USER MOD reduce.3.24.130724 H: found=0, std=0, add=608, rem=0, adj=20 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 223 THR OG1 : rot 18:sc= -0.0197 USER MOD Set 1.2: A 238 GLN : amide:sc= -2.14 K(o=-2.2,f=-4.8!) USER MOD Set 2.1: A 169 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 194 ASN :FLIP amide:sc= 0.39 F(o=-1.6,f=0.89) USER MOD Set 2.3: A 196 LYS NZ :NH3+ -130:sc= 0.503 (180deg=0) USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 SER OG : rot 180:sc= 0 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 THR OG1 : rot 180:sc= 0 USER MOD Single : A 177 LYS NZ :NH3+ -145:sc= -0.022 (180deg=-0.353) USER MOD Single : A 191 TYR OH : rot 180:sc= -0.773 USER MOD Single : A 193 TYR OH : rot 110:sc= -4.73! USER MOD Single : A 197 SER OG : rot 180:sc= 0 USER MOD Single : A 198 LYS NZ :NH3+ -150:sc= -1.53 (180deg=-3.34!) USER MOD Single : A 199 SER OG : rot 180:sc=-0.00111 USER MOD Single : A 207 SER OG : rot 170:sc= -1.13 USER MOD Single : A 209 ASN : amide:sc= -0.878 X(o=-0.88,f=-0.68) USER MOD Single : A 210 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 213 GLN : amide:sc= -4.46 K(o=-4.5,f=-8.5!) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 222 TYR OH : rot 180:sc= 0 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+ 172:sc= 0 (180deg=-0.0317) 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 239 LYS NZ :NH3+ 150:sc= -0.159 (180deg=-0.782) USER MOD Single : A 240 SER OG : rot 117:sc= 0.837 USER MOD Single : A 245 SER OG : rot 180:sc= 0.0173 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 159 18.188 5.079 -13.275 -0.10 0.02 N ATOM 2 CA LYS A 159 16.776 5.332 -12.887 0.22 0.02 C ATOM 3 C LYS A 159 16.696 6.257 -11.675 0.48 0.02 C ATOM 4 O LYS A 159 16.545 5.801 -10.541 -0.48 0.02 O ATOM 5 CB LYS A 159 16.108 3.989 -12.580 -0.20 0.02 C ATOM 6 CG LYS A 159 14.823 3.758 -13.358 -0.20 0.02 C ATOM 7 CD LYS A 159 14.613 2.284 -13.663 -0.20 0.02 C ATOM 8 CE LYS A 159 13.136 1.930 -13.717 0.30 5.02 C ATOM 9 NZ LYS A 159 12.892 0.505 -13.361 -0.81 0.02 N ATOM 0 HA LYS A 159 16.259 5.827 -13.709 0.22 0.02 H new ATOM 0 HB2 LYS A 159 16.808 3.184 -12.804 -0.20 0.02 H new ATOM 0 HB3 LYS A 159 15.892 3.935 -11.513 -0.20 0.02 H new ATOM 0 HG2 LYS A 159 13.977 4.136 -12.785 -0.20 0.02 H new ATOM 0 HG3 LYS A 159 14.854 4.322 -14.290 -0.20 0.02 H new ATOM 0 HD2 LYS A 159 15.082 2.038 -14.616 -0.20 0.02 H new ATOM 0 HD3 LYS A 159 15.105 1.680 -12.901 -0.20 0.02 H new ATOM 0 HE2 LYS A 159 12.583 2.574 -13.033 0.30 5.02 H new ATOM 0 HE3 LYS A 159 12.753 2.124 -14.719 0.30 5.02 H new ATOM 0 HZ1 LYS A 159 11.873 0.305 -13.410 -0.81 0.02 H new ATOM 0 HZ2 LYS A 159 13.398 -0.111 -14.028 -0.81 0.02 H new ATOM 0 HZ3 LYS A 159 13.234 0.325 -12.396 -0.81 0.02 H new ATOM 25 N ASP A 160 16.800 7.561 -11.926 -0.36 0.02 N ATOM 26 CA ASP A 160 16.744 8.569 -10.866 1.00 0.01 C ATOM 27 C ASP A 160 17.552 8.133 -9.634 0.48 0.02 C ATOM 28 O ASP A 160 18.783 8.152 -9.662 -0.48 0.02 O ATOM 29 CB ASP A 160 15.287 8.881 -10.492 -0.45 0.01 C ATOM 30 CG ASP A 160 14.401 7.649 -10.477 0.49 0.01 C ATOM 31 OD1 ASP A 160 14.097 7.121 -11.567 -0.62 0.01 O ATOM 32 OD2 ASP A 160 14.011 7.211 -9.373 -0.62 0.01 O ATOM 0 H ASP A 160 16.925 7.947 -12.862 -0.36 0.02 H new ATOM 0 HA ASP A 160 17.200 9.482 -11.247 1.00 0.01 H new ATOM 0 HB2 ASP A 160 15.263 9.351 -9.509 -0.45 0.01 H new ATOM 0 HB3 ASP A 160 14.883 9.604 -11.201 -0.45 0.01 H new ATOM 37 N VAL A 161 16.867 7.739 -8.558 -0.36 0.01 N ATOM 38 CA VAL A 161 17.541 7.305 -7.339 1.00 0.01 C ATOM 39 C VAL A 161 16.641 6.390 -6.515 0.48 0.01 C ATOM 40 O VAL A 161 15.439 6.634 -6.393 -0.48 0.01 O ATOM 41 CB VAL A 161 17.963 8.504 -6.465 -0.10 0.01 C ATOM 42 CG1 VAL A 161 18.794 8.037 -5.279 -0.30 0.02 C ATOM 43 CG2 VAL A 161 18.729 9.529 -7.289 -0.30 0.02 C ATOM 0 H VAL A 161 15.849 7.713 -8.509 -0.36 0.01 H new ATOM 0 HA VAL A 161 18.433 6.761 -7.650 1.00 0.01 H new ATOM 0 HB VAL A 161 17.061 8.982 -6.083 -0.10 0.01 H new ATOM 0 HG11 VAL A 161 19.082 8.898 -4.675 -0.30 0.02 H new ATOM 0 HG12 VAL A 161 18.207 7.348 -4.672 -0.30 0.02 H new ATOM 0 HG13 VAL A 161 19.690 7.531 -5.639 -0.30 0.02 H new ATOM 0 HG21 VAL A 161 19.017 10.366 -6.653 -0.30 0.02 H new ATOM 0 HG22 VAL A 161 19.623 9.066 -7.706 -0.30 0.02 H new ATOM 0 HG23 VAL A 161 18.096 9.890 -8.100 -0.30 0.02 H new ATOM 53 N ASP A 162 17.233 5.336 -5.951 -0.36 0.01 N ATOM 54 CA ASP A 162 16.491 4.379 -5.132 1.00 0.01 C ATOM 55 C ASP A 162 15.187 3.969 -5.809 0.48 0.01 C ATOM 56 O ASP A 162 14.187 4.681 -5.731 -0.48 0.02 O ATOM 57 CB ASP A 162 16.196 4.978 -3.755 -0.45 0.01 C ATOM 58 CG ASP A 162 17.401 4.937 -2.836 0.49 0.02 C ATOM 59 OD1 ASP A 162 17.688 3.856 -2.280 -0.62 0.02 O ATOM 60 OD2 ASP A 162 18.057 5.987 -2.670 -0.62 0.02 O ATOM 0 H ASP A 162 18.226 5.124 -6.047 -0.36 0.01 H new ATOM 0 HA ASP A 162 17.109 3.489 -5.013 1.00 0.01 H new ATOM 0 HB2 ASP A 162 15.868 6.011 -3.874 -0.45 0.01 H new ATOM 0 HB3 ASP A 162 15.372 4.433 -3.294 -0.45 0.01 H new ATOM 65 N GLU A 163 15.198 2.817 -6.473 -0.36 0.02 N ATOM 66 CA GLU A 163 14.009 2.332 -7.155 1.00 0.02 C ATOM 67 C GLU A 163 13.346 1.223 -6.353 0.48 0.02 C ATOM 68 O GLU A 163 12.193 1.345 -5.939 -0.48 0.02 O ATOM 69 CB GLU A 163 14.363 1.838 -8.557 -0.20 0.01 C ATOM 70 CG GLU A 163 15.100 2.871 -9.395 -0.45 0.01 C ATOM 71 CD GLU A 163 14.380 4.207 -9.449 0.49 0.01 C ATOM 72 OE1 GLU A 163 14.224 4.845 -8.384 -0.62 0.01 O ATOM 73 OE2 GLU A 163 13.973 4.617 -10.556 -0.62 0.01 O ATOM 0 H GLU A 163 16.012 2.208 -6.552 -0.36 0.02 H new ATOM 0 HA GLU A 163 13.304 3.158 -7.246 1.00 0.02 H new ATOM 0 HB2 GLU A 163 14.979 0.943 -8.474 -0.20 0.01 H new ATOM 0 HB3 GLU A 163 13.448 1.548 -9.074 -0.20 0.01 H new ATOM 0 HG2 GLU A 163 16.099 3.018 -8.986 -0.45 0.01 H new ATOM 0 HG3 GLU A 163 15.224 2.489 -10.408 -0.45 0.01 H new ATOM 80 N CYS A 164 14.083 0.145 -6.125 -0.36 0.02 N ATOM 81 CA CYS A 164 13.566 -0.979 -5.358 1.00 0.02 C ATOM 82 C CYS A 164 14.318 -1.131 -4.039 0.48 0.02 C ATOM 83 O CYS A 164 13.886 -1.863 -3.148 -0.48 0.02 O ATOM 84 CB CYS A 164 13.646 -2.264 -6.177 0.20 0.02 C ATOM 85 SG CYS A 164 12.029 -2.834 -6.790 -0.20 0.02 S ATOM 0 H CYS A 164 15.039 0.025 -6.460 -0.36 0.02 H new ATOM 0 HA CYS A 164 12.519 -0.782 -5.126 1.00 0.02 H new ATOM 0 HB2 CYS A 164 14.312 -2.104 -7.025 0.20 0.02 H new ATOM 0 HB3 CYS A 164 14.091 -3.049 -5.565 0.20 0.02 H new ATOM 90 N SER A 165 15.435 -0.419 -3.910 -0.36 0.02 N ATOM 91 CA SER A 165 16.229 -0.460 -2.690 1.00 0.02 C ATOM 92 C SER A 165 15.816 0.672 -1.749 0.48 0.02 C ATOM 93 O SER A 165 16.375 0.824 -0.662 -0.48 0.02 O ATOM 94 CB SER A 165 17.719 -0.350 -3.019 0.08 0.02 C ATOM 95 OG SER A 165 18.092 -1.287 -4.015 -0.68 0.02 O ATOM 0 H SER A 165 15.809 0.192 -4.636 -0.36 0.02 H new ATOM 0 HA SER A 165 16.049 -1.414 -2.194 1.00 0.02 H new ATOM 0 HB2 SER A 165 17.945 0.660 -3.362 0.08 0.02 H new ATOM 0 HB3 SER A 165 18.307 -0.520 -2.117 0.08 0.02 H new ATOM 0 HG SER A 165 19.048 -1.195 -4.209 -0.68 0.02 H new ATOM 101 N LEU A 166 14.830 1.462 -2.175 -0.36 0.02 N ATOM 102 CA LEU A 166 14.336 2.576 -1.377 1.00 0.02 C ATOM 103 C LEU A 166 13.806 2.081 -0.034 0.48 0.02 C ATOM 104 O LEU A 166 13.877 2.786 0.974 -0.48 0.02 O ATOM 105 CB LEU A 166 13.233 3.315 -2.140 -0.20 0.02 C ATOM 106 CG LEU A 166 13.281 4.843 -2.044 -0.10 0.02 C ATOM 107 CD1 LEU A 166 12.996 5.475 -3.401 -0.30 0.02 C ATOM 108 CD2 LEU A 166 12.291 5.345 -1.001 -0.30 0.02 C ATOM 0 H LEU A 166 14.358 1.347 -3.072 -0.36 0.02 H new ATOM 0 HA LEU A 166 15.161 3.263 -1.189 1.00 0.02 H new ATOM 0 HB2 LEU A 166 13.289 3.032 -3.191 -0.20 0.02 H new ATOM 0 HB3 LEU A 166 12.266 2.974 -1.769 -0.20 0.02 H new ATOM 0 HG LEU A 166 14.284 5.136 -1.734 -0.10 0.02 H new ATOM 0 HD11 LEU A 166 13.035 6.561 -3.312 -0.30 0.02 H new ATOM 0 HD12 LEU A 166 13.744 5.143 -4.121 -0.30 0.02 H new ATOM 0 HD13 LEU A 166 12.005 5.174 -3.742 -0.30 0.02 H new ATOM 0 HD21 LEU A 166 12.340 6.433 -0.947 -0.30 0.02 H new ATOM 0 HD22 LEU A 166 11.282 5.040 -1.280 -0.30 0.02 H new ATOM 0 HD23 LEU A 166 12.542 4.922 -0.028 -0.30 0.02 H new ATOM 120 N LYS A 167 13.280 0.861 -0.031 -0.36 0.02 N ATOM 121 CA LYS A 167 12.739 0.255 1.180 1.00 0.02 C ATOM 122 C LYS A 167 13.208 -1.195 1.302 0.48 0.02 C ATOM 123 O LYS A 167 13.534 -1.834 0.302 -0.48 0.02 O ATOM 124 CB LYS A 167 11.209 0.325 1.164 -0.20 0.02 C ATOM 125 CG LYS A 167 10.606 0.917 2.428 -0.20 0.02 C ATOM 126 CD LYS A 167 9.256 0.294 2.751 -0.20 0.02 C ATOM 127 CE LYS A 167 9.362 -1.211 2.954 0.30 5.02 C ATOM 128 NZ LYS A 167 9.032 -1.607 4.351 -0.81 0.02 N ATOM 0 H LYS A 167 13.217 0.269 -0.859 -0.36 0.02 H new ATOM 0 HA LYS A 167 13.104 0.809 2.045 1.00 0.02 H new ATOM 0 HB2 LYS A 167 10.891 0.921 0.308 -0.20 0.02 H new ATOM 0 HB3 LYS A 167 10.811 -0.679 1.019 -0.20 0.02 H new ATOM 0 HG2 LYS A 167 11.288 0.762 3.264 -0.20 0.02 H new ATOM 0 HG3 LYS A 167 10.490 1.994 2.306 -0.20 0.02 H new ATOM 0 HD2 LYS A 167 8.849 0.754 3.651 -0.20 0.02 H new ATOM 0 HD3 LYS A 167 8.556 0.503 1.942 -0.20 0.02 H new ATOM 0 HE2 LYS A 167 8.688 -1.719 2.264 0.30 5.02 H new ATOM 0 HE3 LYS A 167 10.373 -1.540 2.713 0.30 5.02 H new ATOM 0 HZ1 LYS A 167 9.116 -2.639 4.448 -0.81 0.02 H new ATOM 0 HZ2 LYS A 167 9.691 -1.143 5.008 -0.81 0.02 H new ATOM 0 HZ3 LYS A 167 8.059 -1.316 4.573 -0.81 0.02 H new ATOM 142 N PRO A 168 13.263 -1.733 2.534 -0.36 0.02 N ATOM 143 CA PRO A 168 13.712 -3.109 2.779 1.00 0.02 C ATOM 144 C PRO A 168 12.993 -4.144 1.916 0.48 0.02 C ATOM 145 O PRO A 168 13.503 -5.246 1.709 -0.48 0.02 O ATOM 146 CB PRO A 168 13.387 -3.328 4.257 -0.20 0.02 C ATOM 147 CG PRO A 168 13.425 -1.965 4.853 -0.20 0.02 C ATOM 148 CD PRO A 168 12.908 -1.040 3.787 0.06 0.02 C ATOM 0 HA PRO A 168 14.766 -3.233 2.529 1.00 0.02 H new ATOM 0 HB2 PRO A 168 12.408 -3.789 4.384 -0.20 0.02 H new ATOM 0 HB3 PRO A 168 14.114 -3.988 4.730 -0.20 0.02 H new ATOM 0 HG2 PRO A 168 12.808 -1.913 5.750 -0.20 0.02 H new ATOM 0 HG3 PRO A 168 14.439 -1.695 5.148 -0.20 0.02 H new ATOM 0 HD2 PRO A 168 11.832 -0.890 3.872 0.06 0.02 H new ATOM 0 HD3 PRO A 168 13.373 -0.056 3.848 0.06 0.02 H new ATOM 156 N SER A 169 11.809 -3.799 1.417 -0.36 0.02 N ATOM 157 CA SER A 169 11.044 -4.725 0.587 1.00 0.02 C ATOM 158 C SER A 169 10.150 -3.988 -0.407 0.48 0.02 C ATOM 159 O SER A 169 8.994 -3.689 -0.112 -0.48 0.02 O ATOM 160 CB SER A 169 10.193 -5.642 1.467 0.08 0.02 C ATOM 161 OG SER A 169 9.224 -6.333 0.698 -0.68 0.02 O ATOM 0 H SER A 169 11.362 -2.895 1.571 -0.36 0.02 H new ATOM 0 HA SER A 169 11.757 -5.322 0.019 1.00 0.02 H new ATOM 0 HB2 SER A 169 10.835 -6.359 1.978 0.08 0.02 H new ATOM 0 HB3 SER A 169 9.697 -5.053 2.238 0.08 0.02 H new ATOM 0 HG SER A 169 8.694 -6.913 1.284 -0.68 0.02 H new ATOM 167 N ILE A 170 10.690 -3.710 -1.591 -0.36 0.02 N ATOM 168 CA ILE A 170 9.935 -3.021 -2.633 1.00 0.02 C ATOM 169 C ILE A 170 9.414 -3.994 -3.669 0.48 0.02 C ATOM 170 O ILE A 170 8.220 -4.290 -3.726 -0.48 0.02 O ATOM 171 CB ILE A 170 10.789 -1.982 -3.378 -0.10 0.02 C ATOM 172 CG1 ILE A 170 11.415 -1.001 -2.395 -0.20 0.02 C ATOM 173 CG2 ILE A 170 9.954 -1.244 -4.406 -0.30 0.02 C ATOM 174 CD1 ILE A 170 10.407 -0.029 -1.829 -0.30 0.02 C ATOM 0 H ILE A 170 11.646 -3.951 -1.852 -0.36 0.02 H new ATOM 0 HA ILE A 170 9.112 -2.525 -2.119 1.00 0.02 H new ATOM 0 HB ILE A 170 11.590 -2.506 -3.899 -0.10 0.02 H new ATOM 0 HG12 ILE A 170 11.879 -1.555 -1.579 -0.20 0.02 H new ATOM 0 HG13 ILE A 170 12.209 -0.446 -2.895 -0.20 0.02 H new ATOM 0 HG21 ILE A 170 10.576 -0.513 -4.923 -0.30 0.02 H new ATOM 0 HG22 ILE A 170 9.554 -1.955 -5.128 -0.30 0.02 H new ATOM 0 HG23 ILE A 170 9.131 -0.732 -3.907 -0.30 0.02 H new ATOM 0 HD11 ILE A 170 10.905 0.648 -1.134 -0.30 0.02 H new ATOM 0 HD12 ILE A 170 9.961 0.547 -2.640 -0.30 0.02 H new ATOM 0 HD13 ILE A 170 9.627 -0.579 -1.303 -0.30 0.02 H new ATOM 186 N CYS A 171 10.325 -4.457 -4.515 -0.36 0.02 N ATOM 187 CA CYS A 171 9.969 -5.358 -5.581 1.00 0.02 C ATOM 188 C CYS A 171 11.174 -6.171 -6.043 0.48 0.02 C ATOM 189 O CYS A 171 11.265 -6.545 -7.212 -0.48 0.02 O ATOM 190 CB CYS A 171 9.397 -4.541 -6.740 0.20 0.02 C ATOM 191 SG CYS A 171 7.893 -5.234 -7.500 -0.20 0.02 S ATOM 0 H CYS A 171 11.316 -4.217 -4.476 -0.36 0.02 H new ATOM 0 HA CYS A 171 9.222 -6.064 -5.219 1.00 0.02 H new ATOM 0 HB2 CYS A 171 9.175 -3.536 -6.382 0.20 0.02 H new ATOM 0 HB3 CYS A 171 10.163 -4.443 -7.509 0.20 0.02 H new ATOM 196 N GLY A 172 12.100 -6.439 -5.121 -0.36 0.02 N ATOM 197 CA GLY A 172 13.291 -7.202 -5.464 -0.10 0.02 C ATOM 198 C GLY A 172 13.897 -6.736 -6.772 0.48 0.02 C ATOM 199 O GLY A 172 14.325 -7.546 -7.594 -0.48 0.02 O ATOM 0 H GLY A 172 12.047 -6.142 -4.147 -0.36 0.02 H new ATOM 0 HA2 GLY A 172 14.028 -7.105 -4.667 -0.10 0.02 H new ATOM 0 HA3 GLY A 172 13.037 -8.260 -5.537 -0.10 0.02 H new ATOM 203 N THR A 173 13.915 -5.417 -6.955 -0.36 0.02 N ATOM 204 CA THR A 173 14.445 -4.792 -8.156 1.00 0.02 C ATOM 205 C THR A 173 14.151 -5.636 -9.397 0.48 0.02 C ATOM 206 O THR A 173 15.021 -5.855 -10.240 -0.48 0.02 O ATOM 207 CB THR A 173 15.941 -4.549 -7.992 0.18 0.02 C ATOM 208 OG1 THR A 173 16.291 -4.505 -6.619 -0.68 0.02 O ATOM 209 CG2 THR A 173 16.417 -3.257 -8.628 -0.30 0.02 C ATOM 0 H THR A 173 13.559 -4.752 -6.268 -0.36 0.02 H new ATOM 0 HA THR A 173 13.949 -3.832 -8.299 1.00 0.02 H new ATOM 0 HB THR A 173 16.425 -5.382 -8.501 0.18 0.02 H new ATOM 0 HG1 THR A 173 17.255 -4.350 -6.532 -0.68 0.02 H new ATOM 0 HG21 THR A 173 17.490 -3.149 -8.473 -0.30 0.02 H new ATOM 0 HG22 THR A 173 16.205 -3.278 -9.697 -0.30 0.02 H new ATOM 0 HG23 THR A 173 15.898 -2.414 -8.172 -0.30 0.02 H new ATOM 217 N ALA A 174 12.903 -6.100 -9.494 -0.36 0.02 N ATOM 218 CA ALA A 174 12.462 -6.917 -10.620 1.00 0.02 C ATOM 219 C ALA A 174 12.166 -6.039 -11.828 0.48 0.02 C ATOM 220 O ALA A 174 12.903 -6.039 -12.813 -0.48 0.02 O ATOM 221 CB ALA A 174 11.217 -7.714 -10.231 -0.30 0.02 C ATOM 0 H ALA A 174 12.178 -5.921 -8.800 -0.36 0.02 H new ATOM 0 HA ALA A 174 13.260 -7.612 -10.883 1.00 0.02 H new ATOM 0 HB1 ALA A 174 10.895 -8.321 -11.077 -0.30 0.02 H new ATOM 0 HB2 ALA A 174 11.449 -8.363 -9.387 -0.30 0.02 H new ATOM 0 HB3 ALA A 174 10.418 -7.027 -9.952 -0.30 0.02 H new ATOM 227 N VAL A 175 11.087 -5.284 -11.725 -0.36 0.02 N ATOM 228 CA VAL A 175 10.666 -4.374 -12.781 1.00 0.02 C ATOM 229 C VAL A 175 9.856 -3.235 -12.181 0.48 0.02 C ATOM 230 O VAL A 175 8.921 -2.724 -12.797 -0.48 0.02 O ATOM 231 CB VAL A 175 9.820 -5.096 -13.847 -0.10 0.02 C ATOM 232 CG1 VAL A 175 9.531 -4.173 -15.020 -0.30 0.02 C ATOM 233 CG2 VAL A 175 10.519 -6.363 -14.315 -0.30 0.02 C ATOM 0 H VAL A 175 10.476 -5.283 -10.908 -0.36 0.02 H new ATOM 0 HA VAL A 175 11.562 -3.984 -13.264 1.00 0.02 H new ATOM 0 HB VAL A 175 8.868 -5.378 -13.397 -0.10 0.02 H new ATOM 0 HG11 VAL A 175 8.932 -4.703 -15.761 -0.30 0.02 H new ATOM 0 HG12 VAL A 175 8.983 -3.299 -14.669 -0.30 0.02 H new ATOM 0 HG13 VAL A 175 10.470 -3.855 -15.472 -0.30 0.02 H new ATOM 0 HG21 VAL A 175 9.907 -6.860 -15.068 -0.30 0.02 H new ATOM 0 HG22 VAL A 175 11.487 -6.107 -14.746 -0.30 0.02 H new ATOM 0 HG23 VAL A 175 10.665 -7.032 -13.467 -0.30 0.02 H new ATOM 243 N CYS A 176 10.214 -2.863 -10.958 -0.36 0.02 N ATOM 244 CA CYS A 176 9.530 -1.815 -10.237 1.00 0.02 C ATOM 245 C CYS A 176 9.818 -0.436 -10.812 0.48 0.02 C ATOM 246 O CYS A 176 10.829 0.184 -10.483 -0.48 0.02 O ATOM 247 CB CYS A 176 9.953 -1.853 -8.774 0.20 0.02 C ATOM 248 SG CYS A 176 11.756 -1.793 -8.512 -0.20 0.02 S ATOM 0 H CYS A 176 10.988 -3.284 -10.444 -0.36 0.02 H new ATOM 0 HA CYS A 176 8.459 -1.992 -10.332 1.00 0.02 H new ATOM 0 HB2 CYS A 176 9.494 -1.013 -8.253 0.20 0.02 H new ATOM 0 HB3 CYS A 176 9.562 -2.763 -8.318 0.20 0.02 H new ATOM 253 N LYS A 177 8.908 0.059 -11.641 -0.36 0.02 N ATOM 254 CA LYS A 177 9.060 1.385 -12.215 1.00 0.02 C ATOM 255 C LYS A 177 8.938 2.415 -11.101 0.48 0.02 C ATOM 256 O LYS A 177 7.861 2.963 -10.861 -0.48 0.02 O ATOM 257 CB LYS A 177 8.000 1.636 -13.290 -0.20 0.02 C ATOM 258 CG LYS A 177 8.490 2.506 -14.436 -0.20 0.02 C ATOM 259 CD LYS A 177 8.944 3.872 -13.945 -0.20 0.02 C ATOM 260 CE LYS A 177 9.662 4.646 -15.039 0.30 5.02 C ATOM 261 NZ LYS A 177 11.142 4.506 -14.940 -0.81 0.02 N ATOM 0 H LYS A 177 8.063 -0.435 -11.928 -0.36 0.02 H new ATOM 0 HA LYS A 177 10.039 1.465 -12.688 1.00 0.02 H new ATOM 0 HB2 LYS A 177 7.665 0.678 -13.689 -0.20 0.02 H new ATOM 0 HB3 LYS A 177 7.133 2.110 -12.830 -0.20 0.02 H new ATOM 0 HG2 LYS A 177 9.316 2.008 -14.945 -0.20 0.02 H new ATOM 0 HG3 LYS A 177 7.692 2.628 -15.168 -0.20 0.02 H new ATOM 0 HD2 LYS A 177 8.081 4.442 -13.601 -0.20 0.02 H new ATOM 0 HD3 LYS A 177 9.607 3.750 -13.089 -0.20 0.02 H new ATOM 0 HE2 LYS A 177 9.328 4.290 -16.014 0.30 5.02 H new ATOM 0 HE3 LYS A 177 9.392 5.700 -14.975 0.30 5.02 H new ATOM 0 HZ1 LYS A 177 11.595 5.397 -15.228 -0.81 0.02 H new ATOM 0 HZ2 LYS A 177 11.405 4.285 -13.958 -0.81 0.02 H new ATOM 0 HZ3 LYS A 177 11.461 3.738 -15.565 -0.81 0.02 H new ATOM 275 N ASN A 178 10.040 2.640 -10.395 -0.36 0.02 N ATOM 276 CA ASN A 178 10.053 3.571 -9.277 1.00 0.01 C ATOM 277 C ASN A 178 10.208 5.014 -9.733 0.48 0.02 C ATOM 278 O ASN A 178 10.627 5.290 -10.857 -0.48 0.02 O ATOM 279 CB ASN A 178 11.172 3.214 -8.302 -0.20 0.01 C ATOM 280 CG ASN A 178 11.009 3.905 -6.961 0.48 0.01 C ATOM 281 OD1 ASN A 178 11.399 5.060 -6.795 -0.48 0.01 O ATOM 282 ND2 ASN A 178 10.431 3.199 -5.997 -0.52 0.01 N ATOM 0 H ASN A 178 10.936 2.189 -10.579 -0.36 0.02 H new ATOM 0 HA ASN A 178 9.089 3.484 -8.776 1.00 0.01 H new ATOM 0 HB2 ASN A 178 11.190 2.134 -8.152 -0.20 0.01 H new ATOM 0 HB3 ASN A 178 12.132 3.491 -8.737 -0.20 0.01 H new ATOM 0 HD21 ASN A 178 10.295 3.612 -5.074 -0.52 0.01 H new ATOM 0 HD22 ASN A 178 10.123 2.244 -6.179 -0.52 0.01 H new ATOM 289 N ILE A 179 9.866 5.928 -8.834 -0.36 0.01 N ATOM 290 CA ILE A 179 9.955 7.354 -9.101 1.00 0.01 C ATOM 291 C ILE A 179 10.527 8.079 -7.883 0.48 0.01 C ATOM 292 O ILE A 179 10.697 7.473 -6.823 -0.48 0.01 O ATOM 293 CB ILE A 179 8.571 7.935 -9.461 -0.10 0.01 C ATOM 294 CG1 ILE A 179 7.498 7.414 -8.502 -0.20 0.02 C ATOM 295 CG2 ILE A 179 8.214 7.581 -10.897 -0.30 0.02 C ATOM 296 CD1 ILE A 179 6.103 7.893 -8.843 -0.30 5.62 C ATOM 0 H ILE A 179 9.520 5.700 -7.902 -0.36 0.01 H new ATOM 0 HA ILE A 179 10.620 7.502 -9.952 1.00 0.01 H new ATOM 0 HB ILE A 179 8.616 9.020 -9.365 -0.10 0.01 H new ATOM 0 HG12 ILE A 179 7.512 6.324 -8.510 -0.20 0.02 H new ATOM 0 HG13 ILE A 179 7.744 7.728 -7.488 -0.20 0.02 H new ATOM 0 HG21 ILE A 179 7.236 7.995 -11.141 -0.30 0.02 H new ATOM 0 HG22 ILE A 179 8.963 7.997 -11.571 -0.30 0.02 H new ATOM 0 HG23 ILE A 179 8.187 6.497 -11.009 -0.30 0.02 H new ATOM 0 HD11 ILE A 179 5.393 7.486 -8.123 -0.30 5.62 H new ATOM 0 HD12 ILE A 179 6.073 8.982 -8.807 -0.30 5.62 H new ATOM 0 HD13 ILE A 179 5.837 7.556 -9.845 -0.30 5.62 H new ATOM 308 N PRO A 180 10.851 9.381 -8.011 -0.36 0.01 N ATOM 309 CA PRO A 180 11.419 10.165 -6.910 1.00 0.01 C ATOM 310 C PRO A 180 10.775 9.874 -5.556 0.48 0.01 C ATOM 311 O PRO A 180 11.408 10.038 -4.514 -0.48 0.02 O ATOM 312 CB PRO A 180 11.144 11.600 -7.346 -0.20 0.01 C ATOM 313 CG PRO A 180 11.229 11.551 -8.833 -0.20 0.02 C ATOM 314 CD PRO A 180 10.712 10.193 -9.240 0.06 0.01 C ATOM 0 HA PRO A 180 12.472 9.935 -6.750 1.00 0.01 H new ATOM 0 HB2 PRO A 180 10.162 11.936 -7.014 -0.20 0.01 H new ATOM 0 HB3 PRO A 180 11.876 12.291 -6.927 -0.20 0.01 H new ATOM 0 HG2 PRO A 180 10.633 12.345 -9.283 -0.20 0.02 H new ATOM 0 HG3 PRO A 180 12.256 11.693 -9.169 -0.20 0.02 H new ATOM 0 HD2 PRO A 180 9.675 10.243 -9.572 0.06 0.01 H new ATOM 0 HD3 PRO A 180 11.291 9.775 -10.064 0.06 0.01 H new ATOM 322 N GLY A 181 9.519 9.442 -5.572 -0.36 0.02 N ATOM 323 CA GLY A 181 8.832 9.140 -4.328 -0.10 0.02 C ATOM 324 C GLY A 181 7.629 8.231 -4.509 0.48 0.02 C ATOM 325 O GLY A 181 6.536 8.536 -4.031 -0.48 0.02 O ATOM 0 H GLY A 181 8.967 9.296 -6.417 -0.36 0.02 H new ATOM 0 HA2 GLY A 181 9.533 8.669 -3.639 -0.10 0.02 H new ATOM 0 HA3 GLY A 181 8.508 10.072 -3.865 -0.10 0.02 H new ATOM 329 N ASP A 182 7.831 7.107 -5.189 -0.36 0.02 N ATOM 330 CA ASP A 182 6.761 6.144 -5.421 1.00 0.02 C ATOM 331 C ASP A 182 7.288 4.970 -6.234 0.48 0.02 C ATOM 332 O ASP A 182 8.494 4.857 -6.456 -0.48 0.02 O ATOM 333 CB ASP A 182 5.584 6.805 -6.138 -0.45 0.02 C ATOM 334 CG ASP A 182 4.315 6.780 -5.309 0.49 0.02 C ATOM 335 OD1 ASP A 182 4.419 6.744 -4.065 -0.62 0.02 O ATOM 336 OD2 ASP A 182 3.216 6.795 -5.903 -0.62 0.02 O ATOM 0 H ASP A 182 8.730 6.840 -5.590 -0.36 0.02 H new ATOM 0 HA ASP A 182 6.407 5.777 -4.458 1.00 0.02 H new ATOM 0 HB2 ASP A 182 5.840 7.838 -6.375 -0.45 0.02 H new ATOM 0 HB3 ASP A 182 5.406 6.295 -7.085 -0.45 0.02 H new ATOM 341 N PHE A 183 6.394 4.096 -6.679 -0.36 0.02 N ATOM 342 CA PHE A 183 6.817 2.942 -7.465 1.00 0.02 C ATOM 343 C PHE A 183 5.644 2.158 -8.047 0.48 0.02 C ATOM 344 O PHE A 183 4.507 2.262 -7.588 -0.48 0.02 O ATOM 345 CB PHE A 183 7.708 2.022 -6.605 -0.16 0.02 C ATOM 346 CG PHE A 183 6.997 0.852 -5.953 0.03 0.02 C ATOM 347 CD1 PHE A 183 5.693 0.971 -5.487 -0.16 0.02 C ATOM 348 CD2 PHE A 183 7.641 -0.371 -5.809 -0.16 0.02 C ATOM 349 CE1 PHE A 183 5.050 -0.106 -4.896 -0.15 0.02 C ATOM 350 CE2 PHE A 183 7.000 -1.443 -5.217 -0.15 0.02 C ATOM 351 CZ PHE A 183 5.706 -1.311 -4.763 -0.15 0.02 C ATOM 0 H PHE A 183 5.390 4.160 -6.514 -0.36 0.02 H new ATOM 0 HA PHE A 183 7.388 3.321 -8.313 1.00 0.02 H new ATOM 0 HB2 PHE A 183 8.511 1.634 -7.231 -0.16 0.02 H new ATOM 0 HB3 PHE A 183 8.174 2.623 -5.824 -0.16 0.02 H new ATOM 0 HD1 PHE A 183 5.175 1.913 -5.586 -0.16 0.02 H new ATOM 0 HD2 PHE A 183 8.655 -0.485 -6.164 -0.16 0.02 H new ATOM 0 HE1 PHE A 183 4.036 -0.001 -4.540 -0.15 0.02 H new ATOM 0 HE2 PHE A 183 7.515 -2.386 -5.110 -0.15 0.02 H new ATOM 0 HZ PHE A 183 5.206 -2.151 -4.303 -0.15 0.02 H new ATOM 361 N GLU A 184 5.957 1.347 -9.051 -0.36 0.02 N ATOM 362 CA GLU A 184 4.975 0.495 -9.703 1.00 0.02 C ATOM 363 C GLU A 184 5.600 -0.863 -9.976 0.48 0.02 C ATOM 364 O GLU A 184 6.665 -0.952 -10.581 -0.48 0.02 O ATOM 365 CB GLU A 184 4.477 1.120 -11.001 -0.20 0.02 C ATOM 366 CG GLU A 184 3.564 2.313 -10.781 -0.45 0.02 C ATOM 367 CD GLU A 184 2.527 2.465 -11.877 0.49 0.02 C ATOM 368 OE1 GLU A 184 2.040 1.431 -12.381 -0.62 0.02 O ATOM 369 OE2 GLU A 184 2.200 3.618 -12.230 -0.62 0.02 O ATOM 0 H GLU A 184 6.899 1.263 -9.434 -0.36 0.02 H new ATOM 0 HA GLU A 184 4.115 0.379 -9.043 1.00 0.02 H new ATOM 0 HB2 GLU A 184 5.334 1.432 -11.598 -0.20 0.02 H new ATOM 0 HB3 GLU A 184 3.944 0.365 -11.579 -0.20 0.02 H new ATOM 0 HG2 GLU A 184 3.059 2.207 -9.821 -0.45 0.02 H new ATOM 0 HG3 GLU A 184 4.165 3.221 -10.727 -0.45 0.02 H new ATOM 376 N CYS A 185 4.952 -1.915 -9.506 -0.36 0.02 N ATOM 377 CA CYS A 185 5.470 -3.261 -9.675 1.00 0.02 C ATOM 378 C CYS A 185 4.843 -3.971 -10.860 0.48 0.02 C ATOM 379 O CYS A 185 3.756 -3.621 -11.319 -0.48 0.02 O ATOM 380 CB CYS A 185 5.229 -4.085 -8.409 0.20 0.02 C ATOM 381 SG CYS A 185 6.475 -3.837 -7.105 -0.20 0.02 S ATOM 0 H CYS A 185 4.066 -1.863 -9.004 -0.36 0.02 H new ATOM 0 HA CYS A 185 6.540 -3.169 -9.863 1.00 0.02 H new ATOM 0 HB2 CYS A 185 4.246 -3.835 -8.009 0.20 0.02 H new ATOM 0 HB3 CYS A 185 5.205 -5.141 -8.676 0.20 0.02 H new ATOM 386 N GLU A 186 5.543 -4.990 -11.324 -0.36 0.02 N ATOM 387 CA GLU A 186 5.087 -5.806 -12.437 1.00 0.02 C ATOM 388 C GLU A 186 4.337 -7.031 -11.920 0.48 0.02 C ATOM 389 O GLU A 186 3.826 -7.835 -12.700 -0.48 0.02 O ATOM 390 CB GLU A 186 6.276 -6.252 -13.281 -0.20 0.02 C ATOM 391 CG GLU A 186 5.881 -6.904 -14.596 -0.45 0.02 C ATOM 392 CD GLU A 186 6.450 -6.181 -15.802 0.49 0.02 C ATOM 393 OE1 GLU A 186 6.392 -4.934 -15.828 -0.62 0.02 O ATOM 394 OE2 GLU A 186 6.953 -6.863 -16.720 -0.62 0.02 O ATOM 0 H GLU A 186 6.444 -5.276 -10.941 -0.36 0.02 H new ATOM 0 HA GLU A 186 4.414 -5.210 -13.053 1.00 0.02 H new ATOM 0 HB2 GLU A 186 6.907 -5.388 -13.489 -0.20 0.02 H new ATOM 0 HB3 GLU A 186 6.877 -6.954 -12.704 -0.20 0.02 H new ATOM 0 HG2 GLU A 186 6.225 -7.938 -14.602 -0.45 0.02 H new ATOM 0 HG3 GLU A 186 4.794 -6.929 -14.672 -0.45 0.02 H new ATOM 401 N CYS A 187 4.283 -7.167 -10.595 -0.36 0.02 N ATOM 402 CA CYS A 187 3.605 -8.292 -9.969 1.00 0.02 C ATOM 403 C CYS A 187 2.094 -8.205 -10.208 0.48 0.02 C ATOM 404 O CYS A 187 1.603 -7.175 -10.660 -0.48 0.02 O ATOM 405 CB CYS A 187 3.932 -8.352 -8.469 0.20 0.02 C ATOM 406 SG CYS A 187 5.468 -9.252 -8.106 -0.20 0.02 S ATOM 0 H CYS A 187 4.702 -6.509 -9.938 -0.36 0.02 H new ATOM 0 HA CYS A 187 3.964 -9.215 -10.424 1.00 0.02 H new ATOM 0 HB2 CYS A 187 4.013 -7.337 -8.081 0.20 0.02 H new ATOM 0 HB3 CYS A 187 3.106 -8.830 -7.943 0.20 0.02 H new ATOM 411 N PRO A 188 1.346 -9.299 -9.946 -0.36 0.02 N ATOM 412 CA PRO A 188 -0.118 -9.359 -10.167 1.00 0.02 C ATOM 413 C PRO A 188 -0.900 -8.241 -9.468 0.48 0.02 C ATOM 414 O PRO A 188 -1.699 -8.510 -8.575 -0.48 0.02 O ATOM 415 CB PRO A 188 -0.505 -10.720 -9.582 -0.20 0.02 C ATOM 416 CG PRO A 188 0.737 -11.537 -9.670 -0.20 0.02 C ATOM 417 CD PRO A 188 1.875 -10.582 -9.446 0.06 0.02 C ATOM 0 HA PRO A 188 -0.359 -9.232 -11.222 1.00 0.02 H new ATOM 0 HB2 PRO A 188 -0.844 -10.625 -8.551 -0.20 0.02 H new ATOM 0 HB3 PRO A 188 -1.319 -11.176 -10.145 -0.20 0.02 H new ATOM 0 HG2 PRO A 188 0.738 -12.328 -8.920 -0.20 0.02 H new ATOM 0 HG3 PRO A 188 0.818 -12.020 -10.644 -0.20 0.02 H new ATOM 0 HD2 PRO A 188 2.148 -10.521 -8.392 0.06 0.02 H new ATOM 0 HD3 PRO A 188 2.769 -10.887 -9.989 0.06 0.02 H new ATOM 425 N GLU A 189 -0.604 -6.997 -9.856 -0.36 0.02 N ATOM 426 CA GLU A 189 -1.186 -5.770 -9.286 1.00 0.02 C ATOM 427 C GLU A 189 -0.012 -4.903 -8.916 0.48 0.02 C ATOM 428 O GLU A 189 1.080 -5.121 -9.443 -0.48 0.02 O ATOM 429 CB GLU A 189 -2.046 -6.033 -8.043 -0.20 0.02 C ATOM 430 CG GLU A 189 -3.352 -6.729 -8.343 -0.45 0.02 C ATOM 431 CD GLU A 189 -4.548 -5.800 -8.262 0.49 0.02 C ATOM 432 OE1 GLU A 189 -4.800 -5.251 -7.169 -0.62 0.02 O ATOM 433 OE2 GLU A 189 -5.233 -5.622 -9.291 -0.62 0.02 O ATOM 0 H GLU A 189 0.068 -6.806 -10.599 -0.36 0.02 H new ATOM 0 HA GLU A 189 -1.853 -5.305 -10.012 1.00 0.02 H new ATOM 0 HB2 GLU A 189 -1.475 -6.639 -7.339 -0.20 0.02 H new ATOM 0 HB3 GLU A 189 -2.256 -5.084 -7.550 -0.20 0.02 H new ATOM 0 HG2 GLU A 189 -3.304 -7.166 -9.341 -0.45 0.02 H new ATOM 0 HG3 GLU A 189 -3.489 -7.552 -7.641 -0.45 0.02 H new ATOM 440 N GLY A 190 -0.146 -3.994 -7.964 -0.36 0.02 N ATOM 441 CA GLY A 190 1.020 -3.269 -7.557 -0.10 0.02 C ATOM 442 C GLY A 190 1.712 -4.089 -6.496 0.48 0.02 C ATOM 443 O GLY A 190 2.372 -3.564 -5.609 -0.48 0.02 O ATOM 0 H GLY A 190 -1.014 -3.756 -7.484 -0.36 0.02 H new ATOM 0 HA2 GLY A 190 1.683 -3.101 -8.406 -0.10 0.02 H new ATOM 0 HA3 GLY A 190 0.746 -2.289 -7.167 -0.10 0.02 H new ATOM 447 N TYR A 191 1.559 -5.412 -6.623 -0.36 0.02 N ATOM 448 CA TYR A 191 2.152 -6.364 -5.713 1.00 0.02 C ATOM 449 C TYR A 191 3.623 -6.101 -5.532 0.48 0.02 C ATOM 450 O TYR A 191 4.338 -5.760 -6.473 -0.48 0.02 O ATOM 451 CB TYR A 191 1.967 -7.775 -6.274 -0.20 0.02 C ATOM 452 CG TYR A 191 0.733 -8.501 -5.802 1.00 0.02 C ATOM 453 CD1 TYR A 191 -0.368 -7.811 -5.323 -0.14 0.02 C ATOM 454 CD2 TYR A 191 0.672 -9.888 -5.847 -0.14 0.02 C ATOM 455 CE1 TYR A 191 -1.494 -8.484 -4.898 -0.14 0.02 C ATOM 456 CE2 TYR A 191 -0.452 -10.567 -5.425 -0.14 0.02 C ATOM 457 CZ TYR A 191 -1.533 -9.861 -4.950 0.20 0.02 C ATOM 458 OH TYR A 191 -2.658 -10.531 -4.527 -0.60 0.02 O ATOM 0 H TYR A 191 1.014 -5.842 -7.370 -0.36 0.02 H new ATOM 0 HA TYR A 191 1.660 -6.266 -4.745 1.00 0.02 H new ATOM 0 HB2 TYR A 191 1.939 -7.714 -7.362 -0.20 0.02 H new ATOM 0 HB3 TYR A 191 2.841 -8.370 -6.011 -0.20 0.02 H new ATOM 0 HD1 TYR A 191 -0.344 -6.732 -5.282 -0.14 0.02 H new ATOM 0 HD2 TYR A 191 1.520 -10.445 -6.219 -0.14 0.02 H new ATOM 0 HE1 TYR A 191 -2.344 -7.933 -4.525 -0.14 0.02 H new ATOM 0 HE2 TYR A 191 -0.483 -11.646 -5.467 -0.14 0.02 H new ATOM 0 HH TYR A 191 -2.522 -11.496 -4.631 -0.60 0.02 H new ATOM 468 N ARG A 192 4.059 -6.272 -4.313 -0.36 0.02 N ATOM 469 CA ARG A 192 5.454 -6.067 -3.964 1.00 0.02 C ATOM 470 C ARG A 192 6.225 -7.375 -4.121 0.48 0.02 C ATOM 471 O ARG A 192 5.881 -8.391 -3.524 -0.48 0.02 O ATOM 472 CB ARG A 192 5.576 -5.566 -2.523 -0.20 0.02 C ATOM 473 CG ARG A 192 5.315 -4.077 -2.367 -0.20 0.02 C ATOM 474 CD ARG A 192 5.313 -3.663 -0.904 -0.10 0.02 C ATOM 475 NE ARG A 192 6.395 -2.730 -0.596 -0.60 0.02 N ATOM 476 CZ ARG A 192 6.310 -1.411 -0.764 0.60 0.02 C ATOM 477 NH1 ARG A 192 5.199 -0.863 -1.241 -0.60 0.02 N ATOM 478 NH2 ARG A 192 7.341 -0.638 -0.453 -0.60 0.02 N ATOM 0 H ARG A 192 3.467 -6.556 -3.532 -0.36 0.02 H new ATOM 0 HA ARG A 192 5.874 -5.317 -4.634 1.00 0.02 H new ATOM 0 HB2 ARG A 192 4.874 -6.116 -1.896 -0.20 0.02 H new ATOM 0 HB3 ARG A 192 6.577 -5.791 -2.154 -0.20 0.02 H new ATOM 0 HG2 ARG A 192 6.078 -3.514 -2.905 -0.20 0.02 H new ATOM 0 HG3 ARG A 192 4.356 -3.825 -2.819 -0.20 0.02 H new ATOM 0 HD2 ARG A 192 4.356 -3.202 -0.659 -0.10 0.02 H new ATOM 0 HD3 ARG A 192 5.409 -4.549 -0.277 -0.10 0.02 H new ATOM 0 HE ARG A 192 7.268 -3.112 -0.231 -0.60 0.02 H new ATOM 0 HH11 ARG A 192 4.402 -1.453 -1.482 -0.60 0.02 H new ATOM 0 HH12 ARG A 192 5.142 0.148 -1.367 -0.60 0.02 H new ATOM 0 HH21 ARG A 192 8.197 -1.053 -0.086 -0.60 0.02 H new ATOM 0 HH22 ARG A 192 7.278 0.372 -0.581 -0.60 0.02 H new ATOM 492 N TYR A 193 7.266 -7.338 -4.937 -0.36 0.02 N ATOM 493 CA TYR A 193 8.092 -8.504 -5.197 1.00 0.02 C ATOM 494 C TYR A 193 9.251 -8.591 -4.208 0.48 0.02 C ATOM 495 O TYR A 193 9.602 -7.605 -3.560 -0.48 0.02 O ATOM 496 CB TYR A 193 8.624 -8.411 -6.622 -0.20 0.02 C ATOM 497 CG TYR A 193 9.377 -9.627 -7.086 1.00 0.02 C ATOM 498 CD1 TYR A 193 8.705 -10.716 -7.612 -0.14 0.02 C ATOM 499 CD2 TYR A 193 10.760 -9.672 -7.024 -0.14 0.02 C ATOM 500 CE1 TYR A 193 9.389 -11.825 -8.062 -0.14 0.02 C ATOM 501 CE2 TYR A 193 11.457 -10.772 -7.479 -0.14 0.02 C ATOM 502 CZ TYR A 193 10.768 -11.849 -7.997 0.20 0.02 C ATOM 503 OH TYR A 193 11.458 -12.943 -8.463 -0.60 0.02 O ATOM 0 H TYR A 193 7.561 -6.499 -5.437 -0.36 0.02 H new ATOM 0 HA TYR A 193 7.490 -9.404 -5.076 1.00 0.02 H new ATOM 0 HB2 TYR A 193 7.787 -8.237 -7.298 -0.20 0.02 H new ATOM 0 HB3 TYR A 193 9.279 -7.543 -6.696 -0.20 0.02 H new ATOM 0 HD1 TYR A 193 7.627 -10.697 -7.671 -0.14 0.02 H new ATOM 0 HD2 TYR A 193 11.301 -8.833 -6.613 -0.14 0.02 H new ATOM 0 HE1 TYR A 193 8.849 -12.670 -8.463 -0.14 0.02 H new ATOM 0 HE2 TYR A 193 12.536 -10.790 -7.430 -0.14 0.02 H new ATOM 0 HH TYR A 193 11.938 -12.702 -9.283 -0.60 0.02 H new ATOM 513 N ASN A 194 9.838 -9.779 -4.095 -0.36 0.02 N ATOM 514 CA ASN A 194 10.954 -9.995 -3.179 1.00 0.02 C ATOM 515 C ASN A 194 12.099 -10.739 -3.864 0.48 0.02 C ATOM 516 O ASN A 194 11.886 -11.773 -4.501 -0.48 0.02 O ATOM 517 CB ASN A 194 10.484 -10.786 -1.959 -0.20 0.02 C ATOM 518 CG ASN A 194 10.278 -9.906 -0.742 0.48 0.02 C ATOM 519 OD1 ASN A 194 11.338 -9.712 0.034 -0.48 0.02 O flip ATOM 520 ND2 ASN A 194 9.179 -9.407 -0.501 -0.52 0.02 N flip ATOM 0 H ASN A 194 9.560 -10.605 -4.625 -0.36 0.02 H new ATOM 0 HA ASN A 194 11.322 -9.019 -2.863 1.00 0.02 H new ATOM 0 HB2 ASN A 194 9.550 -11.295 -2.198 -0.20 0.02 H new ATOM 0 HB3 ASN A 194 11.217 -11.558 -1.726 -0.20 0.02 H new ATOM 0 HD21 ASN A 194 8.391 -9.583 -1.125 -0.52 0.02 H new ATOM 0 HD22 ASN A 194 9.056 -8.818 0.322 -0.52 0.02 H new ATOM 527 N LEU A 195 13.313 -10.209 -3.721 -0.36 0.02 N ATOM 528 CA LEU A 195 14.496 -10.825 -4.317 1.00 0.02 C ATOM 529 C LEU A 195 15.012 -11.974 -3.451 0.48 0.02 C ATOM 530 O LEU A 195 15.814 -12.791 -3.900 -0.48 0.02 O ATOM 531 CB LEU A 195 15.596 -9.779 -4.509 -0.20 0.02 C ATOM 532 CG LEU A 195 16.929 -10.327 -5.026 -0.10 0.02 C ATOM 533 CD1 LEU A 195 17.481 -9.438 -6.130 -0.30 0.02 C ATOM 534 CD2 LEU A 195 17.933 -10.451 -3.889 -0.30 0.02 C ATOM 0 H LEU A 195 13.502 -9.354 -3.197 -0.36 0.02 H new ATOM 0 HA LEU A 195 14.214 -11.230 -5.289 1.00 0.02 H new ATOM 0 HB2 LEU A 195 15.238 -9.021 -5.206 -0.20 0.02 H new ATOM 0 HB3 LEU A 195 15.771 -9.279 -3.556 -0.20 0.02 H new ATOM 0 HG LEU A 195 16.754 -11.320 -5.440 -0.10 0.02 H new ATOM 0 HD11 LEU A 195 18.429 -9.844 -6.484 -0.30 0.02 H new ATOM 0 HD12 LEU A 195 16.771 -9.400 -6.956 -0.30 0.02 H new ATOM 0 HD13 LEU A 195 17.640 -8.432 -5.742 -0.30 0.02 H new ATOM 0 HD21 LEU A 195 18.874 -10.842 -4.276 -0.30 0.02 H new ATOM 0 HD22 LEU A 195 18.103 -9.470 -3.445 -0.30 0.02 H new ATOM 0 HD23 LEU A 195 17.542 -11.130 -3.131 -0.30 0.02 H new ATOM 546 N LYS A 196 14.554 -12.031 -2.206 -0.36 0.02 N ATOM 547 CA LYS A 196 14.971 -13.080 -1.290 1.00 0.02 C ATOM 548 C LYS A 196 14.583 -14.437 -1.843 0.48 0.02 C ATOM 549 O LYS A 196 15.387 -15.369 -1.876 -0.48 0.02 O ATOM 550 CB LYS A 196 14.313 -12.875 0.073 -0.20 0.02 C ATOM 551 CG LYS A 196 15.196 -12.150 1.064 -0.20 0.02 C ATOM 552 CD LYS A 196 15.207 -10.651 0.811 -0.20 0.02 C ATOM 553 CE LYS A 196 14.086 -9.951 1.562 0.30 5.02 C ATOM 554 NZ LYS A 196 13.832 -8.583 1.032 -0.81 0.02 N ATOM 0 H LYS A 196 13.894 -11.362 -1.810 -0.36 0.02 H new ATOM 0 HA LYS A 196 16.054 -13.036 -1.176 1.00 0.02 H new ATOM 0 HB2 LYS A 196 13.389 -12.312 -0.059 -0.20 0.02 H new ATOM 0 HB3 LYS A 196 14.038 -13.846 0.485 -0.20 0.02 H new ATOM 0 HG2 LYS A 196 14.844 -12.346 2.077 -0.20 0.02 H new ATOM 0 HG3 LYS A 196 16.212 -12.538 0.999 -0.20 0.02 H new ATOM 0 HD2 LYS A 196 16.167 -10.236 1.119 -0.20 0.02 H new ATOM 0 HD3 LYS A 196 15.105 -10.461 -0.257 -0.20 0.02 H new ATOM 0 HE2 LYS A 196 13.174 -10.544 1.488 0.30 5.02 H new ATOM 0 HE3 LYS A 196 14.341 -9.889 2.620 0.30 5.02 H new ATOM 0 HZ1 LYS A 196 13.815 -7.903 1.819 -0.81 0.02 H new ATOM 0 HZ2 LYS A 196 14.587 -8.323 0.366 -0.81 0.02 H new ATOM 0 HZ3 LYS A 196 12.916 -8.566 0.540 -0.81 0.02 H new ATOM 568 N SER A 197 13.335 -14.532 -2.272 -0.36 0.02 N ATOM 569 CA SER A 197 12.811 -15.770 -2.826 1.00 0.02 C ATOM 570 C SER A 197 12.453 -15.627 -4.301 0.48 0.02 C ATOM 571 O SER A 197 12.101 -16.607 -4.956 -0.48 0.02 O ATOM 572 CB SER A 197 11.586 -16.231 -2.032 0.08 0.02 C ATOM 573 OG SER A 197 11.944 -17.189 -1.052 -0.68 0.02 O ATOM 0 H SER A 197 12.664 -13.764 -2.247 -0.36 0.02 H new ATOM 0 HA SER A 197 13.597 -16.521 -2.747 1.00 0.02 H new ATOM 0 HB2 SER A 197 11.116 -15.373 -1.551 0.08 0.02 H new ATOM 0 HB3 SER A 197 10.849 -16.659 -2.711 0.08 0.02 H new ATOM 0 HG SER A 197 11.144 -17.466 -0.558 -0.68 0.02 H new ATOM 579 N LYS A 198 12.522 -14.405 -4.818 -0.36 0.02 N ATOM 580 CA LYS A 198 12.183 -14.148 -6.197 1.00 0.02 C ATOM 581 C LYS A 198 10.794 -14.634 -6.503 0.48 0.02 C ATOM 582 O LYS A 198 10.568 -15.492 -7.356 -0.48 0.02 O ATOM 583 CB LYS A 198 13.203 -14.743 -7.137 -0.20 0.02 C ATOM 584 CG LYS A 198 14.185 -13.689 -7.542 -0.20 0.02 C ATOM 585 CD LYS A 198 15.073 -13.324 -6.375 -0.20 0.02 C ATOM 586 CE LYS A 198 16.186 -14.339 -6.176 0.30 5.02 C ATOM 587 NZ LYS A 198 15.722 -15.533 -5.416 -0.81 0.02 N ATOM 0 H LYS A 198 12.812 -13.579 -4.294 -0.36 0.02 H new ATOM 0 HA LYS A 198 12.199 -13.069 -6.353 1.00 0.02 H new ATOM 0 HB2 LYS A 198 13.721 -15.570 -6.652 -0.20 0.02 H new ATOM 0 HB3 LYS A 198 12.707 -15.150 -8.018 -0.20 0.02 H new ATOM 0 HG2 LYS A 198 14.793 -14.049 -8.372 -0.20 0.02 H new ATOM 0 HG3 LYS A 198 13.655 -12.805 -7.895 -0.20 0.02 H new ATOM 0 HD2 LYS A 198 15.506 -12.338 -6.542 -0.20 0.02 H new ATOM 0 HD3 LYS A 198 14.473 -13.260 -5.467 -0.20 0.02 H new ATOM 0 HE2 LYS A 198 16.568 -14.653 -7.147 0.30 5.02 H new ATOM 0 HE3 LYS A 198 17.014 -13.870 -5.644 0.30 5.02 H new ATOM 0 HZ1 LYS A 198 16.516 -15.929 -4.873 -0.81 0.02 H new ATOM 0 HZ2 LYS A 198 14.961 -15.255 -4.764 -0.81 0.02 H new ATOM 0 HZ3 LYS A 198 15.365 -16.250 -6.080 -0.81 0.02 H new ATOM 601 N SER A 199 9.876 -14.045 -5.781 -0.36 0.02 N ATOM 602 CA SER A 199 8.461 -14.351 -5.913 1.00 0.02 C ATOM 603 C SER A 199 7.630 -13.099 -5.669 0.48 0.02 C ATOM 604 O SER A 199 8.088 -12.158 -5.020 -0.48 0.02 O ATOM 605 CB SER A 199 8.057 -15.449 -4.928 0.08 0.02 C ATOM 606 OG SER A 199 8.874 -16.597 -5.080 -0.68 0.02 O ATOM 0 H SER A 199 10.083 -13.335 -5.079 -0.36 0.02 H new ATOM 0 HA SER A 199 8.276 -14.708 -6.926 1.00 0.02 H new ATOM 0 HB2 SER A 199 8.138 -15.074 -3.908 0.08 0.02 H new ATOM 0 HB3 SER A 199 7.013 -15.718 -5.087 0.08 0.02 H new ATOM 0 HG SER A 199 8.596 -17.283 -4.438 -0.68 0.02 H new ATOM 612 N CYS A 200 6.413 -13.086 -6.193 -0.36 0.02 N ATOM 613 CA CYS A 200 5.533 -11.939 -6.027 1.00 0.02 C ATOM 614 C CYS A 200 4.875 -11.960 -4.652 0.48 0.02 C ATOM 615 O CYS A 200 4.477 -13.018 -4.164 -0.48 0.02 O ATOM 616 CB CYS A 200 4.471 -11.927 -7.124 0.20 0.02 C ATOM 617 SG CYS A 200 5.034 -11.152 -8.670 -0.20 0.02 S ATOM 0 H CYS A 200 6.014 -13.853 -6.734 -0.36 0.02 H new ATOM 0 HA CYS A 200 6.130 -11.031 -6.106 1.00 0.02 H new ATOM 0 HB2 CYS A 200 4.163 -12.952 -7.332 0.20 0.02 H new ATOM 0 HB3 CYS A 200 3.591 -11.397 -6.761 0.20 0.02 H new ATOM 622 N GLU A 201 4.779 -10.793 -4.017 -0.36 0.02 N ATOM 623 CA GLU A 201 4.184 -10.709 -2.689 1.00 0.02 C ATOM 624 C GLU A 201 3.342 -9.447 -2.501 0.48 0.02 C ATOM 625 O GLU A 201 3.871 -8.342 -2.414 -0.48 0.02 O ATOM 626 CB GLU A 201 5.278 -10.762 -1.621 -0.20 0.02 C ATOM 627 CG GLU A 201 5.764 -12.170 -1.317 -0.45 0.02 C ATOM 628 CD GLU A 201 5.450 -12.604 0.102 0.49 0.02 C ATOM 629 OE1 GLU A 201 5.676 -11.802 1.032 -0.62 0.02 O ATOM 630 OE2 GLU A 201 4.979 -13.747 0.283 -0.62 0.02 O ATOM 0 H GLU A 201 5.102 -9.903 -4.397 -0.36 0.02 H new ATOM 0 HA GLU A 201 3.516 -11.564 -2.584 1.00 0.02 H new ATOM 0 HB2 GLU A 201 6.124 -10.158 -1.949 -0.20 0.02 H new ATOM 0 HB3 GLU A 201 4.900 -10.311 -0.703 -0.20 0.02 H new ATOM 0 HG2 GLU A 201 5.303 -12.868 -2.016 -0.45 0.02 H new ATOM 0 HG3 GLU A 201 6.841 -12.221 -1.478 -0.45 0.02 H new ATOM 637 N ASP A 202 2.025 -9.649 -2.435 -0.36 0.02 N ATOM 638 CA ASP A 202 1.044 -8.582 -2.247 1.00 0.02 C ATOM 639 C ASP A 202 1.665 -7.316 -1.667 0.48 0.02 C ATOM 640 O ASP A 202 2.585 -7.362 -0.850 -0.48 0.02 O ATOM 641 CB ASP A 202 -0.091 -9.065 -1.341 -0.45 0.02 C ATOM 642 CG ASP A 202 -1.125 -7.988 -1.083 0.49 0.02 C ATOM 643 OD1 ASP A 202 -1.722 -7.495 -2.063 -0.62 0.02 O ATOM 644 OD2 ASP A 202 -1.338 -7.640 0.098 -0.62 0.02 O ATOM 0 H ASP A 202 1.604 -10.575 -2.512 -0.36 0.02 H new ATOM 0 HA ASP A 202 0.651 -8.331 -3.232 1.00 0.02 H new ATOM 0 HB2 ASP A 202 -0.576 -9.927 -1.799 -0.45 0.02 H new ATOM 0 HB3 ASP A 202 0.325 -9.400 -0.391 -0.45 0.02 H new ATOM 649 N ILE A 203 1.142 -6.193 -2.114 -0.36 0.02 N ATOM 650 CA ILE A 203 1.612 -4.888 -1.692 1.00 0.02 C ATOM 651 C ILE A 203 0.973 -4.439 -0.370 0.48 0.02 C ATOM 652 O ILE A 203 -0.024 -5.012 0.088 -0.48 0.02 O ATOM 653 CB ILE A 203 1.342 -3.863 -2.799 -0.10 0.02 C ATOM 654 CG1 ILE A 203 2.033 -2.536 -2.516 -0.20 0.02 C ATOM 655 CG2 ILE A 203 -0.142 -3.667 -2.982 -0.30 0.02 C ATOM 656 CD1 ILE A 203 2.346 -1.774 -3.776 -0.30 0.02 C ATOM 0 H ILE A 203 0.374 -6.159 -2.784 -0.36 0.02 H new ATOM 0 HA ILE A 203 2.685 -4.960 -1.514 1.00 0.02 H new ATOM 0 HB ILE A 203 1.759 -4.255 -3.726 -0.10 0.02 H new ATOM 0 HG12 ILE A 203 1.396 -1.927 -1.875 -0.20 0.02 H new ATOM 0 HG13 ILE A 203 2.956 -2.720 -1.966 -0.20 0.02 H new ATOM 0 HG21 ILE A 203 -0.318 -2.936 -3.771 -0.30 0.02 H new ATOM 0 HG22 ILE A 203 -0.603 -4.616 -3.256 -0.30 0.02 H new ATOM 0 HG23 ILE A 203 -0.579 -3.307 -2.051 -0.30 0.02 H new ATOM 0 HD11 ILE A 203 2.838 -0.835 -3.521 -0.30 0.02 H new ATOM 0 HD12 ILE A 203 3.006 -2.370 -4.407 -0.30 0.02 H new ATOM 0 HD13 ILE A 203 1.421 -1.564 -4.314 -0.30 0.02 H new ATOM 668 N ASP A 204 1.557 -3.388 0.208 -0.36 0.02 N ATOM 669 CA ASP A 204 1.077 -2.807 1.462 1.00 0.02 C ATOM 670 C ASP A 204 0.416 -1.449 1.210 0.48 0.02 C ATOM 671 O ASP A 204 0.864 -0.417 1.712 -0.48 0.02 O ATOM 672 CB ASP A 204 2.236 -2.662 2.452 -0.45 0.02 C ATOM 673 CG ASP A 204 2.097 -3.592 3.642 0.49 0.02 C ATOM 674 OD1 ASP A 204 0.950 -3.936 3.996 -0.62 0.02 O ATOM 675 OD2 ASP A 204 3.136 -3.974 4.222 -0.62 0.02 O ATOM 0 H ASP A 204 2.374 -2.917 -0.179 -0.36 0.02 H new ATOM 0 HA ASP A 204 0.330 -3.475 1.891 1.00 0.02 H new ATOM 0 HB2 ASP A 204 3.176 -2.869 1.940 -0.45 0.02 H new ATOM 0 HB3 ASP A 204 2.284 -1.631 2.803 -0.45 0.02 H new ATOM 680 N GLU A 205 -0.643 -1.466 0.409 -0.36 0.02 N ATOM 681 CA GLU A 205 -1.379 -0.258 0.047 1.00 0.02 C ATOM 682 C GLU A 205 -1.778 0.598 1.253 0.48 0.02 C ATOM 683 O GLU A 205 -1.944 1.808 1.120 -0.48 0.02 O ATOM 684 CB GLU A 205 -2.636 -0.625 -0.735 -0.20 0.02 C ATOM 685 CG GLU A 205 -2.367 -1.473 -1.966 -0.45 0.02 C ATOM 686 CD GLU A 205 -3.047 -2.829 -1.902 0.49 0.02 C ATOM 687 OE1 GLU A 205 -2.430 -3.783 -1.384 -0.62 0.02 O ATOM 688 OE2 GLU A 205 -4.198 -2.936 -2.368 -0.62 0.02 O ATOM 0 H GLU A 205 -1.017 -2.318 -0.009 -0.36 0.02 H new ATOM 0 HA GLU A 205 -0.700 0.337 -0.564 1.00 0.02 H new ATOM 0 HB2 GLU A 205 -3.318 -1.163 -0.077 -0.20 0.02 H new ATOM 0 HB3 GLU A 205 -3.143 0.290 -1.040 -0.20 0.02 H new ATOM 0 HG2 GLU A 205 -2.711 -0.940 -2.852 -0.45 0.02 H new ATOM 0 HG3 GLU A 205 -1.292 -1.615 -2.077 -0.45 0.02 H new ATOM 695 N CYS A 206 -1.952 -0.016 2.420 -0.36 0.02 N ATOM 696 CA CYS A 206 -2.358 0.744 3.606 1.00 0.02 C ATOM 697 C CYS A 206 -1.167 1.138 4.471 0.48 0.02 C ATOM 698 O CYS A 206 -1.209 2.150 5.171 -0.48 0.02 O ATOM 699 CB CYS A 206 -3.394 -0.031 4.430 0.20 0.02 C ATOM 700 SG CYS A 206 -2.714 -1.254 5.599 -0.20 0.02 S ATOM 0 H CYS A 206 -1.822 -1.016 2.573 -0.36 0.02 H new ATOM 0 HA CYS A 206 -2.819 1.665 3.250 1.00 0.02 H new ATOM 0 HB2 CYS A 206 -3.996 0.685 4.990 0.20 0.02 H new ATOM 0 HB3 CYS A 206 -4.067 -0.546 3.744 0.20 0.02 H new ATOM 705 N SER A 207 -0.108 0.346 4.420 -0.36 0.02 N ATOM 706 CA SER A 207 1.086 0.635 5.204 1.00 0.02 C ATOM 707 C SER A 207 1.664 1.991 4.811 0.48 0.02 C ATOM 708 O SER A 207 2.427 2.596 5.564 -0.48 0.02 O ATOM 709 CB SER A 207 2.134 -0.466 5.012 0.08 0.02 C ATOM 710 OG SER A 207 3.128 -0.079 4.077 -0.68 0.02 O ATOM 0 H SER A 207 -0.049 -0.497 3.849 -0.36 0.02 H new ATOM 0 HA SER A 207 0.807 0.667 6.257 1.00 0.02 H new ATOM 0 HB2 SER A 207 2.603 -0.695 5.969 0.08 0.02 H new ATOM 0 HB3 SER A 207 1.646 -1.379 4.670 0.08 0.02 H new ATOM 0 HG SER A 207 3.864 -0.726 4.095 -0.68 0.02 H new ATOM 716 N GLU A 208 1.332 2.436 3.604 -0.36 0.02 N ATOM 717 CA GLU A 208 1.849 3.687 3.073 1.00 0.02 C ATOM 718 C GLU A 208 1.136 4.907 3.654 0.48 0.02 C ATOM 719 O GLU A 208 1.756 5.702 4.359 -0.48 0.02 O ATOM 720 CB GLU A 208 1.698 3.679 1.553 -0.20 0.02 C ATOM 721 CG GLU A 208 2.805 2.925 0.833 -0.45 0.02 C ATOM 722 CD GLU A 208 3.671 3.832 -0.021 0.49 0.02 C ATOM 723 OE1 GLU A 208 4.254 4.788 0.532 -0.62 0.02 O ATOM 724 OE2 GLU A 208 3.765 3.586 -1.242 -0.62 0.02 O ATOM 0 H GLU A 208 0.702 1.942 2.972 -0.36 0.02 H new ATOM 0 HA GLU A 208 2.898 3.763 3.357 1.00 0.02 H new ATOM 0 HB2 GLU A 208 0.738 3.232 1.294 -0.20 0.02 H new ATOM 0 HB3 GLU A 208 1.678 4.708 1.193 -0.20 0.02 H new ATOM 0 HG2 GLU A 208 3.431 2.418 1.567 -0.45 0.02 H new ATOM 0 HG3 GLU A 208 2.363 2.153 0.203 -0.45 0.02 H new ATOM 731 N ASN A 209 -0.160 5.055 3.369 -0.36 0.02 N ATOM 732 CA ASN A 209 -0.941 6.189 3.877 1.00 0.02 C ATOM 733 C ASN A 209 -2.245 6.339 3.094 0.48 0.02 C ATOM 734 O ASN A 209 -2.483 7.361 2.450 -0.48 0.02 O ATOM 735 CB ASN A 209 -0.135 7.496 3.796 -0.20 0.02 C ATOM 736 CG ASN A 209 0.208 8.051 5.166 0.48 0.02 C ATOM 737 OD1 ASN A 209 0.150 9.260 5.390 -0.48 0.02 O ATOM 738 ND2 ASN A 209 0.569 7.169 6.091 -0.52 0.02 N ATOM 0 H ASN A 209 -0.692 4.405 2.790 -0.36 0.02 H new ATOM 0 HA ASN A 209 -1.174 5.988 4.923 1.00 0.02 H new ATOM 0 HB2 ASN A 209 0.785 7.318 3.238 -0.20 0.02 H new ATOM 0 HB3 ASN A 209 -0.707 8.238 3.239 -0.20 0.02 H new ATOM 0 HD21 ASN A 209 0.812 7.485 7.030 -0.52 0.02 H new ATOM 0 HD22 ASN A 209 0.604 6.176 5.862 -0.52 0.02 H new ATOM 745 N MET A 210 -3.087 5.313 3.145 -0.36 0.02 N ATOM 746 CA MET A 210 -4.361 5.344 2.427 1.00 0.02 C ATOM 747 C MET A 210 -5.529 5.032 3.328 0.48 0.02 C ATOM 748 O MET A 210 -6.631 5.535 3.110 -0.48 0.02 O ATOM 749 CB MET A 210 -4.345 4.372 1.243 -0.20 0.02 C ATOM 750 CG MET A 210 -3.021 4.324 0.497 -0.11 5.02 C ATOM 751 SD MET A 210 -2.944 5.496 -0.870 -0.17 0.02 S ATOM 752 CE MET A 210 -2.257 4.456 -2.158 -0.21 5.02 C ATOM 0 H MET A 210 -2.915 4.456 3.670 -0.36 0.02 H new ATOM 0 HA MET A 210 -4.487 6.361 2.055 1.00 0.02 H new ATOM 0 HB2 MET A 210 -4.582 3.372 1.605 -0.20 0.02 H new ATOM 0 HB3 MET A 210 -5.133 4.654 0.545 -0.20 0.02 H new ATOM 0 HG2 MET A 210 -2.209 4.532 1.194 -0.11 5.02 H new ATOM 0 HG3 MET A 210 -2.862 3.316 0.114 -0.11 5.02 H new ATOM 0 HE1 MET A 210 -2.147 5.036 -3.074 -0.21 5.02 H new ATOM 0 HE2 MET A 210 -1.282 4.084 -1.844 -0.21 5.02 H new ATOM 0 HE3 MET A 210 -2.924 3.614 -2.340 -0.21 5.02 H new ATOM 762 N CYS A 211 -5.317 4.190 4.319 -0.36 0.02 N ATOM 763 CA CYS A 211 -6.411 3.830 5.197 1.00 0.02 C ATOM 764 C CYS A 211 -6.378 4.572 6.515 0.48 0.02 C ATOM 765 O CYS A 211 -5.351 4.651 7.189 -0.48 0.02 O ATOM 766 CB CYS A 211 -6.449 2.325 5.429 0.20 0.02 C ATOM 767 SG CYS A 211 -6.919 1.356 3.962 -0.20 0.02 S ATOM 0 H CYS A 211 -4.421 3.752 4.534 -0.36 0.02 H new ATOM 0 HA CYS A 211 -7.327 4.133 4.689 1.00 0.02 H new ATOM 0 HB2 CYS A 211 -5.467 1.996 5.769 0.20 0.02 H new ATOM 0 HB3 CYS A 211 -7.153 2.110 6.233 0.20 0.02 H new ATOM 772 N ALA A 212 -7.527 5.144 6.847 -0.36 0.02 N ATOM 773 CA ALA A 212 -7.670 5.923 8.055 1.00 0.02 C ATOM 774 C ALA A 212 -7.931 5.062 9.300 0.48 0.02 C ATOM 775 O ALA A 212 -7.019 4.792 10.081 -0.48 0.02 O ATOM 776 CB ALA A 212 -8.774 6.961 7.877 -0.30 0.02 C ATOM 0 H ALA A 212 -8.377 5.078 6.287 -0.36 0.02 H new ATOM 0 HA ALA A 212 -6.718 6.426 8.226 1.00 0.02 H new ATOM 0 HB1 ALA A 212 -8.876 7.544 8.792 -0.30 0.02 H new ATOM 0 HB2 ALA A 212 -8.520 7.624 7.050 -0.30 0.02 H new ATOM 0 HB3 ALA A 212 -9.716 6.457 7.661 -0.30 0.02 H new ATOM 782 N GLN A 213 -9.189 4.669 9.492 -0.36 0.02 N ATOM 783 CA GLN A 213 -9.597 3.876 10.657 1.00 0.02 C ATOM 784 C GLN A 213 -8.868 2.537 10.763 0.48 0.02 C ATOM 785 O GLN A 213 -7.972 2.369 11.590 -0.48 0.02 O ATOM 786 CB GLN A 213 -11.101 3.633 10.618 -0.20 0.02 C ATOM 787 CG GLN A 213 -11.898 4.672 11.384 -0.20 0.02 C ATOM 788 CD GLN A 213 -11.690 4.571 12.883 0.48 0.02 C ATOM 789 OE1 GLN A 213 -10.583 4.769 13.382 -0.48 0.02 O ATOM 790 NE2 GLN A 213 -12.757 4.261 13.609 -0.52 0.02 N ATOM 0 H GLN A 213 -9.952 4.888 8.851 -0.36 0.02 H new ATOM 0 HA GLN A 213 -9.325 4.457 11.538 1.00 0.02 H new ATOM 0 HB2 GLN A 213 -11.433 3.623 9.580 -0.20 0.02 H new ATOM 0 HB3 GLN A 213 -11.313 2.646 11.030 -0.20 0.02 H new ATOM 0 HG2 GLN A 213 -11.611 5.668 11.046 -0.20 0.02 H new ATOM 0 HG3 GLN A 213 -12.958 4.552 11.158 -0.20 0.02 H new ATOM 0 HE21 GLN A 213 -13.656 4.105 13.153 -0.52 0.02 H new ATOM 0 HE22 GLN A 213 -12.678 4.179 14.623 -0.52 0.02 H new ATOM 799 N LEU A 214 -9.264 1.588 9.924 -0.36 0.02 N ATOM 800 CA LEU A 214 -8.668 0.262 9.913 1.00 0.02 C ATOM 801 C LEU A 214 -8.332 -0.144 8.505 0.48 0.02 C ATOM 802 O LEU A 214 -9.124 0.091 7.600 -0.48 0.02 O ATOM 803 CB LEU A 214 -9.639 -0.744 10.488 -0.20 0.02 C ATOM 804 CG LEU A 214 -9.868 -0.613 11.979 -0.10 0.02 C ATOM 805 CD1 LEU A 214 -8.532 -0.635 12.704 -0.30 0.02 C ATOM 806 CD2 LEU A 214 -10.641 0.658 12.284 -0.30 0.02 C ATOM 0 H LEU A 214 -10.005 1.717 9.235 -0.36 0.02 H new ATOM 0 HA LEU A 214 -7.759 0.288 10.515 1.00 0.02 H new ATOM 0 HB2 LEU A 214 -10.596 -0.641 9.976 -0.20 0.02 H new ATOM 0 HB3 LEU A 214 -9.271 -1.748 10.276 -0.20 0.02 H new ATOM 0 HG LEU A 214 -10.464 -1.455 12.330 -0.10 0.02 H new ATOM 0 HD11 LEU A 214 -8.699 -0.541 13.777 -0.30 0.02 H new ATOM 0 HD12 LEU A 214 -8.021 -1.576 12.497 -0.30 0.02 H new ATOM 0 HD13 LEU A 214 -7.917 0.195 12.358 -0.30 0.02 H new ATOM 0 HD21 LEU A 214 -10.798 0.739 13.360 -0.30 0.02 H new ATOM 0 HD22 LEU A 214 -10.075 1.521 11.934 -0.30 0.02 H new ATOM 0 HD23 LEU A 214 -11.606 0.628 11.778 -0.30 0.02 H new ATOM 818 N CYS A 215 -7.148 -0.702 8.283 -0.36 0.02 N ATOM 819 CA CYS A 215 -6.775 -1.047 6.934 1.00 0.02 C ATOM 820 C CYS A 215 -6.653 -2.547 6.651 0.48 0.02 C ATOM 821 O CYS A 215 -5.582 -3.133 6.806 -0.48 0.02 O ATOM 822 CB CYS A 215 -5.468 -0.339 6.575 0.20 0.02 C ATOM 823 SG CYS A 215 -3.941 -1.117 7.217 -0.20 0.02 S ATOM 0 H CYS A 215 -6.455 -0.917 9.000 -0.36 0.02 H new ATOM 0 HA CYS A 215 -7.598 -0.709 6.305 1.00 0.02 H new ATOM 0 HB2 CYS A 215 -5.395 -0.280 5.489 0.20 0.02 H new ATOM 0 HB3 CYS A 215 -5.517 0.684 6.947 0.20 0.02 H new ATOM 828 N VAL A 216 -7.720 -3.157 6.137 -0.36 0.02 N ATOM 829 CA VAL A 216 -7.636 -4.551 5.734 1.00 0.02 C ATOM 830 C VAL A 216 -7.273 -4.555 4.270 0.48 0.02 C ATOM 831 O VAL A 216 -8.133 -4.503 3.392 -0.48 0.02 O ATOM 832 CB VAL A 216 -8.934 -5.357 5.921 -0.10 0.02 C ATOM 833 CG1 VAL A 216 -9.046 -6.480 4.880 -0.30 0.02 C ATOM 834 CG2 VAL A 216 -9.016 -5.937 7.326 -0.30 0.02 C ATOM 0 H VAL A 216 -8.629 -2.718 5.994 -0.36 0.02 H new ATOM 0 HA VAL A 216 -6.898 -5.035 6.373 1.00 0.02 H new ATOM 0 HB VAL A 216 -9.769 -4.671 5.777 -0.10 0.02 H new ATOM 0 HG11 VAL A 216 -9.973 -7.031 5.038 -0.30 0.02 H new ATOM 0 HG12 VAL A 216 -9.046 -6.049 3.879 -0.30 0.02 H new ATOM 0 HG13 VAL A 216 -8.199 -7.158 4.983 -0.30 0.02 H new ATOM 0 HG21 VAL A 216 -9.942 -6.502 7.433 -0.30 0.02 H new ATOM 0 HG22 VAL A 216 -8.166 -6.598 7.497 -0.30 0.02 H new ATOM 0 HG23 VAL A 216 -8.999 -5.127 8.055 -0.30 0.02 H new ATOM 844 N ASN A 217 -6.000 -4.586 4.015 -0.36 0.02 N ATOM 845 CA ASN A 217 -5.527 -4.576 2.660 1.00 0.02 C ATOM 846 C ASN A 217 -5.474 -6.000 2.129 0.48 0.02 C ATOM 847 O ASN A 217 -4.587 -6.761 2.514 -0.48 0.02 O ATOM 848 CB ASN A 217 -4.155 -3.913 2.588 -0.20 0.02 C ATOM 849 CG ASN A 217 -3.505 -4.075 1.236 0.48 0.02 C ATOM 850 OD1 ASN A 217 -4.125 -4.556 0.288 -0.48 0.02 O ATOM 851 ND2 ASN A 217 -2.257 -3.657 1.137 -0.52 0.02 N ATOM 0 H ASN A 217 -5.269 -4.618 4.725 -0.36 0.02 H new ATOM 0 HA ASN A 217 -6.212 -3.999 2.039 1.00 0.02 H new ATOM 0 HB2 ASN A 217 -4.256 -2.852 2.814 -0.20 0.02 H new ATOM 0 HB3 ASN A 217 -3.507 -4.342 3.353 -0.20 0.02 H new ATOM 0 HD21 ASN A 217 -1.765 -3.726 0.246 -0.52 0.02 H new ATOM 0 HD22 ASN A 217 -1.784 -3.265 1.951 -0.52 0.02 H new ATOM 858 N TYR A 218 -6.424 -6.396 1.267 -0.36 0.02 N ATOM 859 CA TYR A 218 -6.405 -7.761 0.774 1.00 0.02 C ATOM 860 C TYR A 218 -5.485 -7.888 -0.418 0.48 0.02 C ATOM 861 O TYR A 218 -5.033 -6.884 -0.980 -0.48 0.02 O ATOM 862 CB TYR A 218 -7.819 -8.283 0.455 -0.20 0.02 C ATOM 863 CG TYR A 218 -8.698 -7.381 -0.386 1.00 0.02 C ATOM 864 CD1 TYR A 218 -8.630 -7.402 -1.777 -0.14 0.02 C ATOM 865 CD2 TYR A 218 -9.631 -6.543 0.211 -0.14 0.02 C ATOM 866 CE1 TYR A 218 -9.466 -6.610 -2.544 -0.14 0.02 C ATOM 867 CE2 TYR A 218 -10.465 -5.744 -0.548 -0.14 0.02 C ATOM 868 CZ TYR A 218 -10.381 -5.782 -1.925 0.20 0.02 C ATOM 869 OH TYR A 218 -11.214 -4.993 -2.684 -0.60 0.02 O ATOM 0 H TYR A 218 -7.181 -5.810 0.915 -0.36 0.02 H new ATOM 0 HA TYR A 218 -6.013 -8.391 1.573 1.00 0.02 H new ATOM 0 HB2 TYR A 218 -7.722 -9.240 -0.058 -0.20 0.02 H new ATOM 0 HB3 TYR A 218 -8.332 -8.477 1.397 -0.20 0.02 H new ATOM 0 HD1 TYR A 218 -7.914 -8.047 -2.265 -0.14 0.02 H new ATOM 0 HD2 TYR A 218 -9.706 -6.515 1.288 -0.14 0.02 H new ATOM 0 HE1 TYR A 218 -9.403 -6.639 -3.622 -0.14 0.02 H new ATOM 0 HE2 TYR A 218 -11.179 -5.093 -0.066 -0.14 0.02 H new ATOM 0 HH TYR A 218 -11.798 -4.472 -2.094 -0.60 0.02 H new ATOM 879 N PRO A 219 -5.146 -9.125 -0.802 -0.36 0.02 N ATOM 880 CA PRO A 219 -4.247 -9.352 -1.911 1.00 0.02 C ATOM 881 C PRO A 219 -4.669 -8.574 -3.152 0.48 0.02 C ATOM 882 O PRO A 219 -5.574 -8.986 -3.877 -0.48 0.02 O ATOM 883 CB PRO A 219 -4.319 -10.868 -2.161 -0.20 0.02 C ATOM 884 CG PRO A 219 -5.438 -11.366 -1.307 -0.20 0.02 C ATOM 885 CD PRO A 219 -5.565 -10.388 -0.177 0.06 0.02 C ATOM 0 HA PRO A 219 -3.236 -9.012 -1.687 1.00 0.02 H new ATOM 0 HB2 PRO A 219 -4.504 -11.083 -3.213 -0.20 0.02 H new ATOM 0 HB3 PRO A 219 -3.379 -11.353 -1.897 -0.20 0.02 H new ATOM 0 HG2 PRO A 219 -6.366 -11.427 -1.876 -0.20 0.02 H new ATOM 0 HG3 PRO A 219 -5.227 -12.368 -0.933 -0.20 0.02 H new ATOM 0 HD2 PRO A 219 -6.586 -10.335 0.201 0.06 0.02 H new ATOM 0 HD3 PRO A 219 -4.927 -10.656 0.665 0.06 0.02 H new ATOM 893 N GLY A 220 -4.000 -7.453 -3.395 -0.36 0.02 N ATOM 894 CA GLY A 220 -4.309 -6.641 -4.555 -0.10 0.02 C ATOM 895 C GLY A 220 -5.054 -5.372 -4.207 0.48 0.02 C ATOM 896 O GLY A 220 -4.508 -4.275 -4.313 -0.48 0.02 O ATOM 0 H GLY A 220 -3.248 -7.092 -2.808 -0.36 0.02 H new ATOM 0 HA2 GLY A 220 -3.383 -6.383 -5.068 -0.10 0.02 H new ATOM 0 HA3 GLY A 220 -4.907 -7.227 -5.253 -0.10 0.02 H new ATOM 900 N GLY A 221 -6.307 -5.523 -3.804 -0.36 0.02 N ATOM 901 CA GLY A 221 -7.117 -4.374 -3.455 -0.10 0.02 C ATOM 902 C GLY A 221 -7.258 -4.165 -1.968 0.48 0.02 C ATOM 903 O GLY A 221 -7.968 -4.906 -1.284 -0.48 0.02 O ATOM 0 H GLY A 221 -6.778 -6.423 -3.712 -0.36 0.02 H new ATOM 0 HA2 GLY A 221 -6.677 -3.481 -3.899 -0.10 0.02 H new ATOM 0 HA3 GLY A 221 -8.108 -4.492 -3.893 -0.10 0.02 H new ATOM 907 N TYR A 222 -6.564 -3.191 -1.426 -0.36 0.02 N ATOM 908 CA TYR A 222 -6.651 -2.962 -0.010 1.00 0.02 C ATOM 909 C TYR A 222 -8.049 -2.498 0.386 0.48 0.02 C ATOM 910 O TYR A 222 -8.930 -2.357 -0.462 -0.48 0.02 O ATOM 911 CB TYR A 222 -5.618 -1.941 0.424 -0.20 0.02 C ATOM 912 CG TYR A 222 -5.886 -0.573 -0.135 1.00 0.02 C ATOM 913 CD1 TYR A 222 -5.495 -0.245 -1.421 -0.14 0.02 C ATOM 914 CD2 TYR A 222 -6.529 0.384 0.626 -0.14 0.02 C ATOM 915 CE1 TYR A 222 -5.736 1.013 -1.939 -0.14 0.02 C ATOM 916 CE2 TYR A 222 -6.779 1.646 0.121 -0.14 0.02 C ATOM 917 CZ TYR A 222 -6.378 1.956 -1.163 0.20 0.02 C ATOM 918 OH TYR A 222 -6.622 3.211 -1.672 -0.60 0.02 O ATOM 0 H TYR A 222 -5.946 -2.559 -1.935 -0.36 0.02 H new ATOM 0 HA TYR A 222 -6.450 -3.906 0.497 1.00 0.02 H new ATOM 0 HB2 TYR A 222 -5.601 -1.887 1.513 -0.20 0.02 H new ATOM 0 HB3 TYR A 222 -4.630 -2.272 0.106 -0.20 0.02 H new ATOM 0 HD1 TYR A 222 -4.994 -0.983 -2.029 -0.14 0.02 H new ATOM 0 HD2 TYR A 222 -6.841 0.142 1.631 -0.14 0.02 H new ATOM 0 HE1 TYR A 222 -5.424 1.256 -2.944 -0.14 0.02 H new ATOM 0 HE2 TYR A 222 -7.284 2.384 0.726 -0.14 0.02 H new ATOM 0 HH TYR A 222 -7.083 3.753 -0.998 -0.60 0.02 H new ATOM 928 N THR A 223 -8.241 -2.251 1.676 -0.36 0.02 N ATOM 929 CA THR A 223 -9.529 -1.791 2.177 1.00 0.02 C ATOM 930 C THR A 223 -9.363 -1.067 3.505 0.48 0.02 C ATOM 931 O THR A 223 -8.470 -1.379 4.289 -0.48 0.02 O ATOM 932 CB THR A 223 -10.490 -2.977 2.313 0.18 0.02 C ATOM 933 OG1 THR A 223 -11.025 -3.327 1.051 -0.68 0.02 O ATOM 934 CG2 THR A 223 -11.654 -2.728 3.242 -0.30 0.02 C ATOM 0 H THR A 223 -7.523 -2.361 2.392 -0.36 0.02 H new ATOM 0 HA THR A 223 -9.952 -1.083 1.464 1.00 0.02 H new ATOM 0 HB THR A 223 -9.885 -3.778 2.737 0.18 0.02 H new ATOM 0 HG1 THR A 223 -10.469 -2.942 0.342 -0.68 0.02 H new ATOM 0 HG21 THR A 223 -12.285 -3.616 3.281 -0.30 0.02 H new ATOM 0 HG22 THR A 223 -11.281 -2.504 4.241 -0.30 0.02 H new ATOM 0 HG23 THR A 223 -12.238 -1.884 2.875 -0.30 0.02 H new ATOM 942 N CYS A 224 -10.226 -0.090 3.741 -0.36 0.02 N ATOM 943 CA CYS A 224 -10.176 0.690 4.965 1.00 0.02 C ATOM 944 C CYS A 224 -11.527 0.677 5.671 0.48 0.02 C ATOM 945 O CYS A 224 -12.462 1.352 5.243 -0.48 0.02 O ATOM 946 CB CYS A 224 -9.766 2.133 4.657 0.20 0.02 C ATOM 947 SG CYS A 224 -8.581 2.298 3.281 -0.20 0.02 S ATOM 0 H CYS A 224 -10.970 0.181 3.098 -0.36 0.02 H new ATOM 0 HA CYS A 224 -9.434 0.239 5.625 1.00 0.02 H new ATOM 0 HB2 CYS A 224 -10.660 2.710 4.422 0.20 0.02 H new ATOM 0 HB3 CYS A 224 -9.328 2.573 5.553 0.20 0.02 H new ATOM 952 N TYR A 225 -11.626 -0.079 6.762 -0.36 0.02 N ATOM 953 CA TYR A 225 -12.873 -0.139 7.510 1.00 0.02 C ATOM 954 C TYR A 225 -12.864 0.869 8.647 0.48 0.02 C ATOM 955 O TYR A 225 -11.851 1.082 9.311 -0.48 0.02 O ATOM 956 CB TYR A 225 -13.196 -1.549 8.015 -0.20 0.02 C ATOM 957 CG TYR A 225 -12.059 -2.284 8.682 1.00 0.02 C ATOM 958 CD1 TYR A 225 -10.953 -2.709 7.961 -0.14 0.02 C ATOM 959 CD2 TYR A 225 -12.118 -2.585 10.033 -0.14 0.02 C ATOM 960 CE1 TYR A 225 -9.939 -3.413 8.562 -0.14 0.02 C ATOM 961 CE2 TYR A 225 -11.100 -3.289 10.651 -0.14 0.02 C ATOM 962 CZ TYR A 225 -10.013 -3.705 9.909 0.20 0.02 C ATOM 963 OH TYR A 225 -8.998 -4.409 10.515 -0.60 0.02 O ATOM 0 H TYR A 225 -10.870 -0.649 7.141 -0.36 0.02 H new ATOM 0 HA TYR A 225 -13.673 0.126 6.818 1.00 0.02 H new ATOM 0 HB2 TYR A 225 -14.024 -1.481 8.721 -0.20 0.02 H new ATOM 0 HB3 TYR A 225 -13.544 -2.146 7.172 -0.20 0.02 H new ATOM 0 HD1 TYR A 225 -10.888 -2.482 6.907 -0.14 0.02 H new ATOM 0 HD2 TYR A 225 -12.971 -2.265 10.612 -0.14 0.02 H new ATOM 0 HE1 TYR A 225 -9.087 -3.737 7.983 -0.14 0.02 H new ATOM 0 HE2 TYR A 225 -11.155 -3.511 11.706 -0.14 0.02 H new ATOM 0 HH TYR A 225 -9.205 -4.529 11.465 -0.60 0.02 H new ATOM 973 N CYS A 226 -13.997 1.527 8.804 -0.36 0.02 N ATOM 974 CA CYS A 226 -14.169 2.582 9.793 1.00 0.02 C ATOM 975 C CYS A 226 -15.135 2.173 10.900 0.48 0.02 C ATOM 976 O CYS A 226 -15.586 1.029 10.945 -0.48 0.02 O ATOM 977 CB CYS A 226 -14.670 3.816 9.065 0.20 0.02 C ATOM 978 SG CYS A 226 -13.888 4.028 7.430 -0.20 0.02 S ATOM 0 H CYS A 226 -14.832 1.346 8.246 -0.36 0.02 H new ATOM 0 HA CYS A 226 -13.216 2.785 10.281 1.00 0.02 H new ATOM 0 HB2 CYS A 226 -15.751 3.747 8.941 0.20 0.02 H new ATOM 0 HB3 CYS A 226 -14.475 4.698 9.675 0.20 0.02 H new ATOM 983 N ASP A 227 -15.424 3.106 11.811 -0.36 0.02 N ATOM 984 CA ASP A 227 -16.309 2.830 12.935 1.00 0.02 C ATOM 985 C ASP A 227 -15.625 1.909 13.941 0.48 0.02 C ATOM 986 O ASP A 227 -15.816 0.693 13.912 -0.48 0.02 O ATOM 987 CB ASP A 227 -17.620 2.200 12.454 -0.45 0.02 C ATOM 988 CG ASP A 227 -18.536 1.810 13.600 0.49 0.02 C ATOM 989 OD1 ASP A 227 -18.546 2.525 14.622 -0.62 0.02 O ATOM 990 OD2 ASP A 227 -19.243 0.788 13.473 -0.62 0.02 O ATOM 0 H ASP A 227 -15.056 4.057 11.788 -0.36 0.02 H new ATOM 0 HA ASP A 227 -16.538 3.777 13.424 1.00 0.02 H new ATOM 0 HB2 ASP A 227 -18.139 2.903 11.802 -0.45 0.02 H new ATOM 0 HB3 ASP A 227 -17.396 1.317 11.856 -0.45 0.02 H new ATOM 995 N GLY A 228 -14.826 2.495 14.828 -0.36 0.02 N ATOM 996 CA GLY A 228 -14.126 1.707 15.825 -0.10 0.02 C ATOM 997 C GLY A 228 -13.967 2.439 17.144 0.48 0.02 C ATOM 998 O GLY A 228 -14.833 2.357 18.015 -0.48 0.02 O ATOM 0 H GLY A 228 -14.652 3.499 14.874 -0.36 0.02 H new ATOM 0 HA2 GLY A 228 -14.669 0.777 15.994 -0.10 0.02 H new ATOM 0 HA3 GLY A 228 -13.141 1.437 15.443 -0.10 0.02 H new ATOM 1002 N LYS A 229 -12.852 3.149 17.295 -0.36 0.02 N ATOM 1003 CA LYS A 229 -12.575 3.891 18.522 1.00 0.02 C ATOM 1004 C LYS A 229 -13.714 4.846 18.868 0.48 0.02 C ATOM 1005 O LYS A 229 -14.241 4.817 19.980 -0.48 0.02 O ATOM 1006 CB LYS A 229 -11.264 4.670 18.388 -0.20 0.02 C ATOM 1007 CG LYS A 229 -11.173 5.502 17.119 -0.20 0.02 C ATOM 1008 CD LYS A 229 -9.762 5.504 16.554 -0.20 0.02 C ATOM 1009 CE LYS A 229 -9.567 6.625 15.546 0.30 5.02 C ATOM 1010 NZ LYS A 229 -8.212 6.588 14.930 -0.81 0.02 N ATOM 0 H LYS A 229 -12.126 3.226 16.583 -0.36 0.02 H new ATOM 0 HA LYS A 229 -12.483 3.167 19.332 1.00 0.02 H new ATOM 0 HB2 LYS A 229 -11.152 5.327 19.251 -0.20 0.02 H new ATOM 0 HB3 LYS A 229 -10.431 3.968 18.412 -0.20 0.02 H new ATOM 0 HG2 LYS A 229 -11.864 5.108 16.374 -0.20 0.02 H new ATOM 0 HG3 LYS A 229 -11.483 6.525 17.331 -0.20 0.02 H new ATOM 0 HD2 LYS A 229 -9.044 5.615 17.366 -0.20 0.02 H new ATOM 0 HD3 LYS A 229 -9.558 4.545 16.077 -0.20 0.02 H new ATOM 0 HE2 LYS A 229 -10.323 6.546 14.765 0.30 5.02 H new ATOM 0 HE3 LYS A 229 -9.716 7.586 16.038 0.30 5.02 H new ATOM 0 HZ1 LYS A 229 -8.119 7.368 14.249 -0.81 0.02 H new ATOM 0 HZ2 LYS A 229 -7.490 6.688 15.672 -0.81 0.02 H new ATOM 0 HZ3 LYS A 229 -8.079 5.681 14.438 -0.81 0.02 H new ATOM 1024 N LYS A 230 -14.089 5.695 17.916 -0.36 0.02 N ATOM 1025 CA LYS A 230 -15.163 6.657 18.135 1.00 0.02 C ATOM 1026 C LYS A 230 -16.531 6.003 17.965 0.48 0.02 C ATOM 1027 O LYS A 230 -17.510 6.427 18.578 -0.48 0.02 O ATOM 1028 CB LYS A 230 -15.028 7.839 17.175 -0.20 0.02 C ATOM 1029 CG LYS A 230 -13.912 8.802 17.548 -0.20 0.02 C ATOM 1030 CD LYS A 230 -13.454 9.617 16.348 -0.20 0.02 C ATOM 1031 CE LYS A 230 -13.287 11.086 16.703 0.30 5.02 C ATOM 1032 NZ LYS A 230 -12.272 11.286 17.774 -0.81 0.02 N ATOM 0 H LYS A 230 -13.666 5.736 16.989 -0.36 0.02 H new ATOM 0 HA LYS A 230 -15.080 7.020 19.159 1.00 0.02 H new ATOM 0 HB2 LYS A 230 -14.849 7.460 16.169 -0.20 0.02 H new ATOM 0 HB3 LYS A 230 -15.972 8.383 17.147 -0.20 0.02 H new ATOM 0 HG2 LYS A 230 -14.257 9.473 18.335 -0.20 0.02 H new ATOM 0 HG3 LYS A 230 -13.068 8.243 17.953 -0.20 0.02 H new ATOM 0 HD2 LYS A 230 -12.508 9.221 15.978 -0.20 0.02 H new ATOM 0 HD3 LYS A 230 -14.179 9.517 15.541 -0.20 0.02 H new ATOM 0 HE2 LYS A 230 -12.991 11.643 15.814 0.30 5.02 H new ATOM 0 HE3 LYS A 230 -14.244 11.492 17.030 0.30 5.02 H new ATOM 0 HZ1 LYS A 230 -12.089 12.303 17.893 -0.81 0.02 H new ATOM 0 HZ2 LYS A 230 -12.628 10.892 18.668 -0.81 0.02 H new ATOM 0 HZ3 LYS A 230 -11.389 10.804 17.510 -0.81 0.02 H new ATOM 1046 N GLY A 231 -16.593 4.970 17.130 -0.36 0.02 N ATOM 1047 CA GLY A 231 -17.850 4.282 16.898 -0.10 0.02 C ATOM 1048 C GLY A 231 -18.740 5.020 15.918 0.48 0.02 C ATOM 1049 O GLY A 231 -19.803 5.519 16.288 -0.48 0.02 O ATOM 0 H GLY A 231 -15.797 4.598 16.611 -0.36 0.02 H new ATOM 0 HA2 GLY A 231 -17.648 3.280 16.518 -0.10 0.02 H new ATOM 0 HA3 GLY A 231 -18.377 4.164 17.845 -0.10 0.02 H new ATOM 1053 N PHE A 232 -18.302 5.094 14.665 -0.36 0.02 N ATOM 1054 CA PHE A 232 -19.062 5.780 13.628 1.00 0.02 C ATOM 1055 C PHE A 232 -19.402 4.851 12.455 0.48 0.02 C ATOM 1056 O PHE A 232 -20.019 3.805 12.653 -0.48 0.02 O ATOM 1057 CB PHE A 232 -18.308 7.008 13.147 -0.16 0.02 C ATOM 1058 CG PHE A 232 -16.844 6.832 12.945 0.03 0.02 C ATOM 1059 CD1 PHE A 232 -15.963 6.967 14.001 -0.16 0.02 C ATOM 1060 CD2 PHE A 232 -16.348 6.585 11.682 -0.16 0.02 C ATOM 1061 CE1 PHE A 232 -14.604 6.848 13.801 -0.15 0.02 C ATOM 1062 CE2 PHE A 232 -14.994 6.475 11.473 -0.15 0.02 C ATOM 1063 CZ PHE A 232 -14.118 6.604 12.534 -0.15 0.02 C ATOM 0 H PHE A 232 -17.424 4.687 14.344 -0.36 0.02 H new ATOM 0 HA PHE A 232 -20.008 6.098 14.067 1.00 0.02 H new ATOM 0 HB2 PHE A 232 -18.749 7.336 12.205 -0.16 0.02 H new ATOM 0 HB3 PHE A 232 -18.462 7.811 13.868 -0.16 0.02 H new ATOM 0 HD1 PHE A 232 -16.342 7.168 14.992 -0.16 0.02 H new ATOM 0 HD2 PHE A 232 -17.029 6.477 10.851 -0.16 0.02 H new ATOM 0 HE1 PHE A 232 -13.923 6.946 14.633 -0.15 0.02 H new ATOM 0 HE2 PHE A 232 -14.615 6.288 10.479 -0.15 0.02 H new ATOM 0 HZ PHE A 232 -13.054 6.514 12.371 -0.15 0.02 H new ATOM 1073 N LYS A 233 -19.034 5.243 11.231 -0.36 0.02 N ATOM 1074 CA LYS A 233 -19.338 4.449 10.053 1.00 0.02 C ATOM 1075 C LYS A 233 -18.393 4.772 8.900 0.48 0.02 C ATOM 1076 O LYS A 233 -17.920 5.898 8.768 -0.48 0.02 O ATOM 1077 CB LYS A 233 -20.762 4.748 9.623 -0.20 0.02 C ATOM 1078 CG LYS A 233 -21.799 3.835 10.256 -0.20 0.02 C ATOM 1079 CD LYS A 233 -23.189 4.097 9.698 -0.20 0.02 C ATOM 1080 CE LYS A 233 -24.257 3.943 10.770 0.30 5.02 C ATOM 1081 NZ LYS A 233 -25.608 4.311 10.265 -0.81 0.02 N ATOM 0 H LYS A 233 -18.526 6.106 11.038 -0.36 0.02 H new ATOM 0 HA LYS A 233 -19.217 3.395 10.305 1.00 0.02 H new ATOM 0 HB2 LYS A 233 -20.999 5.781 9.876 -0.20 0.02 H new ATOM 0 HB3 LYS A 233 -20.830 4.662 8.538 -0.20 0.02 H new ATOM 0 HG2 LYS A 233 -21.525 2.795 10.079 -0.20 0.02 H new ATOM 0 HG3 LYS A 233 -21.805 3.984 11.336 -0.20 0.02 H new ATOM 0 HD2 LYS A 233 -23.232 5.104 9.282 -0.20 0.02 H new ATOM 0 HD3 LYS A 233 -23.390 3.405 8.880 -0.20 0.02 H new ATOM 0 HE2 LYS A 233 -24.270 2.912 11.124 0.30 5.02 H new ATOM 0 HE3 LYS A 233 -24.006 4.570 11.625 0.30 5.02 H new ATOM 0 HZ1 LYS A 233 -26.307 4.192 11.026 -0.81 0.02 H new ATOM 0 HZ2 LYS A 233 -25.603 5.302 9.951 -0.81 0.02 H new ATOM 0 HZ3 LYS A 233 -25.859 3.696 9.465 -0.81 0.02 H new ATOM 1095 N LEU A 234 -18.126 3.781 8.059 -0.36 0.02 N ATOM 1096 CA LEU A 234 -17.247 3.973 6.914 1.00 0.02 C ATOM 1097 C LEU A 234 -17.988 4.666 5.774 0.48 0.02 C ATOM 1098 O LEU A 234 -18.943 4.117 5.225 -0.48 0.02 O ATOM 1099 CB LEU A 234 -16.695 2.621 6.443 -0.20 0.02 C ATOM 1100 CG LEU A 234 -16.229 2.556 4.981 -0.10 0.02 C ATOM 1101 CD1 LEU A 234 -15.312 3.725 4.645 -0.30 0.02 C ATOM 1102 CD2 LEU A 234 -15.527 1.232 4.705 -0.30 0.02 C ATOM 0 H LEU A 234 -18.505 2.838 8.148 -0.36 0.02 H new ATOM 0 HA LEU A 234 -16.416 4.609 7.219 1.00 0.02 H new ATOM 0 HB2 LEU A 234 -15.855 2.351 7.083 -0.20 0.02 H new ATOM 0 HB3 LEU A 234 -17.466 1.865 6.592 -0.20 0.02 H new ATOM 0 HG LEU A 234 -17.110 2.625 4.343 -0.10 0.02 H new ATOM 0 HD11 LEU A 234 -14.998 3.653 3.604 -0.30 0.02 H new ATOM 0 HD12 LEU A 234 -15.846 4.662 4.799 -0.30 0.02 H new ATOM 0 HD13 LEU A 234 -14.435 3.697 5.292 -0.30 0.02 H new ATOM 0 HD21 LEU A 234 -15.203 1.202 3.665 -0.30 0.02 H new ATOM 0 HD22 LEU A 234 -14.660 1.137 5.358 -0.30 0.02 H new ATOM 0 HD23 LEU A 234 -16.216 0.409 4.894 -0.30 0.02 H new ATOM 1114 N ALA A 235 -17.566 5.888 5.443 -0.36 0.02 N ATOM 1115 CA ALA A 235 -18.221 6.659 4.387 1.00 0.02 C ATOM 1116 C ALA A 235 -18.412 5.835 3.113 0.48 0.02 C ATOM 1117 O ALA A 235 -18.106 4.644 3.071 -0.48 0.02 O ATOM 1118 CB ALA A 235 -17.420 7.912 4.073 -0.30 0.02 C ATOM 0 H ALA A 235 -16.780 6.361 5.888 -0.36 0.02 H new ATOM 0 HA ALA A 235 -19.208 6.940 4.756 1.00 0.02 H new ATOM 0 HB1 ALA A 235 -17.920 8.476 3.285 -0.30 0.02 H new ATOM 0 HB2 ALA A 235 -17.344 8.529 4.968 -0.30 0.02 H new ATOM 0 HB3 ALA A 235 -16.421 7.631 3.740 -0.30 0.02 H new ATOM 1124 N GLN A 236 -18.945 6.482 2.082 -0.36 0.02 N ATOM 1125 CA GLN A 236 -19.217 5.818 0.812 1.00 0.02 C ATOM 1126 C GLN A 236 -17.998 5.773 -0.109 0.48 0.02 C ATOM 1127 O GLN A 236 -18.137 5.514 -1.304 -0.48 0.02 O ATOM 1128 CB GLN A 236 -20.378 6.510 0.095 -0.20 0.02 C ATOM 1129 CG GLN A 236 -21.148 5.593 -0.841 -0.20 0.02 C ATOM 1130 CD GLN A 236 -22.023 6.357 -1.816 0.48 0.02 C ATOM 1131 OE1 GLN A 236 -21.551 6.836 -2.847 -0.48 0.02 O ATOM 1132 NE2 GLN A 236 -23.306 6.474 -1.494 -0.52 0.02 N ATOM 0 H GLN A 236 -19.198 7.470 2.101 -0.36 0.02 H new ATOM 0 HA GLN A 236 -19.481 4.787 1.047 1.00 0.02 H new ATOM 0 HB2 GLN A 236 -21.064 6.915 0.839 -0.20 0.02 H new ATOM 0 HB3 GLN A 236 -19.991 7.355 -0.475 -0.20 0.02 H new ATOM 0 HG2 GLN A 236 -20.444 4.974 -1.398 -0.20 0.02 H new ATOM 0 HG3 GLN A 236 -21.770 4.918 -0.253 -0.20 0.02 H new ATOM 0 HE21 GLN A 236 -23.654 6.061 -0.629 -0.52 0.02 H new ATOM 0 HE22 GLN A 236 -23.943 6.977 -2.112 -0.52 0.02 H new ATOM 1141 N ASP A 237 -16.809 6.018 0.430 -0.36 0.02 N ATOM 1142 CA ASP A 237 -15.597 5.989 -0.387 1.00 0.02 C ATOM 1143 C ASP A 237 -14.864 4.656 -0.238 0.48 0.02 C ATOM 1144 O ASP A 237 -14.091 4.265 -1.111 -0.48 0.02 O ATOM 1145 CB ASP A 237 -14.656 7.142 -0.012 -0.45 0.02 C ATOM 1146 CG ASP A 237 -15.400 8.379 0.457 0.49 0.02 C ATOM 1147 OD1 ASP A 237 -16.470 8.679 -0.113 -0.62 0.02 O ATOM 1148 OD2 ASP A 237 -14.911 9.046 1.393 -0.62 0.02 O ATOM 0 H ASP A 237 -16.657 6.236 1.415 -0.36 0.02 H new ATOM 0 HA ASP A 237 -15.901 6.106 -1.427 1.00 0.02 H new ATOM 0 HB2 ASP A 237 -13.979 6.811 0.775 -0.45 0.02 H new ATOM 0 HB3 ASP A 237 -14.041 7.399 -0.875 -0.45 0.02 H new ATOM 1153 N GLN A 238 -15.108 3.964 0.877 -0.36 0.02 N ATOM 1154 CA GLN A 238 -14.469 2.673 1.149 1.00 0.02 C ATOM 1155 C GLN A 238 -13.009 2.850 1.590 0.48 0.02 C ATOM 1156 O GLN A 238 -12.349 1.887 1.980 -0.48 0.02 O ATOM 1157 CB GLN A 238 -14.562 1.754 -0.083 -0.20 0.02 C ATOM 1158 CG GLN A 238 -13.276 1.642 -0.893 -0.20 0.02 C ATOM 1159 CD GLN A 238 -12.370 0.533 -0.396 0.48 0.02 C ATOM 1160 OE1 GLN A 238 -12.691 -0.160 0.570 -0.48 0.02 O ATOM 1161 NE2 GLN A 238 -11.231 0.359 -1.056 -0.52 0.02 N ATOM 0 H GLN A 238 -15.746 4.277 1.609 -0.36 0.02 H new ATOM 0 HA GLN A 238 -15.005 2.202 1.973 1.00 0.02 H new ATOM 0 HB2 GLN A 238 -14.856 0.757 0.246 -0.20 0.02 H new ATOM 0 HB3 GLN A 238 -15.355 2.122 -0.735 -0.20 0.02 H new ATOM 0 HG2 GLN A 238 -13.524 1.462 -1.939 -0.20 0.02 H new ATOM 0 HG3 GLN A 238 -12.740 2.590 -0.851 -0.20 0.02 H new ATOM 0 HE21 GLN A 238 -11.006 0.957 -1.851 -0.52 0.02 H new ATOM 0 HE22 GLN A 238 -10.581 -0.373 -0.768 -0.52 0.02 H new ATOM 1170 N LYS A 239 -12.517 4.084 1.526 -0.36 0.02 N ATOM 1171 CA LYS A 239 -11.143 4.379 1.916 1.00 0.02 C ATOM 1172 C LYS A 239 -11.106 5.331 3.110 0.48 0.02 C ATOM 1173 O LYS A 239 -10.380 5.099 4.076 -0.48 0.02 O ATOM 1174 CB LYS A 239 -10.360 4.972 0.740 -0.20 0.02 C ATOM 1175 CG LYS A 239 -11.102 6.069 -0.012 -0.20 0.02 C ATOM 1176 CD LYS A 239 -11.216 5.753 -1.495 -0.20 0.02 C ATOM 1177 CE LYS A 239 -11.146 7.015 -2.341 0.30 5.02 C ATOM 1178 NZ LYS A 239 -9.844 7.719 -2.180 -0.81 0.02 N ATOM 0 H LYS A 239 -13.049 4.894 1.208 -0.36 0.02 H new ATOM 0 HA LYS A 239 -10.671 3.442 2.210 1.00 0.02 H new ATOM 0 HB2 LYS A 239 -9.418 5.375 1.111 -0.20 0.02 H new ATOM 0 HB3 LYS A 239 -10.112 4.172 0.042 -0.20 0.02 H new ATOM 0 HG2 LYS A 239 -12.099 6.191 0.412 -0.20 0.02 H new ATOM 0 HG3 LYS A 239 -10.581 7.017 0.119 -0.20 0.02 H new ATOM 0 HD2 LYS A 239 -10.415 5.074 -1.786 -0.20 0.02 H new ATOM 0 HD3 LYS A 239 -12.157 5.237 -1.687 -0.20 0.02 H new ATOM 0 HE2 LYS A 239 -11.292 6.758 -3.390 0.30 5.02 H new ATOM 0 HE3 LYS A 239 -11.958 7.685 -2.061 0.30 5.02 H new ATOM 0 HZ1 LYS A 239 -9.610 8.222 -3.060 -0.81 0.02 H new ATOM 0 HZ2 LYS A 239 -9.913 8.402 -1.399 -0.81 0.02 H new ATOM 0 HZ3 LYS A 239 -9.098 7.026 -1.969 -0.81 0.02 H new ATOM 1192 N SER A 240 -11.899 6.397 3.041 -0.36 0.02 N ATOM 1193 CA SER A 240 -11.960 7.376 4.122 1.00 0.02 C ATOM 1194 C SER A 240 -12.875 6.880 5.233 0.48 0.02 C ATOM 1195 O SER A 240 -13.350 5.746 5.191 -0.48 0.02 O ATOM 1196 CB SER A 240 -12.454 8.725 3.596 0.08 0.02 C ATOM 1197 OG SER A 240 -12.196 8.859 2.209 -0.68 0.02 O ATOM 0 H SER A 240 -12.507 6.605 2.249 -0.36 0.02 H new ATOM 0 HA SER A 240 -10.956 7.507 4.526 1.00 0.02 H new ATOM 0 HB2 SER A 240 -13.524 8.821 3.781 0.08 0.02 H new ATOM 0 HB3 SER A 240 -11.963 9.532 4.140 0.08 0.02 H new ATOM 0 HG SER A 240 -13.044 8.939 1.725 -0.68 0.02 H new ATOM 1203 N CYS A 241 -13.113 7.726 6.231 -0.36 0.02 N ATOM 1204 CA CYS A 241 -13.964 7.353 7.357 1.00 0.02 C ATOM 1205 C CYS A 241 -14.711 8.563 7.905 0.48 0.02 C ATOM 1206 O CYS A 241 -14.123 9.625 8.110 -0.48 0.02 O ATOM 1207 CB CYS A 241 -13.104 6.693 8.435 0.20 0.02 C ATOM 1208 SG CYS A 241 -12.290 5.196 7.835 -0.20 0.02 S ATOM 0 H CYS A 241 -12.731 8.670 6.283 -0.36 0.02 H new ATOM 0 HA CYS A 241 -14.718 6.642 7.019 1.00 0.02 H new ATOM 0 HB2 CYS A 241 -12.351 7.401 8.780 0.20 0.02 H new ATOM 0 HB3 CYS A 241 -13.727 6.446 9.294 0.20 0.02 H new ATOM 1213 N GLU A 242 -16.020 8.409 8.118 -0.36 0.02 N ATOM 1214 CA GLU A 242 -16.834 9.512 8.614 1.00 0.02 C ATOM 1215 C GLU A 242 -17.819 9.085 9.706 0.48 0.02 C ATOM 1216 O GLU A 242 -18.429 8.018 9.636 -0.48 0.02 O ATOM 1217 CB GLU A 242 -17.598 10.158 7.457 -0.20 0.02 C ATOM 1218 CG GLU A 242 -18.687 9.269 6.876 -0.45 0.02 C ATOM 1219 CD GLU A 242 -19.567 10.001 5.881 0.49 0.02 C ATOM 1220 OE1 GLU A 242 -19.708 11.235 6.008 -0.62 0.02 O ATOM 1221 OE2 GLU A 242 -20.115 9.339 4.974 -0.62 0.02 O ATOM 0 H GLU A 242 -16.531 7.541 7.956 -0.36 0.02 H new ATOM 0 HA GLU A 242 -16.149 10.231 9.064 1.00 0.02 H new ATOM 0 HB2 GLU A 242 -18.047 11.089 7.804 -0.20 0.02 H new ATOM 0 HB3 GLU A 242 -16.893 10.418 6.667 -0.20 0.02 H new ATOM 0 HG2 GLU A 242 -18.227 8.410 6.386 -0.45 0.02 H new ATOM 0 HG3 GLU A 242 -19.305 8.881 7.686 -0.45 0.02 H new ATOM 1228 N VAL A 243 -17.978 9.950 10.705 -0.36 0.02 N ATOM 1229 CA VAL A 243 -18.899 9.705 11.813 1.00 0.02 C ATOM 1230 C VAL A 243 -20.214 10.448 11.595 0.48 0.02 C ATOM 1231 O VAL A 243 -20.223 11.636 11.273 -0.48 0.02 O ATOM 1232 CB VAL A 243 -18.285 10.147 13.159 -0.10 0.02 C ATOM 1233 CG1 VAL A 243 -17.732 11.560 13.055 -0.30 0.02 C ATOM 1234 CG2 VAL A 243 -19.309 10.048 14.285 -0.30 0.02 C ATOM 0 H VAL A 243 -17.476 10.835 10.770 -0.36 0.02 H new ATOM 0 HA VAL A 243 -19.088 8.632 11.846 1.00 0.02 H new ATOM 0 HB VAL A 243 -17.462 9.473 13.395 -0.10 0.02 H new ATOM 0 HG11 VAL A 243 -17.303 11.854 14.013 -0.30 0.02 H new ATOM 0 HG12 VAL A 243 -16.960 11.593 12.287 -0.30 0.02 H new ATOM 0 HG13 VAL A 243 -18.536 12.247 12.791 -0.30 0.02 H new ATOM 0 HG21 VAL A 243 -18.851 10.365 15.222 -0.30 0.02 H new ATOM 0 HG22 VAL A 243 -20.160 10.692 14.061 -0.30 0.02 H new ATOM 0 HG23 VAL A 243 -19.649 9.017 14.378 -0.30 0.02 H new ATOM 1244 N VAL A 244 -21.323 9.738 11.771 -0.36 0.02 N ATOM 1245 CA VAL A 244 -22.640 10.323 11.594 1.00 0.02 C ATOM 1246 C VAL A 244 -23.226 10.771 12.927 0.48 0.02 C ATOM 1247 O VAL A 244 -24.016 10.057 13.545 -0.48 0.02 O ATOM 1248 CB VAL A 244 -23.605 9.324 10.942 -0.10 0.02 C ATOM 1249 CG1 VAL A 244 -23.180 9.019 9.514 -0.30 0.02 C ATOM 1250 CG2 VAL A 244 -23.690 8.049 11.770 -0.30 0.02 C ATOM 0 H VAL A 244 -21.332 8.753 12.037 -0.36 0.02 H new ATOM 0 HA VAL A 244 -22.519 11.188 10.943 1.00 0.02 H new ATOM 0 HB VAL A 244 -24.597 9.774 10.907 -0.10 0.02 H new ATOM 0 HG11 VAL A 244 -23.878 8.309 9.071 -0.30 0.02 H new ATOM 0 HG12 VAL A 244 -23.179 9.939 8.930 -0.30 0.02 H new ATOM 0 HG13 VAL A 244 -22.178 8.590 9.516 -0.30 0.02 H new ATOM 0 HG21 VAL A 244 -24.379 7.351 11.294 -0.30 0.02 H new ATOM 0 HG22 VAL A 244 -22.702 7.594 11.839 -0.30 0.02 H new ATOM 0 HG23 VAL A 244 -24.050 8.288 12.771 -0.30 0.02 H new ATOM 1260 N SER A 245 -22.838 11.956 13.368 -0.36 0.02 N ATOM 1261 CA SER A 245 -23.330 12.487 14.630 1.00 0.02 C ATOM 1262 C SER A 245 -24.325 13.619 14.395 0.14 0.02 C ATOM 1263 O SER A 245 -25.128 13.900 15.309 -0.57 0.02 O ATOM 1264 CB SER A 245 -22.167 12.982 15.492 0.08 0.02 C ATOM 1265 OG SER A 245 -21.070 13.381 14.689 -0.68 0.02 O ATOM 1266 OXT SER A 245 -24.291 14.217 13.298 -0.57 0.02 O ATOM 0 H SER A 245 -22.187 12.567 12.874 -0.36 0.02 H new ATOM 0 HA SER A 245 -23.843 11.682 15.156 1.00 0.02 H new ATOM 0 HB2 SER A 245 -22.496 13.821 16.106 0.08 0.02 H new ATOM 0 HB3 SER A 245 -21.854 12.192 16.174 0.08 0.02 H new ATOM 0 HG SER A 245 -20.341 13.695 15.264 -0.68 0.02 H new TER 1272 SER A 245 HETATM 1273 CA CA A 246 13.092 6.674 -7.235 2.00 0.02 CA HETATM 1274 CA CA A 247 -2.497 -5.978 -0.483 2.00 0.02 CA HETATM 1275 O HOH A 248 12.603 7.831 -5.140 -0.83 4.02 O HETATM 1278 O HOH A 249 -4.672 -5.067 -1.112 -0.83 4.02 O