USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 740 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 213 THR OG1 : rot -89:sc= -0.139 USER MOD Set 1.2: A 286 CYS SG : rot 112:sc= -3.45! USER MOD Set 1.3: A 293 CYS SG : rot -76:sc= -5.49! USER MOD Set 2.1: A 248 LYS NZ :NH3+ -166:sc= 1.1 (180deg=0) USER MOD Set 2.2: A 249 ASN : amide:sc= -2.41 K(o=-1.3,f=-4.2!) USER MOD Set 3.1: A 234 THR OG1 : rot 180:sc= 0.275 USER MOD Set 3.2: A 270 THR OG1 : rot -102:sc= 0.293 USER MOD Single : A 210 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0631) USER MOD Single : A 211 LYS NZ :NH3+ 136:sc= 1.1 (180deg=-0.245) USER MOD Single : A 212 SER OG : rot -20:sc= 0.545 USER MOD Single : A 216 GLN : amide:sc= -2.95! K(o=-2.9!,f=-0.63) USER MOD Single : A 217 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 218 LYS NZ :NH3+ 180:sc= 1.76 (180deg=1.76) USER MOD Single : A 223 TYR OH : rot 180:sc= -1.18! USER MOD Single : A 224 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 226 SER OG : rot 180:sc= 0 USER MOD Single : A 227 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 229 HIS : no HD1:sc= -0.153 X(o=-0.15,f=-0.16) USER MOD Single : A 230 LYS NZ :NH3+ -158:sc= 1.14 (180deg=0.784) USER MOD Single : A 240 HIS : no HD1:sc= -2.16 K(o=-2.2,f=0.099) USER MOD Single : A 245 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 251 GLN : amide:sc= -1.12! K(o=-1.1!,f=-0.0069) USER MOD Single : A 254 GLN : amide:sc= -0.0936 X(o=-0.094,f=-0.51) USER MOD Single : A 255 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 256 SER OG : rot 180:sc=-0.000364 USER MOD Single : A 258 SER OG : rot 180:sc= 0 USER MOD Single : A 259 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 260 TYR OH : rot 180:sc= 0 USER MOD Single : A 264 SER OG : rot 180:sc= 0 USER MOD Single : A 268 LYS NZ :NH3+ -112:sc= 1.27 (180deg=-0.768) USER MOD Single : A 272 THR OG1 : rot 180:sc= -0.0391 USER MOD Single : A 274 SER OG : rot 180:sc= 0 USER MOD Single : A 275 GLN : amide:sc= -1.02 K(o=-1,f=-3.3!) USER MOD Single : A 276 CYS SG : rot -140:sc= -1.89 USER MOD Single : A 277 SER OG : rot 180:sc= 0 USER MOD Single : A 284 TYR OH : rot 180:sc= 0 USER MOD Single : A 285 GLN : amide:sc= -16.6! C(o=-17!,f=-12!) USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 SER OG : rot 180:sc= 0.00331 USER MOD Single : A 295 THR OG1 : rot -149:sc= -2.71! USER MOD Single : A 300 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 208 5.911 -15.249 -3.957 1.00 3.09 N ATOM 2 CA ASP A 208 6.647 -15.535 -2.697 1.00 2.68 C ATOM 3 C ASP A 208 6.654 -14.306 -1.796 1.00 1.97 C ATOM 4 O ASP A 208 7.681 -13.945 -1.218 1.00 2.14 O ATOM 5 CB ASP A 208 8.085 -15.934 -3.035 1.00 3.41 C ATOM 6 CG ASP A 208 8.167 -17.088 -4.010 1.00 4.18 C ATOM 7 OD1 ASP A 208 7.444 -18.087 -3.817 1.00 4.43 O ATOM 8 OD2 ASP A 208 8.936 -17.001 -4.983 1.00 4.71 O ATOM 0 HA ASP A 208 6.151 -16.350 -2.170 1.00 2.68 H new ATOM 0 HB2 ASP A 208 8.605 -15.073 -3.455 1.00 3.41 H new ATOM 0 HB3 ASP A 208 8.606 -16.204 -2.117 1.00 3.41 H new ATOM 13 N GLU A 209 5.537 -13.605 -1.779 1.00 1.38 N ATOM 14 CA GLU A 209 5.427 -12.337 -1.086 1.00 0.90 C ATOM 15 C GLU A 209 5.158 -12.536 0.404 1.00 0.92 C ATOM 16 O GLU A 209 4.157 -13.144 0.782 1.00 1.33 O ATOM 17 CB GLU A 209 4.296 -11.505 -1.703 1.00 1.00 C ATOM 18 CG GLU A 209 4.483 -11.145 -3.176 1.00 0.81 C ATOM 19 CD GLU A 209 4.111 -12.264 -4.140 1.00 1.10 C ATOM 20 OE1 GLU A 209 3.891 -13.399 -3.674 1.00 1.52 O ATOM 21 OE2 GLU A 209 4.035 -12.023 -5.365 1.00 1.51 O ATOM 0 H GLU A 209 4.679 -13.899 -2.246 1.00 1.38 H new ATOM 0 HA GLU A 209 6.376 -11.813 -1.194 1.00 0.90 H new ATOM 0 HB2 GLU A 209 3.361 -12.055 -1.596 1.00 1.00 H new ATOM 0 HB3 GLU A 209 4.191 -10.583 -1.131 1.00 1.00 H new ATOM 0 HG2 GLU A 209 3.879 -10.267 -3.404 1.00 0.81 H new ATOM 0 HG3 GLU A 209 5.524 -10.867 -3.342 1.00 0.81 H new ATOM 28 N LYS A 210 5.989 -11.918 1.234 1.00 1.02 N ATOM 29 CA LYS A 210 5.799 -11.905 2.674 1.00 1.23 C ATOM 30 C LYS A 210 6.403 -10.618 3.204 1.00 1.22 C ATOM 31 O LYS A 210 5.996 -9.530 2.788 1.00 1.70 O ATOM 32 CB LYS A 210 6.444 -13.131 3.341 1.00 1.64 C ATOM 33 CG LYS A 210 5.651 -14.418 3.172 1.00 2.30 C ATOM 34 CD LYS A 210 4.289 -14.331 3.845 1.00 2.91 C ATOM 35 CE LYS A 210 3.462 -15.588 3.615 1.00 3.69 C ATOM 36 NZ LYS A 210 4.075 -16.787 4.247 1.00 4.13 N ATOM 0 H LYS A 210 6.817 -11.410 0.923 1.00 1.02 H new ATOM 0 HA LYS A 210 4.735 -11.952 2.908 1.00 1.23 H new ATOM 0 HB2 LYS A 210 7.442 -13.274 2.926 1.00 1.64 H new ATOM 0 HB3 LYS A 210 6.567 -12.930 4.405 1.00 1.64 H new ATOM 0 HG2 LYS A 210 5.520 -14.628 2.111 1.00 2.30 H new ATOM 0 HG3 LYS A 210 6.214 -15.250 3.595 1.00 2.30 H new ATOM 0 HD2 LYS A 210 4.422 -14.175 4.915 1.00 2.91 H new ATOM 0 HD3 LYS A 210 3.749 -13.466 3.461 1.00 2.91 H new ATOM 0 HE2 LYS A 210 2.460 -15.440 4.017 1.00 3.69 H new ATOM 0 HE3 LYS A 210 3.354 -15.759 2.544 1.00 3.69 H new ATOM 0 HZ1 LYS A 210 3.430 -17.597 4.153 1.00 4.13 H new ATOM 0 HZ2 LYS A 210 4.976 -17.005 3.776 1.00 4.13 H new ATOM 0 HZ3 LYS A 210 4.248 -16.598 5.255 1.00 4.13 H new ATOM 50 N LYS A 211 7.474 -10.730 3.962 1.00 0.88 N ATOM 51 CA LYS A 211 8.244 -9.557 4.319 1.00 0.88 C ATOM 52 C LYS A 211 9.572 -9.524 3.565 1.00 0.95 C ATOM 53 O LYS A 211 10.420 -10.402 3.727 1.00 1.30 O ATOM 54 CB LYS A 211 8.487 -9.469 5.818 1.00 1.13 C ATOM 55 CG LYS A 211 9.287 -8.234 6.188 1.00 1.10 C ATOM 56 CD LYS A 211 8.575 -6.957 5.750 1.00 0.94 C ATOM 57 CE LYS A 211 9.334 -5.701 6.158 1.00 0.58 C ATOM 58 NZ LYS A 211 10.733 -5.684 5.649 1.00 1.33 N ATOM 0 H LYS A 211 7.828 -11.609 4.339 1.00 0.88 H new ATOM 0 HA LYS A 211 7.653 -8.689 4.028 1.00 0.88 H new ATOM 0 HB2 LYS A 211 7.531 -9.453 6.341 1.00 1.13 H new ATOM 0 HB3 LYS A 211 9.018 -10.360 6.153 1.00 1.13 H new ATOM 0 HG2 LYS A 211 9.447 -8.212 7.266 1.00 1.10 H new ATOM 0 HG3 LYS A 211 10.271 -8.282 5.721 1.00 1.10 H new ATOM 0 HD2 LYS A 211 8.450 -6.967 4.667 1.00 0.94 H new ATOM 0 HD3 LYS A 211 7.576 -6.933 6.186 1.00 0.94 H new ATOM 0 HE2 LYS A 211 8.805 -4.824 5.784 1.00 0.58 H new ATOM 0 HE3 LYS A 211 9.346 -5.626 7.245 1.00 0.58 H new ATOM 0 HZ1 LYS A 211 10.952 -4.741 5.268 1.00 1.33 H new ATOM 0 HZ2 LYS A 211 11.388 -5.904 6.426 1.00 1.33 H new ATOM 0 HZ3 LYS A 211 10.837 -6.394 4.896 1.00 1.33 H new ATOM 72 N SER A 212 9.749 -8.479 2.779 1.00 1.04 N ATOM 73 CA SER A 212 10.958 -8.246 1.999 1.00 1.39 C ATOM 74 C SER A 212 10.953 -6.781 1.557 1.00 1.11 C ATOM 75 O SER A 212 10.698 -5.900 2.381 1.00 1.73 O ATOM 76 CB SER A 212 11.020 -9.175 0.777 1.00 1.91 C ATOM 77 OG SER A 212 10.859 -10.537 1.146 1.00 2.46 O ATOM 0 H SER A 212 9.044 -7.751 2.660 1.00 1.04 H new ATOM 0 HA SER A 212 11.837 -8.460 2.608 1.00 1.39 H new ATOM 0 HB2 SER A 212 10.242 -8.895 0.067 1.00 1.91 H new ATOM 0 HB3 SER A 212 11.976 -9.046 0.269 1.00 1.91 H new ATOM 0 HG SER A 212 11.054 -10.643 2.101 1.00 2.46 H new ATOM 83 N THR A 213 11.071 -6.549 0.239 1.00 0.75 N ATOM 84 CA THR A 213 10.950 -5.213 -0.368 1.00 0.42 C ATOM 85 C THR A 213 11.872 -4.187 0.288 1.00 0.62 C ATOM 86 O THR A 213 12.715 -4.527 1.119 1.00 1.59 O ATOM 87 CB THR A 213 9.477 -4.704 -0.349 1.00 0.48 C ATOM 88 OG1 THR A 213 8.933 -4.720 0.975 1.00 1.20 O ATOM 89 CG2 THR A 213 8.616 -5.552 -1.253 1.00 0.93 C ATOM 0 H THR A 213 11.254 -7.288 -0.440 1.00 0.75 H new ATOM 0 HA THR A 213 11.265 -5.323 -1.406 1.00 0.42 H new ATOM 0 HB THR A 213 9.483 -3.675 -0.708 1.00 0.48 H new ATOM 0 HG1 THR A 213 8.527 -5.594 1.151 1.00 1.20 H new ATOM 0 HG21 THR A 213 7.590 -5.184 -1.229 1.00 0.93 H new ATOM 0 HG22 THR A 213 8.997 -5.499 -2.273 1.00 0.93 H new ATOM 0 HG23 THR A 213 8.638 -6.587 -0.911 1.00 0.93 H new ATOM 97 N ALA A 214 11.736 -2.931 -0.111 1.00 0.50 N ATOM 98 CA ALA A 214 12.522 -1.866 0.481 1.00 0.39 C ATOM 99 C ALA A 214 11.723 -1.174 1.559 1.00 0.25 C ATOM 100 O ALA A 214 11.997 -0.031 1.926 1.00 0.27 O ATOM 101 CB ALA A 214 12.945 -0.861 -0.556 1.00 0.48 C ATOM 0 H ALA A 214 11.090 -2.628 -0.840 1.00 0.50 H new ATOM 0 HA ALA A 214 13.418 -2.310 0.916 1.00 0.39 H new ATOM 0 HB1 ALA A 214 13.533 -0.075 -0.082 1.00 0.48 H new ATOM 0 HB2 ALA A 214 13.548 -1.356 -1.318 1.00 0.48 H new ATOM 0 HB3 ALA A 214 12.061 -0.424 -1.021 1.00 0.48 H new ATOM 107 N PHE A 215 10.737 -1.872 2.072 1.00 0.25 N ATOM 108 CA PHE A 215 9.935 -1.365 3.150 1.00 0.18 C ATOM 109 C PHE A 215 10.478 -1.943 4.430 1.00 0.21 C ATOM 110 O PHE A 215 10.331 -3.140 4.686 1.00 0.28 O ATOM 111 CB PHE A 215 8.458 -1.738 2.948 1.00 0.20 C ATOM 112 CG PHE A 215 7.887 -1.284 1.617 1.00 0.23 C ATOM 113 CD1 PHE A 215 8.390 -1.769 0.418 1.00 0.41 C ATOM 114 CD2 PHE A 215 6.852 -0.366 1.565 1.00 0.26 C ATOM 115 CE1 PHE A 215 7.877 -1.351 -0.793 1.00 0.46 C ATOM 116 CE2 PHE A 215 6.338 0.059 0.354 1.00 0.31 C ATOM 117 CZ PHE A 215 6.851 -0.434 -0.825 1.00 0.35 C ATOM 0 H PHE A 215 10.472 -2.804 1.752 1.00 0.25 H new ATOM 0 HA PHE A 215 9.982 -0.277 3.186 1.00 0.18 H new ATOM 0 HB2 PHE A 215 8.352 -2.820 3.028 1.00 0.20 H new ATOM 0 HB3 PHE A 215 7.869 -1.300 3.754 1.00 0.20 H new ATOM 0 HD1 PHE A 215 9.197 -2.486 0.433 1.00 0.41 H new ATOM 0 HD2 PHE A 215 6.440 0.024 2.484 1.00 0.26 H new ATOM 0 HE1 PHE A 215 8.280 -1.743 -1.715 1.00 0.46 H new ATOM 0 HE2 PHE A 215 5.533 0.779 0.333 1.00 0.31 H new ATOM 0 HZ PHE A 215 6.450 -0.102 -1.771 1.00 0.35 H new ATOM 127 N GLN A 216 11.165 -1.091 5.181 1.00 0.18 N ATOM 128 CA GLN A 216 11.766 -1.457 6.453 1.00 0.21 C ATOM 129 C GLN A 216 10.773 -2.267 7.252 1.00 0.24 C ATOM 130 O GLN A 216 11.025 -3.413 7.624 1.00 0.31 O ATOM 131 CB GLN A 216 12.109 -0.187 7.226 1.00 0.20 C ATOM 132 CG GLN A 216 13.439 -0.258 7.962 1.00 0.25 C ATOM 133 CD GLN A 216 13.786 1.021 8.702 1.00 0.30 C ATOM 134 OE1 GLN A 216 14.679 1.038 9.547 1.00 0.92 O ATOM 135 NE2 GLN A 216 13.112 2.108 8.370 1.00 0.79 N ATOM 0 H GLN A 216 11.321 -0.117 4.920 1.00 0.18 H new ATOM 0 HA GLN A 216 12.670 -2.042 6.281 1.00 0.21 H new ATOM 0 HB2 GLN A 216 12.132 0.654 6.533 1.00 0.20 H new ATOM 0 HB3 GLN A 216 11.316 0.015 7.946 1.00 0.20 H new ATOM 0 HG2 GLN A 216 13.409 -1.084 8.673 1.00 0.25 H new ATOM 0 HG3 GLN A 216 14.230 -0.482 7.247 1.00 0.25 H new ATOM 0 HE21 GLN A 216 12.377 2.057 7.664 1.00 0.79 H new ATOM 0 HE22 GLN A 216 13.327 2.998 8.819 1.00 0.79 H new ATOM 144 N LYS A 217 9.583 -1.714 7.347 1.00 0.20 N ATOM 145 CA LYS A 217 8.467 -2.419 7.904 1.00 0.22 C ATOM 146 C LYS A 217 7.220 -2.193 7.047 1.00 0.17 C ATOM 147 O LYS A 217 6.717 -1.079 6.970 1.00 0.17 O ATOM 148 CB LYS A 217 8.243 -1.915 9.322 1.00 0.28 C ATOM 149 CG LYS A 217 7.102 -2.583 10.040 1.00 0.36 C ATOM 150 CD LYS A 217 6.825 -1.893 11.362 1.00 0.59 C ATOM 151 CE LYS A 217 7.962 -2.089 12.353 1.00 1.26 C ATOM 152 NZ LYS A 217 7.724 -1.346 13.617 1.00 1.85 N ATOM 0 H LYS A 217 9.370 -0.765 7.039 1.00 0.20 H new ATOM 0 HA LYS A 217 8.669 -3.490 7.923 1.00 0.22 H new ATOM 0 HB2 LYS A 217 9.157 -2.064 9.897 1.00 0.28 H new ATOM 0 HB3 LYS A 217 8.058 -0.841 9.289 1.00 0.28 H new ATOM 0 HG2 LYS A 217 6.208 -2.558 9.416 1.00 0.36 H new ATOM 0 HG3 LYS A 217 7.340 -3.632 10.214 1.00 0.36 H new ATOM 0 HD2 LYS A 217 6.673 -0.827 11.190 1.00 0.59 H new ATOM 0 HD3 LYS A 217 5.901 -2.283 11.788 1.00 0.59 H new ATOM 0 HE2 LYS A 217 8.076 -3.151 12.571 1.00 1.26 H new ATOM 0 HE3 LYS A 217 8.897 -1.754 11.905 1.00 1.26 H new ATOM 0 HZ1 LYS A 217 8.520 -1.504 14.268 1.00 1.85 H new ATOM 0 HZ2 LYS A 217 7.641 -0.330 13.412 1.00 1.85 H new ATOM 0 HZ3 LYS A 217 6.845 -1.683 14.058 1.00 1.85 H new ATOM 166 N LYS A 218 6.622 -3.275 6.587 1.00 0.19 N ATOM 167 CA LYS A 218 5.305 -3.211 5.962 1.00 0.20 C ATOM 168 C LYS A 218 4.256 -3.445 7.037 1.00 0.18 C ATOM 169 O LYS A 218 4.457 -4.269 7.931 1.00 0.20 O ATOM 170 CB LYS A 218 5.173 -4.257 4.838 1.00 0.31 C ATOM 171 CG LYS A 218 3.774 -4.378 4.238 1.00 0.39 C ATOM 172 CD LYS A 218 3.571 -5.748 3.607 1.00 0.96 C ATOM 173 CE LYS A 218 3.557 -6.837 4.670 1.00 1.56 C ATOM 174 NZ LYS A 218 3.706 -8.201 4.095 1.00 2.42 N ATOM 0 H LYS A 218 7.023 -4.212 6.632 1.00 0.19 H new ATOM 0 HA LYS A 218 5.163 -2.230 5.508 1.00 0.20 H new ATOM 0 HB2 LYS A 218 5.874 -4.005 4.042 1.00 0.31 H new ATOM 0 HB3 LYS A 218 5.471 -5.230 5.229 1.00 0.31 H new ATOM 0 HG2 LYS A 218 3.026 -4.216 5.014 1.00 0.39 H new ATOM 0 HG3 LYS A 218 3.628 -3.602 3.487 1.00 0.39 H new ATOM 0 HD2 LYS A 218 2.632 -5.763 3.053 1.00 0.96 H new ATOM 0 HD3 LYS A 218 4.368 -5.944 2.890 1.00 0.96 H new ATOM 0 HE2 LYS A 218 4.364 -6.656 5.380 1.00 1.56 H new ATOM 0 HE3 LYS A 218 2.622 -6.782 5.228 1.00 1.56 H new ATOM 0 HZ1 LYS A 218 3.690 -8.904 4.861 1.00 2.42 H new ATOM 0 HZ2 LYS A 218 2.923 -8.388 3.437 1.00 2.42 H new ATOM 0 HZ3 LYS A 218 4.610 -8.266 3.584 1.00 2.42 H new ATOM 188 N LEU A 219 3.163 -2.703 6.977 1.00 0.16 N ATOM 189 CA LEU A 219 2.102 -2.832 7.963 1.00 0.16 C ATOM 190 C LEU A 219 1.535 -4.256 7.945 1.00 0.16 C ATOM 191 O LEU A 219 1.824 -5.031 7.028 1.00 0.17 O ATOM 192 CB LEU A 219 0.995 -1.811 7.699 1.00 0.20 C ATOM 193 CG LEU A 219 -0.054 -1.664 8.805 1.00 0.66 C ATOM 194 CD1 LEU A 219 0.582 -1.145 10.085 1.00 1.20 C ATOM 195 CD2 LEU A 219 -1.175 -0.741 8.353 1.00 1.62 C ATOM 0 H LEU A 219 2.987 -2.004 6.255 1.00 0.16 H new ATOM 0 HA LEU A 219 2.519 -2.635 8.950 1.00 0.16 H new ATOM 0 HB2 LEU A 219 1.457 -0.838 7.531 1.00 0.20 H new ATOM 0 HB3 LEU A 219 0.486 -2.086 6.775 1.00 0.20 H new ATOM 0 HG LEU A 219 -0.477 -2.648 9.010 1.00 0.66 H new ATOM 0 HD11 LEU A 219 -0.181 -1.048 10.857 1.00 1.20 H new ATOM 0 HD12 LEU A 219 1.350 -1.843 10.419 1.00 1.20 H new ATOM 0 HD13 LEU A 219 1.034 -0.171 9.898 1.00 1.20 H new ATOM 0 HD21 LEU A 219 -1.912 -0.647 9.150 1.00 1.62 H new ATOM 0 HD22 LEU A 219 -0.765 0.242 8.120 1.00 1.62 H new ATOM 0 HD23 LEU A 219 -1.652 -1.156 7.465 1.00 1.62 H new ATOM 207 N GLU A 220 0.786 -4.611 8.985 1.00 0.17 N ATOM 208 CA GLU A 220 0.192 -5.942 9.107 1.00 0.20 C ATOM 209 C GLU A 220 -0.491 -6.353 7.802 1.00 0.19 C ATOM 210 O GLU A 220 -1.088 -5.514 7.131 1.00 0.19 O ATOM 211 CB GLU A 220 -0.829 -5.938 10.250 1.00 0.23 C ATOM 212 CG GLU A 220 -1.890 -4.853 10.111 1.00 0.24 C ATOM 213 CD GLU A 220 -2.771 -4.727 11.337 1.00 0.75 C ATOM 214 OE1 GLU A 220 -2.243 -4.437 12.430 1.00 1.43 O ATOM 215 OE2 GLU A 220 -3.997 -4.921 11.215 1.00 1.12 O ATOM 0 H GLU A 220 0.573 -3.989 9.765 1.00 0.17 H new ATOM 0 HA GLU A 220 0.982 -6.662 9.321 1.00 0.20 H new ATOM 0 HB2 GLU A 220 -1.319 -6.911 10.293 1.00 0.23 H new ATOM 0 HB3 GLU A 220 -0.304 -5.803 11.196 1.00 0.23 H new ATOM 0 HG2 GLU A 220 -1.402 -3.897 9.921 1.00 0.24 H new ATOM 0 HG3 GLU A 220 -2.513 -5.071 9.243 1.00 0.24 H new ATOM 222 N PRO A 221 -0.330 -7.624 7.376 1.00 0.22 N ATOM 223 CA PRO A 221 -0.858 -8.123 6.090 1.00 0.23 C ATOM 224 C PRO A 221 -2.383 -8.158 6.023 1.00 0.20 C ATOM 225 O PRO A 221 -2.954 -8.982 5.317 1.00 0.19 O ATOM 226 CB PRO A 221 -0.288 -9.542 5.989 1.00 0.29 C ATOM 227 CG PRO A 221 0.036 -9.924 7.388 1.00 0.57 C ATOM 228 CD PRO A 221 0.458 -8.653 8.068 1.00 0.26 C ATOM 0 HA PRO A 221 -0.568 -7.465 5.271 1.00 0.23 H new ATOM 0 HB2 PRO A 221 -1.012 -10.228 5.550 1.00 0.29 H new ATOM 0 HB3 PRO A 221 0.600 -9.567 5.357 1.00 0.29 H new ATOM 0 HG2 PRO A 221 -0.829 -10.365 7.884 1.00 0.57 H new ATOM 0 HG3 PRO A 221 0.833 -10.667 7.417 1.00 0.57 H new ATOM 0 HD2 PRO A 221 0.240 -8.676 9.136 1.00 0.26 H new ATOM 0 HD3 PRO A 221 1.529 -8.477 7.965 1.00 0.26 H new ATOM 236 N ALA A 222 -3.013 -7.167 6.620 1.00 0.20 N ATOM 237 CA ALA A 222 -4.444 -6.984 6.521 1.00 0.19 C ATOM 238 C ALA A 222 -4.791 -5.536 6.802 1.00 0.15 C ATOM 239 O ALA A 222 -5.143 -5.169 7.924 1.00 0.17 O ATOM 240 CB ALA A 222 -5.195 -7.904 7.467 1.00 0.24 C ATOM 0 H ALA A 222 -2.543 -6.463 7.190 1.00 0.20 H new ATOM 0 HA ALA A 222 -4.751 -7.242 5.508 1.00 0.19 H new ATOM 0 HB1 ALA A 222 -6.267 -7.736 7.363 1.00 0.24 H new ATOM 0 HB2 ALA A 222 -4.965 -8.942 7.225 1.00 0.24 H new ATOM 0 HB3 ALA A 222 -4.893 -7.695 8.493 1.00 0.24 H new ATOM 246 N TYR A 223 -4.718 -4.721 5.769 1.00 0.12 N ATOM 247 CA TYR A 223 -5.073 -3.323 5.887 1.00 0.11 C ATOM 248 C TYR A 223 -6.588 -3.217 5.882 1.00 0.13 C ATOM 249 O TYR A 223 -7.246 -3.869 5.072 1.00 0.17 O ATOM 250 CB TYR A 223 -4.488 -2.511 4.723 1.00 0.12 C ATOM 251 CG TYR A 223 -2.975 -2.353 4.723 1.00 0.12 C ATOM 252 CD1 TYR A 223 -2.178 -3.209 5.472 1.00 0.16 C ATOM 253 CD2 TYR A 223 -2.343 -1.344 4.008 1.00 0.18 C ATOM 254 CE1 TYR A 223 -0.802 -3.068 5.505 1.00 0.18 C ATOM 255 CE2 TYR A 223 -0.966 -1.200 4.042 1.00 0.20 C ATOM 256 CZ TYR A 223 -0.206 -2.061 4.652 1.00 0.16 C ATOM 257 OH TYR A 223 1.163 -1.920 4.833 1.00 0.21 O ATOM 0 H TYR A 223 -4.415 -5.004 4.837 1.00 0.12 H new ATOM 0 HA TYR A 223 -4.665 -2.919 6.814 1.00 0.11 H new ATOM 0 HB2 TYR A 223 -4.785 -2.985 3.788 1.00 0.12 H new ATOM 0 HB3 TYR A 223 -4.938 -1.518 4.734 1.00 0.12 H new ATOM 0 HD1 TYR A 223 -2.642 -4.001 6.041 1.00 0.16 H new ATOM 0 HD2 TYR A 223 -2.935 -0.661 3.416 1.00 0.18 H new ATOM 0 HE1 TYR A 223 -0.193 -3.688 6.146 1.00 0.18 H new ATOM 0 HE2 TYR A 223 -0.512 -0.352 3.550 1.00 0.20 H new ATOM 0 HH TYR A 223 1.503 -1.227 4.229 1.00 0.21 H new ATOM 267 N GLN A 224 -7.142 -2.493 6.842 1.00 0.15 N ATOM 268 CA GLN A 224 -8.589 -2.392 6.971 1.00 0.18 C ATOM 269 C GLN A 224 -9.086 -1.018 6.548 1.00 0.17 C ATOM 270 O GLN A 224 -8.985 -0.054 7.308 1.00 0.22 O ATOM 271 CB GLN A 224 -9.024 -2.683 8.408 1.00 0.26 C ATOM 272 CG GLN A 224 -8.953 -4.156 8.778 1.00 0.34 C ATOM 273 CD GLN A 224 -9.437 -4.427 10.190 1.00 0.61 C ATOM 274 OE1 GLN A 224 -8.801 -4.027 11.165 1.00 1.42 O ATOM 275 NE2 GLN A 224 -10.574 -5.095 10.306 1.00 0.99 N ATOM 0 H GLN A 224 -6.615 -1.969 7.541 1.00 0.15 H new ATOM 0 HA GLN A 224 -9.031 -3.136 6.309 1.00 0.18 H new ATOM 0 HB2 GLN A 224 -8.394 -2.114 9.092 1.00 0.26 H new ATOM 0 HB3 GLN A 224 -10.046 -2.330 8.548 1.00 0.26 H new ATOM 0 HG2 GLN A 224 -9.554 -4.733 8.075 1.00 0.34 H new ATOM 0 HG3 GLN A 224 -7.925 -4.503 8.678 1.00 0.34 H new ATOM 0 HE21 GLN A 224 -11.069 -5.408 9.471 1.00 0.99 H new ATOM 0 HE22 GLN A 224 -10.955 -5.296 11.230 1.00 0.99 H new ATOM 284 N VAL A 225 -9.612 -0.932 5.328 1.00 0.16 N ATOM 285 CA VAL A 225 -10.135 0.318 4.805 1.00 0.18 C ATOM 286 C VAL A 225 -11.252 0.840 5.677 1.00 0.24 C ATOM 287 O VAL A 225 -12.280 0.192 5.799 1.00 0.30 O ATOM 288 CB VAL A 225 -10.742 0.168 3.393 1.00 0.28 C ATOM 289 CG1 VAL A 225 -10.933 1.532 2.748 1.00 0.77 C ATOM 290 CG2 VAL A 225 -9.915 -0.737 2.505 1.00 0.77 C ATOM 0 H VAL A 225 -9.685 -1.720 4.684 1.00 0.16 H new ATOM 0 HA VAL A 225 -9.281 0.995 4.779 1.00 0.18 H new ATOM 0 HB VAL A 225 -11.717 -0.306 3.508 1.00 0.28 H new ATOM 0 HG11 VAL A 225 -11.362 1.407 1.754 1.00 0.77 H new ATOM 0 HG12 VAL A 225 -11.605 2.133 3.360 1.00 0.77 H new ATOM 0 HG13 VAL A 225 -9.969 2.034 2.667 1.00 0.77 H new ATOM 0 HG21 VAL A 225 -10.383 -0.810 1.523 1.00 0.77 H new ATOM 0 HG22 VAL A 225 -8.912 -0.324 2.399 1.00 0.77 H new ATOM 0 HG23 VAL A 225 -9.854 -1.729 2.953 1.00 0.77 H new ATOM 300 N SER A 226 -11.205 2.113 5.966 1.00 0.26 N ATOM 301 CA SER A 226 -12.406 2.769 6.416 1.00 0.33 C ATOM 302 C SER A 226 -13.172 3.162 5.161 1.00 0.32 C ATOM 303 O SER A 226 -12.655 3.941 4.364 1.00 0.32 O ATOM 304 CB SER A 226 -12.063 3.991 7.258 1.00 0.42 C ATOM 305 OG SER A 226 -11.245 3.637 8.362 1.00 1.20 O ATOM 0 H SER A 226 -10.376 2.703 5.902 1.00 0.26 H new ATOM 0 HA SER A 226 -13.007 2.115 7.048 1.00 0.33 H new ATOM 0 HB2 SER A 226 -11.548 4.728 6.642 1.00 0.42 H new ATOM 0 HB3 SER A 226 -12.980 4.459 7.616 1.00 0.42 H new ATOM 0 HG SER A 226 -11.037 4.439 8.886 1.00 1.20 H new ATOM 311 N LYS A 227 -14.171 2.353 4.824 1.00 0.34 N ATOM 312 CA LYS A 227 -14.798 2.405 3.502 1.00 0.37 C ATOM 313 C LYS A 227 -15.040 3.838 3.033 1.00 0.42 C ATOM 314 O LYS A 227 -15.652 4.655 3.729 1.00 0.48 O ATOM 315 CB LYS A 227 -16.118 1.615 3.486 1.00 0.44 C ATOM 316 CG LYS A 227 -17.274 2.317 4.182 1.00 0.95 C ATOM 317 CD LYS A 227 -18.519 2.375 3.308 1.00 0.93 C ATOM 318 CE LYS A 227 -19.139 1.002 3.107 1.00 0.96 C ATOM 319 NZ LYS A 227 -20.380 1.066 2.289 1.00 1.54 N ATOM 0 H LYS A 227 -14.567 1.650 5.448 1.00 0.34 H new ATOM 0 HA LYS A 227 -14.099 1.942 2.806 1.00 0.37 H new ATOM 0 HB2 LYS A 227 -16.398 1.418 2.451 1.00 0.44 H new ATOM 0 HB3 LYS A 227 -15.955 0.648 3.962 1.00 0.44 H new ATOM 0 HG2 LYS A 227 -17.508 1.796 5.111 1.00 0.95 H new ATOM 0 HG3 LYS A 227 -16.973 3.329 4.451 1.00 0.95 H new ATOM 0 HD2 LYS A 227 -19.252 3.040 3.765 1.00 0.93 H new ATOM 0 HD3 LYS A 227 -18.262 2.802 2.339 1.00 0.93 H new ATOM 0 HE2 LYS A 227 -18.417 0.346 2.620 1.00 0.96 H new ATOM 0 HE3 LYS A 227 -19.367 0.561 4.078 1.00 0.96 H new ATOM 0 HZ1 LYS A 227 -20.771 0.109 2.176 1.00 1.54 H new ATOM 0 HZ2 LYS A 227 -21.079 1.671 2.765 1.00 1.54 H new ATOM 0 HZ3 LYS A 227 -20.159 1.463 1.353 1.00 1.54 H new ATOM 333 N GLY A 228 -14.514 4.148 1.858 1.00 0.46 N ATOM 334 CA GLY A 228 -14.696 5.469 1.283 1.00 0.57 C ATOM 335 C GLY A 228 -13.870 6.549 1.961 1.00 0.57 C ATOM 336 O GLY A 228 -13.763 7.661 1.449 1.00 0.70 O ATOM 0 H GLY A 228 -13.962 3.507 1.288 1.00 0.46 H new ATOM 0 HA2 GLY A 228 -14.435 5.434 0.225 1.00 0.57 H new ATOM 0 HA3 GLY A 228 -15.750 5.739 1.342 1.00 0.57 H new ATOM 340 N HIS A 229 -13.231 6.215 3.075 1.00 0.47 N ATOM 341 CA HIS A 229 -12.356 7.166 3.756 1.00 0.53 C ATOM 342 C HIS A 229 -10.999 7.174 3.078 1.00 0.54 C ATOM 343 O HIS A 229 -10.103 7.925 3.462 1.00 1.02 O ATOM 344 CB HIS A 229 -12.206 6.816 5.243 1.00 0.55 C ATOM 345 CG HIS A 229 -11.476 7.863 6.035 1.00 1.32 C ATOM 346 ND1 HIS A 229 -11.942 9.149 6.185 1.00 1.94 N ATOM 347 CD2 HIS A 229 -10.294 7.815 6.691 1.00 2.31 C ATOM 348 CE1 HIS A 229 -11.078 9.847 6.897 1.00 2.66 C ATOM 349 NE2 HIS A 229 -10.065 9.062 7.215 1.00 2.89 N ATOM 0 H HIS A 229 -13.300 5.302 3.524 1.00 0.47 H new ATOM 0 HA HIS A 229 -12.803 8.158 3.693 1.00 0.53 H new ATOM 0 HB2 HIS A 229 -13.196 6.670 5.675 1.00 0.55 H new ATOM 0 HB3 HIS A 229 -11.675 5.868 5.333 1.00 0.55 H new ATOM 0 HD2 HIS A 229 -9.649 6.954 6.785 1.00 2.31 H new ATOM 0 HE1 HIS A 229 -11.182 10.886 7.173 1.00 2.66 H new ATOM 0 HE2 HIS A 229 -9.248 9.337 7.760 1.00 2.89 H new ATOM 358 N LYS A 230 -10.869 6.301 2.080 1.00 0.30 N ATOM 359 CA LYS A 230 -9.633 6.131 1.315 1.00 0.28 C ATOM 360 C LYS A 230 -8.572 5.484 2.201 1.00 0.24 C ATOM 361 O LYS A 230 -8.090 6.104 3.150 1.00 0.28 O ATOM 362 CB LYS A 230 -9.092 7.474 0.774 1.00 0.36 C ATOM 363 CG LYS A 230 -10.145 8.482 0.319 1.00 1.00 C ATOM 364 CD LYS A 230 -11.089 7.918 -0.725 1.00 1.23 C ATOM 365 CE LYS A 230 -11.954 9.009 -1.340 1.00 1.65 C ATOM 366 NZ LYS A 230 -12.830 9.672 -0.337 1.00 2.24 N ATOM 0 H LYS A 230 -11.624 5.686 1.777 1.00 0.30 H new ATOM 0 HA LYS A 230 -9.861 5.494 0.460 1.00 0.28 H new ATOM 0 HB2 LYS A 230 -8.484 7.938 1.551 1.00 0.36 H new ATOM 0 HB3 LYS A 230 -8.430 7.265 -0.066 1.00 0.36 H new ATOM 0 HG2 LYS A 230 -10.722 8.812 1.183 1.00 1.00 H new ATOM 0 HG3 LYS A 230 -9.647 9.362 -0.087 1.00 1.00 H new ATOM 0 HD2 LYS A 230 -10.514 7.423 -1.508 1.00 1.23 H new ATOM 0 HD3 LYS A 230 -11.726 7.160 -0.270 1.00 1.23 H new ATOM 0 HE2 LYS A 230 -11.313 9.756 -1.809 1.00 1.65 H new ATOM 0 HE3 LYS A 230 -12.571 8.578 -2.129 1.00 1.65 H new ATOM 0 HZ1 LYS A 230 -13.636 10.117 -0.820 1.00 2.24 H new ATOM 0 HZ2 LYS A 230 -13.180 8.964 0.340 1.00 2.24 H new ATOM 0 HZ3 LYS A 230 -12.287 10.398 0.172 1.00 2.24 H new ATOM 380 N ILE A 231 -8.255 4.216 1.962 1.00 0.20 N ATOM 381 CA ILE A 231 -7.311 3.544 2.853 1.00 0.17 C ATOM 382 C ILE A 231 -5.868 3.769 2.419 1.00 0.16 C ATOM 383 O ILE A 231 -5.519 3.663 1.246 1.00 0.17 O ATOM 384 CB ILE A 231 -7.571 2.025 3.010 1.00 0.16 C ATOM 385 CG1 ILE A 231 -6.502 1.413 3.923 1.00 0.17 C ATOM 386 CG2 ILE A 231 -7.559 1.332 1.664 1.00 0.18 C ATOM 387 CD1 ILE A 231 -6.750 -0.024 4.296 1.00 0.19 C ATOM 0 H ILE A 231 -8.618 3.651 1.194 1.00 0.20 H new ATOM 0 HA ILE A 231 -7.475 4.003 3.828 1.00 0.17 H new ATOM 0 HB ILE A 231 -8.556 1.885 3.456 1.00 0.16 H new ATOM 0 HG12 ILE A 231 -5.534 1.485 3.427 1.00 0.17 H new ATOM 0 HG13 ILE A 231 -6.438 2.006 4.835 1.00 0.17 H new ATOM 0 HG21 ILE A 231 -7.744 0.267 1.802 1.00 0.18 H new ATOM 0 HG22 ILE A 231 -8.337 1.756 1.029 1.00 0.18 H new ATOM 0 HG23 ILE A 231 -6.587 1.473 1.191 1.00 0.18 H new ATOM 0 HD11 ILE A 231 -5.946 -0.376 4.942 1.00 0.19 H new ATOM 0 HD12 ILE A 231 -7.701 -0.104 4.823 1.00 0.19 H new ATOM 0 HD13 ILE A 231 -6.783 -0.634 3.393 1.00 0.19 H new ATOM 399 N ARG A 232 -5.062 4.159 3.383 1.00 0.17 N ATOM 400 CA ARG A 232 -3.665 4.465 3.166 1.00 0.17 C ATOM 401 C ARG A 232 -2.800 3.251 3.499 1.00 0.15 C ATOM 402 O ARG A 232 -3.069 2.556 4.481 1.00 0.19 O ATOM 403 CB ARG A 232 -3.291 5.641 4.058 1.00 0.22 C ATOM 404 CG ARG A 232 -4.087 6.905 3.779 1.00 0.34 C ATOM 405 CD ARG A 232 -3.999 7.871 4.946 1.00 0.77 C ATOM 406 NE ARG A 232 -4.562 7.288 6.163 1.00 1.44 N ATOM 407 CZ ARG A 232 -4.501 7.851 7.368 1.00 2.13 C ATOM 408 NH1 ARG A 232 -3.896 9.020 7.537 1.00 2.48 N ATOM 409 NH2 ARG A 232 -5.041 7.230 8.411 1.00 3.14 N ATOM 0 H ARG A 232 -5.362 4.274 4.351 1.00 0.17 H new ATOM 0 HA ARG A 232 -3.496 4.722 2.120 1.00 0.17 H new ATOM 0 HB2 ARG A 232 -3.436 5.355 5.100 1.00 0.22 H new ATOM 0 HB3 ARG A 232 -2.230 5.857 3.932 1.00 0.22 H new ATOM 0 HG2 ARG A 232 -3.710 7.385 2.876 1.00 0.34 H new ATOM 0 HG3 ARG A 232 -5.130 6.649 3.592 1.00 0.34 H new ATOM 0 HD2 ARG A 232 -2.957 8.142 5.118 1.00 0.77 H new ATOM 0 HD3 ARG A 232 -4.531 8.790 4.701 1.00 0.77 H new ATOM 0 HE ARG A 232 -5.034 6.387 6.083 1.00 1.44 H new ATOM 0 HH11 ARG A 232 -3.473 9.495 6.740 1.00 2.48 H new ATOM 0 HH12 ARG A 232 -3.854 9.443 8.464 1.00 2.48 H new ATOM 0 HH21 ARG A 232 -5.499 6.327 8.286 1.00 3.14 H new ATOM 0 HH22 ARG A 232 -4.998 7.656 9.337 1.00 3.14 H new ATOM 423 N LEU A 233 -1.775 2.975 2.694 1.00 0.13 N ATOM 424 CA LEU A 233 -0.919 1.844 2.955 1.00 0.14 C ATOM 425 C LEU A 233 0.343 2.336 3.624 1.00 0.13 C ATOM 426 O LEU A 233 1.256 2.811 2.954 1.00 0.13 O ATOM 427 CB LEU A 233 -0.602 1.101 1.646 1.00 0.15 C ATOM 428 CG LEU A 233 -1.719 0.171 1.130 1.00 0.17 C ATOM 429 CD1 LEU A 233 -2.960 0.952 0.728 1.00 0.18 C ATOM 430 CD2 LEU A 233 -1.234 -0.667 -0.037 1.00 0.23 C ATOM 0 H LEU A 233 -1.528 3.519 1.867 1.00 0.13 H new ATOM 0 HA LEU A 233 -1.422 1.140 3.617 1.00 0.14 H new ATOM 0 HB2 LEU A 233 -0.379 1.838 0.874 1.00 0.15 H new ATOM 0 HB3 LEU A 233 0.302 0.510 1.793 1.00 0.15 H new ATOM 0 HG LEU A 233 -1.987 -0.492 1.952 1.00 0.17 H new ATOM 0 HD11 LEU A 233 -3.724 0.262 0.370 1.00 0.18 H new ATOM 0 HD12 LEU A 233 -3.341 1.499 1.590 1.00 0.18 H new ATOM 0 HD13 LEU A 233 -2.706 1.655 -0.065 1.00 0.18 H new ATOM 0 HD21 LEU A 233 -2.041 -1.313 -0.381 1.00 0.23 H new ATOM 0 HD22 LEU A 233 -0.922 -0.012 -0.850 1.00 0.23 H new ATOM 0 HD23 LEU A 233 -0.390 -1.279 0.280 1.00 0.23 H new ATOM 442 N THR A 234 0.328 2.345 4.949 1.00 0.14 N ATOM 443 CA THR A 234 1.424 2.907 5.715 1.00 0.16 C ATOM 444 C THR A 234 2.483 1.858 6.010 1.00 0.16 C ATOM 445 O THR A 234 2.179 0.740 6.427 1.00 0.22 O ATOM 446 CB THR A 234 0.929 3.534 7.032 1.00 0.22 C ATOM 447 OG1 THR A 234 -0.084 4.509 6.748 1.00 0.33 O ATOM 448 CG2 THR A 234 2.076 4.195 7.785 1.00 0.24 C ATOM 0 H THR A 234 -0.433 1.968 5.514 1.00 0.14 H new ATOM 0 HA THR A 234 1.869 3.693 5.105 1.00 0.16 H new ATOM 0 HB THR A 234 0.517 2.742 7.658 1.00 0.22 H new ATOM 0 HG1 THR A 234 -0.400 4.906 7.586 1.00 0.33 H new ATOM 0 HG21 THR A 234 1.700 4.630 8.711 1.00 0.24 H new ATOM 0 HG22 THR A 234 2.837 3.449 8.017 1.00 0.24 H new ATOM 0 HG23 THR A 234 2.513 4.979 7.167 1.00 0.24 H new ATOM 456 N VAL A 235 3.719 2.219 5.738 1.00 0.14 N ATOM 457 CA VAL A 235 4.858 1.340 5.903 1.00 0.14 C ATOM 458 C VAL A 235 6.035 2.159 6.394 1.00 0.14 C ATOM 459 O VAL A 235 6.172 3.315 6.026 1.00 0.16 O ATOM 460 CB VAL A 235 5.240 0.678 4.559 1.00 0.14 C ATOM 461 CG1 VAL A 235 4.108 -0.176 4.035 1.00 0.15 C ATOM 462 CG2 VAL A 235 5.578 1.748 3.546 1.00 0.14 C ATOM 0 H VAL A 235 3.965 3.146 5.391 1.00 0.14 H new ATOM 0 HA VAL A 235 4.601 0.559 6.619 1.00 0.14 H new ATOM 0 HB VAL A 235 6.106 0.037 4.724 1.00 0.14 H new ATOM 0 HG11 VAL A 235 4.403 -0.630 3.089 1.00 0.15 H new ATOM 0 HG12 VAL A 235 3.879 -0.959 4.757 1.00 0.15 H new ATOM 0 HG13 VAL A 235 3.225 0.445 3.880 1.00 0.15 H new ATOM 0 HG21 VAL A 235 5.847 1.280 2.599 1.00 0.14 H new ATOM 0 HG22 VAL A 235 4.714 2.395 3.398 1.00 0.14 H new ATOM 0 HG23 VAL A 235 6.417 2.341 3.909 1.00 0.14 H new ATOM 472 N GLU A 236 6.965 1.536 7.072 1.00 0.13 N ATOM 473 CA GLU A 236 8.205 2.210 7.358 1.00 0.13 C ATOM 474 C GLU A 236 9.175 1.840 6.262 1.00 0.13 C ATOM 475 O GLU A 236 9.401 0.666 6.023 1.00 0.17 O ATOM 476 CB GLU A 236 8.753 1.800 8.724 1.00 0.18 C ATOM 477 CG GLU A 236 9.942 2.630 9.170 1.00 0.29 C ATOM 478 CD GLU A 236 10.191 2.538 10.656 1.00 0.54 C ATOM 479 OE1 GLU A 236 10.443 1.423 11.158 1.00 1.18 O ATOM 480 OE2 GLU A 236 10.108 3.580 11.337 1.00 1.05 O ATOM 0 H GLU A 236 6.891 0.584 7.430 1.00 0.13 H new ATOM 0 HA GLU A 236 8.051 3.289 7.392 1.00 0.13 H new ATOM 0 HB2 GLU A 236 7.960 1.887 9.466 1.00 0.18 H new ATOM 0 HB3 GLU A 236 9.044 0.750 8.690 1.00 0.18 H new ATOM 0 HG2 GLU A 236 10.832 2.299 8.635 1.00 0.29 H new ATOM 0 HG3 GLU A 236 9.775 3.672 8.897 1.00 0.29 H new ATOM 487 N LEU A 237 9.601 2.813 5.477 1.00 0.13 N ATOM 488 CA LEU A 237 10.452 2.522 4.336 1.00 0.15 C ATOM 489 C LEU A 237 11.886 2.303 4.768 1.00 0.17 C ATOM 490 O LEU A 237 12.355 2.922 5.713 1.00 0.19 O ATOM 491 CB LEU A 237 10.409 3.649 3.305 1.00 0.17 C ATOM 492 CG LEU A 237 9.443 3.439 2.144 1.00 0.23 C ATOM 493 CD1 LEU A 237 9.576 4.572 1.143 1.00 0.44 C ATOM 494 CD2 LEU A 237 9.695 2.103 1.468 1.00 0.55 C ATOM 0 H LEU A 237 9.376 3.800 5.605 1.00 0.13 H new ATOM 0 HA LEU A 237 10.068 1.609 3.880 1.00 0.15 H new ATOM 0 HB2 LEU A 237 10.141 4.574 3.815 1.00 0.17 H new ATOM 0 HB3 LEU A 237 11.412 3.786 2.900 1.00 0.17 H new ATOM 0 HG LEU A 237 8.427 3.434 2.537 1.00 0.23 H new ATOM 0 HD11 LEU A 237 8.882 4.412 0.318 1.00 0.44 H new ATOM 0 HD12 LEU A 237 9.346 5.519 1.632 1.00 0.44 H new ATOM 0 HD13 LEU A 237 10.596 4.600 0.759 1.00 0.44 H new ATOM 0 HD21 LEU A 237 8.994 1.975 0.643 1.00 0.55 H new ATOM 0 HD22 LEU A 237 10.715 2.076 1.085 1.00 0.55 H new ATOM 0 HD23 LEU A 237 9.557 1.298 2.190 1.00 0.55 H new ATOM 506 N ALA A 238 12.593 1.495 4.002 1.00 0.19 N ATOM 507 CA ALA A 238 14.026 1.334 4.165 1.00 0.21 C ATOM 508 C ALA A 238 14.724 2.392 3.324 1.00 0.23 C ATOM 509 O ALA A 238 15.746 2.955 3.710 1.00 0.28 O ATOM 510 CB ALA A 238 14.454 -0.060 3.736 1.00 0.25 C ATOM 0 H ALA A 238 12.192 0.933 3.251 1.00 0.19 H new ATOM 0 HA ALA A 238 14.299 1.456 5.213 1.00 0.21 H new ATOM 0 HB1 ALA A 238 15.531 -0.165 3.864 1.00 0.25 H new ATOM 0 HB2 ALA A 238 13.941 -0.802 4.348 1.00 0.25 H new ATOM 0 HB3 ALA A 238 14.197 -0.213 2.688 1.00 0.25 H new ATOM 516 N ASP A 239 14.102 2.701 2.191 1.00 0.22 N ATOM 517 CA ASP A 239 14.601 3.728 1.280 1.00 0.25 C ATOM 518 C ASP A 239 14.323 5.123 1.812 1.00 0.25 C ATOM 519 O ASP A 239 15.147 6.020 1.664 1.00 0.34 O ATOM 520 CB ASP A 239 13.969 3.586 -0.098 1.00 0.31 C ATOM 521 CG ASP A 239 14.595 2.468 -0.909 1.00 0.63 C ATOM 522 OD1 ASP A 239 15.827 2.279 -0.815 1.00 1.28 O ATOM 523 OD2 ASP A 239 13.874 1.808 -1.674 1.00 1.19 O ATOM 0 H ASP A 239 13.242 2.250 1.878 1.00 0.22 H new ATOM 0 HA ASP A 239 15.679 3.588 1.201 1.00 0.25 H new ATOM 0 HB2 ASP A 239 12.901 3.397 0.013 1.00 0.31 H new ATOM 0 HB3 ASP A 239 14.072 4.526 -0.640 1.00 0.31 H new ATOM 528 N HIS A 240 13.135 5.293 2.394 1.00 0.27 N ATOM 529 CA HIS A 240 12.682 6.574 2.961 1.00 0.39 C ATOM 530 C HIS A 240 12.274 7.559 1.864 1.00 0.47 C ATOM 531 O HIS A 240 11.112 7.954 1.773 1.00 0.70 O ATOM 532 CB HIS A 240 13.761 7.234 3.844 1.00 0.46 C ATOM 533 CG HIS A 240 14.324 6.369 4.935 1.00 0.46 C ATOM 534 ND1 HIS A 240 15.259 6.826 5.834 1.00 0.56 N ATOM 535 CD2 HIS A 240 14.102 5.073 5.259 1.00 0.40 C ATOM 536 CE1 HIS A 240 15.589 5.854 6.658 1.00 0.57 C ATOM 537 NE2 HIS A 240 14.902 4.778 6.334 1.00 0.48 N ATOM 0 H HIS A 240 12.451 4.542 2.488 1.00 0.27 H new ATOM 0 HA HIS A 240 11.817 6.338 3.580 1.00 0.39 H new ATOM 0 HB2 HIS A 240 14.581 7.559 3.203 1.00 0.46 H new ATOM 0 HB3 HIS A 240 13.336 8.130 4.297 1.00 0.46 H new ATOM 0 HD2 HIS A 240 13.421 4.397 4.763 1.00 0.40 H new ATOM 0 HE1 HIS A 240 16.303 5.927 7.465 1.00 0.57 H new ATOM 0 HE2 HIS A 240 14.956 3.875 6.805 1.00 0.48 H new ATOM 546 N ASP A 241 13.229 7.934 1.026 1.00 0.41 N ATOM 547 CA ASP A 241 13.002 8.921 -0.022 1.00 0.51 C ATOM 548 C ASP A 241 12.982 8.244 -1.382 1.00 0.44 C ATOM 549 O ASP A 241 13.797 8.522 -2.262 1.00 0.78 O ATOM 550 CB ASP A 241 14.081 10.011 0.037 1.00 0.80 C ATOM 551 CG ASP A 241 13.739 11.251 -0.779 1.00 1.53 C ATOM 552 OD1 ASP A 241 13.754 11.168 -2.027 1.00 2.22 O ATOM 553 OD2 ASP A 241 13.445 12.310 -0.189 1.00 2.08 O ATOM 0 H ASP A 241 14.180 7.565 1.052 1.00 0.41 H new ATOM 0 HA ASP A 241 12.033 9.394 0.136 1.00 0.51 H new ATOM 0 HB2 ASP A 241 14.236 10.301 1.076 1.00 0.80 H new ATOM 0 HB3 ASP A 241 15.023 9.598 -0.323 1.00 0.80 H new ATOM 558 N ALA A 242 12.093 7.286 -1.508 1.00 0.33 N ATOM 559 CA ALA A 242 11.949 6.532 -2.741 1.00 0.30 C ATOM 560 C ALA A 242 10.486 6.436 -3.134 1.00 0.24 C ATOM 561 O ALA A 242 9.620 6.275 -2.269 1.00 0.28 O ATOM 562 CB ALA A 242 12.534 5.145 -2.580 1.00 0.38 C ATOM 0 H ALA A 242 11.451 7.005 -0.767 1.00 0.33 H new ATOM 0 HA ALA A 242 12.491 7.054 -3.530 1.00 0.30 H new ATOM 0 HB1 ALA A 242 12.419 4.591 -3.512 1.00 0.38 H new ATOM 0 HB2 ALA A 242 13.593 5.223 -2.333 1.00 0.38 H new ATOM 0 HB3 ALA A 242 12.012 4.621 -1.780 1.00 0.38 H new ATOM 568 N GLU A 243 10.220 6.468 -4.433 1.00 0.26 N ATOM 569 CA GLU A 243 8.866 6.282 -4.922 1.00 0.30 C ATOM 570 C GLU A 243 8.461 4.839 -4.722 1.00 0.25 C ATOM 571 O GLU A 243 9.076 3.927 -5.278 1.00 0.25 O ATOM 572 CB GLU A 243 8.738 6.631 -6.403 1.00 0.39 C ATOM 573 CG GLU A 243 9.292 7.995 -6.770 1.00 0.67 C ATOM 574 CD GLU A 243 8.976 8.371 -8.202 1.00 1.10 C ATOM 575 OE1 GLU A 243 9.408 7.643 -9.121 1.00 1.64 O ATOM 576 OE2 GLU A 243 8.279 9.380 -8.414 1.00 1.56 O ATOM 0 H GLU A 243 10.919 6.620 -5.160 1.00 0.26 H new ATOM 0 HA GLU A 243 8.215 6.952 -4.361 1.00 0.30 H new ATOM 0 HB2 GLU A 243 9.255 5.871 -6.990 1.00 0.39 H new ATOM 0 HB3 GLU A 243 7.686 6.591 -6.685 1.00 0.39 H new ATOM 0 HG2 GLU A 243 8.878 8.747 -6.098 1.00 0.67 H new ATOM 0 HG3 GLU A 243 10.372 7.998 -6.625 1.00 0.67 H new ATOM 583 N VAL A 244 7.414 4.633 -3.959 1.00 0.24 N ATOM 584 CA VAL A 244 6.923 3.297 -3.723 1.00 0.21 C ATOM 585 C VAL A 244 5.832 2.958 -4.716 1.00 0.20 C ATOM 586 O VAL A 244 4.824 3.658 -4.821 1.00 0.23 O ATOM 587 CB VAL A 244 6.398 3.121 -2.283 1.00 0.22 C ATOM 588 CG1 VAL A 244 7.557 3.160 -1.296 1.00 0.24 C ATOM 589 CG2 VAL A 244 5.356 4.191 -1.948 1.00 0.27 C ATOM 0 H VAL A 244 6.887 5.371 -3.492 1.00 0.24 H new ATOM 0 HA VAL A 244 7.761 2.613 -3.855 1.00 0.21 H new ATOM 0 HB VAL A 244 5.911 2.149 -2.206 1.00 0.22 H new ATOM 0 HG11 VAL A 244 7.176 3.035 -0.282 1.00 0.24 H new ATOM 0 HG12 VAL A 244 8.256 2.355 -1.523 1.00 0.24 H new ATOM 0 HG13 VAL A 244 8.070 4.118 -1.375 1.00 0.24 H new ATOM 0 HG21 VAL A 244 5.001 4.046 -0.928 1.00 0.27 H new ATOM 0 HG22 VAL A 244 5.807 5.179 -2.038 1.00 0.27 H new ATOM 0 HG23 VAL A 244 4.517 4.111 -2.639 1.00 0.27 H new ATOM 599 N LYS A 245 6.008 1.844 -5.387 1.00 0.18 N ATOM 600 CA LYS A 245 4.979 1.320 -6.246 1.00 0.19 C ATOM 601 C LYS A 245 4.256 0.236 -5.472 1.00 0.15 C ATOM 602 O LYS A 245 4.792 -0.299 -4.503 1.00 0.16 O ATOM 603 CB LYS A 245 5.567 0.776 -7.555 1.00 0.30 C ATOM 604 CG LYS A 245 6.152 1.838 -8.478 1.00 0.89 C ATOM 605 CD LYS A 245 7.599 2.153 -8.133 1.00 1.51 C ATOM 606 CE LYS A 245 8.223 3.106 -9.141 1.00 2.00 C ATOM 607 NZ LYS A 245 9.680 3.293 -8.903 1.00 2.79 N ATOM 0 H LYS A 245 6.859 1.283 -5.352 1.00 0.18 H new ATOM 0 HA LYS A 245 4.284 2.110 -6.531 1.00 0.19 H new ATOM 0 HB2 LYS A 245 6.347 0.053 -7.315 1.00 0.30 H new ATOM 0 HB3 LYS A 245 4.787 0.237 -8.092 1.00 0.30 H new ATOM 0 HG2 LYS A 245 6.091 1.495 -9.511 1.00 0.89 H new ATOM 0 HG3 LYS A 245 5.556 2.748 -8.409 1.00 0.89 H new ATOM 0 HD2 LYS A 245 7.648 2.593 -7.137 1.00 1.51 H new ATOM 0 HD3 LYS A 245 8.175 1.228 -8.101 1.00 1.51 H new ATOM 0 HE2 LYS A 245 8.067 2.721 -10.149 1.00 2.00 H new ATOM 0 HE3 LYS A 245 7.720 4.071 -9.087 1.00 2.00 H new ATOM 0 HZ1 LYS A 245 10.066 3.949 -9.611 1.00 2.79 H new ATOM 0 HZ2 LYS A 245 9.829 3.684 -7.951 1.00 2.79 H new ATOM 0 HZ3 LYS A 245 10.165 2.376 -8.980 1.00 2.79 H new ATOM 621 N TRP A 246 3.003 0.022 -5.746 1.00 0.14 N ATOM 622 CA TRP A 246 2.258 -0.930 -4.953 1.00 0.13 C ATOM 623 C TRP A 246 1.574 -1.907 -5.876 1.00 0.14 C ATOM 624 O TRP A 246 1.772 -1.854 -7.083 1.00 0.14 O ATOM 625 CB TRP A 246 1.288 -0.244 -3.973 1.00 0.14 C ATOM 626 CG TRP A 246 1.982 0.709 -3.025 1.00 0.12 C ATOM 627 CD1 TRP A 246 2.537 1.911 -3.355 1.00 0.14 C ATOM 628 CD2 TRP A 246 2.224 0.547 -1.607 1.00 0.11 C ATOM 629 NE1 TRP A 246 3.089 2.499 -2.251 1.00 0.15 N ATOM 630 CE2 TRP A 246 2.919 1.692 -1.177 1.00 0.12 C ATOM 631 CE3 TRP A 246 1.928 -0.437 -0.657 1.00 0.13 C ATOM 632 CZ2 TRP A 246 3.318 1.885 0.142 1.00 0.14 C ATOM 633 CZ3 TRP A 246 2.332 -0.231 0.658 1.00 0.15 C ATOM 634 CH2 TRP A 246 3.018 0.920 1.036 1.00 0.15 C ATOM 0 H TRP A 246 2.479 0.478 -6.493 1.00 0.14 H new ATOM 0 HA TRP A 246 2.948 -1.484 -4.316 1.00 0.13 H new ATOM 0 HB2 TRP A 246 0.533 0.301 -4.539 1.00 0.14 H new ATOM 0 HB3 TRP A 246 0.765 -1.006 -3.395 1.00 0.14 H new ATOM 0 HD1 TRP A 246 2.540 2.337 -4.347 1.00 0.14 H new ATOM 0 HE1 TRP A 246 3.557 3.405 -2.238 1.00 0.15 H new ATOM 0 HE3 TRP A 246 1.398 -1.335 -0.938 1.00 0.13 H new ATOM 0 HZ2 TRP A 246 3.850 2.777 0.440 1.00 0.14 H new ATOM 0 HZ3 TRP A 246 2.108 -0.981 1.402 1.00 0.15 H new ATOM 0 HH2 TRP A 246 3.316 1.043 2.067 1.00 0.15 H new ATOM 645 N LEU A 247 1.068 -2.964 -5.323 1.00 0.15 N ATOM 646 CA LEU A 247 0.585 -4.059 -6.126 1.00 0.14 C ATOM 647 C LEU A 247 -0.825 -4.429 -5.681 1.00 0.15 C ATOM 648 O LEU A 247 -1.051 -4.662 -4.517 1.00 0.16 O ATOM 649 CB LEU A 247 1.537 -5.249 -5.935 1.00 0.15 C ATOM 650 CG LEU A 247 2.404 -5.693 -7.120 1.00 0.16 C ATOM 651 CD1 LEU A 247 1.735 -6.827 -7.876 1.00 0.21 C ATOM 652 CD2 LEU A 247 2.717 -4.534 -8.047 1.00 0.17 C ATOM 0 H LEU A 247 0.975 -3.099 -4.316 1.00 0.15 H new ATOM 0 HA LEU A 247 0.553 -3.780 -7.179 1.00 0.14 H new ATOM 0 HB2 LEU A 247 2.205 -5.009 -5.108 1.00 0.15 H new ATOM 0 HB3 LEU A 247 0.938 -6.105 -5.624 1.00 0.15 H new ATOM 0 HG LEU A 247 3.351 -6.056 -6.721 1.00 0.16 H new ATOM 0 HD11 LEU A 247 2.365 -7.128 -8.713 1.00 0.21 H new ATOM 0 HD12 LEU A 247 1.591 -7.675 -7.207 1.00 0.21 H new ATOM 0 HD13 LEU A 247 0.768 -6.493 -8.252 1.00 0.21 H new ATOM 0 HD21 LEU A 247 3.333 -4.886 -8.875 1.00 0.17 H new ATOM 0 HD22 LEU A 247 1.788 -4.119 -8.437 1.00 0.17 H new ATOM 0 HD23 LEU A 247 3.256 -3.763 -7.496 1.00 0.17 H new ATOM 664 N LYS A 248 -1.720 -4.657 -6.610 1.00 0.19 N ATOM 665 CA LYS A 248 -2.986 -5.283 -6.270 1.00 0.25 C ATOM 666 C LYS A 248 -2.764 -6.762 -6.503 1.00 0.25 C ATOM 667 O LYS A 248 -1.889 -7.089 -7.295 1.00 0.21 O ATOM 668 CB LYS A 248 -4.122 -4.759 -7.168 1.00 0.34 C ATOM 669 CG LYS A 248 -5.521 -4.869 -6.563 1.00 0.77 C ATOM 670 CD LYS A 248 -6.059 -6.295 -6.559 1.00 0.95 C ATOM 671 CE LYS A 248 -6.378 -6.782 -7.962 1.00 1.57 C ATOM 672 NZ LYS A 248 -6.959 -8.150 -7.960 1.00 2.06 N ATOM 0 H LYS A 248 -1.604 -4.424 -7.596 1.00 0.19 H new ATOM 0 HA LYS A 248 -3.282 -5.065 -5.244 1.00 0.25 H new ATOM 0 HB2 LYS A 248 -3.925 -3.713 -7.405 1.00 0.34 H new ATOM 0 HB3 LYS A 248 -4.105 -5.308 -8.109 1.00 0.34 H new ATOM 0 HG2 LYS A 248 -5.499 -4.492 -5.540 1.00 0.77 H new ATOM 0 HG3 LYS A 248 -6.204 -4.231 -7.123 1.00 0.77 H new ATOM 0 HD2 LYS A 248 -5.325 -6.959 -6.102 1.00 0.95 H new ATOM 0 HD3 LYS A 248 -6.958 -6.342 -5.945 1.00 0.95 H new ATOM 0 HE2 LYS A 248 -7.077 -6.092 -8.434 1.00 1.57 H new ATOM 0 HE3 LYS A 248 -5.469 -6.776 -8.563 1.00 1.57 H new ATOM 0 HZ1 LYS A 248 -6.942 -8.536 -8.926 1.00 2.06 H new ATOM 0 HZ2 LYS A 248 -6.401 -8.763 -7.332 1.00 2.06 H new ATOM 0 HZ3 LYS A 248 -7.941 -8.109 -7.621 1.00 2.06 H new ATOM 686 N ASN A 249 -3.344 -7.644 -5.693 1.00 0.34 N ATOM 687 CA ASN A 249 -2.996 -9.063 -5.803 1.00 0.40 C ATOM 688 C ASN A 249 -2.978 -9.499 -7.270 1.00 0.35 C ATOM 689 O ASN A 249 -3.964 -9.338 -7.989 1.00 0.35 O ATOM 690 CB ASN A 249 -3.911 -9.972 -4.954 1.00 0.61 C ATOM 691 CG ASN A 249 -5.391 -9.922 -5.303 1.00 0.75 C ATOM 692 OD1 ASN A 249 -5.804 -10.216 -6.422 1.00 1.38 O ATOM 693 ND2 ASN A 249 -6.213 -9.602 -4.322 1.00 1.19 N ATOM 0 H ASN A 249 -4.033 -7.416 -4.977 1.00 0.34 H new ATOM 0 HA ASN A 249 -1.992 -9.179 -5.394 1.00 0.40 H new ATOM 0 HB2 ASN A 249 -3.566 -11.001 -5.055 1.00 0.61 H new ATOM 0 HB3 ASN A 249 -3.794 -9.698 -3.905 1.00 0.61 H new ATOM 0 HD21 ASN A 249 -7.220 -9.594 -4.483 1.00 1.19 H new ATOM 0 HD22 ASN A 249 -5.841 -9.362 -3.403 1.00 1.19 H new ATOM 700 N GLY A 250 -1.770 -9.781 -7.756 1.00 0.35 N ATOM 701 CA GLY A 250 -1.558 -10.042 -9.170 1.00 0.35 C ATOM 702 C GLY A 250 -1.370 -8.787 -10.026 1.00 0.33 C ATOM 703 O GLY A 250 -0.461 -8.738 -10.853 1.00 0.39 O ATOM 0 H GLY A 250 -0.925 -9.833 -7.187 1.00 0.35 H new ATOM 0 HA2 GLY A 250 -0.679 -10.677 -9.281 1.00 0.35 H new ATOM 0 HA3 GLY A 250 -2.409 -10.604 -9.554 1.00 0.35 H new ATOM 707 N GLN A 251 -2.244 -7.796 -9.871 1.00 0.30 N ATOM 708 CA GLN A 251 -2.191 -6.587 -10.705 1.00 0.36 C ATOM 709 C GLN A 251 -1.161 -5.595 -10.178 1.00 0.25 C ATOM 710 O GLN A 251 -1.138 -5.291 -8.999 1.00 0.28 O ATOM 711 CB GLN A 251 -3.563 -5.914 -10.756 1.00 0.52 C ATOM 712 CG GLN A 251 -4.654 -6.786 -11.356 1.00 1.28 C ATOM 713 CD GLN A 251 -6.029 -6.144 -11.281 1.00 2.00 C ATOM 714 OE1 GLN A 251 -7.032 -6.760 -11.638 1.00 2.77 O ATOM 715 NE2 GLN A 251 -6.090 -4.903 -10.818 1.00 2.59 N ATOM 0 H GLN A 251 -2.995 -7.801 -9.181 1.00 0.30 H new ATOM 0 HA GLN A 251 -1.897 -6.893 -11.709 1.00 0.36 H new ATOM 0 HB2 GLN A 251 -3.855 -5.628 -9.745 1.00 0.52 H new ATOM 0 HB3 GLN A 251 -3.485 -4.995 -11.337 1.00 0.52 H new ATOM 0 HG2 GLN A 251 -4.413 -6.996 -12.398 1.00 1.28 H new ATOM 0 HG3 GLN A 251 -4.676 -7.743 -10.834 1.00 1.28 H new ATOM 0 HE21 GLN A 251 -5.237 -4.423 -10.531 1.00 2.59 H new ATOM 0 HE22 GLN A 251 -6.990 -4.428 -10.749 1.00 2.59 H new ATOM 724 N GLU A 252 -0.337 -5.053 -11.048 1.00 0.26 N ATOM 725 CA GLU A 252 0.666 -4.095 -10.611 1.00 0.25 C ATOM 726 C GLU A 252 0.084 -2.693 -10.468 1.00 0.27 C ATOM 727 O GLU A 252 -0.773 -2.280 -11.251 1.00 0.32 O ATOM 728 CB GLU A 252 1.863 -4.115 -11.544 1.00 0.32 C ATOM 729 CG GLU A 252 2.600 -5.443 -11.515 1.00 0.60 C ATOM 730 CD GLU A 252 3.845 -5.428 -12.374 1.00 1.05 C ATOM 731 OE1 GLU A 252 3.712 -5.270 -13.607 1.00 1.49 O ATOM 732 OE2 GLU A 252 4.959 -5.570 -11.828 1.00 1.60 O ATOM 0 H GLU A 252 -0.337 -5.252 -12.048 1.00 0.26 H new ATOM 0 HA GLU A 252 1.007 -4.394 -9.620 1.00 0.25 H new ATOM 0 HB2 GLU A 252 1.530 -3.910 -12.561 1.00 0.32 H new ATOM 0 HB3 GLU A 252 2.550 -3.316 -11.266 1.00 0.32 H new ATOM 0 HG2 GLU A 252 2.873 -5.682 -10.487 1.00 0.60 H new ATOM 0 HG3 GLU A 252 1.933 -6.234 -11.859 1.00 0.60 H new ATOM 739 N ILE A 253 0.425 -2.044 -9.362 1.00 0.23 N ATOM 740 CA ILE A 253 -0.176 -0.775 -8.988 1.00 0.27 C ATOM 741 C ILE A 253 0.838 0.382 -9.021 1.00 0.28 C ATOM 742 O ILE A 253 1.753 0.483 -8.183 1.00 0.28 O ATOM 743 CB ILE A 253 -0.850 -0.928 -7.598 1.00 0.26 C ATOM 744 CG1 ILE A 253 -2.283 -1.426 -7.749 1.00 0.31 C ATOM 745 CG2 ILE A 253 -0.807 0.337 -6.764 1.00 0.28 C ATOM 746 CD1 ILE A 253 -2.948 -1.718 -6.425 1.00 0.33 C ATOM 0 H ILE A 253 1.125 -2.383 -8.702 1.00 0.23 H new ATOM 0 HA ILE A 253 -0.937 -0.513 -9.723 1.00 0.27 H new ATOM 0 HB ILE A 253 -0.266 -1.670 -7.054 1.00 0.26 H new ATOM 0 HG12 ILE A 253 -2.867 -0.678 -8.286 1.00 0.31 H new ATOM 0 HG13 ILE A 253 -2.286 -2.330 -8.358 1.00 0.31 H new ATOM 0 HG21 ILE A 253 -1.296 0.158 -5.806 1.00 0.28 H new ATOM 0 HG22 ILE A 253 0.230 0.626 -6.594 1.00 0.28 H new ATOM 0 HG23 ILE A 253 -1.325 1.138 -7.291 1.00 0.28 H new ATOM 0 HD11 ILE A 253 -3.965 -2.069 -6.598 1.00 0.33 H new ATOM 0 HD12 ILE A 253 -2.384 -2.487 -5.896 1.00 0.33 H new ATOM 0 HD13 ILE A 253 -2.975 -0.810 -5.823 1.00 0.33 H new ATOM 758 N GLN A 254 0.640 1.278 -9.980 1.00 0.36 N ATOM 759 CA GLN A 254 1.461 2.472 -10.104 1.00 0.43 C ATOM 760 C GLN A 254 0.793 3.632 -9.382 1.00 0.61 C ATOM 761 O GLN A 254 -0.426 3.795 -9.459 1.00 1.42 O ATOM 762 CB GLN A 254 1.680 2.826 -11.577 1.00 0.70 C ATOM 763 CG GLN A 254 2.452 1.769 -12.352 1.00 1.00 C ATOM 764 CD GLN A 254 3.823 1.505 -11.762 1.00 1.75 C ATOM 765 OE1 GLN A 254 4.637 2.419 -11.619 1.00 2.63 O ATOM 766 NE2 GLN A 254 4.095 0.255 -11.425 1.00 2.21 N ATOM 0 H GLN A 254 -0.089 1.197 -10.688 1.00 0.36 H new ATOM 0 HA GLN A 254 2.432 2.277 -9.650 1.00 0.43 H new ATOM 0 HB2 GLN A 254 0.711 2.977 -12.053 1.00 0.70 H new ATOM 0 HB3 GLN A 254 2.217 3.773 -11.638 1.00 0.70 H new ATOM 0 HG2 GLN A 254 1.880 0.841 -12.364 1.00 1.00 H new ATOM 0 HG3 GLN A 254 2.561 2.090 -13.388 1.00 1.00 H new ATOM 0 HE21 GLN A 254 3.394 -0.473 -11.559 1.00 2.21 H new ATOM 0 HE22 GLN A 254 5.006 0.020 -11.031 1.00 2.21 H new ATOM 775 N MET A 255 1.581 4.411 -8.654 1.00 0.59 N ATOM 776 CA MET A 255 1.046 5.531 -7.886 1.00 0.61 C ATOM 777 C MET A 255 0.469 6.608 -8.805 1.00 0.65 C ATOM 778 O MET A 255 0.954 6.821 -9.921 1.00 0.95 O ATOM 779 CB MET A 255 2.109 6.110 -6.936 1.00 0.95 C ATOM 780 CG MET A 255 3.402 6.558 -7.605 1.00 1.58 C ATOM 781 SD MET A 255 3.288 8.197 -8.353 1.00 2.30 S ATOM 782 CE MET A 255 4.995 8.464 -8.828 1.00 2.61 C ATOM 0 H MET A 255 2.591 4.290 -8.578 1.00 0.59 H new ATOM 0 HA MET A 255 0.228 5.154 -7.272 1.00 0.61 H new ATOM 0 HB2 MET A 255 1.677 6.961 -6.409 1.00 0.95 H new ATOM 0 HB3 MET A 255 2.349 5.358 -6.184 1.00 0.95 H new ATOM 0 HG2 MET A 255 4.204 6.558 -6.867 1.00 1.58 H new ATOM 0 HG3 MET A 255 3.676 5.834 -8.373 1.00 1.58 H new ATOM 0 HE1 MET A 255 5.091 9.439 -9.306 1.00 2.61 H new ATOM 0 HE2 MET A 255 5.629 8.430 -7.942 1.00 2.61 H new ATOM 0 HE3 MET A 255 5.305 7.685 -9.525 1.00 2.61 H new ATOM 792 N SER A 256 -0.644 7.189 -8.381 1.00 0.57 N ATOM 793 CA SER A 256 -1.375 8.152 -9.189 1.00 0.69 C ATOM 794 C SER A 256 -2.132 9.145 -8.301 1.00 1.00 C ATOM 795 O SER A 256 -1.794 9.323 -7.127 1.00 1.47 O ATOM 796 CB SER A 256 -2.350 7.411 -10.107 1.00 0.76 C ATOM 797 OG SER A 256 -1.659 6.613 -11.056 1.00 1.64 O ATOM 0 H SER A 256 -1.064 7.006 -7.470 1.00 0.57 H new ATOM 0 HA SER A 256 -0.665 8.715 -9.794 1.00 0.69 H new ATOM 0 HB2 SER A 256 -3.008 6.781 -9.509 1.00 0.76 H new ATOM 0 HB3 SER A 256 -2.983 8.131 -10.626 1.00 0.76 H new ATOM 0 HG SER A 256 -2.307 6.150 -11.628 1.00 1.64 H new ATOM 803 N GLY A 257 -3.144 9.799 -8.868 1.00 1.01 N ATOM 804 CA GLY A 257 -3.910 10.780 -8.121 1.00 1.41 C ATOM 805 C GLY A 257 -5.304 10.294 -7.774 1.00 1.28 C ATOM 806 O GLY A 257 -5.789 10.514 -6.667 1.00 1.69 O ATOM 0 H GLY A 257 -3.446 9.666 -9.833 1.00 1.01 H new ATOM 0 HA2 GLY A 257 -3.377 11.028 -7.203 1.00 1.41 H new ATOM 0 HA3 GLY A 257 -3.984 11.698 -8.705 1.00 1.41 H new ATOM 810 N SER A 258 -5.968 9.671 -8.736 1.00 1.07 N ATOM 811 CA SER A 258 -7.323 9.175 -8.526 1.00 0.96 C ATOM 812 C SER A 258 -7.316 7.991 -7.564 1.00 0.74 C ATOM 813 O SER A 258 -8.152 7.896 -6.664 1.00 1.14 O ATOM 814 CB SER A 258 -7.945 8.777 -9.864 1.00 1.08 C ATOM 815 OG SER A 258 -7.839 9.837 -10.801 1.00 1.77 O ATOM 0 H SER A 258 -5.593 9.496 -9.668 1.00 1.07 H new ATOM 0 HA SER A 258 -7.924 9.969 -8.082 1.00 0.96 H new ATOM 0 HB2 SER A 258 -7.446 7.890 -10.253 1.00 1.08 H new ATOM 0 HB3 SER A 258 -8.993 8.516 -9.720 1.00 1.08 H new ATOM 0 HG SER A 258 -8.241 9.563 -11.652 1.00 1.77 H new ATOM 821 N LYS A 259 -6.314 7.137 -7.715 1.00 0.51 N ATOM 822 CA LYS A 259 -6.109 6.003 -6.826 1.00 0.37 C ATOM 823 C LYS A 259 -4.617 5.819 -6.605 1.00 0.33 C ATOM 824 O LYS A 259 -3.818 6.381 -7.355 1.00 0.45 O ATOM 825 CB LYS A 259 -6.705 4.721 -7.416 1.00 0.48 C ATOM 826 CG LYS A 259 -8.222 4.710 -7.487 1.00 1.11 C ATOM 827 CD LYS A 259 -8.739 3.373 -7.987 1.00 1.59 C ATOM 828 CE LYS A 259 -10.257 3.309 -7.955 1.00 2.02 C ATOM 829 NZ LYS A 259 -10.764 1.981 -8.392 1.00 2.41 N ATOM 0 H LYS A 259 -5.619 7.211 -8.458 1.00 0.51 H new ATOM 0 HA LYS A 259 -6.612 6.202 -5.880 1.00 0.37 H new ATOM 0 HB2 LYS A 259 -6.305 4.577 -8.420 1.00 0.48 H new ATOM 0 HB3 LYS A 259 -6.375 3.872 -6.817 1.00 0.48 H new ATOM 0 HG2 LYS A 259 -8.636 4.917 -6.500 1.00 1.11 H new ATOM 0 HG3 LYS A 259 -8.563 5.506 -8.149 1.00 1.11 H new ATOM 0 HD2 LYS A 259 -8.389 3.206 -9.006 1.00 1.59 H new ATOM 0 HD3 LYS A 259 -8.328 2.571 -7.373 1.00 1.59 H new ATOM 0 HE2 LYS A 259 -10.608 3.517 -6.944 1.00 2.02 H new ATOM 0 HE3 LYS A 259 -10.667 4.085 -8.601 1.00 2.02 H new ATOM 0 HZ1 LYS A 259 -11.803 1.977 -8.356 1.00 2.41 H new ATOM 0 HZ2 LYS A 259 -10.450 1.793 -9.366 1.00 2.41 H new ATOM 0 HZ3 LYS A 259 -10.393 1.243 -7.760 1.00 2.41 H new ATOM 843 N TYR A 260 -4.242 4.989 -5.625 1.00 0.24 N ATOM 844 CA TYR A 260 -2.835 4.691 -5.366 1.00 0.27 C ATOM 845 C TYR A 260 -2.034 5.981 -5.179 1.00 0.27 C ATOM 846 O TYR A 260 -1.072 6.238 -5.895 1.00 0.29 O ATOM 847 CB TYR A 260 -2.244 3.860 -6.514 1.00 0.33 C ATOM 848 CG TYR A 260 -3.237 2.900 -7.139 1.00 0.43 C ATOM 849 CD1 TYR A 260 -3.860 1.925 -6.370 1.00 0.29 C ATOM 850 CD2 TYR A 260 -3.537 2.956 -8.494 1.00 0.84 C ATOM 851 CE1 TYR A 260 -4.755 1.038 -6.932 1.00 0.52 C ATOM 852 CE2 TYR A 260 -4.430 2.070 -9.064 1.00 1.11 C ATOM 853 CZ TYR A 260 -5.082 1.167 -8.290 1.00 0.95 C ATOM 854 OH TYR A 260 -5.927 0.234 -8.851 1.00 1.24 O ATOM 0 H TYR A 260 -4.894 4.514 -5.001 1.00 0.24 H new ATOM 0 HA TYR A 260 -2.773 4.111 -4.445 1.00 0.27 H new ATOM 0 HB2 TYR A 260 -1.868 4.534 -7.284 1.00 0.33 H new ATOM 0 HB3 TYR A 260 -1.390 3.295 -6.141 1.00 0.33 H new ATOM 0 HD1 TYR A 260 -3.640 1.860 -5.315 1.00 0.29 H new ATOM 0 HD2 TYR A 260 -3.064 3.705 -9.112 1.00 0.84 H new ATOM 0 HE1 TYR A 260 -5.198 0.255 -6.334 1.00 0.52 H new ATOM 0 HE2 TYR A 260 -4.610 2.096 -10.129 1.00 1.11 H new ATOM 0 HH TYR A 260 -6.068 0.447 -9.797 1.00 1.24 H new ATOM 864 N ILE A 261 -2.473 6.807 -4.247 1.00 0.26 N ATOM 865 CA ILE A 261 -1.849 8.101 -4.006 1.00 0.27 C ATOM 866 C ILE A 261 -0.617 7.948 -3.118 1.00 0.28 C ATOM 867 O ILE A 261 -0.680 7.323 -2.069 1.00 0.35 O ATOM 868 CB ILE A 261 -2.848 9.051 -3.312 1.00 0.29 C ATOM 869 CG1 ILE A 261 -4.056 9.318 -4.211 1.00 0.32 C ATOM 870 CG2 ILE A 261 -2.174 10.354 -2.924 1.00 0.33 C ATOM 871 CD1 ILE A 261 -5.112 10.182 -3.557 1.00 0.39 C ATOM 0 H ILE A 261 -3.266 6.605 -3.638 1.00 0.26 H new ATOM 0 HA ILE A 261 -1.550 8.516 -4.969 1.00 0.27 H new ATOM 0 HB ILE A 261 -3.199 8.565 -2.402 1.00 0.29 H new ATOM 0 HG12 ILE A 261 -3.718 9.802 -5.127 1.00 0.32 H new ATOM 0 HG13 ILE A 261 -4.503 8.366 -4.499 1.00 0.32 H new ATOM 0 HG21 ILE A 261 -2.898 11.007 -2.437 1.00 0.33 H new ATOM 0 HG22 ILE A 261 -1.352 10.148 -2.239 1.00 0.33 H new ATOM 0 HG23 ILE A 261 -1.787 10.844 -3.818 1.00 0.33 H new ATOM 0 HD11 ILE A 261 -5.940 10.332 -4.250 1.00 0.39 H new ATOM 0 HD12 ILE A 261 -5.477 9.690 -2.656 1.00 0.39 H new ATOM 0 HD13 ILE A 261 -4.680 11.148 -3.294 1.00 0.39 H new ATOM 883 N PHE A 262 0.495 8.541 -3.513 1.00 0.30 N ATOM 884 CA PHE A 262 1.693 8.472 -2.694 1.00 0.32 C ATOM 885 C PHE A 262 1.601 9.450 -1.523 1.00 0.30 C ATOM 886 O PHE A 262 1.127 10.577 -1.671 1.00 0.37 O ATOM 887 CB PHE A 262 2.961 8.716 -3.531 1.00 0.46 C ATOM 888 CG PHE A 262 3.039 10.060 -4.201 1.00 0.63 C ATOM 889 CD1 PHE A 262 3.406 11.190 -3.488 1.00 0.87 C ATOM 890 CD2 PHE A 262 2.757 10.187 -5.550 1.00 0.84 C ATOM 891 CE1 PHE A 262 3.487 12.420 -4.107 1.00 1.13 C ATOM 892 CE2 PHE A 262 2.835 11.417 -6.174 1.00 1.09 C ATOM 893 CZ PHE A 262 3.202 12.533 -5.452 1.00 1.18 C ATOM 0 H PHE A 262 0.595 9.068 -4.381 1.00 0.30 H new ATOM 0 HA PHE A 262 1.765 7.464 -2.287 1.00 0.32 H new ATOM 0 HB2 PHE A 262 3.831 8.599 -2.885 1.00 0.46 H new ATOM 0 HB3 PHE A 262 3.026 7.942 -4.296 1.00 0.46 H new ATOM 0 HD1 PHE A 262 3.631 11.107 -2.435 1.00 0.87 H new ATOM 0 HD2 PHE A 262 2.473 9.315 -6.121 1.00 0.84 H new ATOM 0 HE1 PHE A 262 3.773 13.293 -3.540 1.00 1.13 H new ATOM 0 HE2 PHE A 262 2.609 11.504 -7.226 1.00 1.09 H new ATOM 0 HZ PHE A 262 3.266 13.495 -5.939 1.00 1.18 H new ATOM 903 N GLU A 263 1.996 8.986 -0.350 1.00 0.26 N ATOM 904 CA GLU A 263 1.951 9.792 0.861 1.00 0.30 C ATOM 905 C GLU A 263 3.168 9.456 1.712 1.00 0.28 C ATOM 906 O GLU A 263 3.561 8.294 1.800 1.00 0.33 O ATOM 907 CB GLU A 263 0.658 9.509 1.637 1.00 0.37 C ATOM 908 CG GLU A 263 0.475 10.354 2.890 1.00 0.56 C ATOM 909 CD GLU A 263 0.169 11.806 2.584 1.00 1.07 C ATOM 910 OE1 GLU A 263 1.037 12.497 2.011 1.00 1.73 O ATOM 911 OE2 GLU A 263 -0.949 12.263 2.907 1.00 1.79 O ATOM 0 H GLU A 263 2.356 8.042 -0.209 1.00 0.26 H new ATOM 0 HA GLU A 263 1.965 10.851 0.604 1.00 0.30 H new ATOM 0 HB2 GLU A 263 -0.192 9.675 0.975 1.00 0.37 H new ATOM 0 HB3 GLU A 263 0.641 8.456 1.919 1.00 0.37 H new ATOM 0 HG2 GLU A 263 -0.334 9.936 3.489 1.00 0.56 H new ATOM 0 HG3 GLU A 263 1.380 10.299 3.495 1.00 0.56 H new ATOM 918 N SER A 264 3.850 10.467 2.212 1.00 0.34 N ATOM 919 CA SER A 264 5.083 10.241 2.941 1.00 0.36 C ATOM 920 C SER A 264 4.981 10.790 4.355 1.00 0.34 C ATOM 921 O SER A 264 4.613 11.949 4.559 1.00 0.39 O ATOM 922 CB SER A 264 6.262 10.887 2.207 1.00 0.46 C ATOM 923 OG SER A 264 7.503 10.391 2.688 1.00 1.41 O ATOM 0 H SER A 264 3.575 11.446 2.128 1.00 0.34 H new ATOM 0 HA SER A 264 5.252 9.166 3.000 1.00 0.36 H new ATOM 0 HB2 SER A 264 6.179 10.691 1.138 1.00 0.46 H new ATOM 0 HB3 SER A 264 6.225 11.969 2.336 1.00 0.46 H new ATOM 0 HG SER A 264 8.237 10.819 2.201 1.00 1.41 H new ATOM 929 N ILE A 265 5.373 9.974 5.317 1.00 0.31 N ATOM 930 CA ILE A 265 5.448 10.400 6.703 1.00 0.34 C ATOM 931 C ILE A 265 6.864 10.153 7.203 1.00 0.38 C ATOM 932 O ILE A 265 7.205 9.036 7.603 1.00 0.42 O ATOM 933 CB ILE A 265 4.450 9.618 7.588 1.00 0.42 C ATOM 934 CG1 ILE A 265 3.042 9.664 6.982 1.00 0.82 C ATOM 935 CG2 ILE A 265 4.443 10.174 9.006 1.00 0.73 C ATOM 936 CD1 ILE A 265 2.031 8.815 7.724 1.00 1.31 C ATOM 0 H ILE A 265 5.647 9.004 5.161 1.00 0.31 H new ATOM 0 HA ILE A 265 5.191 11.458 6.762 1.00 0.34 H new ATOM 0 HB ILE A 265 4.770 8.577 7.630 1.00 0.42 H new ATOM 0 HG12 ILE A 265 2.695 10.697 6.969 1.00 0.82 H new ATOM 0 HG13 ILE A 265 3.091 9.331 5.945 1.00 0.82 H new ATOM 0 HG21 ILE A 265 3.735 9.611 9.614 1.00 0.73 H new ATOM 0 HG22 ILE A 265 5.441 10.086 9.436 1.00 0.73 H new ATOM 0 HG23 ILE A 265 4.149 11.223 8.984 1.00 0.73 H new ATOM 0 HD11 ILE A 265 1.059 8.898 7.237 1.00 1.31 H new ATOM 0 HD12 ILE A 265 2.354 7.774 7.715 1.00 1.31 H new ATOM 0 HD13 ILE A 265 1.952 9.161 8.754 1.00 1.31 H new ATOM 948 N GLY A 266 7.719 11.156 7.053 1.00 0.48 N ATOM 949 CA GLY A 266 9.127 10.954 7.319 1.00 0.65 C ATOM 950 C GLY A 266 9.694 9.877 6.413 1.00 0.86 C ATOM 951 O GLY A 266 9.519 9.934 5.193 1.00 1.93 O ATOM 0 H GLY A 266 7.465 12.098 6.754 1.00 0.48 H new ATOM 0 HA2 GLY A 266 9.669 11.887 7.166 1.00 0.65 H new ATOM 0 HA3 GLY A 266 9.268 10.671 8.362 1.00 0.65 H new ATOM 955 N ALA A 267 10.212 8.815 7.014 1.00 0.48 N ATOM 956 CA ALA A 267 10.617 7.638 6.259 1.00 0.39 C ATOM 957 C ALA A 267 9.415 6.781 5.932 1.00 0.30 C ATOM 958 O ALA A 267 9.418 6.031 4.954 1.00 0.32 O ATOM 959 CB ALA A 267 11.604 6.795 7.033 1.00 0.44 C ATOM 0 H ALA A 267 10.361 8.744 8.021 1.00 0.48 H new ATOM 0 HA ALA A 267 11.089 7.993 5.343 1.00 0.39 H new ATOM 0 HB1 ALA A 267 11.884 5.925 6.439 1.00 0.44 H new ATOM 0 HB2 ALA A 267 12.493 7.386 7.253 1.00 0.44 H new ATOM 0 HB3 ALA A 267 11.148 6.465 7.966 1.00 0.44 H new ATOM 965 N LYS A 268 8.452 6.785 6.842 1.00 0.26 N ATOM 966 CA LYS A 268 7.295 5.926 6.717 1.00 0.25 C ATOM 967 C LYS A 268 6.480 6.320 5.498 1.00 0.29 C ATOM 968 O LYS A 268 5.952 7.427 5.400 1.00 0.47 O ATOM 969 CB LYS A 268 6.442 5.972 7.984 1.00 0.28 C ATOM 970 CG LYS A 268 7.167 5.457 9.219 1.00 0.30 C ATOM 971 CD LYS A 268 6.292 5.580 10.459 1.00 0.41 C ATOM 972 CE LYS A 268 7.066 5.296 11.738 1.00 1.20 C ATOM 973 NZ LYS A 268 7.481 3.872 11.850 1.00 2.00 N ATOM 0 H LYS A 268 8.453 7.376 7.674 1.00 0.26 H new ATOM 0 HA LYS A 268 7.638 4.900 6.586 1.00 0.25 H new ATOM 0 HB2 LYS A 268 6.123 6.999 8.161 1.00 0.28 H new ATOM 0 HB3 LYS A 268 5.540 5.380 7.828 1.00 0.28 H new ATOM 0 HG2 LYS A 268 7.449 4.415 9.071 1.00 0.30 H new ATOM 0 HG3 LYS A 268 8.090 6.019 9.364 1.00 0.30 H new ATOM 0 HD2 LYS A 268 5.871 6.584 10.506 1.00 0.41 H new ATOM 0 HD3 LYS A 268 5.455 4.886 10.381 1.00 0.41 H new ATOM 0 HE2 LYS A 268 7.950 5.932 11.772 1.00 1.20 H new ATOM 0 HE3 LYS A 268 6.450 5.560 12.598 1.00 1.20 H new ATOM 0 HZ1 LYS A 268 6.959 3.418 12.627 1.00 2.00 H new ATOM 0 HZ2 LYS A 268 7.273 3.379 10.959 1.00 2.00 H new ATOM 0 HZ3 LYS A 268 8.502 3.822 12.043 1.00 2.00 H new ATOM 987 N ARG A 269 6.435 5.415 4.551 1.00 0.16 N ATOM 988 CA ARG A 269 5.747 5.650 3.312 1.00 0.16 C ATOM 989 C ARG A 269 4.313 5.159 3.389 1.00 0.18 C ATOM 990 O ARG A 269 4.005 4.224 4.115 1.00 0.17 O ATOM 991 CB ARG A 269 6.476 4.971 2.165 1.00 0.20 C ATOM 992 CG ARG A 269 5.852 5.260 0.831 1.00 0.53 C ATOM 993 CD ARG A 269 5.956 6.736 0.471 1.00 0.79 C ATOM 994 NE ARG A 269 7.330 7.233 0.550 1.00 0.69 N ATOM 995 CZ ARG A 269 7.753 8.342 -0.058 1.00 0.97 C ATOM 996 NH1 ARG A 269 6.949 8.981 -0.901 1.00 1.85 N ATOM 997 NH2 ARG A 269 8.979 8.800 0.166 1.00 1.17 N ATOM 0 H ARG A 269 6.875 4.497 4.620 1.00 0.16 H new ATOM 0 HA ARG A 269 5.731 6.725 3.130 1.00 0.16 H new ATOM 0 HB2 ARG A 269 7.515 5.300 2.155 1.00 0.20 H new ATOM 0 HB3 ARG A 269 6.484 3.894 2.332 1.00 0.20 H new ATOM 0 HG2 ARG A 269 6.342 4.662 0.062 1.00 0.53 H new ATOM 0 HG3 ARG A 269 4.804 4.962 0.847 1.00 0.53 H new ATOM 0 HD2 ARG A 269 5.575 6.889 -0.539 1.00 0.79 H new ATOM 0 HD3 ARG A 269 5.323 7.317 1.142 1.00 0.79 H new ATOM 0 HE ARG A 269 8.003 6.701 1.102 1.00 0.69 H new ATOM 0 HH11 ARG A 269 6.011 8.623 -1.082 1.00 1.85 H new ATOM 0 HH12 ARG A 269 7.270 9.829 -1.368 1.00 1.85 H new ATOM 0 HH21 ARG A 269 9.600 8.303 0.805 1.00 1.17 H new ATOM 0 HH22 ARG A 269 9.300 9.648 -0.301 1.00 1.17 H new ATOM 1011 N THR A 270 3.426 5.862 2.723 1.00 0.18 N ATOM 1012 CA THR A 270 2.025 5.524 2.752 1.00 0.18 C ATOM 1013 C THR A 270 1.404 5.585 1.357 1.00 0.19 C ATOM 1014 O THR A 270 1.619 6.541 0.607 1.00 0.22 O ATOM 1015 CB THR A 270 1.275 6.473 3.708 1.00 0.20 C ATOM 1016 OG1 THR A 270 1.758 6.299 5.049 1.00 0.25 O ATOM 1017 CG2 THR A 270 -0.213 6.221 3.668 1.00 0.24 C ATOM 0 H THR A 270 3.654 6.676 2.152 1.00 0.18 H new ATOM 0 HA THR A 270 1.934 4.499 3.112 1.00 0.18 H new ATOM 0 HB THR A 270 1.459 7.497 3.382 1.00 0.20 H new ATOM 0 HG1 THR A 270 1.123 5.752 5.557 1.00 0.25 H new ATOM 0 HG21 THR A 270 -0.716 6.904 4.352 1.00 0.24 H new ATOM 0 HG22 THR A 270 -0.582 6.383 2.655 1.00 0.24 H new ATOM 0 HG23 THR A 270 -0.416 5.193 3.968 1.00 0.24 H new ATOM 1025 N LEU A 271 0.624 4.568 1.021 1.00 0.17 N ATOM 1026 CA LEU A 271 -0.098 4.553 -0.242 1.00 0.17 C ATOM 1027 C LEU A 271 -1.569 4.878 0.009 1.00 0.16 C ATOM 1028 O LEU A 271 -2.328 4.020 0.434 1.00 0.17 O ATOM 1029 CB LEU A 271 0.036 3.182 -0.917 1.00 0.20 C ATOM 1030 CG LEU A 271 -0.413 3.087 -2.384 1.00 0.26 C ATOM 1031 CD1 LEU A 271 -1.922 2.917 -2.499 1.00 0.56 C ATOM 1032 CD2 LEU A 271 0.052 4.307 -3.164 1.00 0.49 C ATOM 0 H LEU A 271 0.475 3.744 1.604 1.00 0.17 H new ATOM 0 HA LEU A 271 0.328 5.305 -0.906 1.00 0.17 H new ATOM 0 HB2 LEU A 271 1.081 2.876 -0.861 1.00 0.20 H new ATOM 0 HB3 LEU A 271 -0.540 2.460 -0.338 1.00 0.20 H new ATOM 0 HG LEU A 271 0.050 2.200 -2.816 1.00 0.26 H new ATOM 0 HD11 LEU A 271 -2.202 2.854 -3.551 1.00 0.56 H new ATOM 0 HD12 LEU A 271 -2.225 2.004 -1.987 1.00 0.56 H new ATOM 0 HD13 LEU A 271 -2.420 3.772 -2.042 1.00 0.56 H new ATOM 0 HD21 LEU A 271 -0.275 4.223 -4.200 1.00 0.49 H new ATOM 0 HD22 LEU A 271 -0.375 5.207 -2.721 1.00 0.49 H new ATOM 0 HD23 LEU A 271 1.140 4.367 -3.130 1.00 0.49 H new ATOM 1044 N THR A 272 -1.973 6.099 -0.261 1.00 0.18 N ATOM 1045 CA THR A 272 -3.353 6.495 -0.065 1.00 0.21 C ATOM 1046 C THR A 272 -4.227 5.993 -1.210 1.00 0.22 C ATOM 1047 O THR A 272 -4.199 6.533 -2.315 1.00 0.29 O ATOM 1048 CB THR A 272 -3.472 8.024 0.045 1.00 0.27 C ATOM 1049 OG1 THR A 272 -2.424 8.528 0.882 1.00 0.33 O ATOM 1050 CG2 THR A 272 -4.814 8.418 0.631 1.00 0.30 C ATOM 0 H THR A 272 -1.366 6.837 -0.617 1.00 0.18 H new ATOM 0 HA THR A 272 -3.698 6.047 0.866 1.00 0.21 H new ATOM 0 HB THR A 272 -3.387 8.450 -0.955 1.00 0.27 H new ATOM 0 HG1 THR A 272 -2.500 9.503 0.950 1.00 0.33 H new ATOM 0 HG21 THR A 272 -4.876 9.504 0.700 1.00 0.30 H new ATOM 0 HG22 THR A 272 -5.614 8.049 -0.011 1.00 0.30 H new ATOM 0 HG23 THR A 272 -4.918 7.985 1.626 1.00 0.30 H new ATOM 1058 N ILE A 273 -5.001 4.960 -0.949 1.00 0.23 N ATOM 1059 CA ILE A 273 -5.887 4.417 -1.957 1.00 0.26 C ATOM 1060 C ILE A 273 -7.279 5.031 -1.803 1.00 0.28 C ATOM 1061 O ILE A 273 -7.897 4.977 -0.728 1.00 0.27 O ATOM 1062 CB ILE A 273 -5.922 2.856 -1.930 1.00 0.31 C ATOM 1063 CG1 ILE A 273 -5.781 2.295 -3.351 1.00 0.41 C ATOM 1064 CG2 ILE A 273 -7.186 2.303 -1.280 1.00 0.32 C ATOM 1065 CD1 ILE A 273 -6.929 2.654 -4.274 1.00 0.86 C ATOM 0 H ILE A 273 -5.035 4.481 -0.049 1.00 0.23 H new ATOM 0 HA ILE A 273 -5.500 4.686 -2.940 1.00 0.26 H new ATOM 0 HB ILE A 273 -5.078 2.536 -1.319 1.00 0.31 H new ATOM 0 HG12 ILE A 273 -4.851 2.663 -3.785 1.00 0.41 H new ATOM 0 HG13 ILE A 273 -5.699 1.209 -3.295 1.00 0.41 H new ATOM 0 HG21 ILE A 273 -7.154 1.214 -1.290 1.00 0.32 H new ATOM 0 HG22 ILE A 273 -7.249 2.654 -0.250 1.00 0.32 H new ATOM 0 HG23 ILE A 273 -8.060 2.645 -1.834 1.00 0.32 H new ATOM 0 HD11 ILE A 273 -6.754 2.220 -5.258 1.00 0.86 H new ATOM 0 HD12 ILE A 273 -7.861 2.262 -3.865 1.00 0.86 H new ATOM 0 HD13 ILE A 273 -6.999 3.738 -4.363 1.00 0.86 H new ATOM 1077 N SER A 274 -7.688 5.747 -2.839 1.00 0.33 N ATOM 1078 CA SER A 274 -8.946 6.464 -2.838 1.00 0.39 C ATOM 1079 C SER A 274 -9.994 5.689 -3.620 1.00 0.45 C ATOM 1080 O SER A 274 -9.658 4.963 -4.555 1.00 0.50 O ATOM 1081 CB SER A 274 -8.756 7.858 -3.438 1.00 0.52 C ATOM 1082 OG SER A 274 -7.842 8.619 -2.667 1.00 1.13 O ATOM 0 H SER A 274 -7.154 5.845 -3.703 1.00 0.33 H new ATOM 0 HA SER A 274 -9.290 6.570 -1.809 1.00 0.39 H new ATOM 0 HB2 SER A 274 -8.391 7.771 -4.461 1.00 0.52 H new ATOM 0 HB3 SER A 274 -9.716 8.373 -3.484 1.00 0.52 H new ATOM 0 HG SER A 274 -7.734 9.506 -3.069 1.00 1.13 H new ATOM 1088 N GLN A 275 -11.249 5.795 -3.183 1.00 0.51 N ATOM 1089 CA GLN A 275 -12.353 5.055 -3.782 1.00 0.62 C ATOM 1090 C GLN A 275 -12.097 3.562 -3.664 1.00 0.62 C ATOM 1091 O GLN A 275 -11.704 2.896 -4.622 1.00 0.74 O ATOM 1092 CB GLN A 275 -12.576 5.471 -5.234 1.00 0.75 C ATOM 1093 CG GLN A 275 -12.933 6.941 -5.379 1.00 0.90 C ATOM 1094 CD GLN A 275 -14.217 7.315 -4.657 1.00 1.53 C ATOM 1095 OE1 GLN A 275 -14.298 7.266 -3.427 1.00 2.14 O ATOM 1096 NE2 GLN A 275 -15.231 7.692 -5.416 1.00 2.27 N ATOM 0 H GLN A 275 -11.525 6.395 -2.406 1.00 0.51 H new ATOM 0 HA GLN A 275 -13.268 5.293 -3.239 1.00 0.62 H new ATOM 0 HB2 GLN A 275 -11.674 5.263 -5.809 1.00 0.75 H new ATOM 0 HB3 GLN A 275 -13.374 4.864 -5.662 1.00 0.75 H new ATOM 0 HG2 GLN A 275 -12.115 7.548 -4.991 1.00 0.90 H new ATOM 0 HG3 GLN A 275 -13.035 7.182 -6.437 1.00 0.90 H new ATOM 0 HE21 GLN A 275 -15.126 7.720 -6.430 1.00 2.27 H new ATOM 0 HE22 GLN A 275 -16.119 7.955 -4.988 1.00 2.27 H new ATOM 1105 N CYS A 276 -12.253 3.072 -2.451 1.00 0.60 N ATOM 1106 CA CYS A 276 -11.973 1.706 -2.114 1.00 0.69 C ATOM 1107 C CYS A 276 -12.690 1.412 -0.827 1.00 0.75 C ATOM 1108 O CYS A 276 -12.582 2.171 0.142 1.00 1.27 O ATOM 1109 CB CYS A 276 -10.464 1.493 -1.953 1.00 0.80 C ATOM 1110 SG CYS A 276 -10.003 -0.091 -1.207 1.00 2.00 S ATOM 0 H CYS A 276 -12.584 3.629 -1.663 1.00 0.60 H new ATOM 0 HA CYS A 276 -12.312 1.035 -2.903 1.00 0.69 H new ATOM 0 HB2 CYS A 276 -9.993 1.569 -2.933 1.00 0.80 H new ATOM 0 HB3 CYS A 276 -10.060 2.299 -1.341 1.00 0.80 H new ATOM 0 HG CYS A 276 -9.014 0.089 -0.383 1.00 2.00 H new ATOM 1116 N SER A 277 -13.589 0.471 -0.890 1.00 0.54 N ATOM 1117 CA SER A 277 -14.456 0.210 0.218 1.00 0.52 C ATOM 1118 C SER A 277 -14.860 -1.252 0.212 1.00 0.48 C ATOM 1119 O SER A 277 -14.032 -2.114 -0.098 1.00 0.47 O ATOM 1120 CB SER A 277 -15.682 1.121 0.137 1.00 0.56 C ATOM 1121 OG SER A 277 -16.356 0.959 -1.101 1.00 0.63 O ATOM 0 H SER A 277 -13.739 -0.129 -1.701 1.00 0.54 H new ATOM 0 HA SER A 277 -13.936 0.419 1.153 1.00 0.52 H new ATOM 0 HB2 SER A 277 -16.362 0.894 0.958 1.00 0.56 H new ATOM 0 HB3 SER A 277 -15.375 2.160 0.255 1.00 0.56 H new ATOM 0 HG SER A 277 -17.137 1.550 -1.128 1.00 0.63 H new ATOM 1127 N LEU A 278 -16.135 -1.528 0.489 1.00 0.51 N ATOM 1128 CA LEU A 278 -16.650 -2.892 0.494 1.00 0.54 C ATOM 1129 C LEU A 278 -16.770 -3.438 -0.930 1.00 0.58 C ATOM 1130 O LEU A 278 -17.828 -3.917 -1.339 1.00 0.71 O ATOM 1131 CB LEU A 278 -18.012 -2.960 1.199 1.00 0.63 C ATOM 1132 CG LEU A 278 -17.970 -3.151 2.720 1.00 0.78 C ATOM 1133 CD1 LEU A 278 -17.401 -4.516 3.073 1.00 1.22 C ATOM 1134 CD2 LEU A 278 -17.154 -2.053 3.383 1.00 0.79 C ATOM 0 H LEU A 278 -16.832 -0.818 0.714 1.00 0.51 H new ATOM 0 HA LEU A 278 -15.941 -3.511 1.044 1.00 0.54 H new ATOM 0 HB2 LEU A 278 -18.558 -2.042 0.983 1.00 0.63 H new ATOM 0 HB3 LEU A 278 -18.584 -3.780 0.765 1.00 0.63 H new ATOM 0 HG LEU A 278 -18.992 -3.092 3.094 1.00 0.78 H new ATOM 0 HD11 LEU A 278 -17.380 -4.632 4.157 1.00 1.22 H new ATOM 0 HD12 LEU A 278 -18.027 -5.295 2.637 1.00 1.22 H new ATOM 0 HD13 LEU A 278 -16.388 -4.601 2.679 1.00 1.22 H new ATOM 0 HD21 LEU A 278 -17.140 -2.211 4.461 1.00 0.79 H new ATOM 0 HD22 LEU A 278 -16.134 -2.076 2.999 1.00 0.79 H new ATOM 0 HD23 LEU A 278 -17.603 -1.084 3.164 1.00 0.79 H new ATOM 1146 N ALA A 279 -15.692 -3.318 -1.684 1.00 0.53 N ATOM 1147 CA ALA A 279 -15.648 -3.759 -3.064 1.00 0.61 C ATOM 1148 C ALA A 279 -14.209 -4.035 -3.472 1.00 0.58 C ATOM 1149 O ALA A 279 -13.899 -5.114 -3.970 1.00 0.62 O ATOM 1150 CB ALA A 279 -16.273 -2.719 -3.981 1.00 0.71 C ATOM 0 H ALA A 279 -14.818 -2.909 -1.353 1.00 0.53 H new ATOM 0 HA ALA A 279 -16.224 -4.680 -3.156 1.00 0.61 H new ATOM 0 HB1 ALA A 279 -16.230 -3.070 -5.012 1.00 0.71 H new ATOM 0 HB2 ALA A 279 -17.313 -2.560 -3.695 1.00 0.71 H new ATOM 0 HB3 ALA A 279 -15.725 -1.781 -3.894 1.00 0.71 H new ATOM 1156 N ASP A 280 -13.313 -3.088 -3.196 1.00 0.56 N ATOM 1157 CA ASP A 280 -11.895 -3.280 -3.508 1.00 0.59 C ATOM 1158 C ASP A 280 -11.186 -4.089 -2.422 1.00 0.50 C ATOM 1159 O ASP A 280 -9.961 -4.218 -2.438 1.00 0.70 O ATOM 1160 CB ASP A 280 -11.185 -1.940 -3.716 1.00 0.70 C ATOM 1161 CG ASP A 280 -11.447 -1.345 -5.087 1.00 1.21 C ATOM 1162 OD1 ASP A 280 -12.601 -0.954 -5.366 1.00 1.84 O ATOM 1163 OD2 ASP A 280 -10.496 -1.249 -5.890 1.00 1.77 O ATOM 0 H ASP A 280 -13.538 -2.192 -2.763 1.00 0.56 H new ATOM 0 HA ASP A 280 -11.847 -3.844 -4.439 1.00 0.59 H new ATOM 0 HB2 ASP A 280 -11.513 -1.237 -2.951 1.00 0.70 H new ATOM 0 HB3 ASP A 280 -10.112 -2.078 -3.583 1.00 0.70 H new ATOM 1168 N ASP A 281 -11.979 -4.741 -1.577 1.00 0.37 N ATOM 1169 CA ASP A 281 -11.473 -5.704 -0.605 1.00 0.33 C ATOM 1170 C ASP A 281 -10.732 -6.815 -1.337 1.00 0.34 C ATOM 1171 O ASP A 281 -11.266 -7.400 -2.286 1.00 0.43 O ATOM 1172 CB ASP A 281 -12.648 -6.276 0.194 1.00 0.40 C ATOM 1173 CG ASP A 281 -12.301 -7.534 0.974 1.00 0.52 C ATOM 1174 OD1 ASP A 281 -11.517 -7.457 1.935 1.00 1.12 O ATOM 1175 OD2 ASP A 281 -12.844 -8.609 0.642 1.00 0.81 O ATOM 0 H ASP A 281 -12.991 -4.616 -1.547 1.00 0.37 H new ATOM 0 HA ASP A 281 -10.782 -5.217 0.083 1.00 0.33 H new ATOM 0 HB2 ASP A 281 -13.008 -5.516 0.888 1.00 0.40 H new ATOM 0 HB3 ASP A 281 -13.468 -6.497 -0.490 1.00 0.40 H new ATOM 1180 N ALA A 282 -9.457 -6.985 -1.012 1.00 0.31 N ATOM 1181 CA ALA A 282 -8.589 -7.865 -1.784 1.00 0.37 C ATOM 1182 C ALA A 282 -7.232 -8.028 -1.110 1.00 0.35 C ATOM 1183 O ALA A 282 -7.160 -8.326 0.079 1.00 0.58 O ATOM 1184 CB ALA A 282 -8.425 -7.299 -3.190 1.00 0.48 C ATOM 0 H ALA A 282 -9.002 -6.527 -0.222 1.00 0.31 H new ATOM 0 HA ALA A 282 -9.047 -8.853 -1.841 1.00 0.37 H new ATOM 0 HB1 ALA A 282 -7.776 -7.953 -3.772 1.00 0.48 H new ATOM 0 HB2 ALA A 282 -9.401 -7.233 -3.672 1.00 0.48 H new ATOM 0 HB3 ALA A 282 -7.981 -6.305 -3.133 1.00 0.48 H new ATOM 1190 N ALA A 283 -6.162 -7.775 -1.860 1.00 0.22 N ATOM 1191 CA ALA A 283 -4.814 -7.789 -1.314 1.00 0.17 C ATOM 1192 C ALA A 283 -3.957 -6.798 -2.077 1.00 0.15 C ATOM 1193 O ALA A 283 -3.936 -6.823 -3.307 1.00 0.19 O ATOM 1194 CB ALA A 283 -4.209 -9.185 -1.388 1.00 0.22 C ATOM 0 H ALA A 283 -6.207 -7.556 -2.855 1.00 0.22 H new ATOM 0 HA ALA A 283 -4.854 -7.502 -0.263 1.00 0.17 H new ATOM 0 HB1 ALA A 283 -3.201 -9.167 -0.973 1.00 0.22 H new ATOM 0 HB2 ALA A 283 -4.825 -9.879 -0.816 1.00 0.22 H new ATOM 0 HB3 ALA A 283 -4.168 -9.509 -2.428 1.00 0.22 H new ATOM 1200 N TYR A 284 -3.272 -5.919 -1.362 1.00 0.12 N ATOM 1201 CA TYR A 284 -2.398 -4.945 -2.003 1.00 0.13 C ATOM 1202 C TYR A 284 -0.960 -5.116 -1.506 1.00 0.14 C ATOM 1203 O TYR A 284 -0.640 -4.803 -0.365 1.00 0.16 O ATOM 1204 CB TYR A 284 -2.880 -3.494 -1.780 1.00 0.15 C ATOM 1205 CG TYR A 284 -4.111 -3.089 -2.590 1.00 0.19 C ATOM 1206 CD1 TYR A 284 -5.123 -4.011 -2.878 1.00 0.22 C ATOM 1207 CD2 TYR A 284 -4.268 -1.792 -3.064 1.00 0.26 C ATOM 1208 CE1 TYR A 284 -6.240 -3.642 -3.607 1.00 0.29 C ATOM 1209 CE2 TYR A 284 -5.382 -1.419 -3.789 1.00 0.32 C ATOM 1210 CZ TYR A 284 -6.351 -2.354 -4.083 1.00 0.35 C ATOM 1211 OH TYR A 284 -7.481 -1.969 -4.773 1.00 0.41 O ATOM 0 H TYR A 284 -3.303 -5.859 -0.344 1.00 0.12 H new ATOM 0 HA TYR A 284 -2.430 -5.133 -3.076 1.00 0.13 H new ATOM 0 HB2 TYR A 284 -3.100 -3.359 -0.721 1.00 0.15 H new ATOM 0 HB3 TYR A 284 -2.063 -2.815 -2.025 1.00 0.15 H new ATOM 0 HD1 TYR A 284 -5.031 -5.028 -2.526 1.00 0.22 H new ATOM 0 HD2 TYR A 284 -3.501 -1.059 -2.861 1.00 0.26 H new ATOM 0 HE1 TYR A 284 -7.022 -4.361 -3.802 1.00 0.29 H new ATOM 0 HE2 TYR A 284 -5.494 -0.399 -4.124 1.00 0.32 H new ATOM 0 HH TYR A 284 -7.398 -1.029 -5.037 1.00 0.41 H new ATOM 1221 N GLN A 285 -0.100 -5.576 -2.398 1.00 0.13 N ATOM 1222 CA GLN A 285 1.310 -5.745 -2.119 1.00 0.13 C ATOM 1223 C GLN A 285 2.043 -4.413 -2.245 1.00 0.12 C ATOM 1224 O GLN A 285 1.517 -3.450 -2.802 1.00 0.13 O ATOM 1225 CB GLN A 285 1.939 -6.759 -3.084 1.00 0.12 C ATOM 1226 CG GLN A 285 1.296 -8.137 -3.062 1.00 0.15 C ATOM 1227 CD GLN A 285 0.066 -8.257 -3.944 1.00 0.21 C ATOM 1228 OE1 GLN A 285 -0.710 -9.200 -3.804 1.00 0.29 O ATOM 1229 NE2 GLN A 285 -0.111 -7.331 -4.878 1.00 0.18 N ATOM 0 H GLN A 285 -0.367 -5.845 -3.345 1.00 0.13 H new ATOM 0 HA GLN A 285 1.405 -6.116 -1.099 1.00 0.13 H new ATOM 0 HB2 GLN A 285 1.880 -6.361 -4.097 1.00 0.12 H new ATOM 0 HB3 GLN A 285 2.997 -6.862 -2.843 1.00 0.12 H new ATOM 0 HG2 GLN A 285 2.032 -8.876 -3.380 1.00 0.15 H new ATOM 0 HG3 GLN A 285 1.021 -8.382 -2.036 1.00 0.15 H new ATOM 0 HE21 GLN A 285 0.553 -6.562 -4.966 1.00 0.18 H new ATOM 0 HE22 GLN A 285 -0.911 -7.388 -5.508 1.00 0.18 H new ATOM 1238 N CYS A 286 3.269 -4.380 -1.756 1.00 0.14 N ATOM 1239 CA CYS A 286 4.093 -3.181 -1.821 1.00 0.19 C ATOM 1240 C CYS A 286 5.364 -3.440 -2.572 1.00 0.19 C ATOM 1241 O CYS A 286 5.859 -4.559 -2.554 1.00 0.20 O ATOM 1242 CB CYS A 286 4.428 -2.719 -0.441 1.00 0.28 C ATOM 1243 SG CYS A 286 5.275 -3.945 0.586 1.00 1.00 S ATOM 0 H CYS A 286 3.721 -5.175 -1.305 1.00 0.14 H new ATOM 0 HA CYS A 286 3.526 -2.412 -2.345 1.00 0.19 H new ATOM 0 HB2 CYS A 286 5.055 -1.830 -0.513 1.00 0.28 H new ATOM 0 HB3 CYS A 286 3.507 -2.420 0.060 1.00 0.28 H new ATOM 0 HG CYS A 286 6.493 -3.553 0.814 1.00 1.00 H new ATOM 1249 N VAL A 287 5.748 -2.500 -3.425 1.00 0.20 N ATOM 1250 CA VAL A 287 6.778 -2.797 -4.394 1.00 0.21 C ATOM 1251 C VAL A 287 7.705 -1.609 -4.674 1.00 0.22 C ATOM 1252 O VAL A 287 7.283 -0.463 -4.848 1.00 0.24 O ATOM 1253 CB VAL A 287 6.130 -3.353 -5.693 1.00 0.21 C ATOM 1254 CG1 VAL A 287 4.642 -3.611 -5.457 1.00 0.18 C ATOM 1255 CG2 VAL A 287 6.334 -2.441 -6.896 1.00 0.27 C ATOM 0 H VAL A 287 5.371 -1.553 -3.462 1.00 0.20 H new ATOM 0 HA VAL A 287 7.424 -3.564 -3.966 1.00 0.21 H new ATOM 0 HB VAL A 287 6.633 -4.290 -5.931 1.00 0.21 H new ATOM 0 HG11 VAL A 287 4.191 -4.001 -6.370 1.00 0.18 H new ATOM 0 HG12 VAL A 287 4.522 -4.338 -4.654 1.00 0.18 H new ATOM 0 HG13 VAL A 287 4.151 -2.679 -5.179 1.00 0.18 H new ATOM 0 HG21 VAL A 287 5.859 -2.883 -7.772 1.00 0.27 H new ATOM 0 HG22 VAL A 287 5.888 -1.467 -6.694 1.00 0.27 H new ATOM 0 HG23 VAL A 287 7.401 -2.320 -7.084 1.00 0.27 H new ATOM 1265 N VAL A 288 8.990 -1.899 -4.686 1.00 0.24 N ATOM 1266 CA VAL A 288 10.007 -0.899 -4.952 1.00 0.26 C ATOM 1267 C VAL A 288 11.097 -1.514 -5.816 1.00 0.33 C ATOM 1268 O VAL A 288 11.687 -2.533 -5.446 1.00 0.37 O ATOM 1269 CB VAL A 288 10.617 -0.348 -3.641 1.00 0.27 C ATOM 1270 CG1 VAL A 288 11.919 0.381 -3.905 1.00 0.31 C ATOM 1271 CG2 VAL A 288 9.641 0.582 -2.939 1.00 0.36 C ATOM 0 H VAL A 288 9.360 -2.834 -4.512 1.00 0.24 H new ATOM 0 HA VAL A 288 9.543 -0.064 -5.476 1.00 0.26 H new ATOM 0 HB VAL A 288 10.822 -1.201 -2.994 1.00 0.27 H new ATOM 0 HG11 VAL A 288 12.323 0.756 -2.965 1.00 0.31 H new ATOM 0 HG12 VAL A 288 12.634 -0.305 -4.359 1.00 0.31 H new ATOM 0 HG13 VAL A 288 11.738 1.216 -4.581 1.00 0.31 H new ATOM 0 HG21 VAL A 288 10.092 0.957 -2.020 1.00 0.36 H new ATOM 0 HG22 VAL A 288 9.402 1.420 -3.594 1.00 0.36 H new ATOM 0 HG23 VAL A 288 8.728 0.037 -2.699 1.00 0.36 H new ATOM 1281 N GLY A 289 11.267 -0.971 -7.017 1.00 0.43 N ATOM 1282 CA GLY A 289 12.213 -1.523 -7.972 1.00 0.57 C ATOM 1283 C GLY A 289 11.685 -2.770 -8.667 1.00 0.73 C ATOM 1284 O GLY A 289 11.895 -2.962 -9.864 1.00 1.51 O ATOM 0 H GLY A 289 10.761 -0.150 -7.349 1.00 0.43 H new ATOM 0 HA2 GLY A 289 12.450 -0.767 -8.721 1.00 0.57 H new ATOM 0 HA3 GLY A 289 13.143 -1.765 -7.458 1.00 0.57 H new ATOM 1288 N GLY A 290 11.021 -3.623 -7.902 1.00 0.41 N ATOM 1289 CA GLY A 290 10.497 -4.867 -8.427 1.00 0.41 C ATOM 1290 C GLY A 290 9.971 -5.758 -7.320 1.00 0.37 C ATOM 1291 O GLY A 290 9.035 -6.533 -7.519 1.00 0.64 O ATOM 0 H GLY A 290 10.833 -3.472 -6.911 1.00 0.41 H new ATOM 0 HA2 GLY A 290 9.697 -4.656 -9.137 1.00 0.41 H new ATOM 0 HA3 GLY A 290 11.280 -5.390 -8.976 1.00 0.41 H new ATOM 1295 N GLU A 291 10.591 -5.640 -6.151 1.00 0.27 N ATOM 1296 CA GLU A 291 10.212 -6.408 -4.972 1.00 0.22 C ATOM 1297 C GLU A 291 8.785 -6.086 -4.547 1.00 0.16 C ATOM 1298 O GLU A 291 8.489 -4.933 -4.261 1.00 0.19 O ATOM 1299 CB GLU A 291 11.161 -6.047 -3.822 1.00 0.26 C ATOM 1300 CG GLU A 291 12.583 -6.529 -4.020 1.00 0.53 C ATOM 1301 CD GLU A 291 13.510 -6.044 -2.928 1.00 1.48 C ATOM 1302 OE1 GLU A 291 13.652 -4.814 -2.764 1.00 2.11 O ATOM 1303 OE2 GLU A 291 14.104 -6.889 -2.228 1.00 2.19 O ATOM 0 H GLU A 291 11.374 -5.006 -5.995 1.00 0.27 H new ATOM 0 HA GLU A 291 10.275 -7.470 -5.211 1.00 0.22 H new ATOM 0 HB2 GLU A 291 11.170 -4.964 -3.699 1.00 0.26 H new ATOM 0 HB3 GLU A 291 10.771 -6.470 -2.896 1.00 0.26 H new ATOM 0 HG2 GLU A 291 12.595 -7.619 -4.046 1.00 0.53 H new ATOM 0 HG3 GLU A 291 12.951 -6.183 -4.986 1.00 0.53 H new ATOM 1310 N LYS A 292 7.935 -7.105 -4.414 1.00 0.18 N ATOM 1311 CA LYS A 292 6.576 -6.914 -3.910 1.00 0.16 C ATOM 1312 C LYS A 292 6.324 -7.756 -2.658 1.00 0.17 C ATOM 1313 O LYS A 292 6.714 -8.921 -2.581 1.00 0.29 O ATOM 1314 CB LYS A 292 5.538 -7.226 -4.987 1.00 0.18 C ATOM 1315 CG LYS A 292 5.723 -8.564 -5.664 1.00 0.23 C ATOM 1316 CD LYS A 292 4.689 -8.760 -6.753 1.00 0.29 C ATOM 1317 CE LYS A 292 5.051 -9.936 -7.645 1.00 0.49 C ATOM 1318 NZ LYS A 292 4.134 -10.071 -8.806 1.00 1.33 N ATOM 0 H LYS A 292 8.164 -8.071 -4.649 1.00 0.18 H new ATOM 0 HA LYS A 292 6.475 -5.864 -3.636 1.00 0.16 H new ATOM 0 HB2 LYS A 292 4.545 -7.194 -4.538 1.00 0.18 H new ATOM 0 HB3 LYS A 292 5.571 -6.442 -5.744 1.00 0.18 H new ATOM 0 HG2 LYS A 292 6.724 -8.626 -6.091 1.00 0.23 H new ATOM 0 HG3 LYS A 292 5.640 -9.364 -4.928 1.00 0.23 H new ATOM 0 HD2 LYS A 292 3.710 -8.928 -6.304 1.00 0.29 H new ATOM 0 HD3 LYS A 292 4.613 -7.854 -7.354 1.00 0.29 H new ATOM 0 HE2 LYS A 292 6.073 -9.814 -8.005 1.00 0.49 H new ATOM 0 HE3 LYS A 292 5.027 -10.854 -7.058 1.00 0.49 H new ATOM 0 HZ1 LYS A 292 4.423 -10.887 -9.383 1.00 1.33 H new ATOM 0 HZ2 LYS A 292 3.162 -10.214 -8.466 1.00 1.33 H new ATOM 0 HZ3 LYS A 292 4.175 -9.207 -9.383 1.00 1.33 H new ATOM 1332 N CYS A 293 5.686 -7.140 -1.672 1.00 0.16 N ATOM 1333 CA CYS A 293 5.351 -7.802 -0.418 1.00 0.18 C ATOM 1334 C CYS A 293 3.868 -7.686 -0.170 1.00 0.15 C ATOM 1335 O CYS A 293 3.301 -6.613 -0.333 1.00 0.14 O ATOM 1336 CB CYS A 293 6.125 -7.190 0.739 1.00 0.28 C ATOM 1337 SG CYS A 293 7.805 -7.808 0.859 1.00 1.55 S ATOM 0 H CYS A 293 5.386 -6.166 -1.719 1.00 0.16 H new ATOM 0 HA CYS A 293 5.626 -8.854 -0.491 1.00 0.18 H new ATOM 0 HB2 CYS A 293 6.149 -6.107 0.621 1.00 0.28 H new ATOM 0 HB3 CYS A 293 5.599 -7.397 1.671 1.00 0.28 H new ATOM 0 HG CYS A 293 7.792 -9.005 1.366 1.00 1.55 H new ATOM 1343 N SER A 294 3.226 -8.815 0.042 1.00 0.17 N ATOM 1344 CA SER A 294 1.780 -8.855 0.037 1.00 0.18 C ATOM 1345 C SER A 294 1.170 -8.406 1.352 1.00 0.17 C ATOM 1346 O SER A 294 1.665 -8.721 2.435 1.00 0.20 O ATOM 1347 CB SER A 294 1.303 -10.261 -0.317 1.00 0.27 C ATOM 1348 OG SER A 294 1.924 -11.227 0.514 1.00 0.61 O ATOM 0 H SER A 294 3.679 -9.712 0.219 1.00 0.17 H new ATOM 0 HA SER A 294 1.442 -8.147 -0.719 1.00 0.18 H new ATOM 0 HB2 SER A 294 0.220 -10.321 -0.206 1.00 0.27 H new ATOM 0 HB3 SER A 294 1.529 -10.474 -1.362 1.00 0.27 H new ATOM 0 HG SER A 294 1.604 -12.121 0.272 1.00 0.61 H new ATOM 1354 N THR A 295 0.049 -7.726 1.236 1.00 0.17 N ATOM 1355 CA THR A 295 -0.726 -7.320 2.380 1.00 0.15 C ATOM 1356 C THR A 295 -2.199 -7.368 1.995 1.00 0.15 C ATOM 1357 O THR A 295 -2.567 -6.957 0.894 1.00 0.15 O ATOM 1358 CB THR A 295 -0.305 -5.910 2.870 1.00 0.18 C ATOM 1359 OG1 THR A 295 -0.083 -5.942 4.282 1.00 0.29 O ATOM 1360 CG2 THR A 295 -1.342 -4.841 2.543 1.00 0.20 C ATOM 0 H THR A 295 -0.348 -7.440 0.341 1.00 0.17 H new ATOM 0 HA THR A 295 -0.547 -7.999 3.213 1.00 0.15 H new ATOM 0 HB THR A 295 0.612 -5.645 2.344 1.00 0.18 H new ATOM 0 HG1 THR A 295 -0.299 -5.067 4.667 1.00 0.29 H new ATOM 0 HG21 THR A 295 -0.996 -3.874 2.909 1.00 0.20 H new ATOM 0 HG22 THR A 295 -1.485 -4.791 1.464 1.00 0.20 H new ATOM 0 HG23 THR A 295 -2.288 -5.093 3.023 1.00 0.20 H new ATOM 1368 N GLU A 296 -2.998 -8.067 2.781 1.00 0.15 N ATOM 1369 CA GLU A 296 -4.383 -8.287 2.410 1.00 0.15 C ATOM 1370 C GLU A 296 -5.201 -7.052 2.732 1.00 0.14 C ATOM 1371 O GLU A 296 -4.920 -6.335 3.691 1.00 0.19 O ATOM 1372 CB GLU A 296 -4.940 -9.522 3.107 1.00 0.18 C ATOM 1373 CG GLU A 296 -4.014 -10.719 3.000 1.00 0.22 C ATOM 1374 CD GLU A 296 -4.643 -12.008 3.485 1.00 0.34 C ATOM 1375 OE1 GLU A 296 -5.147 -12.041 4.625 1.00 0.76 O ATOM 1376 OE2 GLU A 296 -4.607 -13.005 2.732 1.00 0.96 O ATOM 0 H GLU A 296 -2.717 -8.486 3.667 1.00 0.15 H new ATOM 0 HA GLU A 296 -4.440 -8.468 1.337 1.00 0.15 H new ATOM 0 HB2 GLU A 296 -5.113 -9.294 4.159 1.00 0.18 H new ATOM 0 HB3 GLU A 296 -5.907 -9.775 2.672 1.00 0.18 H new ATOM 0 HG2 GLU A 296 -3.708 -10.841 1.961 1.00 0.22 H new ATOM 0 HG3 GLU A 296 -3.111 -10.524 3.578 1.00 0.22 H new ATOM 1383 N LEU A 297 -6.115 -6.733 1.847 1.00 0.15 N ATOM 1384 CA LEU A 297 -6.895 -5.526 1.969 1.00 0.15 C ATOM 1385 C LEU A 297 -8.321 -5.854 2.369 1.00 0.15 C ATOM 1386 O LEU A 297 -9.120 -6.280 1.539 1.00 0.23 O ATOM 1387 CB LEU A 297 -6.871 -4.762 0.644 1.00 0.22 C ATOM 1388 CG LEU A 297 -7.543 -3.398 0.676 1.00 0.21 C ATOM 1389 CD1 LEU A 297 -7.069 -2.621 1.895 1.00 0.26 C ATOM 1390 CD2 LEU A 297 -7.225 -2.633 -0.596 1.00 0.29 C ATOM 0 H LEU A 297 -6.338 -7.299 1.028 1.00 0.15 H new ATOM 0 HA LEU A 297 -6.460 -4.899 2.747 1.00 0.15 H new ATOM 0 HB2 LEU A 297 -5.834 -4.632 0.336 1.00 0.22 H new ATOM 0 HB3 LEU A 297 -7.356 -5.372 -0.118 1.00 0.22 H new ATOM 0 HG LEU A 297 -8.623 -3.530 0.741 1.00 0.21 H new ATOM 0 HD11 LEU A 297 -7.553 -1.644 1.915 1.00 0.26 H new ATOM 0 HD12 LEU A 297 -7.326 -3.171 2.800 1.00 0.26 H new ATOM 0 HD13 LEU A 297 -5.988 -2.490 1.845 1.00 0.26 H new ATOM 0 HD21 LEU A 297 -7.710 -1.657 -0.565 1.00 0.29 H new ATOM 0 HD22 LEU A 297 -6.147 -2.499 -0.680 1.00 0.29 H new ATOM 0 HD23 LEU A 297 -7.590 -3.192 -1.458 1.00 0.29 H new ATOM 1402 N PHE A 298 -8.639 -5.573 3.623 1.00 0.14 N ATOM 1403 CA PHE A 298 -9.980 -5.752 4.155 1.00 0.19 C ATOM 1404 C PHE A 298 -10.593 -4.390 4.423 1.00 0.19 C ATOM 1405 O PHE A 298 -9.872 -3.413 4.588 1.00 0.24 O ATOM 1406 CB PHE A 298 -9.964 -6.583 5.443 1.00 0.26 C ATOM 1407 CG PHE A 298 -9.540 -8.013 5.243 1.00 0.28 C ATOM 1408 CD1 PHE A 298 -8.202 -8.335 5.090 1.00 0.25 C ATOM 1409 CD2 PHE A 298 -10.480 -9.031 5.192 1.00 0.50 C ATOM 1410 CE1 PHE A 298 -7.806 -9.645 4.898 1.00 0.32 C ATOM 1411 CE2 PHE A 298 -10.089 -10.344 5.000 1.00 0.58 C ATOM 1412 CZ PHE A 298 -8.761 -10.658 4.894 1.00 0.45 C ATOM 0 H PHE A 298 -7.970 -5.212 4.304 1.00 0.14 H new ATOM 0 HA PHE A 298 -10.577 -6.292 3.420 1.00 0.19 H new ATOM 0 HB2 PHE A 298 -9.291 -6.112 6.159 1.00 0.26 H new ATOM 0 HB3 PHE A 298 -10.960 -6.569 5.885 1.00 0.26 H new ATOM 0 HD1 PHE A 298 -7.458 -7.552 5.121 1.00 0.25 H new ATOM 0 HD2 PHE A 298 -11.528 -8.796 5.303 1.00 0.50 H new ATOM 0 HE1 PHE A 298 -6.762 -9.881 4.752 1.00 0.32 H new ATOM 0 HE2 PHE A 298 -10.834 -11.123 4.934 1.00 0.58 H new ATOM 0 HZ PHE A 298 -8.454 -11.690 4.807 1.00 0.45 H new ATOM 1422 N VAL A 299 -11.897 -4.278 4.312 1.00 0.28 N ATOM 1423 CA VAL A 299 -12.528 -2.982 4.443 1.00 0.28 C ATOM 1424 C VAL A 299 -13.609 -2.976 5.520 1.00 0.32 C ATOM 1425 O VAL A 299 -14.471 -3.854 5.567 1.00 0.40 O ATOM 1426 CB VAL A 299 -13.118 -2.511 3.102 1.00 0.33 C ATOM 1427 CG1 VAL A 299 -14.037 -3.565 2.517 1.00 0.44 C ATOM 1428 CG2 VAL A 299 -13.844 -1.186 3.274 1.00 0.35 C ATOM 0 H VAL A 299 -12.534 -5.054 4.134 1.00 0.28 H new ATOM 0 HA VAL A 299 -11.747 -2.285 4.748 1.00 0.28 H new ATOM 0 HB VAL A 299 -12.298 -2.359 2.401 1.00 0.33 H new ATOM 0 HG11 VAL A 299 -14.442 -3.209 1.570 1.00 0.44 H new ATOM 0 HG12 VAL A 299 -13.476 -4.484 2.350 1.00 0.44 H new ATOM 0 HG13 VAL A 299 -14.855 -3.760 3.211 1.00 0.44 H new ATOM 0 HG21 VAL A 299 -14.254 -0.869 2.315 1.00 0.35 H new ATOM 0 HG22 VAL A 299 -14.654 -1.306 3.994 1.00 0.35 H new ATOM 0 HG23 VAL A 299 -13.145 -0.432 3.636 1.00 0.35 H new ATOM 1438 N LYS A 300 -13.609 -1.922 6.319 1.00 0.33 N ATOM 1439 CA LYS A 300 -14.645 -1.697 7.301 1.00 0.41 C ATOM 1440 C LYS A 300 -15.640 -0.672 6.775 1.00 0.40 C ATOM 1441 O LYS A 300 -15.245 0.370 6.243 1.00 0.37 O ATOM 1442 CB LYS A 300 -14.031 -1.207 8.612 1.00 0.48 C ATOM 1443 CG LYS A 300 -13.477 -2.324 9.485 1.00 1.17 C ATOM 1444 CD LYS A 300 -14.557 -3.324 9.879 1.00 1.72 C ATOM 1445 CE LYS A 300 -15.648 -2.677 10.718 1.00 2.32 C ATOM 1446 NZ LYS A 300 -16.721 -3.644 11.075 1.00 3.03 N ATOM 0 H LYS A 300 -12.888 -1.200 6.301 1.00 0.33 H new ATOM 0 HA LYS A 300 -15.166 -2.636 7.488 1.00 0.41 H new ATOM 0 HB2 LYS A 300 -13.230 -0.503 8.387 1.00 0.48 H new ATOM 0 HB3 LYS A 300 -14.787 -0.660 9.175 1.00 0.48 H new ATOM 0 HG2 LYS A 300 -12.680 -2.841 8.951 1.00 1.17 H new ATOM 0 HG3 LYS A 300 -13.033 -1.896 10.384 1.00 1.17 H new ATOM 0 HD2 LYS A 300 -14.998 -3.756 8.980 1.00 1.72 H new ATOM 0 HD3 LYS A 300 -14.106 -4.144 10.439 1.00 1.72 H new ATOM 0 HE2 LYS A 300 -15.211 -2.268 11.629 1.00 2.32 H new ATOM 0 HE3 LYS A 300 -16.081 -1.841 10.168 1.00 2.32 H new ATOM 0 HZ1 LYS A 300 -17.445 -3.164 11.647 1.00 3.03 H new ATOM 0 HZ2 LYS A 300 -17.156 -4.016 10.207 1.00 3.03 H new ATOM 0 HZ3 LYS A 300 -16.313 -4.429 11.622 1.00 3.03 H new ATOM 1460 N GLU A 301 -16.922 -0.966 6.932 1.00 0.50 N ATOM 1461 CA GLU A 301 -17.977 -0.049 6.524 1.00 0.57 C ATOM 1462 C GLU A 301 -17.965 1.196 7.416 1.00 0.65 C ATOM 1463 O GLU A 301 -17.417 1.122 8.539 1.00 1.41 O ATOM 1464 CB GLU A 301 -19.346 -0.731 6.627 1.00 0.83 C ATOM 1465 CG GLU A 301 -19.615 -1.751 5.533 1.00 0.66 C ATOM 1466 CD GLU A 301 -20.883 -2.550 5.768 1.00 0.90 C ATOM 1467 OE1 GLU A 301 -21.554 -2.324 6.797 1.00 1.44 O ATOM 1468 OE2 GLU A 301 -21.227 -3.399 4.916 1.00 1.21 O ATOM 1469 OXT GLU A 301 -18.514 2.235 7.003 1.00 1.20 O ATOM 0 H GLU A 301 -17.259 -1.837 7.341 1.00 0.50 H new ATOM 0 HA GLU A 301 -17.798 0.242 5.489 1.00 0.57 H new ATOM 0 HB2 GLU A 301 -19.422 -1.225 7.596 1.00 0.83 H new ATOM 0 HB3 GLU A 301 -20.123 0.032 6.596 1.00 0.83 H new ATOM 0 HG2 GLU A 301 -19.688 -1.237 4.574 1.00 0.66 H new ATOM 0 HG3 GLU A 301 -18.769 -2.434 5.465 1.00 0.66 H new TER 1476 GLU A 301