30 0.02 C ATOM 0 H ILE A 203 -0.062 -5.429 -2.622 -0.36 0.02 H new ATOM 0 HA ILE A 203 2.215 -5.007 -0.873 1.00 0.02 H new ATOM 0 HB ILE A 203 1.819 -3.801 -3.022 -0.10 0.02 H new ATOM 0 HG12 ILE A 203 1.656 -1.696 -0.909 -0.20 0.02 H new ATOM 0 HG13 ILE A 203 2.986 -2.837 -0.857 -0.20 0.02 H new ATOM 0 HG21 ILE A 203 0.104 -2.035 -3.102 -0.30 0.02 H new ATOM 0 HG22 ILE A 203 -0.605 -3.660 -2.940 -0.30 0.02 H new ATOM 0 HG23 ILE A 203 -0.515 -2.582 -1.526 -0.30 0.02 H new ATOM 0 HD11 ILE A 203 3.593 -0.841 -2.134 -0.30 0.02 H new ATOM 0 HD12 ILE A 203 3.576 -2.277 -3.184 -0.30 0.02 H new ATOM 0 HD13 ILE A 203 2.226 -1.118 -3.238 -0.30 0.02 H new ATOM 668 N ASP A 204 1.228 -3.536 0.958 -0.36 0.02 N ATOM 669 CA ASP A 204 0.722 -3.068 2.243 1.00 0.02 C ATOM 670 C ASP A 204 0.359 -1.588 2.158 0.48 0.02 C ATOM 671 O ASP A 204 0.870 -0.758 2.910 -0.48 0.02 O ATOM 672 CB ASP A 204 1.768 -3.298 3.335 -0.45 0.02 C ATOM 673 CG ASP A 204 1.512 -4.568 4.124 0.49 0.02 C ATOM 674 OD1 ASP A 204 1.725 -5.665 3.567 -0.62 0.02 O ATOM 675 OD2 ASP A 204 1.100 -4.464 5.298 -0.62 0.02 O ATOM 0 H ASP A 204 2.180 -3.232 0.755 -0.36 0.02 H new ATOM 0 HA ASP A 204 -0.176 -3.632 2.495 1.00 0.02 H new ATOM 0 HB2 ASP A 204 2.758 -3.349 2.881 -0.45 0.02 H new ATOM 0 HB3 ASP A 204 1.773 -2.446 4.015 -0.45 0.02 H new ATOM 680 N GLU A 205 -0.523 -1.277 1.219 -0.36 0.02 N ATOM 681 CA GLU A 205 -0.978 0.091 0.983 1.00 0.02 C ATOM 682 C GLU A 205 -1.417 0.800 2.263 0.48 0.02 C ATOM 683 O GLU A 205 -1.433 2.024 2.312 -0.48 0.02 O ATOM 684 CB GLU A 205 -2.144 0.091 -0.006 -0.20 0.02 C ATOM 685 CG GLU A 205 -1.928 -0.811 -1.207 -0.45 0.02 C ATOM 686 CD GLU A 205 -2.892 -1.986 -1.244 0.49 0.02 C ATOM 687 OE1 GLU A 205 -2.571 -3.040 -0.653 -0.62 0.02 O ATOM 688 OE2 GLU A 205 -3.968 -1.851 -1.859 -0.62 0.02 O ATOM 0 H GLU A 205 -0.946 -1.966 0.597 -0.36 0.02 H new ATOM 0 HA GLU A 205 -0.126 0.636 0.576 1.00 0.02 H new ATOM 0 HB2 GLU A 205 -3.049 -0.222 0.514 -0.20 0.02 H new ATOM 0 HB3 GLU A 205 -2.313 1.110 -0.354 -0.20 0.02 H new ATOM 0 HG2 GLU A 205 -2.041 -0.226 -2.120 -0.45 0.02 H new ATOM 0 HG3 GLU A 205 -0.905 -1.187 -1.194 -0.45 0.02 H new ATOM 695 N CYS A 206 -1.799 0.047 3.290 -0.36 0.02 N ATOM 696 CA CYS A 206 -2.260 0.664 4.532 1.00 0.02 C ATOM 697 C CYS A 206 -1.168 0.709 5.592 0.48 0.02 C ATOM 698 O CYS A 206 -1.139 1.621 6.418 -0.48 0.02 O ATOM 699 CB CYS A 206 -3.503 -0.053 5.067 0.20 0.02 C ATOM 700 SG CYS A 206 -3.179 -1.531 6.084 -0.20 0.02 S ATOM 0 H CYS A 206 -1.800 -0.973 3.290 -0.36 0.02 H new ATOM 0 HA CYS A 206 -2.525 1.695 4.298 1.00 0.02 H new ATOM 0 HB2 CYS A 206 -4.082 0.655 5.660 0.20 0.02 H new ATOM 0 HB3 CYS A 206 -4.125 -0.345 4.221 0.20 0.02 H new ATOM 705 N SER A 207 -0.264 -0.261 5.567 -0.36 0.02 N ATOM 706 CA SER A 207 0.822 -0.288 6.535 1.00 0.02 C ATOM 707 C SER A 207 1.643 0.991 6.427 0.48 0.02 C ATOM 708 O SER A 207 2.351 1.372 7.359 -0.48 0.02 O ATOM 709 CB SER A 207 1.713 -1.514 6.314 0.08 0.02 C ATOM 710 OG SER A 207 2.810 -1.211 5.468 -0.68 0.02 O ATOM 0 H SER A 207 -0.260 -1.030 4.896 -0.36 0.02 H new ATOM 0 HA SER A 207 0.396 -0.353 7.536 1.00 0.02 H new ATOM 0 HB2 SER A 207 2.081 -1.876 7.274 0.08 0.02 H new ATOM 0 HB3 SER A 207 1.124 -2.319 5.874 0.08 0.02 H new ATOM 0 HG SER A 207 3.444 -1.958 5.474 -0.68 0.02 H new ATOM 716 N GLU A 208 1.572 1.627 5.259 -0.36 0.02 N ATOM 717 CA GLU A 208 2.333 2.834 4.992 1.00 0.02 C ATOM 718 C GLU A 208 1.695 4.063 5.643 0.48 0.02 C ATOM 719 O GLU A 208 2.313 5.127 5.688 -0.48 0.02 O ATOM 720 CB GLU A 208 2.456 3.023 3.471 -0.20 0.02 C ATOM 721 CG GLU A 208 1.345 3.855 2.846 -0.45 0.02 C ATOM 722 CD GLU A 208 1.557 4.085 1.363 0.49 0.02 C ATOM 723 OE1 GLU A 208 1.260 3.165 0.571 -0.62 0.02 O ATOM 724 OE2 GLU A 208 2.020 5.184 0.992 -0.62 0.02 O ATOM 0 H GLU A 208 0.989 1.319 4.481 -0.36 0.02 H new ATOM 0 HA GLU A 208 3.325 2.725 5.430 1.00 0.02 H new ATOM 0 HB2 GLU A 208 3.413 3.496 3.253 -0.20 0.02 H new ATOM 0 HB3 GLU A 208 2.469 2.042 2.996 -0.20 0.02 H new ATOM 0 HG2 GLU A 208 0.389 3.354 3.000 -0.45 0.02 H new ATOM 0 HG3 GLU A 208 1.286 4.817 3.355 -0.45 0.02 H new ATOM 731 N ASN A 209 0.465 3.912 6.147 -0.36 0.02 N ATOM 732 CA ASN A 209 -0.256 5.007 6.805 1.00 0.02 C ATOM 733 C ASN A 209 -1.160 5.745 5.823 0.48 0.02 C ATOM 734 O ASN A 209 -0.937 6.916 5.514 -0.48 0.02 O ATOM 735 CB ASN A 209 0.707 5.994 7.477 -0.20 0.02 C ATOM 736 CG ASN A 209 0.093 6.666 8.689 0.48 0.02 C ATOM 737 OD1 ASN A 209 -0.707 6.067 9.407 -0.48 0.02 O ATOM 738 ND2 ASN A 209 0.466 7.919 8.924 -0.52 0.02 N ATOM 0 H ASN A 209 -0.055 3.035 6.111 -0.36 0.02 H new ATOM 0 HA ASN A 209 -0.878 4.557 7.578 1.00 0.02 H new ATOM 0 HB2 ASN A 209 1.612 5.467 7.777 -0.20 0.02 H new ATOM 0 HB3 ASN A 209 1.005 6.755 6.755 -0.20 0.02 H new ATOM 0 HD21 ASN A 209 0.086 8.422 9.726 -0.52 0.02 H new ATOM 0 HD22 ASN A 209 1.132 8.378 8.303 -0.52 0.02 H new ATOM 745 N MET A 210 -2.190 5.054 5.345 -0.36 0.02 N ATOM 746 CA MET A 210 -3.143 5.645 4.406 1.00 0.02 C ATOM 747 C MET A 210 -4.562 5.495 4.889 0.48 0.02 C ATOM 748 O MET A 210 -5.444 6.246 4.472 -0.48 0.02 O ATOM 749 CB MET A 210 -3.001 5.024 3.016 -0.20 0.02 C ATOM 750 CG MET A 210 -1.562 4.782 2.601 -0.11 5.02 C ATOM 751 SD MET A 210 -0.937 6.049 1.482 -0.17 0.02 S ATOM 752 CE MET A 210 -1.029 5.179 -0.082 -0.21 5.02 C ATOM 0 H MET A 210 -2.388 4.084 5.591 -0.36 0.02 H new ATOM 0 HA MET A 210 -2.912 6.708 4.343 1.00 0.02 H new ATOM 0 HB2 MET A 210 -3.541 4.077 2.994 -0.20 0.02 H new ATOM 0 HB3 MET A 210 -3.476 5.679 2.285 -0.20 0.02 H new ATOM 0 HG2 MET A 210 -0.933 4.747 3.490 -0.11 5.02 H new ATOM 0 HG3 MET A 210 -1.487 3.808 2.118 -0.11 5.02 H new ATOM 0 HE1 MET A 210 -0.131 5.383 -0.665 -0.21 5.02 H new ATOM 0 HE2 MET A 210 -1.106 4.107 0.102 -0.21 5.02 H new ATOM 0 HE3 MET A 210 -1.906 5.516 -0.635 -0.21 5.02 H new ATOM 762 N CYS A 211 -4.800 4.523 5.745 -0.36 0.02 N ATOM 763 CA CYS A 211 -6.147 4.314 6.229 1.00 0.02 C ATOM 764 C CYS A 211 -6.444 5.065 7.511 0.48 0.02 C ATOM 765 O CYS A 211 -5.557 5.639 8.143 -0.48 0.02 O ATOM 766 CB CYS A 211 -6.457 2.829 6.378 0.20 0.02 C ATOM 767 SG CYS A 211 -6.619 1.974 4.781 -0.20 0.02 S ATOM 0 H CYS A 211 -4.098 3.880 6.112 -0.36 0.02 H new ATOM 0 HA CYS A 211 -6.810 4.730 5.470 1.00 0.02 H new ATOM 0 HB2 CYS A 211 -5.666 2.355 6.959 0.20 0.02 H new ATOM 0 HB3 CYS A 211 -7.382 2.711 6.943 0.20 0.02 H new ATOM 772 N ALA A 212 -7.726 5.082 7.858 -0.36 0.02 N ATOM 773 CA ALA A 212 -8.191 5.791 9.030 1.00 0.02 C ATOM 774 C ALA A 212 -7.994 4.983 10.320 0.48 0.02 C ATOM 775 O ALA A 212 -6.953 5.091 10.969 -0.48 0.02 O ATOM 776 CB ALA A 212 -9.650 6.199 8.851 -0.30 0.02 C ATOM 0 H ALA A 212 -8.462 4.607 7.335 -0.36 0.02 H new ATOM 0 HA ALA A 212 -7.583 6.690 9.134 1.00 0.02 H new ATOM 0 HB1 ALA A 212 -9.990 6.732 9.739 -0.30 0.02 H new ATOM 0 HB2 ALA A 212 -9.742 6.848 7.980 -0.30 0.02 H new ATOM 0 HB3 ALA A 212 -10.262 5.309 8.706 -0.30 0.02 H new ATOM 782 N GLN A 213 -8.998 4.185 10.698 -0.36 0.02 N ATOM 783 CA GLN A 213 -8.919 3.383 11.921 1.00 0.02 C ATOM 784 C GLN A 213 -8.642 1.912 11.611 0.48 0.02 C ATOM 785 O GLN A 213 -7.867 1.256 12.306 -0.48 0.02 O ATOM 786 CB GLN A 213 -10.212 3.519 12.729 -0.20 0.02 C ATOM 787 CG GLN A 213 -9.984 3.674 14.225 -0.20 0.02 C ATOM 788 CD GLN A 213 -9.037 2.632 14.789 0.48 0.02 C ATOM 789 OE1 GLN A 213 -9.423 1.486 15.019 -0.48 0.02 O ATOM 790 NE2 GLN A 213 -7.790 3.027 15.017 -0.52 0.02 N ATOM 0 H GLN A 213 -9.869 4.078 10.178 -0.36 0.02 H new ATOM 0 HA GLN A 213 -8.086 3.761 12.513 1.00 0.02 H new ATOM 0 HB2 GLN A 213 -10.769 4.382 12.364 -0.20 0.02 H new ATOM 0 HB3 GLN A 213 -10.834 2.641 12.554 -0.20 0.02 H new ATOM 0 HG2 GLN A 213 -9.584 4.668 14.425 -0.20 0.02 H new ATOM 0 HG3 GLN A 213 -10.941 3.606 14.742 -0.20 0.02 H new ATOM 0 HE21 GLN A 213 -7.513 3.987 14.811 -0.52 0.02 H new ATOM 0 HE22 GLN A 213 -7.109 2.370 15.398 -0.52 0.02 H new ATOM 799 N LEU A 214 -9.259 1.413 10.547 -0.36 0.02 N ATOM 800 CA LEU A 214 -9.062 0.036 10.118 1.00 0.02 C ATOM 801 C LEU A 214 -8.736 -0.008 8.650 0.48 0.02 C ATOM 802 O LEU A 214 -9.360 0.687 7.853 -0.48 0.02 O ATOM 803 CB LEU A 214 -10.296 -0.809 10.370 -0.20 0.02 C ATOM 804 CG LEU A 214 -10.554 -1.119 11.826 -0.10 0.02 C ATOM 805 CD1 LEU A 214 -9.382 -1.904 12.390 -0.30 0.02 C ATOM 806 CD2 LEU A 214 -10.785 0.162 12.603 -0.30 0.02 C ATOM 0 H LEU A 214 -9.904 1.946 9.963 -0.36 0.02 H new ATOM 0 HA LEU A 214 -8.235 -0.370 10.700 1.00 0.02 H new ATOM 0 HB2 LEU A 214 -11.165 -0.292 9.962 -0.20 0.02 H new ATOM 0 HB3 LEU A 214 -10.197 -1.747 9.824 -0.20 0.02 H new ATOM 0 HG LEU A 214 -11.454 -1.727 11.917 -0.10 0.02 H new ATOM 0 HD11 LEU A 214 -9.566 -2.129 13.441 -0.30 0.02 H new ATOM 0 HD12 LEU A 214 -9.267 -2.835 11.835 -0.30 0.02 H new ATOM 0 HD13 LEU A 214 -8.471 -1.313 12.300 -0.30 0.02 H new ATOM 0 HD21 LEU A 214 -10.970 -0.076 13.651 -0.30 0.02 H new ATOM 0 HD22 LEU A 214 -9.904 0.799 12.525 -0.30 0.02 H new ATOM 0 HD23 LEU A 214 -11.648 0.686 12.192 -0.30 0.02 H new ATOM 818 N CYS A 215 -7.740 -0.795 8.286 -0.36 0.02 N ATOM 819 CA CYS A 215 -7.347 -0.867 6.905 1.00 0.02 C ATOM 820 C CYS A 215 -7.466 -2.277 6.319 0.48 0.02 C ATOM 821 O CYS A 215 -6.466 -2.990 6.226 -0.48 0.02 O ATOM 822 CB CYS A 215 -5.910 -0.367 6.768 0.20 0.02 C ATOM 823 SG CYS A 215 -4.638 -1.458 7.498 -0.20 0.02 S ATOM 0 H CYS A 215 -7.200 -1.382 8.922 -0.36 0.02 H new ATOM 0 HA CYS A 215 -8.032 -0.236 6.338 1.00 0.02 H new ATOM 0 HB2 CYS A 215 -5.688 -0.233 5.709 0.20 0.02 H new ATOM 0 HB3 CYS A 215 -5.837 0.615 7.236 0.20 0.02 H new ATOM 828 N VAL A 216 -8.656 -2.685 5.863 -0.36 0.02 N ATOM 829 CA VAL A 216 -8.760 -3.999 5.245 1.00 0.02 C ATOM 830 C VAL A 216 -8.121 -3.912 3.887 0.48 0.02 C ATOM 831 O VAL A 216 -8.769 -3.585 2.892 -0.48 0.02 O ATOM 832 CB VAL A 216 -10.200 -4.515 5.066 -0.10 0.02 C ATOM 833 CG1 VAL A 216 -10.290 -5.516 3.904 -0.30 0.02 C ATOM 834 CG2 VAL A 216 -10.717 -5.151 6.348 -0.30 0.02 C ATOM 0 H VAL A 216 -9.522 -2.147 5.909 -0.36 0.02 H new ATOM 0 HA VAL A 216 -8.266 -4.703 5.915 1.00 0.02 H new ATOM 0 HB VAL A 216 -10.828 -3.656 4.829 -0.10 0.02 H new ATOM 0 HG11 VAL A 216 -11.318 -5.863 3.802 -0.30 0.02 H new ATOM 0 HG12 VAL A 216 -9.977 -5.030 2.980 -0.30 0.02 H new ATOM 0 HG13 VAL A 216 -9.638 -6.366 4.105 -0.30 0.02 H new ATOM 0 HG21 VAL A 216 -11.736 -5.506 6.193 -0.30 0.02 H new ATOM 0 HG22 VAL A 216 -10.078 -5.990 6.621 -0.30 0.02 H new ATOM 0 HG23 VAL A 216 -10.709 -4.412 7.150 -0.30 0.02 H new ATOM 844 N ASN A 217 -6.852 -4.188 3.854 -0.36 0.02 N ATOM 845 CA ASN A 217 -6.111 -4.130 2.622 1.00 0.02 C ATOM 846 C ASN A 217 -6.253 -5.441 1.869 0.48 0.02 C ATOM 847 O ASN A 217 -5.605 -6.420 2.240 -0.48 0.02 O ATOM 848 CB ASN A 217 -4.639 -3.874 2.928 -0.20 0.02 C ATOM 849 CG ASN A 217 -3.878 -3.410 1.713 0.48 0.02 C ATOM 850 OD1 ASN A 217 -4.020 -3.965 0.626 -0.48 0.02 O ATOM 851 ND2 ASN A 217 -3.071 -2.377 1.889 -0.52 0.02 N ATOM 0 H ASN A 217 -6.302 -4.458 4.670 -0.36 0.02 H new ATOM 0 HA ASN A 217 -6.503 -3.321 2.005 1.00 0.02 H new ATOM 0 HB2 ASN A 217 -4.558 -3.123 3.714 -0.20 0.02 H new ATOM 0 HB3 ASN A 217 -4.185 -4.788 3.312 -0.20 0.02 H new ATOM 0 HD21 ASN A 217 -2.535 -2.009 1.103 -0.52 0.02 H new ATOM 0 HD22 ASN A 217 -2.985 -1.948 2.810 -0.52 0.02 H new ATOM 858 N TYR A 218 -7.091 -5.509 0.822 -0.36 0.02 N ATOM 859 CA TYR A 218 -7.222 -6.776 0.124 1.00 0.02 C ATOM 860 C TYR A 218 -6.158 -6.906 -0.938 0.48 0.02 C ATOM 861 O TYR A 218 -5.491 -5.928 -1.292 -0.48 0.02 O ATOM 862 CB TYR A 218 -8.627 -7.000 -0.469 -0.20 0.02 C ATOM 863 CG TYR A 218 -9.294 -5.802 -1.113 1.00 0.02 C ATOM 864 CD1 TYR A 218 -10.102 -4.954 -0.367 -0.14 0.02 C ATOM 865 CD2 TYR A 218 -9.162 -5.553 -2.477 -0.14 0.02 C ATOM 866 CE1 TYR A 218 -10.751 -3.885 -0.954 -0.14 0.02 C ATOM 867 CE2 TYR A 218 -9.815 -4.488 -3.074 -0.14 0.02 C ATOM 868 CZ TYR A 218 -10.606 -3.657 -2.308 0.20 0.02 C ATOM 869 OH TYR A 218 -11.258 -2.598 -2.897 -0.60 0.02 O ATOM 0 H TYR A 218 -7.656 -4.740 0.462 -0.36 0.02 H new ATOM 0 HA TYR A 218 -7.080 -7.560 0.868 1.00 0.02 H new ATOM 0 HB2 TYR A 218 -8.559 -7.793 -1.214 -0.20 0.02 H new ATOM 0 HB3 TYR A 218 -9.277 -7.365 0.326 -0.20 0.02 H new ATOM 0 HD1 TYR A 218 -10.225 -5.133 0.691 -0.14 0.02 H new ATOM 0 HD2 TYR A 218 -8.541 -6.200 -3.078 -0.14 0.02 H new ATOM 0 HE1 TYR A 218 -11.369 -3.231 -0.357 -0.14 0.02 H new ATOM 0 HE2 TYR A 218 -9.706 -4.309 -4.133 -0.14 0.02 H new ATOM 0 HH TYR A 218 -11.050 -2.577 -3.854 -0.60 0.02 H new ATOM 879 N PRO A 219 -5.945 -8.126 -1.444 -0.36 0.02 N ATOM 880 CA PRO A 219 -4.932 -8.365 -2.446 1.00 0.02 C ATOM 881 C PRO A 219 -5.016 -7.351 -3.581 0.48 0.02 C ATOM 882 O PRO A 219 -5.825 -7.495 -4.497 -0.48 0.02 O ATOM 883 CB PRO A 219 -5.223 -9.788 -2.953 -0.20 0.02 C ATOM 884 CG PRO A 219 -6.516 -10.188 -2.318 -0.20 0.02 C ATOM 885 CD PRO A 219 -6.636 -9.367 -1.068 0.06 0.02 C ATOM 0 HA PRO A 219 -3.925 -8.265 -2.041 1.00 0.02 H new ATOM 0 HB2 PRO A 219 -5.298 -9.808 -4.040 -0.20 0.02 H new ATOM 0 HB3 PRO A 219 -4.422 -10.474 -2.676 -0.20 0.02 H new ATOM 0 HG2 PRO A 219 -7.354 -10.001 -2.989 -0.20 0.02 H new ATOM 0 HG3 PRO A 219 -6.524 -11.253 -2.087 -0.20 0.02 H new ATOM 0 HD2 PRO A 219 -7.676 -9.188 -0.797 0.06 0.02 H new ATOM 0 HD3 PRO A 219 -6.164 -9.853 -0.215 0.06 0.02 H new ATOM 893 N GLY A 220 -4.170 -6.328 -3.517 -0.36 0.02 N ATOM 894 CA GLY A 220 -4.159 -5.312 -4.544 -0.10 0.02 C ATOM 895 C GLY A 220 -4.737 -3.990 -4.082 0.48 0.02 C ATOM 896 O GLY A 220 -4.006 -3.019 -3.896 -0.48 0.02 O ATOM 0 H GLY A 220 -3.491 -6.188 -2.769 -0.36 0.02 H new ATOM 0 HA2 GLY A 220 -3.134 -5.155 -4.880 -0.10 0.02 H new ATOM 0 HA3 GLY A 220 -4.726 -5.668 -5.404 -0.10 0.02 H new ATOM 900 N GLY A 221 -6.054 -3.947 -3.927 -0.36 0.02 N ATOM 901 CA GLY A 221 -6.721 -2.722 -3.513 -0.10 0.02 C ATOM 902 C GLY A 221 -7.137 -2.685 -2.055 0.48 0.02 C ATOM 903 O GLY A 221 -8.024 -3.424 -1.627 -0.48 0.02 O ATOM 0 H GLY A 221 -6.676 -4.740 -4.081 -0.36 0.02 H new ATOM 0 HA2 GLY A 221 -6.057 -1.880 -3.708 -0.10 0.02 H new ATOM 0 HA3 GLY A 221 -7.607 -2.580 -4.133 -0.10 0.02 H new ATOM 907 N TYR A 222 -6.479 -1.873 -1.256 -0.36 0.02 N ATOM 908 CA TYR A 222 -6.809 -1.811 0.150 1.00 0.02 C ATOM 909 C TYR A 222 -8.158 -1.134 0.407 0.48 0.02 C ATOM 910 O TYR A 222 -8.826 -0.672 -0.517 -0.48 0.02 O ATOM 911 CB TYR A 222 -5.711 -1.077 0.899 -0.20 0.02 C ATOM 912 CG TYR A 222 -5.631 0.379 0.538 1.00 0.02 C ATOM 913 CD1 TYR A 222 -4.946 0.788 -0.592 -0.14 0.02 C ATOM 914 CD2 TYR A 222 -6.237 1.335 1.326 -0.14 0.02 C ATOM 915 CE1 TYR A 222 -4.862 2.124 -0.931 -0.14 0.02 C ATOM 916 CE2 TYR A 222 -6.161 2.677 0.999 -0.14 0.02 C ATOM 917 CZ TYR A 222 -5.471 3.066 -0.130 0.20 0.02 C ATOM 918 OH TYR A 222 -5.392 4.399 -0.460 -0.60 0.02 O ATOM 0 H TYR A 222 -5.723 -1.255 -1.551 -0.36 0.02 H new ATOM 0 HA TYR A 222 -6.891 -2.836 0.512 1.00 0.02 H new ATOM 0 HB2 TYR A 222 -5.883 -1.172 1.971 -0.20 0.02 H new ATOM 0 HB3 TYR A 222 -4.753 -1.552 0.687 -0.20 0.02 H new ATOM 0 HD1 TYR A 222 -4.469 0.050 -1.220 -0.14 0.02 H new ATOM 0 HD2 TYR A 222 -6.778 1.032 2.210 -0.14 0.02 H new ATOM 0 HE1 TYR A 222 -4.324 2.428 -1.816 -0.14 0.02 H new ATOM 0 HE2 TYR A 222 -6.639 3.416 1.624 -0.14 0.02 H new ATOM 0 HH TYR A 222 -5.325 4.492 -1.433 -0.60 0.02 H new ATOM 928 N THR A 223 -8.532 -1.075 1.685 -0.36 0.02 N ATOM 929 CA THR A 223 -9.781 -0.450 2.113 1.00 0.02 C ATOM 930 C THR A 223 -9.614 0.096 3.524 0.48 0.02 C ATOM 931 O THR A 223 -8.919 -0.496 4.347 -0.48 0.02 O ATOM 932 CB THR A 223 -10.937 -1.457 2.052 0.18 0.02 C ATOM 933 OG1 THR A 223 -11.449 -1.537 0.736 -0.68 0.02 O ATOM 934 CG2 THR A 223 -12.101 -1.128 2.966 -0.30 0.02 C ATOM 0 H THR A 223 -7.978 -1.459 2.451 -0.36 0.02 H new ATOM 0 HA THR A 223 -10.021 0.373 1.439 1.00 0.02 H new ATOM 0 HB THR A 223 -10.503 -2.400 2.384 0.18 0.02 H new ATOM 0 HG1 THR A 223 -10.770 -1.226 0.101 -0.68 0.02 H new ATOM 0 HG21 THR A 223 -12.873 -1.890 2.860 -0.30 0.02 H new ATOM 0 HG22 THR A 223 -11.756 -1.102 4.000 -0.30 0.02 H new ATOM 0 HG23 THR A 223 -12.512 -0.155 2.696 -0.30 0.02 H new ATOM 942 N CYS A 224 -10.218 1.245 3.789 -0.36 0.02 N ATOM 943 CA CYS A 224 -10.087 1.873 5.096 1.00 0.02 C ATOM 944 C CYS A 224 -11.433 2.092 5.773 0.48 0.02 C ATOM 945 O CYS A 224 -12.175 3.005 5.418 -0.48 0.02 O ATOM 946 CB CYS A 224 -9.362 3.204 4.942 0.20 0.02 C ATOM 947 SG CYS A 224 -7.955 3.134 3.792 -0.20 0.02 S ATOM 0 H CYS A 224 -10.798 1.757 3.124 -0.36 0.02 H new ATOM 0 HA CYS A 224 -9.514 1.199 5.733 1.00 0.02 H new ATOM 0 HB2 CYS A 224 -10.070 3.956 4.593 0.20 0.02 H new ATOM 0 HB3 CYS A 224 -9.007 3.530 5.919 0.20 0.02 H new ATOM 952 N TYR A 225 -11.721 1.267 6.775 -0.36 0.02 N ATOM 953 CA TYR A 225 -12.959 1.383 7.532 1.00 0.02 C ATOM 954 C TYR A 225 -12.661 1.813 8.964 0.48 0.02 C ATOM 955 O TYR A 225 -11.752 1.290 9.592 -0.48 0.02 O ATOM 956 CB TYR A 225 -13.731 0.064 7.516 -0.20 0.02 C ATOM 957 CG TYR A 225 -13.003 -1.097 8.155 1.00 0.02 C ATOM 958 CD1 TYR A 225 -11.907 -1.690 7.538 -0.14 0.02 C ATOM 959 CD2 TYR A 225 -13.434 -1.620 9.366 -0.14 0.02 C ATOM 960 CE1 TYR A 225 -11.267 -2.767 8.106 -0.14 0.02 C ATOM 961 CE2 TYR A 225 -12.793 -2.698 9.947 -0.14 0.02 C ATOM 962 CZ TYR A 225 -11.712 -3.271 9.311 0.20 0.02 C ATOM 963 OH TYR A 225 -11.073 -4.348 9.882 -0.60 0.02 O ATOM 0 H TYR A 225 -11.111 0.509 7.081 -0.36 0.02 H new ATOM 0 HA TYR A 225 -13.582 2.144 7.061 1.00 0.02 H new ATOM 0 HB2 TYR A 225 -14.681 0.208 8.030 -0.20 0.02 H new ATOM 0 HB3 TYR A 225 -13.963 -0.194 6.483 -0.20 0.02 H new ATOM 0 HD1 TYR A 225 -11.552 -1.298 6.596 -0.14 0.02 H new ATOM 0 HD2 TYR A 225 -14.285 -1.177 9.863 -0.14 0.02 H new ATOM 0 HE1 TYR A 225 -10.419 -3.217 7.611 -0.14 0.02 H new ATOM 0 HE2 TYR A 225 -13.137 -3.089 10.893 -0.14 0.02 H new ATOM 0 HH TYR A 225 -11.511 -4.577 10.728 -0.60 0.02 H new ATOM 973 N CYS A 226 -13.386 2.805 9.466 -0.36 0.02 N ATOM 974 CA CYS A 226 -13.125 3.310 10.810 1.00 0.02 C ATOM 975 C CYS A 226 -13.710 2.444 11.907 0.48 0.02 C ATOM 976 O CYS A 226 -12.977 1.740 12.598 -0.48 0.02 O ATOM 977 CB CYS A 226 -13.652 4.710 10.971 0.20 0.02 C ATOM 978 SG CYS A 226 -12.350 5.987 11.064 -0.20 0.02 S ATOM 0 H CYS A 226 -14.148 3.270 8.973 -0.36 0.02 H new ATOM 0 HA CYS A 226 -12.040 3.295 10.917 1.00 0.02 H new ATOM 0 HB2 CYS A 226 -14.311 4.938 10.133 0.20 0.02 H new ATOM 0 HB3 CYS A 226 -14.258 4.757 11.876 0.20 0.02 H new ATOM 983 N ASP A 227 -15.030 2.514 12.076 -0.36 0.02 N ATOM 984 CA ASP A 227 -15.742 1.757 13.101 1.00 0.02 C ATOM 985 C ASP A 227 -14.837 0.810 13.887 0.48 0.02 C ATOM 986 O ASP A 227 -14.518 -0.293 13.442 -0.48 0.02 O ATOM 987 CB ASP A 227 -16.906 1.014 12.448 -0.45 0.02 C ATOM 988 CG ASP A 227 -16.469 -0.212 11.667 0.49 0.02 C ATOM 989 OD1 ASP A 227 -16.132 -0.066 10.474 -0.62 0.02 O ATOM 990 OD2 ASP A 227 -16.465 -1.317 12.250 -0.62 0.02 O ATOM 0 H ASP A 227 -15.637 3.100 11.503 -0.36 0.02 H new ATOM 0 HA ASP A 227 -16.124 2.462 13.839 1.00 0.02 H new ATOM 0 HB2 ASP A 227 -17.615 0.712 13.219 -0.45 0.02 H new ATOM 0 HB3 ASP A 227 -17.433 1.694 11.779 -0.45 0.02 H new ATOM 995 N GLY A 228 -14.426 1.267 15.063 -0.36 0.02 N ATOM 996 CA GLY A 228 -13.559 0.476 15.910 -0.10 0.02 C ATOM 997 C GLY A 228 -12.956 1.289 17.042 0.48 0.02 C ATOM 998 O GLY A 228 -12.641 0.748 18.102 -0.48 0.02 O ATOM 0 H GLY A 228 -14.680 2.178 15.446 -0.36 0.02 H new ATOM 0 HA2 GLY A 228 -14.124 -0.358 16.326 -0.10 0.02 H new ATOM 0 HA3 GLY A 228 -12.758 0.048 15.307 -0.10 0.02 H new ATOM 1002 N LYS A 229 -12.807 2.593 16.821 -0.36 0.02 N ATOM 1003 CA LYS A 229 -12.252 3.482 17.837 1.00 0.02 C ATOM 1004 C LYS A 229 -13.356 4.348 18.436 0.48 0.02 C ATOM 1005 O LYS A 229 -13.341 4.663 19.626 -0.48 0.02 O ATOM 1006 CB LYS A 229 -11.143 4.359 17.244 -0.20 0.02 C ATOM 1007 CG LYS A 229 -11.648 5.474 16.338 -0.20 0.02 C ATOM 1008 CD LYS A 229 -11.646 6.818 17.051 -0.20 0.02 C ATOM 1009 CE LYS A 229 -10.617 7.766 16.457 0.30 5.02 C ATOM 1010 NZ LYS A 229 -9.935 8.574 17.505 -0.81 0.02 N ATOM 0 H LYS A 229 -13.062 3.056 15.949 -0.36 0.02 H new ATOM 0 HA LYS A 229 -11.815 2.873 18.629 1.00 0.02 H new ATOM 0 HB2 LYS A 229 -10.569 4.800 18.059 -0.20 0.02 H new ATOM 0 HB3 LYS A 229 -10.459 3.727 16.677 -0.20 0.02 H new ATOM 0 HG2 LYS A 229 -11.021 5.533 15.448 -0.20 0.02 H new ATOM 0 HG3 LYS A 229 -12.658 5.241 16.002 -0.20 0.02 H new ATOM 0 HD2 LYS A 229 -12.637 7.267 16.984 -0.20 0.02 H new ATOM 0 HD3 LYS A 229 -11.435 6.668 18.110 -0.20 0.02 H new ATOM 0 HE2 LYS A 229 -9.875 7.194 15.900 0.30 5.02 H new ATOM 0 HE3 LYS A 229 -11.105 8.432 15.746 0.30 5.02 H new ATOM 0 HZ1 LYS A 229 -9.241 9.207 17.058 -0.81 0.02 H new ATOM 0 HZ2 LYS A 229 -10.639 9.140 18.020 -0.81 0.02 H new ATOM 0 HZ3 LYS A 229 -9.447 7.940 18.170 -0.81 0.02 H new ATOM 1024 N LYS A 230 -14.320 4.718 17.598 -0.36 0.02 N ATOM 1025 CA LYS A 230 -15.448 5.535 18.032 1.00 0.02 C ATOM 1026 C LYS A 230 -16.767 4.803 17.813 0.48 0.02 C ATOM 1027 O LYS A 230 -17.781 5.141 18.423 -0.48 0.02 O ATOM 1028 CB LYS A 230 -15.455 6.874 17.302 -0.20 0.02 C ATOM 1029 CG LYS A 230 -15.620 8.068 18.227 -0.20 0.02 C ATOM 1030 CD LYS A 230 -15.124 9.351 17.580 -0.20 0.02 C ATOM 1031 CE LYS A 230 -15.008 10.476 18.596 0.30 5.02 C ATOM 1032 NZ LYS A 230 -14.558 11.750 17.969 -0.81 0.02 N ATOM 0 H LYS A 230 -14.342 4.464 16.611 -0.36 0.02 H new ATOM 0 HA LYS A 230 -15.336 5.723 19.100 1.00 0.02 H new ATOM 0 HB2 LYS A 230 -14.523 6.981 16.747 -0.20 0.02 H new ATOM 0 HB3 LYS A 230 -16.264 6.876 16.571 -0.20 0.02 H new ATOM 0 HG2 LYS A 230 -16.671 8.178 18.496 -0.20 0.02 H new ATOM 0 HG3 LYS A 230 -15.071 7.891 19.152 -0.20 0.02 H new ATOM 0 HD2 LYS A 230 -14.153 9.175 17.117 -0.20 0.02 H new ATOM 0 HD3 LYS A 230 -15.807 9.647 16.784 -0.20 0.02 H new ATOM 0 HE2 LYS A 230 -15.973 10.630 19.078 0.30 5.02 H new ATOM 0 HE3 LYS A 230 -14.304 10.188 19.377 0.30 5.02 H new ATOM 0 HZ1 LYS A 230 -14.492 12.491 18.696 -0.81 0.02 H new ATOM 0 HZ2 LYS A 230 -13.625 11.611 17.531 -0.81 0.02 H new ATOM 0 HZ3 LYS A 230 -15.242 12.039 17.241 -0.81 0.02 H new ATOM 1046 N GLY A 231 -16.750 3.796 16.944 -0.36 0.02 N ATOM 1047 CA GLY A 231 -17.950 3.038 16.673 -0.10 0.02 C ATOM 1048 C GLY A 231 -18.835 3.706 15.645 0.48 0.02 C ATOM 1049 O GLY A 231 -19.872 4.274 15.989 -0.48 0.02 O ATOM 0 H GLY A 231 -15.925 3.495 16.425 -0.36 0.02 H new ATOM 0 HA2 GLY A 231 -17.676 2.043 16.321 -0.10 0.02 H new ATOM 0 HA3 GLY A 231 -18.510 2.906 17.599 -0.10 0.02 H new ATOM 1053 N PHE A 232 -18.442 3.628 14.378 -0.36 0.02 N ATOM 1054 CA PHE A 232 -19.236 4.223 13.313 1.00 0.02 C ATOM 1055 C PHE A 232 -19.126 3.448 11.995 0.48 0.02 C ATOM 1056 O PHE A 232 -19.332 2.235 11.980 -0.48 0.02 O ATOM 1057 CB PHE A 232 -18.923 5.703 13.133 -0.16 0.02 C ATOM 1058 CG PHE A 232 -17.482 6.120 13.100 0.03 0.02 C ATOM 1059 CD1 PHE A 232 -16.751 6.070 11.921 -0.16 0.02 C ATOM 1060 CD2 PHE A 232 -16.896 6.691 14.223 -0.16 0.02 C ATOM 1061 CE1 PHE A 232 -15.477 6.578 11.873 -0.15 0.02 C ATOM 1062 CE2 PHE A 232 -15.605 7.175 14.174 -0.15 0.02 C ATOM 1063 CZ PHE A 232 -14.899 7.125 12.996 -0.15 0.02 C ATOM 0 H PHE A 232 -17.588 3.164 14.067 -0.36 0.02 H new ATOM 0 HA PHE A 232 -20.278 4.151 13.625 1.00 0.02 H new ATOM 0 HB2 PHE A 232 -19.387 6.032 12.203 -0.16 0.02 H new ATOM 0 HB3 PHE A 232 -19.410 6.248 13.942 -0.16 0.02 H new ATOM 0 HD1 PHE A 232 -17.187 5.629 11.037 -0.16 0.02 H new ATOM 0 HD2 PHE A 232 -17.457 6.757 15.144 -0.16 0.02 H new ATOM 0 HE1 PHE A 232 -14.923 6.548 10.946 -0.15 0.02 H new ATOM 0 HE2 PHE A 232 -15.150 7.593 15.060 -0.15 0.02 H new ATOM 0 HZ PHE A 232 -13.893 7.514 12.952 -0.15 0.02 H new ATOM 1073 N LYS A 233 -18.865 4.138 10.880 -0.36 0.02 N ATOM 1074 CA LYS A 233 -18.805 3.470 9.587 1.00 0.02 C ATOM 1075 C LYS A 233 -17.840 4.139 8.608 0.48 0.02 C ATOM 1076 O LYS A 233 -17.195 5.139 8.920 -0.48 0.02 O ATOM 1077 CB LYS A 233 -20.198 3.468 8.982 -0.20 0.02 C ATOM 1078 CG LYS A 233 -20.531 2.207 8.202 -0.20 0.02 C ATOM 1079 CD LYS A 233 -22.009 1.861 8.305 -0.20 0.02 C ATOM 1080 CE LYS A 233 -22.428 0.879 7.223 0.30 5.02 C ATOM 1081 NZ LYS A 233 -23.858 0.485 7.351 -0.81 0.02 N ATOM 0 H LYS A 233 -18.695 5.143 10.851 -0.36 0.02 H new ATOM 0 HA LYS A 233 -18.435 2.459 9.758 1.00 0.02 H new ATOM 0 HB2 LYS A 233 -20.930 3.593 9.780 -0.20 0.02 H new ATOM 0 HB3 LYS A 233 -20.297 4.329 8.321 -0.20 0.02 H new ATOM 0 HG2 LYS A 233 -20.260 2.344 7.155 -0.20 0.02 H new ATOM 0 HG3 LYS A 233 -19.935 1.376 8.580 -0.20 0.02 H new ATOM 0 HD2 LYS A 233 -22.216 1.433 9.286 -0.20 0.02 H new ATOM 0 HD3 LYS A 233 -22.603 2.771 8.222 -0.20 0.02 H new ATOM 0 HE2 LYS A 233 -22.262 1.326 6.243 0.30 5.02 H new ATOM 0 HE3 LYS A 233 -21.800 -0.011 7.278 0.30 5.02 H new ATOM 0 HZ1 LYS A 233 -24.103 -0.185 6.594 -0.81 0.02 H new ATOM 0 HZ2 LYS A 233 -24.013 0.035 8.276 -0.81 0.02 H new ATOM 0 HZ3 LYS A 233 -24.459 1.330 7.273 -0.81 0.02 H new ATOM 1095 N LEU A 234 -17.769 3.559 7.411 -0.36 0.02 N ATOM 1096 CA LEU A 234 -16.915 4.048 6.341 1.00 0.02 C ATOM 1097 C LEU A 234 -17.701 4.900 5.345 0.48 0.02 C ATOM 1098 O LEU A 234 -18.555 4.386 4.622 -0.48 0.02 O ATOM 1099 CB LEU A 234 -16.305 2.859 5.603 -0.20 0.02 C ATOM 1100 CG LEU A 234 -14.906 3.090 5.055 -0.10 0.02 C ATOM 1101 CD1 LEU A 234 -14.352 1.807 4.455 -0.30 0.02 C ATOM 1102 CD2 LEU A 234 -14.912 4.206 4.020 -0.30 0.02 C ATOM 0 H LEU A 234 -18.308 2.731 7.159 -0.36 0.02 H new ATOM 0 HA LEU A 234 -16.135 4.667 6.784 1.00 0.02 H new ATOM 0 HB2 LEU A 234 -16.277 2.006 6.281 -0.20 0.02 H new ATOM 0 HB3 LEU A 234 -16.962 2.588 4.777 -0.20 0.02 H new ATOM 0 HG LEU A 234 -14.260 3.393 5.879 -0.10 0.02 H new ATOM 0 HD11 LEU A 234 -13.350 1.990 4.067 -0.30 0.02 H new ATOM 0 HD12 LEU A 234 -14.309 1.035 5.223 -0.30 0.02 H new ATOM 0 HD13 LEU A 234 -15.000 1.475 3.644 -0.30 0.02 H new ATOM 0 HD21 LEU A 234 -13.901 4.356 3.640 -0.30 0.02 H new ATOM 0 HD22 LEU A 234 -15.573 3.935 3.196 -0.30 0.02 H new ATOM 0 HD23 LEU A 234 -15.266 5.128 4.481 -0.30 0.02 H new ATOM 1114 N ALA A 235 -17.410 6.197 5.305 -0.36 0.02 N ATOM 1115 CA ALA A 235 -18.091 7.107 4.388 1.00 0.02 C ATOM 1116 C ALA A 235 -18.024 6.595 2.952 0.48 0.02 C ATOM 1117 O ALA A 235 -17.544 5.491 2.696 -0.48 0.02 O ATOM 1118 CB ALA A 235 -17.482 8.498 4.472 -0.30 0.02 C ATOM 0 H ALA A 235 -16.708 6.642 5.896 -0.36 0.02 H new ATOM 0 HA ALA A 235 -19.139 7.158 4.685 1.00 0.02 H new ATOM 0 HB1 ALA A 235 -18.000 9.164 3.783 -0.30 0.02 H new ATOM 0 HB2 ALA A 235 -17.582 8.878 5.489 -0.30 0.02 H new ATOM 0 HB3 ALA A 235 -16.426 8.450 4.205 -0.30 0.02 H new ATOM 1124 N GLN A 236 -18.512 7.404 2.018 -0.36 0.02 N ATOM 1125 CA GLN A 236 -18.516 7.030 0.609 1.00 0.02 C ATOM 1126 C GLN A 236 -17.197 7.381 -0.081 0.48 0.02 C ATOM 1127 O GLN A 236 -17.123 7.397 -1.309 -0.48 0.02 O ATOM 1128 CB GLN A 236 -19.678 7.712 -0.115 -0.20 0.02 C ATOM 1129 CG GLN A 236 -21.044 7.195 0.305 -0.20 0.02 C ATOM 1130 CD GLN A 236 -22.164 7.754 -0.551 0.48 0.02 C ATOM 1131 OE1 GLN A 236 -22.179 7.574 -1.768 -0.48 0.02 O ATOM 1132 NE2 GLN A 236 -23.109 8.437 0.084 -0.52 0.02 N ATOM 0 H GLN A 236 -18.910 8.323 2.211 -0.36 0.02 H new ATOM 0 HA GLN A 236 -18.638 5.948 0.560 1.00 0.02 H new ATOM 0 HB2 GLN A 236 -19.632 8.785 0.072 -0.20 0.02 H new ATOM 0 HB3 GLN A 236 -19.559 7.570 -1.189 -0.20 0.02 H new ATOM 0 HG2 GLN A 236 -21.052 6.107 0.243 -0.20 0.02 H new ATOM 0 HG3 GLN A 236 -21.223 7.456 1.348 -0.20 0.02 H new ATOM 0 HE21 GLN A 236 -23.056 8.562 1.095 -0.52 0.02 H new ATOM 0 HE22 GLN A 236 -23.888 8.837 -0.439 -0.52 0.02 H new ATOM 1141 N ASP A 237 -16.156 7.655 0.703 -0.36 0.02 N ATOM 1142 CA ASP A 237 -14.851 7.993 0.139 1.00 0.02 C ATOM 1143 C ASP A 237 -14.012 6.734 -0.062 0.48 0.02 C ATOM 1144 O ASP A 237 -13.201 6.661 -0.983 -0.48 0.02 O ATOM 1145 CB ASP A 237 -14.101 8.980 1.042 -0.45 0.02 C ATOM 1146 CG ASP A 237 -15.032 9.893 1.819 0.49 0.02 C ATOM 1147 OD1 ASP A 237 -15.666 10.767 1.191 -0.62 0.02 O ATOM 1148 OD2 ASP A 237 -15.126 9.733 3.054 -0.62 0.02 O ATOM 0 H ASP A 237 -16.190 7.650 1.722 -0.36 0.02 H new ATOM 0 HA ASP A 237 -15.018 8.467 -0.828 1.00 0.02 H new ATOM 0 HB2 ASP A 237 -13.478 8.423 1.742 -0.45 0.02 H new ATOM 0 HB3 ASP A 237 -13.431 9.586 0.432 -0.45 0.02 H new ATOM 1153 N GLN A 238 -14.214 5.754 0.823 -0.36 0.02 N ATOM 1154 CA GLN A 238 -13.491 4.478 0.786 1.00 0.02 C ATOM 1155 C GLN A 238 -12.233 4.540 1.652 0.48 0.02 C ATOM 1156 O GLN A 238 -11.937 3.606 2.397 -0.48 0.02 O ATOM 1157 CB GLN A 238 -13.147 4.056 -0.657 -0.20 0.02 C ATOM 1158 CG GLN A 238 -11.694 4.286 -1.056 -0.20 0.02 C ATOM 1159 CD GLN A 238 -11.401 3.840 -2.474 0.48 0.02 C ATOM 1160 OE1 GLN A 238 -11.086 4.656 -3.342 -0.48 0.02 O ATOM 1161 NE2 GLN A 238 -11.502 2.539 -2.718 -0.52 0.02 N ATOM 0 H GLN A 238 -14.885 5.823 1.588 -0.36 0.02 H new ATOM 0 HA GLN A 238 -14.153 3.716 1.197 1.00 0.02 H new ATOM 0 HB2 GLN A 238 -13.380 2.998 -0.778 -0.20 0.02 H new ATOM 0 HB3 GLN A 238 -13.790 4.604 -1.345 -0.20 0.02 H new ATOM 0 HG2 GLN A 238 -11.457 5.345 -0.956 -0.20 0.02 H new ATOM 0 HG3 GLN A 238 -11.043 3.747 -0.368 -0.20 0.02 H new ATOM 0 HE21 GLN A 238 -11.766 1.899 -1.969 -0.52 0.02 H new ATOM 0 HE22 GLN A 238 -11.316 2.180 -3.654 -0.52 0.02 H new ATOM 1170 N LYS A 239 -11.499 5.645 1.556 -0.36 0.02 N ATOM 1171 CA LYS A 239 -10.280 5.821 2.340 1.00 0.02 C ATOM 1172 C LYS A 239 -10.602 6.475 3.679 0.48 0.02 C ATOM 1173 O LYS A 239 -10.012 6.141 4.706 -0.48 0.02 O ATOM 1174 CB LYS A 239 -9.257 6.675 1.580 -0.20 0.02 C ATOM 1175 CG LYS A 239 -9.355 6.567 0.065 -0.20 0.02 C ATOM 1176 CD LYS A 239 -8.446 7.573 -0.627 -0.20 0.02 C ATOM 1177 CE LYS A 239 -7.307 6.887 -1.364 0.30 5.02 C ATOM 1178 NZ LYS A 239 -7.803 5.864 -2.325 -0.81 0.02 N ATOM 0 H LYS A 239 -11.726 6.430 0.945 -0.36 0.02 H new ATOM 0 HA LYS A 239 -9.848 4.836 2.516 1.00 0.02 H new ATOM 0 HB2 LYS A 239 -9.387 7.718 1.868 -0.20 0.02 H new ATOM 0 HB3 LYS A 239 -8.254 6.381 1.890 -0.20 0.02 H new ATOM 0 HG2 LYS A 239 -9.086 5.558 -0.247 -0.20 0.02 H new ATOM 0 HG3 LYS A 239 -10.386 6.733 -0.246 -0.20 0.02 H new ATOM 0 HD2 LYS A 239 -9.029 8.167 -1.331 -0.20 0.02 H new ATOM 0 HD3 LYS A 239 -8.038 8.263 0.111 -0.20 0.02 H new ATOM 0 HE2 LYS A 239 -6.720 7.633 -1.899 0.30 5.02 H new ATOM 0 HE3 LYS A 239 -6.641 6.414 -0.643 0.30 5.02 H new ATOM 0 HZ1 LYS A 239 -7.168 5.824 -3.148 -0.81 0.02 H new ATOM 0 HZ2 LYS A 239 -7.826 4.934 -1.861 -0.81 0.02 H new ATOM 0 HZ3 LYS A 239 -8.761 6.118 -2.639 -0.81 0.02 H new ATOM 1192 N SER A 240 -11.550 7.406 3.659 -0.36 0.02 N ATOM 1193 CA SER A 240 -11.962 8.104 4.870 1.00 0.02 C ATOM 1194 C SER A 240 -13.167 7.413 5.493 0.48 0.02 C ATOM 1195 O SER A 240 -13.776 6.536 4.882 -0.48 0.02 O ATOM 1196 CB SER A 240 -12.298 9.564 4.562 0.08 0.02 C ATOM 1197 OG SER A 240 -11.665 9.993 3.368 -0.68 0.02 O ATOM 0 H SER A 240 -12.047 7.694 2.816 -0.36 0.02 H new ATOM 0 HA SER A 240 -11.134 8.079 5.578 1.00 0.02 H new ATOM 0 HB2 SER A 240 -13.378 9.679 4.467 0.08 0.02 H new ATOM 0 HB3 SER A 240 -11.982 10.196 5.392 0.08 0.02 H new ATOM 0 HG SER A 240 -11.897 10.929 3.193 -0.68 0.02 H new ATOM 1203 N CYS A 241 -13.489 7.793 6.720 -0.36 0.02 N ATOM 1204 CA CYS A 241 -14.603 7.185 7.434 1.00 0.02 C ATOM 1205 C CYS A 241 -15.615 8.218 7.919 0.48 0.02 C ATOM 1206 O CYS A 241 -15.271 9.369 8.189 -0.48 0.02 O ATOM 1207 CB CYS A 241 -14.074 6.404 8.621 0.20 0.02 C ATOM 1208 SG CYS A 241 -12.846 7.310 9.612 -0.20 0.02 S ATOM 0 H CYS A 241 -12.996 8.518 7.242 -0.36 0.02 H new ATOM 0 HA CYS A 241 -15.117 6.523 6.737 1.00 0.02 H new ATOM 0 HB2 CYS A 241 -14.910 6.126 9.262 0.20 0.02 H new ATOM 0 HB3 CYS A 241 -13.625 5.477 8.263 0.20 0.02 H new ATOM 1213 N GLU A 242 -16.867 7.782 8.038 -0.36 0.02 N ATOM 1214 CA GLU A 242 -17.947 8.642 8.505 1.00 0.02 C ATOM 1215 C GLU A 242 -18.918 7.855 9.385 0.48 0.02 C ATOM 1216 O GLU A 242 -19.175 6.676 9.141 -0.48 0.02 O ATOM 1217 CB GLU A 242 -18.692 9.254 7.317 -0.20 0.02 C ATOM 1218 CG GLU A 242 -19.765 10.253 7.719 -0.45 0.02 C ATOM 1219 CD GLU A 242 -19.278 11.688 7.655 0.49 0.02 C ATOM 1220 OE1 GLU A 242 -18.442 11.992 6.779 -0.62 0.02 O ATOM 1221 OE2 GLU A 242 -19.733 12.506 8.481 -0.62 0.02 O ATOM 0 H GLU A 242 -17.158 6.830 7.815 -0.36 0.02 H new ATOM 0 HA GLU A 242 -17.512 9.446 9.099 1.00 0.02 H new ATOM 0 HB2 GLU A 242 -17.973 9.749 6.664 -0.20 0.02 H new ATOM 0 HB3 GLU A 242 -19.152 8.454 6.736 -0.20 0.02 H new ATOM 0 HG2 GLU A 242 -20.629 10.137 7.064 -0.45 0.02 H new ATOM 0 HG3 GLU A 242 -20.101 10.032 8.732 -0.45 0.02 H new ATOM 1228 N VAL A 243 -19.457 8.514 10.406 -0.36 0.02 N ATOM 1229 CA VAL A 243 -20.403 7.877 11.317 1.00 0.02 C ATOM 1230 C VAL A 243 -21.833 8.024 10.802 0.48 0.02 C ATOM 1231 O VAL A 243 -22.121 8.902 9.988 -0.48 0.02 O ATOM 1232 CB VAL A 243 -20.303 8.480 12.734 -0.10 0.02 C ATOM 1233 CG1 VAL A 243 -20.498 9.987 12.689 -0.30 0.02 C ATOM 1234 CG2 VAL A 243 -21.310 7.832 13.673 -0.30 0.02 C ATOM 0 H VAL A 243 -19.255 9.490 10.624 -0.36 0.02 H new ATOM 0 HA VAL A 243 -20.147 6.819 11.366 1.00 0.02 H new ATOM 0 HB VAL A 243 -19.304 8.276 13.120 -0.10 0.02 H new ATOM 0 HG11 VAL A 243 -20.424 10.394 13.698 -0.30 0.02 H new ATOM 0 HG12 VAL A 243 -19.729 10.435 12.060 -0.30 0.02 H new ATOM 0 HG13 VAL A 243 -21.481 10.215 12.277 -0.30 0.02 H new ATOM 0 HG21 VAL A 243 -21.219 8.274 14.665 -0.30 0.02 H new ATOM 0 HG22 VAL A 243 -22.319 7.995 13.294 -0.30 0.02 H new ATOM 0 HG23 VAL A 243 -21.114 6.761 13.734 -0.30 0.02 H new ATOM 1244 N VAL A 244 -22.725 7.163 11.281 -0.36 0.02 N ATOM 1245 CA VAL A 244 -24.120 7.201 10.869 1.00 0.02 C ATOM 1246 C VAL A 244 -25.036 6.789 12.012 0.48 0.02 C ATOM 1247 O VAL A 244 -24.785 5.803 12.704 -0.48 0.02 O ATOM 1248 CB VAL A 244 -24.379 6.286 9.656 -0.10 0.02 C ATOM 1249 CG1 VAL A 244 -23.993 4.850 9.975 -0.30 0.02 C ATOM 1250 CG2 VAL A 244 -25.836 6.369 9.219 -0.30 0.02 C ATOM 0 H VAL A 244 -22.504 6.430 11.956 -0.36 0.02 H new ATOM 0 HA VAL A 244 -24.338 8.230 10.583 1.00 0.02 H new ATOM 0 HB VAL A 244 -23.757 6.631 8.830 -0.10 0.02 H new ATOM 0 HG11 VAL A 244 -24.184 4.220 9.106 -0.30 0.02 H new ATOM 0 HG12 VAL A 244 -22.934 4.806 10.230 -0.30 0.02 H new ATOM 0 HG13 VAL A 244 -24.584 4.493 10.818 -0.30 0.02 H new ATOM 0 HG21 VAL A 244 -25.996 5.715 8.362 -0.30 0.02 H new ATOM 0 HG22 VAL A 244 -26.481 6.055 10.040 -0.30 0.02 H new ATOM 0 HG23 VAL A 244 -26.075 7.396 8.942 -0.30 0.02 H new ATOM 1260 N SER A 245 -26.099 7.556 12.200 -0.36 0.02 N ATOM 1261 CA SER A 245 -27.065 7.285 13.258 1.00 0.02 C ATOM 1262 C SER A 245 -28.143 6.319 12.776 0.14 0.02 C ATOM 1263 O SER A 245 -29.247 6.328 13.358 -0.57 0.02 O ATOM 1264 CB SER A 245 -27.708 8.589 13.735 0.08 0.02 C ATOM 1265 OG SER A 245 -26.968 9.163 14.799 -0.68 0.02 O ATOM 1266 OXT SER A 245 -27.873 5.563 11.820 -0.57 0.02 O ATOM 0 H SER A 245 -26.317 8.375 11.632 -0.36 0.02 H new ATOM 0 HA SER A 245 -26.535 6.823 14.091 1.00 0.02 H new ATOM 0 HB2 SER A 245 -27.766 9.294 12.906 0.08 0.02 H new ATOM 0 HB3 SER A 245 -28.730 8.396 14.061 0.08 0.02 H new ATOM 0 HG SER A 245 -27.398 9.996 15.085 -0.68 0.02 H new TER 1272 SER A 245 HETATM 1273 CA CA A 246 14.049 6.309 -9.006 2.00 0.02 CA HETATM 1274 CA CA A 247 -2.909 -5.448 -0.741 2.00 0.02 CA HETATM 1275 O HOH A 248 15.063 8.032 -7.602 -0.83 4.02 O HETATM 1278 O HOH A 249 -4.971 -4.155 -0.863 -0.83 4.02 O