USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 545 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 310 THR OG1 : rot -59:sc= 0.166 USER MOD Set 1.2: A 311 ASN : amide:sc= -1.47! C(o=-1.3!,f=-5.1!) USER MOD Set 2.1: A 309 HIS : no HE2:sc= -22.1! C(o=-23!,f=-27!) USER MOD Set 2.2: A 312 CYS SG : rot 180:sc= -1.39 USER MOD Set 3.1: A 249 MET CE :methyl -162:sc= -0.623 (180deg=-1.58!) USER MOD Set 3.2: A 251 GLN : amide:sc= -0.0263 K(o=-0.65,f=-1.6) USER MOD Single : A 252 CYS SG : rot 118:sc= -8.07! USER MOD Single : A 254 SER OG : rot 87:sc= -0.302! USER MOD Single : A 260 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 263 THR OG1 : rot 180:sc= 0 USER MOD Single : A 267 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 275 SER OG : rot -178:sc= -2.66! USER MOD Single : A 276 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0212) USER MOD Single : A 278 THR OG1 : rot 37:sc= 0.363 USER MOD Single : A 279 THR OG1 : rot 180:sc= 0.0604 USER MOD Single : A 280 ASN : amide:sc= -0.0892 X(o=-0.089,f=0) USER MOD Single : A 281 ASN : amide:sc= -1.42! C(o=-1.4!,f=-7!) USER MOD Single : A 284 ASN : amide:sc= -0.656 K(o=-0.66,f=-3.8!) USER MOD Single : A 292 LYS NZ :NH3+ -108:sc= -0.534 (180deg=-3.8!) USER MOD Single : A 294 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 ASN : amide:sc=-0.00126 K(o=-0.0013,f=-1.2) USER MOD Single : A 299 SER OG : rot 89:sc= 0.669 USER MOD Single : A 300 THR OG1 : rot 55:sc= -0.17 USER MOD Single : A 302 ASN : amide:sc=-0.000857 X(o=-0.00086,f=0) USER MOD Single : A 305 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 306 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 75 N ARG A 247 -4.695 -15.786 3.681 1.00 0.00 N ATOM 76 CA ARG A 247 -4.398 -15.093 2.431 1.00 0.00 C ATOM 77 C ARG A 247 -4.951 -13.685 2.451 1.00 0.00 C ATOM 78 O ARG A 247 -5.753 -13.330 3.315 1.00 0.00 O ATOM 79 CB ARG A 247 -4.954 -15.880 1.237 1.00 0.00 C ATOM 80 CG ARG A 247 -4.676 -15.244 -0.116 1.00 0.00 C ATOM 81 CD ARG A 247 -5.276 -16.060 -1.252 1.00 0.00 C ATOM 82 NE ARG A 247 -4.271 -16.460 -2.235 1.00 0.00 N ATOM 83 CZ ARG A 247 -3.559 -17.583 -2.158 1.00 0.00 C ATOM 84 NH1 ARG A 247 -3.724 -18.416 -1.138 1.00 0.00 N ATOM 85 NH2 ARG A 247 -2.676 -17.873 -3.104 1.00 0.00 N ATOM 0 HA ARG A 247 -3.315 -15.027 2.325 1.00 0.00 H new ATOM 0 HB2 ARG A 247 -4.528 -16.883 1.248 1.00 0.00 H new ATOM 0 HB3 ARG A 247 -6.032 -15.990 1.359 1.00 0.00 H new ATOM 0 HG2 ARG A 247 -5.087 -14.235 -0.136 1.00 0.00 H new ATOM 0 HG3 ARG A 247 -3.600 -15.153 -0.262 1.00 0.00 H new ATOM 0 HD2 ARG A 247 -5.757 -16.949 -0.844 1.00 0.00 H new ATOM 0 HD3 ARG A 247 -6.053 -15.476 -1.746 1.00 0.00 H new ATOM 0 HE ARG A 247 -4.105 -15.841 -3.029 1.00 0.00 H new ATOM 0 HH11 ARG A 247 -4.400 -18.198 -0.406 1.00 0.00 H new ATOM 0 HH12 ARG A 247 -3.175 -19.274 -1.086 1.00 0.00 H new ATOM 0 HH21 ARG A 247 -2.543 -17.236 -3.890 1.00 0.00 H new ATOM 0 HH22 ARG A 247 -2.130 -18.733 -3.046 1.00 0.00 H new ATOM 99 N TRP A 248 -4.472 -12.869 1.526 1.00 0.00 N ATOM 100 CA TRP A 248 -4.877 -11.481 1.480 1.00 0.00 C ATOM 101 C TRP A 248 -4.933 -10.897 0.081 1.00 0.00 C ATOM 102 O TRP A 248 -4.656 -11.554 -0.921 1.00 0.00 O ATOM 103 CB TRP A 248 -3.881 -10.672 2.285 1.00 0.00 C ATOM 104 CG TRP A 248 -4.126 -10.649 3.747 1.00 0.00 C ATOM 105 CD1 TRP A 248 -3.450 -11.345 4.697 1.00 0.00 C ATOM 106 CD2 TRP A 248 -5.109 -9.875 4.425 1.00 0.00 C ATOM 107 NE1 TRP A 248 -3.919 -11.004 5.947 1.00 0.00 N ATOM 108 CE2 TRP A 248 -4.950 -10.101 5.797 1.00 0.00 C ATOM 109 CE3 TRP A 248 -6.098 -8.999 3.994 1.00 0.00 C ATOM 110 CZ2 TRP A 248 -5.751 -9.466 6.745 1.00 0.00 C ATOM 111 CZ3 TRP A 248 -6.898 -8.382 4.929 1.00 0.00 C ATOM 112 CH2 TRP A 248 -6.716 -8.613 6.292 1.00 0.00 C ATOM 0 H TRP A 248 -3.807 -13.145 0.803 1.00 0.00 H new ATOM 0 HA TRP A 248 -5.889 -11.436 1.883 1.00 0.00 H new ATOM 0 HB2 TRP A 248 -2.883 -11.071 2.106 1.00 0.00 H new ATOM 0 HB3 TRP A 248 -3.886 -9.647 1.915 1.00 0.00 H new ATOM 0 HD1 TRP A 248 -2.663 -12.059 4.502 1.00 0.00 H new ATOM 0 HE1 TRP A 248 -3.563 -11.360 6.834 1.00 0.00 H new ATOM 0 HE3 TRP A 248 -6.237 -8.805 2.941 1.00 0.00 H new ATOM 0 HZ2 TRP A 248 -5.613 -9.643 7.801 1.00 0.00 H new ATOM 0 HZ3 TRP A 248 -7.677 -7.710 4.602 1.00 0.00 H new ATOM 0 HH2 TRP A 248 -7.351 -8.107 7.004 1.00 0.00 H new ATOM 123 N MET A 249 -5.279 -9.622 0.083 1.00 0.00 N ATOM 124 CA MET A 249 -5.387 -8.785 -1.103 1.00 0.00 C ATOM 125 C MET A 249 -5.744 -7.382 -0.637 1.00 0.00 C ATOM 126 O MET A 249 -6.916 -7.021 -0.550 1.00 0.00 O ATOM 127 CB MET A 249 -6.442 -9.293 -2.068 1.00 0.00 C ATOM 128 CG MET A 249 -7.626 -9.971 -1.397 1.00 0.00 C ATOM 129 SD MET A 249 -8.865 -10.535 -2.580 1.00 0.00 S ATOM 130 CE MET A 249 -8.981 -9.108 -3.655 1.00 0.00 C ATOM 0 H MET A 249 -5.501 -9.120 0.943 1.00 0.00 H new ATOM 0 HA MET A 249 -4.439 -8.799 -1.641 1.00 0.00 H new ATOM 0 HB2 MET A 249 -6.807 -8.456 -2.664 1.00 0.00 H new ATOM 0 HB3 MET A 249 -5.978 -9.997 -2.758 1.00 0.00 H new ATOM 0 HG2 MET A 249 -7.271 -10.822 -0.815 1.00 0.00 H new ATOM 0 HG3 MET A 249 -8.088 -9.276 -0.696 1.00 0.00 H new ATOM 0 HE1 MET A 249 -9.906 -9.160 -4.230 1.00 0.00 H new ATOM 0 HE2 MET A 249 -8.977 -8.199 -3.054 1.00 0.00 H new ATOM 0 HE3 MET A 249 -8.131 -9.096 -4.337 1.00 0.00 H new ATOM 140 N VAL A 250 -4.724 -6.622 -0.286 1.00 0.00 N ATOM 141 CA VAL A 250 -4.909 -5.278 0.247 1.00 0.00 C ATOM 142 C VAL A 250 -5.341 -4.277 -0.806 1.00 0.00 C ATOM 143 O VAL A 250 -5.092 -4.453 -1.998 1.00 0.00 O ATOM 144 CB VAL A 250 -3.629 -4.759 0.929 1.00 0.00 C ATOM 145 CG1 VAL A 250 -2.426 -4.949 0.024 1.00 0.00 C ATOM 146 CG2 VAL A 250 -3.788 -3.296 1.316 1.00 0.00 C ATOM 0 H VAL A 250 -3.749 -6.912 -0.360 1.00 0.00 H new ATOM 0 HA VAL A 250 -5.709 -5.368 0.982 1.00 0.00 H new ATOM 0 HB VAL A 250 -3.464 -5.337 1.838 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -1.532 -4.576 0.524 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -2.302 -6.009 -0.199 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -2.579 -4.399 -0.904 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -2.875 -2.945 1.797 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -3.979 -2.702 0.422 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -4.625 -3.191 2.007 1.00 0.00 H new ATOM 156 N GLN A 251 -5.967 -3.202 -0.339 1.00 0.00 N ATOM 157 CA GLN A 251 -6.408 -2.143 -1.218 1.00 0.00 C ATOM 158 C GLN A 251 -6.223 -0.821 -0.515 1.00 0.00 C ATOM 159 O GLN A 251 -7.147 -0.025 -0.347 1.00 0.00 O ATOM 160 CB GLN A 251 -7.858 -2.358 -1.628 1.00 0.00 C ATOM 161 CG GLN A 251 -8.020 -2.858 -3.055 1.00 0.00 C ATOM 162 CD GLN A 251 -8.704 -4.209 -3.128 1.00 0.00 C ATOM 163 OE1 GLN A 251 -9.919 -4.295 -3.305 1.00 0.00 O ATOM 164 NE2 GLN A 251 -7.923 -5.275 -2.991 1.00 0.00 N ATOM 0 H GLN A 251 -6.177 -3.048 0.647 1.00 0.00 H new ATOM 0 HA GLN A 251 -5.813 -2.146 -2.131 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -8.317 -3.074 -0.947 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -8.401 -1.419 -1.517 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -8.598 -2.132 -3.627 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -7.039 -2.926 -3.525 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -6.920 -5.157 -2.846 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -8.326 -6.211 -3.031 1.00 0.00 H new ATOM 173 N CYS A 252 -4.991 -0.624 -0.114 1.00 0.00 N ATOM 174 CA CYS A 252 -4.560 0.567 0.584 1.00 0.00 C ATOM 175 C CYS A 252 -4.322 1.679 -0.423 1.00 0.00 C ATOM 176 O CYS A 252 -4.984 1.736 -1.458 1.00 0.00 O ATOM 177 CB CYS A 252 -3.279 0.245 1.361 1.00 0.00 C ATOM 178 SG CYS A 252 -1.990 -0.527 0.353 1.00 0.00 S ATOM 0 H CYS A 252 -4.243 -1.300 -0.266 1.00 0.00 H new ATOM 0 HA CYS A 252 -5.324 0.899 1.287 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -2.887 1.165 1.794 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -3.525 -0.418 2.190 1.00 0.00 H new ATOM 0 HG CYS A 252 -0.942 0.242 0.324 1.00 0.00 H new ATOM 184 N GLY A 253 -3.372 2.545 -0.136 1.00 0.00 N ATOM 185 CA GLY A 253 -3.064 3.607 -1.056 1.00 0.00 C ATOM 186 C GLY A 253 -4.084 4.718 -1.058 1.00 0.00 C ATOM 187 O GLY A 253 -4.867 4.869 -0.122 1.00 0.00 O ATOM 0 H GLY A 253 -2.810 2.532 0.715 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -2.088 4.022 -0.806 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -2.987 3.194 -2.062 1.00 0.00 H new ATOM 191 N SER A 254 -4.075 5.486 -2.139 1.00 0.00 N ATOM 192 CA SER A 254 -5.002 6.593 -2.319 1.00 0.00 C ATOM 193 C SER A 254 -4.623 7.783 -1.453 1.00 0.00 C ATOM 194 O SER A 254 -5.292 8.084 -0.465 1.00 0.00 O ATOM 195 CB SER A 254 -6.439 6.148 -2.014 1.00 0.00 C ATOM 196 OG SER A 254 -6.559 4.736 -2.051 1.00 0.00 O ATOM 0 H SER A 254 -3.425 5.359 -2.915 1.00 0.00 H new ATOM 0 HA SER A 254 -4.944 6.906 -3.362 1.00 0.00 H new ATOM 0 HB2 SER A 254 -6.735 6.515 -1.031 1.00 0.00 H new ATOM 0 HB3 SER A 254 -7.121 6.592 -2.739 1.00 0.00 H new ATOM 0 HG SER A 254 -6.332 4.365 -1.173 1.00 0.00 H new ATOM 202 N PHE A 255 -3.550 8.468 -1.836 1.00 0.00 N ATOM 203 CA PHE A 255 -3.101 9.638 -1.089 1.00 0.00 C ATOM 204 C PHE A 255 -3.013 10.875 -1.962 1.00 0.00 C ATOM 205 O PHE A 255 -2.372 10.859 -3.015 1.00 0.00 O ATOM 206 CB PHE A 255 -1.728 9.419 -0.426 1.00 0.00 C ATOM 207 CG PHE A 255 -1.181 8.025 -0.533 1.00 0.00 C ATOM 208 CD1 PHE A 255 -1.802 6.987 0.126 1.00 0.00 C ATOM 209 CD2 PHE A 255 -0.034 7.757 -1.274 1.00 0.00 C ATOM 210 CE1 PHE A 255 -1.305 5.708 0.053 1.00 0.00 C ATOM 211 CE2 PHE A 255 0.467 6.470 -1.352 1.00 0.00 C ATOM 212 CZ PHE A 255 -0.171 5.445 -0.688 1.00 0.00 C ATOM 0 H PHE A 255 -2.981 8.237 -2.650 1.00 0.00 H new ATOM 0 HA PHE A 255 -3.855 9.789 -0.317 1.00 0.00 H new ATOM 0 HB2 PHE A 255 -1.012 10.108 -0.874 1.00 0.00 H new ATOM 0 HB3 PHE A 255 -1.806 9.681 0.629 1.00 0.00 H new ATOM 0 HD1 PHE A 255 -2.691 7.181 0.708 1.00 0.00 H new ATOM 0 HD2 PHE A 255 0.469 8.560 -1.792 1.00 0.00 H new ATOM 0 HE1 PHE A 255 -1.803 4.906 0.577 1.00 0.00 H new ATOM 0 HE2 PHE A 255 1.356 6.269 -1.932 1.00 0.00 H new ATOM 0 HZ PHE A 255 0.215 4.438 -0.747 1.00 0.00 H new ATOM 222 N ARG A 256 -3.606 11.973 -1.493 1.00 0.00 N ATOM 223 CA ARG A 256 -3.530 13.234 -2.219 1.00 0.00 C ATOM 224 C ARG A 256 -2.069 13.531 -2.527 1.00 0.00 C ATOM 225 O ARG A 256 -1.742 14.228 -3.488 1.00 0.00 O ATOM 226 CB ARG A 256 -4.138 14.372 -1.396 1.00 0.00 C ATOM 227 CG ARG A 256 -3.773 14.321 0.080 1.00 0.00 C ATOM 228 CD ARG A 256 -3.534 15.711 0.646 1.00 0.00 C ATOM 229 NE ARG A 256 -2.175 15.869 1.159 1.00 0.00 N ATOM 230 CZ ARG A 256 -1.691 15.194 2.200 1.00 0.00 C ATOM 231 NH1 ARG A 256 -2.448 14.305 2.832 1.00 0.00 N ATOM 232 NH2 ARG A 256 -0.447 15.405 2.607 1.00 0.00 N ATOM 0 H ARG A 256 -4.138 12.012 -0.623 1.00 0.00 H new ATOM 0 HA ARG A 256 -4.097 13.153 -3.146 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -3.808 15.325 -1.810 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -5.223 14.340 -1.494 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -4.573 13.834 0.637 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -2.877 13.714 0.213 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -3.717 16.454 -0.130 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -4.248 15.904 1.447 1.00 0.00 H new ATOM 0 HE ARG A 256 -1.561 16.536 0.692 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -3.405 14.137 2.521 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -2.073 13.790 3.629 1.00 0.00 H new ATOM 0 HH21 ARG A 256 0.140 16.085 2.123 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -0.077 14.888 3.404 1.00 0.00 H new ATOM 246 N GLY A 257 -1.198 12.952 -1.702 1.00 0.00 N ATOM 247 CA GLY A 257 0.225 13.098 -1.868 1.00 0.00 C ATOM 248 C GLY A 257 0.728 12.354 -3.092 1.00 0.00 C ATOM 249 O GLY A 257 1.623 11.527 -2.984 1.00 0.00 O ATOM 0 H GLY A 257 -1.469 12.374 -0.907 1.00 0.00 H new ATOM 0 HA2 GLY A 257 0.474 14.155 -1.957 1.00 0.00 H new ATOM 0 HA3 GLY A 257 0.735 12.724 -0.980 1.00 0.00 H new ATOM 253 N ALA A 258 0.139 12.641 -4.257 1.00 0.00 N ATOM 254 CA ALA A 258 0.515 11.989 -5.511 1.00 0.00 C ATOM 255 C ALA A 258 2.022 11.829 -5.623 1.00 0.00 C ATOM 256 O ALA A 258 2.523 10.750 -5.942 1.00 0.00 O ATOM 257 CB ALA A 258 -0.022 12.780 -6.694 1.00 0.00 C ATOM 0 H ALA A 258 -0.608 13.329 -4.355 1.00 0.00 H new ATOM 0 HA ALA A 258 0.073 10.993 -5.518 1.00 0.00 H new ATOM 0 HB1 ALA A 258 0.264 12.285 -7.622 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -1.109 12.835 -6.632 1.00 0.00 H new ATOM 0 HB3 ALA A 258 0.394 13.788 -6.677 1.00 0.00 H new ATOM 263 N GLU A 259 2.742 12.904 -5.338 1.00 0.00 N ATOM 264 CA GLU A 259 4.199 12.869 -5.388 1.00 0.00 C ATOM 265 C GLU A 259 4.711 11.901 -4.335 1.00 0.00 C ATOM 266 O GLU A 259 5.617 11.108 -4.588 1.00 0.00 O ATOM 267 CB GLU A 259 4.783 14.266 -5.163 1.00 0.00 C ATOM 268 CG GLU A 259 5.784 14.684 -6.229 1.00 0.00 C ATOM 269 CD GLU A 259 6.713 15.785 -5.757 1.00 0.00 C ATOM 270 OE1 GLU A 259 6.356 16.490 -4.789 1.00 0.00 O ATOM 271 OE2 GLU A 259 7.799 15.943 -6.355 1.00 0.00 O ATOM 0 H GLU A 259 2.346 13.806 -5.071 1.00 0.00 H new ATOM 0 HA GLU A 259 4.516 12.531 -6.375 1.00 0.00 H new ATOM 0 HB2 GLU A 259 3.970 14.991 -5.135 1.00 0.00 H new ATOM 0 HB3 GLU A 259 5.269 14.295 -4.188 1.00 0.00 H new ATOM 0 HG2 GLU A 259 6.375 13.818 -6.527 1.00 0.00 H new ATOM 0 HG3 GLU A 259 5.246 15.022 -7.115 1.00 0.00 H new ATOM 278 N GLN A 260 4.093 11.951 -3.162 1.00 0.00 N ATOM 279 CA GLN A 260 4.450 11.058 -2.074 1.00 0.00 C ATOM 280 C GLN A 260 4.008 9.642 -2.420 1.00 0.00 C ATOM 281 O GLN A 260 4.656 8.672 -2.050 1.00 0.00 O ATOM 282 CB GLN A 260 3.793 11.512 -0.768 1.00 0.00 C ATOM 283 CG GLN A 260 4.754 11.572 0.409 1.00 0.00 C ATOM 284 CD GLN A 260 4.928 12.979 0.949 1.00 0.00 C ATOM 285 OE1 GLN A 260 5.329 13.889 0.224 1.00 0.00 O ATOM 286 NE2 GLN A 260 4.625 13.164 2.229 1.00 0.00 N ATOM 0 H GLN A 260 3.340 12.603 -2.942 1.00 0.00 H new ATOM 0 HA GLN A 260 5.531 11.078 -1.936 1.00 0.00 H new ATOM 0 HB2 GLN A 260 3.352 12.498 -0.917 1.00 0.00 H new ATOM 0 HB3 GLN A 260 2.977 10.831 -0.526 1.00 0.00 H new ATOM 0 HG2 GLN A 260 4.388 10.924 1.205 1.00 0.00 H new ATOM 0 HG3 GLN A 260 5.724 11.182 0.101 1.00 0.00 H new ATOM 0 HE21 GLN A 260 4.296 12.381 2.794 1.00 0.00 H new ATOM 0 HE22 GLN A 260 4.721 14.089 2.647 1.00 0.00 H new ATOM 295 N ALA A 261 2.900 9.546 -3.151 1.00 0.00 N ATOM 296 CA ALA A 261 2.358 8.267 -3.576 1.00 0.00 C ATOM 297 C ALA A 261 3.376 7.509 -4.414 1.00 0.00 C ATOM 298 O ALA A 261 3.550 6.300 -4.257 1.00 0.00 O ATOM 299 CB ALA A 261 1.077 8.482 -4.351 1.00 0.00 C ATOM 0 H ALA A 261 2.358 10.352 -3.462 1.00 0.00 H new ATOM 0 HA ALA A 261 2.134 7.667 -2.694 1.00 0.00 H new ATOM 0 HB1 ALA A 261 0.676 7.519 -4.666 1.00 0.00 H new ATOM 0 HB2 ALA A 261 0.349 8.988 -3.717 1.00 0.00 H new ATOM 0 HB3 ALA A 261 1.281 9.095 -5.229 1.00 0.00 H new ATOM 305 N GLU A 262 4.061 8.234 -5.292 1.00 0.00 N ATOM 306 CA GLU A 262 5.080 7.636 -6.142 1.00 0.00 C ATOM 307 C GLU A 262 6.224 7.114 -5.285 1.00 0.00 C ATOM 308 O GLU A 262 6.584 5.939 -5.360 1.00 0.00 O ATOM 309 CB GLU A 262 5.594 8.664 -7.156 1.00 0.00 C ATOM 310 CG GLU A 262 5.131 8.397 -8.579 1.00 0.00 C ATOM 311 CD GLU A 262 4.253 9.507 -9.125 1.00 0.00 C ATOM 312 OE1 GLU A 262 4.806 10.516 -9.611 1.00 0.00 O ATOM 313 OE2 GLU A 262 3.014 9.367 -9.067 1.00 0.00 O ATOM 0 H GLU A 262 3.928 9.236 -5.432 1.00 0.00 H new ATOM 0 HA GLU A 262 4.643 6.802 -6.691 1.00 0.00 H new ATOM 0 HB2 GLU A 262 5.261 9.657 -6.855 1.00 0.00 H new ATOM 0 HB3 GLU A 262 6.684 8.672 -7.133 1.00 0.00 H new ATOM 0 HG2 GLU A 262 6.002 8.277 -9.224 1.00 0.00 H new ATOM 0 HG3 GLU A 262 4.581 7.456 -8.608 1.00 0.00 H new ATOM 320 N THR A 263 6.774 7.988 -4.450 1.00 0.00 N ATOM 321 CA THR A 263 7.855 7.604 -3.557 1.00 0.00 C ATOM 322 C THR A 263 7.337 6.610 -2.522 1.00 0.00 C ATOM 323 O THR A 263 8.080 5.763 -2.026 1.00 0.00 O ATOM 324 CB THR A 263 8.439 8.835 -2.861 1.00 0.00 C ATOM 325 OG1 THR A 263 8.688 9.868 -3.796 1.00 0.00 O ATOM 326 CG2 THR A 263 9.736 8.551 -2.134 1.00 0.00 C ATOM 0 H THR A 263 6.488 8.964 -4.374 1.00 0.00 H new ATOM 0 HA THR A 263 8.645 7.134 -4.142 1.00 0.00 H new ATOM 0 HB THR A 263 7.689 9.137 -2.130 1.00 0.00 H new ATOM 0 HG1 THR A 263 9.059 10.647 -3.332 1.00 0.00 H new ATOM 0 HG21 THR A 263 10.097 9.465 -1.663 1.00 0.00 H new ATOM 0 HG22 THR A 263 9.567 7.792 -1.371 1.00 0.00 H new ATOM 0 HG23 THR A 263 10.480 8.191 -2.845 1.00 0.00 H new ATOM 334 N VAL A 264 6.045 6.717 -2.215 1.00 0.00 N ATOM 335 CA VAL A 264 5.404 5.830 -1.257 1.00 0.00 C ATOM 336 C VAL A 264 5.421 4.400 -1.783 1.00 0.00 C ATOM 337 O VAL A 264 5.632 3.452 -1.031 1.00 0.00 O ATOM 338 CB VAL A 264 3.941 6.270 -0.961 1.00 0.00 C ATOM 339 CG1 VAL A 264 3.066 5.082 -0.579 1.00 0.00 C ATOM 340 CG2 VAL A 264 3.917 7.318 0.143 1.00 0.00 C ATOM 0 H VAL A 264 5.422 7.415 -2.621 1.00 0.00 H new ATOM 0 HA VAL A 264 5.964 5.883 -0.323 1.00 0.00 H new ATOM 0 HB VAL A 264 3.534 6.704 -1.874 1.00 0.00 H new ATOM 0 HG11 VAL A 264 2.051 5.427 -0.379 1.00 0.00 H new ATOM 0 HG12 VAL A 264 3.050 4.363 -1.398 1.00 0.00 H new ATOM 0 HG13 VAL A 264 3.470 4.605 0.314 1.00 0.00 H new ATOM 0 HG21 VAL A 264 2.887 7.616 0.339 1.00 0.00 H new ATOM 0 HG22 VAL A 264 4.353 6.900 1.051 1.00 0.00 H new ATOM 0 HG23 VAL A 264 4.494 8.189 -0.169 1.00 0.00 H new ATOM 350 N ARG A 265 5.203 4.260 -3.086 1.00 0.00 N ATOM 351 CA ARG A 265 5.198 2.951 -3.723 1.00 0.00 C ATOM 352 C ARG A 265 6.542 2.261 -3.546 1.00 0.00 C ATOM 353 O ARG A 265 6.618 1.141 -3.040 1.00 0.00 O ATOM 354 CB ARG A 265 4.878 3.089 -5.214 1.00 0.00 C ATOM 355 CG ARG A 265 3.895 2.052 -5.729 1.00 0.00 C ATOM 356 CD ARG A 265 4.599 0.918 -6.456 1.00 0.00 C ATOM 357 NE ARG A 265 4.853 1.242 -7.859 1.00 0.00 N ATOM 358 CZ ARG A 265 5.093 0.331 -8.801 1.00 0.00 C ATOM 359 NH1 ARG A 265 5.123 -0.960 -8.495 1.00 0.00 N ATOM 360 NH2 ARG A 265 5.306 0.714 -10.053 1.00 0.00 N ATOM 0 H ARG A 265 5.027 5.039 -3.721 1.00 0.00 H new ATOM 0 HA ARG A 265 4.429 2.343 -3.247 1.00 0.00 H new ATOM 0 HB2 ARG A 265 4.472 4.084 -5.398 1.00 0.00 H new ATOM 0 HB3 ARG A 265 5.804 3.012 -5.783 1.00 0.00 H new ATOM 0 HG2 ARG A 265 3.322 1.648 -4.894 1.00 0.00 H new ATOM 0 HG3 ARG A 265 3.183 2.529 -6.403 1.00 0.00 H new ATOM 0 HD2 ARG A 265 5.543 0.699 -5.958 1.00 0.00 H new ATOM 0 HD3 ARG A 265 3.990 0.016 -6.397 1.00 0.00 H new ATOM 0 HE ARG A 265 4.846 2.224 -8.133 1.00 0.00 H new ATOM 0 HH11 ARG A 265 4.962 -1.260 -7.534 1.00 0.00 H new ATOM 0 HH12 ARG A 265 5.307 -1.652 -9.221 1.00 0.00 H new ATOM 0 HH21 ARG A 265 5.286 1.705 -10.294 1.00 0.00 H new ATOM 0 HH22 ARG A 265 5.490 0.017 -10.775 1.00 0.00 H new ATOM 374 N ALA A 266 7.600 2.938 -3.969 1.00 0.00 N ATOM 375 CA ALA A 266 8.944 2.393 -3.862 1.00 0.00 C ATOM 376 C ALA A 266 9.313 2.116 -2.410 1.00 0.00 C ATOM 377 O ALA A 266 9.958 1.117 -2.111 1.00 0.00 O ATOM 378 CB ALA A 266 9.949 3.343 -4.495 1.00 0.00 C ATOM 0 H ALA A 266 7.553 3.866 -4.390 1.00 0.00 H new ATOM 0 HA ALA A 266 8.969 1.445 -4.399 1.00 0.00 H new ATOM 0 HB1 ALA A 266 10.951 2.923 -4.408 1.00 0.00 H new ATOM 0 HB2 ALA A 266 9.704 3.483 -5.548 1.00 0.00 H new ATOM 0 HB3 ALA A 266 9.913 4.305 -3.983 1.00 0.00 H new ATOM 384 N GLN A 267 8.904 3.004 -1.508 1.00 0.00 N ATOM 385 CA GLN A 267 9.211 2.838 -0.090 1.00 0.00 C ATOM 386 C GLN A 267 8.348 1.753 0.559 1.00 0.00 C ATOM 387 O GLN A 267 8.524 1.437 1.734 1.00 0.00 O ATOM 388 CB GLN A 267 9.036 4.164 0.653 1.00 0.00 C ATOM 389 CG GLN A 267 10.281 4.604 1.406 1.00 0.00 C ATOM 390 CD GLN A 267 11.112 5.606 0.628 1.00 0.00 C ATOM 391 OE1 GLN A 267 11.689 5.279 -0.408 1.00 0.00 O ATOM 392 NE2 GLN A 267 11.177 6.835 1.127 1.00 0.00 N ATOM 0 H GLN A 267 8.363 3.840 -1.731 1.00 0.00 H new ATOM 0 HA GLN A 267 10.251 2.520 -0.018 1.00 0.00 H new ATOM 0 HB2 GLN A 267 8.760 4.939 -0.062 1.00 0.00 H new ATOM 0 HB3 GLN A 267 8.209 4.071 1.357 1.00 0.00 H new ATOM 0 HG2 GLN A 267 9.988 5.044 2.359 1.00 0.00 H new ATOM 0 HG3 GLN A 267 10.891 3.730 1.633 1.00 0.00 H new ATOM 0 HE21 GLN A 267 10.682 7.062 1.990 1.00 0.00 H new ATOM 0 HE22 GLN A 267 11.722 7.552 0.648 1.00 0.00 H new ATOM 401 N LEU A 268 7.429 1.176 -0.207 1.00 0.00 N ATOM 402 CA LEU A 268 6.566 0.122 0.298 1.00 0.00 C ATOM 403 C LEU A 268 6.992 -1.202 -0.313 1.00 0.00 C ATOM 404 O LEU A 268 6.924 -2.241 0.337 1.00 0.00 O ATOM 405 CB LEU A 268 5.081 0.498 0.030 1.00 0.00 C ATOM 406 CG LEU A 268 4.253 -0.423 -0.882 1.00 0.00 C ATOM 407 CD1 LEU A 268 3.172 -1.178 -0.105 1.00 0.00 C ATOM 408 CD2 LEU A 268 3.618 0.392 -2.002 1.00 0.00 C ATOM 0 H LEU A 268 7.264 1.423 -1.183 1.00 0.00 H new ATOM 0 HA LEU A 268 6.660 0.010 1.378 1.00 0.00 H new ATOM 0 HB2 LEU A 268 4.573 0.558 0.993 1.00 0.00 H new ATOM 0 HB3 LEU A 268 5.063 1.498 -0.402 1.00 0.00 H new ATOM 0 HG LEU A 268 4.930 -1.165 -1.305 1.00 0.00 H new ATOM 0 HD11 LEU A 268 2.612 -1.816 -0.788 1.00 0.00 H new ATOM 0 HD12 LEU A 268 3.639 -1.792 0.665 1.00 0.00 H new ATOM 0 HD13 LEU A 268 2.494 -0.464 0.363 1.00 0.00 H new ATOM 0 HD21 LEU A 268 3.033 -0.266 -2.644 1.00 0.00 H new ATOM 0 HD22 LEU A 268 2.967 1.154 -1.573 1.00 0.00 H new ATOM 0 HD23 LEU A 268 4.400 0.872 -2.591 1.00 0.00 H new ATOM 420 N ALA A 269 7.494 -1.149 -1.540 1.00 0.00 N ATOM 421 CA ALA A 269 7.988 -2.342 -2.205 1.00 0.00 C ATOM 422 C ALA A 269 9.485 -2.504 -1.966 1.00 0.00 C ATOM 423 O ALA A 269 10.005 -3.620 -1.977 1.00 0.00 O ATOM 424 CB ALA A 269 7.678 -2.293 -3.692 1.00 0.00 C ATOM 0 H ALA A 269 7.569 -0.294 -2.091 1.00 0.00 H new ATOM 0 HA ALA A 269 7.480 -3.209 -1.783 1.00 0.00 H new ATOM 0 HB1 ALA A 269 8.056 -3.195 -4.172 1.00 0.00 H new ATOM 0 HB2 ALA A 269 6.600 -2.229 -3.837 1.00 0.00 H new ATOM 0 HB3 ALA A 269 8.156 -1.419 -4.135 1.00 0.00 H new ATOM 430 N PHE A 270 10.173 -1.388 -1.730 1.00 0.00 N ATOM 431 CA PHE A 270 11.603 -1.428 -1.465 1.00 0.00 C ATOM 432 C PHE A 270 11.848 -1.638 0.022 1.00 0.00 C ATOM 433 O PHE A 270 12.849 -2.233 0.416 1.00 0.00 O ATOM 434 CB PHE A 270 12.291 -0.142 -1.931 1.00 0.00 C ATOM 435 CG PHE A 270 13.788 -0.152 -1.756 1.00 0.00 C ATOM 436 CD1 PHE A 270 14.486 -1.345 -1.638 1.00 0.00 C ATOM 437 CD2 PHE A 270 14.494 1.039 -1.707 1.00 0.00 C ATOM 438 CE1 PHE A 270 15.858 -1.349 -1.476 1.00 0.00 C ATOM 439 CE2 PHE A 270 15.867 1.041 -1.545 1.00 0.00 C ATOM 440 CZ PHE A 270 16.550 -0.154 -1.429 1.00 0.00 C ATOM 0 H PHE A 270 9.764 -0.454 -1.718 1.00 0.00 H new ATOM 0 HA PHE A 270 12.028 -2.261 -2.025 1.00 0.00 H new ATOM 0 HB2 PHE A 270 12.059 0.021 -2.983 1.00 0.00 H new ATOM 0 HB3 PHE A 270 11.876 0.701 -1.379 1.00 0.00 H new ATOM 0 HD1 PHE A 270 13.950 -2.282 -1.673 1.00 0.00 H new ATOM 0 HD2 PHE A 270 13.966 1.977 -1.796 1.00 0.00 H new ATOM 0 HE1 PHE A 270 16.389 -2.285 -1.386 1.00 0.00 H new ATOM 0 HE2 PHE A 270 16.405 1.977 -1.509 1.00 0.00 H new ATOM 0 HZ PHE A 270 17.622 -0.154 -1.302 1.00 0.00 H new ATOM 450 N GLU A 271 10.917 -1.158 0.847 1.00 0.00 N ATOM 451 CA GLU A 271 11.041 -1.318 2.286 1.00 0.00 C ATOM 452 C GLU A 271 10.850 -2.780 2.661 1.00 0.00 C ATOM 453 O GLU A 271 11.386 -3.248 3.666 1.00 0.00 O ATOM 454 CB GLU A 271 10.021 -0.443 3.017 1.00 0.00 C ATOM 455 CG GLU A 271 10.053 -0.595 4.530 1.00 0.00 C ATOM 456 CD GLU A 271 10.974 0.408 5.197 1.00 0.00 C ATOM 457 OE1 GLU A 271 10.558 1.573 5.367 1.00 0.00 O ATOM 458 OE2 GLU A 271 12.111 0.030 5.546 1.00 0.00 O ATOM 0 H GLU A 271 10.080 -0.661 0.543 1.00 0.00 H new ATOM 0 HA GLU A 271 12.039 -1.001 2.588 1.00 0.00 H new ATOM 0 HB2 GLU A 271 10.203 0.601 2.762 1.00 0.00 H new ATOM 0 HB3 GLU A 271 9.022 -0.689 2.658 1.00 0.00 H new ATOM 0 HG2 GLU A 271 9.044 -0.475 4.925 1.00 0.00 H new ATOM 0 HG3 GLU A 271 10.377 -1.605 4.783 1.00 0.00 H new ATOM 465 N GLY A 272 10.095 -3.508 1.837 1.00 0.00 N ATOM 466 CA GLY A 272 9.875 -4.914 2.105 1.00 0.00 C ATOM 467 C GLY A 272 8.427 -5.343 1.971 1.00 0.00 C ATOM 468 O GLY A 272 8.078 -6.453 2.374 1.00 0.00 O ATOM 0 H GLY A 272 9.638 -3.150 0.998 1.00 0.00 H new ATOM 0 HA2 GLY A 272 10.484 -5.504 1.420 1.00 0.00 H new ATOM 0 HA3 GLY A 272 10.219 -5.140 3.114 1.00 0.00 H new ATOM 472 N PHE A 273 7.572 -4.489 1.404 1.00 0.00 N ATOM 473 CA PHE A 273 6.172 -4.860 1.243 1.00 0.00 C ATOM 474 C PHE A 273 5.628 -4.532 -0.143 1.00 0.00 C ATOM 475 O PHE A 273 5.265 -3.394 -0.435 1.00 0.00 O ATOM 476 CB PHE A 273 5.287 -4.246 2.334 1.00 0.00 C ATOM 477 CG PHE A 273 5.395 -2.754 2.571 1.00 0.00 C ATOM 478 CD1 PHE A 273 6.565 -2.158 3.043 1.00 0.00 C ATOM 479 CD2 PHE A 273 4.275 -1.959 2.419 1.00 0.00 C ATOM 480 CE1 PHE A 273 6.599 -0.809 3.357 1.00 0.00 C ATOM 481 CE2 PHE A 273 4.321 -0.613 2.714 1.00 0.00 C ATOM 482 CZ PHE A 273 5.475 -0.044 3.191 1.00 0.00 C ATOM 0 H PHE A 273 7.818 -3.561 1.058 1.00 0.00 H new ATOM 0 HA PHE A 273 6.139 -5.944 1.351 1.00 0.00 H new ATOM 0 HB2 PHE A 273 4.249 -4.473 2.091 1.00 0.00 H new ATOM 0 HB3 PHE A 273 5.512 -4.752 3.273 1.00 0.00 H new ATOM 0 HD1 PHE A 273 7.456 -2.756 3.165 1.00 0.00 H new ATOM 0 HD2 PHE A 273 3.353 -2.397 2.065 1.00 0.00 H new ATOM 0 HE1 PHE A 273 7.508 -0.362 3.731 1.00 0.00 H new ATOM 0 HE2 PHE A 273 3.442 -0.002 2.569 1.00 0.00 H new ATOM 0 HZ PHE A 273 5.497 1.008 3.436 1.00 0.00 H new ATOM 492 N ASP A 274 5.559 -5.561 -0.986 1.00 0.00 N ATOM 493 CA ASP A 274 5.048 -5.425 -2.347 1.00 0.00 C ATOM 494 C ASP A 274 3.794 -4.565 -2.385 1.00 0.00 C ATOM 495 O ASP A 274 3.204 -4.253 -1.353 1.00 0.00 O ATOM 496 CB ASP A 274 4.750 -6.804 -2.936 1.00 0.00 C ATOM 497 CG ASP A 274 5.968 -7.429 -3.587 1.00 0.00 C ATOM 498 OD1 ASP A 274 6.504 -6.828 -4.542 1.00 0.00 O ATOM 499 OD2 ASP A 274 6.386 -8.518 -3.142 1.00 0.00 O ATOM 0 H ASP A 274 5.854 -6.507 -0.746 1.00 0.00 H new ATOM 0 HA ASP A 274 5.815 -4.933 -2.945 1.00 0.00 H new ATOM 0 HB2 ASP A 274 4.385 -7.462 -2.147 1.00 0.00 H new ATOM 0 HB3 ASP A 274 3.952 -6.717 -3.673 1.00 0.00 H new ATOM 504 N SER A 275 3.409 -4.182 -3.592 1.00 0.00 N ATOM 505 CA SER A 275 2.233 -3.344 -3.810 1.00 0.00 C ATOM 506 C SER A 275 2.124 -2.962 -5.283 1.00 0.00 C ATOM 507 O SER A 275 3.038 -3.203 -6.072 1.00 0.00 O ATOM 508 CB SER A 275 2.326 -2.067 -2.983 1.00 0.00 C ATOM 509 OG SER A 275 1.059 -1.711 -2.455 1.00 0.00 O ATOM 0 H SER A 275 3.899 -4.441 -4.448 1.00 0.00 H new ATOM 0 HA SER A 275 1.354 -3.913 -3.507 1.00 0.00 H new ATOM 0 HB2 SER A 275 3.037 -2.208 -2.169 1.00 0.00 H new ATOM 0 HB3 SER A 275 2.707 -1.255 -3.602 1.00 0.00 H new ATOM 0 HG SER A 275 1.137 -0.873 -1.953 1.00 0.00 H new ATOM 515 N LYS A 276 1.015 -2.339 -5.629 1.00 0.00 N ATOM 516 CA LYS A 276 0.772 -1.877 -7.000 1.00 0.00 C ATOM 517 C LYS A 276 -0.162 -0.666 -6.989 1.00 0.00 C ATOM 518 O LYS A 276 -1.339 -0.786 -6.649 1.00 0.00 O ATOM 519 CB LYS A 276 0.185 -2.996 -7.876 1.00 0.00 C ATOM 520 CG LYS A 276 -0.457 -4.137 -7.099 1.00 0.00 C ATOM 521 CD LYS A 276 -0.570 -5.393 -7.949 1.00 0.00 C ATOM 522 CE LYS A 276 0.563 -6.364 -7.662 1.00 0.00 C ATOM 523 NZ LYS A 276 1.699 -6.186 -8.607 1.00 0.00 N ATOM 0 H LYS A 276 0.255 -2.135 -4.980 1.00 0.00 H new ATOM 0 HA LYS A 276 1.730 -1.586 -7.431 1.00 0.00 H new ATOM 0 HB2 LYS A 276 -0.560 -2.564 -8.544 1.00 0.00 H new ATOM 0 HB3 LYS A 276 0.978 -3.402 -8.504 1.00 0.00 H new ATOM 0 HG2 LYS A 276 0.134 -4.351 -6.208 1.00 0.00 H new ATOM 0 HG3 LYS A 276 -1.448 -3.836 -6.759 1.00 0.00 H new ATOM 0 HD2 LYS A 276 -1.526 -5.880 -7.755 1.00 0.00 H new ATOM 0 HD3 LYS A 276 -0.559 -5.121 -9.005 1.00 0.00 H new ATOM 0 HE2 LYS A 276 0.915 -6.220 -6.640 1.00 0.00 H new ATOM 0 HE3 LYS A 276 0.191 -7.386 -7.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 2.422 -6.911 -8.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 1.356 -6.281 -9.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 2.114 -5.241 -8.477 1.00 0.00 H new ATOM 537 N ILE A 277 0.374 0.506 -7.332 1.00 0.00 N ATOM 538 CA ILE A 277 -0.408 1.735 -7.327 1.00 0.00 C ATOM 539 C ILE A 277 -1.262 1.903 -8.575 1.00 0.00 C ATOM 540 O ILE A 277 -1.035 1.266 -9.603 1.00 0.00 O ATOM 541 CB ILE A 277 0.485 2.978 -7.182 1.00 0.00 C ATOM 542 CG1 ILE A 277 1.622 2.960 -8.204 1.00 0.00 C ATOM 543 CG2 ILE A 277 1.031 3.084 -5.767 1.00 0.00 C ATOM 544 CD1 ILE A 277 2.500 4.190 -8.138 1.00 0.00 C ATOM 0 H ILE A 277 1.346 0.626 -7.616 1.00 0.00 H new ATOM 0 HA ILE A 277 -1.067 1.646 -6.463 1.00 0.00 H new ATOM 0 HB ILE A 277 -0.127 3.858 -7.379 1.00 0.00 H new ATOM 0 HG12 ILE A 277 2.235 2.074 -8.040 1.00 0.00 H new ATOM 0 HG13 ILE A 277 1.201 2.875 -9.206 1.00 0.00 H new ATOM 0 HG21 ILE A 277 1.660 3.970 -5.685 1.00 0.00 H new ATOM 0 HG22 ILE A 277 0.203 3.161 -5.062 1.00 0.00 H new ATOM 0 HG23 ILE A 277 1.622 2.197 -5.538 1.00 0.00 H new ATOM 0 HD11 ILE A 277 3.287 4.116 -8.888 1.00 0.00 H new ATOM 0 HD12 ILE A 277 1.898 5.078 -8.331 1.00 0.00 H new ATOM 0 HD13 ILE A 277 2.949 4.264 -7.147 1.00 0.00 H new ATOM 556 N THR A 278 -2.244 2.793 -8.455 1.00 0.00 N ATOM 557 CA THR A 278 -3.163 3.110 -9.541 1.00 0.00 C ATOM 558 C THR A 278 -4.113 4.220 -9.105 1.00 0.00 C ATOM 559 O THR A 278 -4.870 4.059 -8.150 1.00 0.00 O ATOM 560 CB THR A 278 -3.968 1.878 -9.957 1.00 0.00 C ATOM 561 OG1 THR A 278 -4.191 1.022 -8.850 1.00 0.00 O ATOM 562 CG2 THR A 278 -3.303 1.063 -11.047 1.00 0.00 C ATOM 0 H THR A 278 -2.424 3.316 -7.598 1.00 0.00 H new ATOM 0 HA THR A 278 -2.577 3.443 -10.398 1.00 0.00 H new ATOM 0 HB THR A 278 -4.908 2.270 -10.345 1.00 0.00 H new ATOM 0 HG1 THR A 278 -4.346 1.561 -8.046 1.00 0.00 H new ATOM 0 HG21 THR A 278 -3.929 0.205 -11.293 1.00 0.00 H new ATOM 0 HG22 THR A 278 -3.171 1.682 -11.935 1.00 0.00 H new ATOM 0 HG23 THR A 278 -2.330 0.715 -10.699 1.00 0.00 H new ATOM 570 N THR A 279 -4.066 5.347 -9.802 1.00 0.00 N ATOM 571 CA THR A 279 -4.922 6.482 -9.473 1.00 0.00 C ATOM 572 C THR A 279 -6.380 6.175 -9.806 1.00 0.00 C ATOM 573 O THR A 279 -6.664 5.403 -10.721 1.00 0.00 O ATOM 574 CB THR A 279 -4.464 7.729 -10.231 1.00 0.00 C ATOM 575 OG1 THR A 279 -3.933 7.382 -11.497 1.00 0.00 O ATOM 576 CG2 THR A 279 -3.408 8.523 -9.493 1.00 0.00 C ATOM 0 H THR A 279 -3.446 5.501 -10.597 1.00 0.00 H new ATOM 0 HA THR A 279 -4.843 6.669 -8.402 1.00 0.00 H new ATOM 0 HB THR A 279 -5.356 8.347 -10.334 1.00 0.00 H new ATOM 0 HG1 THR A 279 -3.648 8.194 -11.966 1.00 0.00 H new ATOM 0 HG21 THR A 279 -3.127 9.394 -10.085 1.00 0.00 H new ATOM 0 HG22 THR A 279 -3.804 8.850 -8.532 1.00 0.00 H new ATOM 0 HG23 THR A 279 -2.530 7.897 -9.330 1.00 0.00 H new ATOM 584 N ASN A 280 -7.305 6.782 -9.063 1.00 0.00 N ATOM 585 CA ASN A 280 -8.731 6.560 -9.298 1.00 0.00 C ATOM 586 C ASN A 280 -9.579 7.625 -8.620 1.00 0.00 C ATOM 587 O ASN A 280 -10.254 8.411 -9.285 1.00 0.00 O ATOM 588 CB ASN A 280 -9.142 5.170 -8.809 1.00 0.00 C ATOM 589 CG ASN A 280 -10.163 4.514 -9.718 1.00 0.00 C ATOM 590 OD1 ASN A 280 -11.281 4.214 -9.300 1.00 0.00 O ATOM 591 ND2 ASN A 280 -9.781 4.286 -10.969 1.00 0.00 N ATOM 0 H ASN A 280 -7.095 7.426 -8.300 1.00 0.00 H new ATOM 0 HA ASN A 280 -8.904 6.626 -10.372 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -8.258 4.535 -8.743 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -9.554 5.249 -7.803 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -10.424 3.846 -11.626 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -8.844 4.551 -11.273 1.00 0.00 H new ATOM 598 N ASN A 281 -9.532 7.659 -7.296 1.00 0.00 N ATOM 599 CA ASN A 281 -10.288 8.644 -6.532 1.00 0.00 C ATOM 600 C ASN A 281 -9.619 10.012 -6.608 1.00 0.00 C ATOM 601 O ASN A 281 -9.945 10.918 -5.839 1.00 0.00 O ATOM 602 CB ASN A 281 -10.391 8.207 -5.074 1.00 0.00 C ATOM 603 CG ASN A 281 -11.343 7.042 -4.885 1.00 0.00 C ATOM 604 OD1 ASN A 281 -11.601 6.280 -5.816 1.00 0.00 O ATOM 605 ND2 ASN A 281 -11.867 6.895 -3.674 1.00 0.00 N ATOM 0 H ASN A 281 -8.979 7.017 -6.728 1.00 0.00 H new ATOM 0 HA ASN A 281 -11.287 8.717 -6.961 1.00 0.00 H new ATOM 0 HB2 ASN A 281 -9.402 7.927 -4.711 1.00 0.00 H new ATOM 0 HB3 ASN A 281 -10.727 9.049 -4.468 1.00 0.00 H new ATOM 0 HD21 ASN A 281 -12.511 6.127 -3.487 1.00 0.00 H new ATOM 0 HD22 ASN A 281 -11.625 7.550 -2.931 1.00 0.00 H new ATOM 612 N GLY A 282 -8.668 10.150 -7.525 1.00 0.00 N ATOM 613 CA GLY A 282 -7.950 11.399 -7.671 1.00 0.00 C ATOM 614 C GLY A 282 -6.508 11.256 -7.241 1.00 0.00 C ATOM 615 O GLY A 282 -5.617 11.906 -7.786 1.00 0.00 O ATOM 0 H GLY A 282 -8.382 9.415 -8.172 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -7.991 11.726 -8.710 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -8.435 12.172 -7.074 1.00 0.00 H new ATOM 619 N TRP A 283 -6.283 10.392 -6.255 1.00 0.00 N ATOM 620 CA TRP A 283 -4.950 10.148 -5.743 1.00 0.00 C ATOM 621 C TRP A 283 -4.500 8.722 -6.037 1.00 0.00 C ATOM 622 O TRP A 283 -5.312 7.839 -6.312 1.00 0.00 O ATOM 623 CB TRP A 283 -4.900 10.410 -4.240 1.00 0.00 C ATOM 624 CG TRP A 283 -6.122 9.976 -3.490 1.00 0.00 C ATOM 625 CD1 TRP A 283 -6.776 8.790 -3.607 1.00 0.00 C ATOM 626 CD2 TRP A 283 -6.822 10.723 -2.490 1.00 0.00 C ATOM 627 NE1 TRP A 283 -7.852 8.753 -2.753 1.00 0.00 N ATOM 628 CE2 TRP A 283 -7.900 9.930 -2.054 1.00 0.00 C ATOM 629 CE3 TRP A 283 -6.645 11.985 -1.922 1.00 0.00 C ATOM 630 CZ2 TRP A 283 -8.794 10.360 -1.077 1.00 0.00 C ATOM 631 CZ3 TRP A 283 -7.530 12.411 -0.953 1.00 0.00 C ATOM 632 CH2 TRP A 283 -8.594 11.600 -0.537 1.00 0.00 C ATOM 0 H TRP A 283 -7.015 9.850 -5.797 1.00 0.00 H new ATOM 0 HA TRP A 283 -4.269 10.833 -6.247 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -4.033 9.897 -3.824 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -4.749 11.477 -4.075 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -6.491 7.991 -4.275 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -8.507 7.977 -2.656 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -5.828 12.618 -2.236 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -9.616 9.736 -0.757 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -7.400 13.386 -0.508 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -9.269 11.961 0.225 1.00 0.00 H new ATOM 643 N ASN A 284 -3.192 8.519 -5.979 1.00 0.00 N ATOM 644 CA ASN A 284 -2.592 7.215 -6.239 1.00 0.00 C ATOM 645 C ASN A 284 -3.178 6.137 -5.326 1.00 0.00 C ATOM 646 O ASN A 284 -2.720 5.954 -4.200 1.00 0.00 O ATOM 647 CB ASN A 284 -1.073 7.310 -6.043 1.00 0.00 C ATOM 648 CG ASN A 284 -0.314 7.203 -7.351 1.00 0.00 C ATOM 649 OD1 ASN A 284 -0.241 6.131 -7.954 1.00 0.00 O ATOM 650 ND2 ASN A 284 0.256 8.316 -7.795 1.00 0.00 N ATOM 0 H ASN A 284 -2.517 9.249 -5.751 1.00 0.00 H new ATOM 0 HA ASN A 284 -2.814 6.929 -7.267 1.00 0.00 H new ATOM 0 HB2 ASN A 284 -0.830 8.257 -5.561 1.00 0.00 H new ATOM 0 HB3 ASN A 284 -0.746 6.517 -5.370 1.00 0.00 H new ATOM 0 HD21 ASN A 284 0.781 8.306 -8.669 1.00 0.00 H new ATOM 0 HD22 ASN A 284 0.169 9.181 -7.262 1.00 0.00 H new ATOM 657 N ARG A 285 -4.189 5.425 -5.825 1.00 0.00 N ATOM 658 CA ARG A 285 -4.836 4.362 -5.054 1.00 0.00 C ATOM 659 C ARG A 285 -4.072 3.046 -5.184 1.00 0.00 C ATOM 660 O ARG A 285 -4.302 2.276 -6.118 1.00 0.00 O ATOM 661 CB ARG A 285 -6.281 4.163 -5.518 1.00 0.00 C ATOM 662 CG ARG A 285 -7.131 5.418 -5.425 1.00 0.00 C ATOM 663 CD ARG A 285 -8.597 5.080 -5.212 1.00 0.00 C ATOM 664 NE ARG A 285 -8.807 4.280 -4.007 1.00 0.00 N ATOM 665 CZ ARG A 285 -9.992 3.804 -3.630 1.00 0.00 C ATOM 666 NH1 ARG A 285 -11.075 4.048 -4.358 1.00 0.00 N ATOM 667 NH2 ARG A 285 -10.095 3.082 -2.521 1.00 0.00 N ATOM 0 H ARG A 285 -4.577 5.564 -6.758 1.00 0.00 H new ATOM 0 HA ARG A 285 -4.834 4.666 -4.007 1.00 0.00 H new ATOM 0 HB2 ARG A 285 -6.277 3.814 -6.550 1.00 0.00 H new ATOM 0 HB3 ARG A 285 -6.741 3.378 -4.918 1.00 0.00 H new ATOM 0 HG2 ARG A 285 -6.776 6.040 -4.603 1.00 0.00 H new ATOM 0 HG3 ARG A 285 -7.020 6.003 -6.338 1.00 0.00 H new ATOM 0 HD2 ARG A 285 -9.174 6.002 -5.140 1.00 0.00 H new ATOM 0 HD3 ARG A 285 -8.973 4.535 -6.078 1.00 0.00 H new ATOM 0 HE ARG A 285 -7.998 4.074 -3.420 1.00 0.00 H new ATOM 0 HH11 ARG A 285 -11.002 4.603 -5.211 1.00 0.00 H new ATOM 0 HH12 ARG A 285 -11.980 3.681 -4.064 1.00 0.00 H new ATOM 0 HH21 ARG A 285 -9.266 2.892 -1.957 1.00 0.00 H new ATOM 0 HH22 ARG A 285 -11.003 2.717 -2.232 1.00 0.00 H new ATOM 681 N VAL A 286 -3.157 2.795 -4.251 1.00 0.00 N ATOM 682 CA VAL A 286 -2.356 1.575 -4.279 1.00 0.00 C ATOM 683 C VAL A 286 -3.124 0.355 -3.793 1.00 0.00 C ATOM 684 O VAL A 286 -4.187 0.451 -3.187 1.00 0.00 O ATOM 685 CB VAL A 286 -1.042 1.711 -3.464 1.00 0.00 C ATOM 686 CG1 VAL A 286 -1.256 1.513 -1.965 1.00 0.00 C ATOM 687 CG2 VAL A 286 0.020 0.750 -3.977 1.00 0.00 C ATOM 0 H VAL A 286 -2.953 3.418 -3.469 1.00 0.00 H new ATOM 0 HA VAL A 286 -2.104 1.427 -5.329 1.00 0.00 H new ATOM 0 HB VAL A 286 -0.694 2.734 -3.608 1.00 0.00 H new ATOM 0 HG11 VAL A 286 -0.304 1.619 -1.444 1.00 0.00 H new ATOM 0 HG12 VAL A 286 -1.957 2.261 -1.596 1.00 0.00 H new ATOM 0 HG13 VAL A 286 -1.660 0.517 -1.784 1.00 0.00 H new ATOM 0 HG21 VAL A 286 0.930 0.866 -3.389 1.00 0.00 H new ATOM 0 HG22 VAL A 286 -0.342 -0.274 -3.887 1.00 0.00 H new ATOM 0 HG23 VAL A 286 0.234 0.969 -5.023 1.00 0.00 H new ATOM 697 N VAL A 287 -2.534 -0.787 -4.077 1.00 0.00 N ATOM 698 CA VAL A 287 -3.065 -2.098 -3.708 1.00 0.00 C ATOM 699 C VAL A 287 -1.941 -3.116 -3.852 1.00 0.00 C ATOM 700 O VAL A 287 -1.128 -2.993 -4.759 1.00 0.00 O ATOM 701 CB VAL A 287 -4.246 -2.532 -4.607 1.00 0.00 C ATOM 702 CG1 VAL A 287 -5.333 -1.468 -4.638 1.00 0.00 C ATOM 703 CG2 VAL A 287 -3.773 -2.851 -6.020 1.00 0.00 C ATOM 0 H VAL A 287 -1.650 -0.839 -4.583 1.00 0.00 H new ATOM 0 HA VAL A 287 -3.437 -2.041 -2.685 1.00 0.00 H new ATOM 0 HB VAL A 287 -4.669 -3.439 -4.176 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -6.150 -1.801 -5.278 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -5.708 -1.301 -3.628 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -4.921 -0.538 -5.030 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -4.625 -3.153 -6.629 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -3.310 -1.966 -6.457 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -3.046 -3.662 -5.986 1.00 0.00 H new ATOM 713 N ILE A 288 -1.881 -4.117 -2.987 1.00 0.00 N ATOM 714 CA ILE A 288 -0.818 -5.115 -3.103 1.00 0.00 C ATOM 715 C ILE A 288 -1.388 -6.457 -3.531 1.00 0.00 C ATOM 716 O ILE A 288 -2.388 -6.919 -2.982 1.00 0.00 O ATOM 717 CB ILE A 288 -0.022 -5.303 -1.791 1.00 0.00 C ATOM 718 CG1 ILE A 288 0.297 -3.961 -1.124 1.00 0.00 C ATOM 719 CG2 ILE A 288 1.260 -6.078 -2.045 1.00 0.00 C ATOM 720 CD1 ILE A 288 0.382 -4.046 0.375 1.00 0.00 C ATOM 0 H ILE A 288 -2.533 -4.263 -2.216 1.00 0.00 H new ATOM 0 HA ILE A 288 -0.131 -4.737 -3.860 1.00 0.00 H new ATOM 0 HB ILE A 288 -0.652 -5.875 -1.110 1.00 0.00 H new ATOM 0 HG12 ILE A 288 1.243 -3.586 -1.514 1.00 0.00 H new ATOM 0 HG13 ILE A 288 -0.470 -3.236 -1.397 1.00 0.00 H new ATOM 0 HG21 ILE A 288 1.804 -6.198 -1.108 1.00 0.00 H new ATOM 0 HG22 ILE A 288 1.017 -7.059 -2.452 1.00 0.00 H new ATOM 0 HG23 ILE A 288 1.880 -5.533 -2.757 1.00 0.00 H new ATOM 0 HD11 ILE A 288 0.611 -3.061 0.783 1.00 0.00 H new ATOM 0 HD12 ILE A 288 -0.571 -4.392 0.774 1.00 0.00 H new ATOM 0 HD13 ILE A 288 1.169 -4.746 0.656 1.00 0.00 H new ATOM 732 N GLY A 289 -0.744 -7.079 -4.519 1.00 0.00 N ATOM 733 CA GLY A 289 -1.199 -8.368 -5.011 1.00 0.00 C ATOM 734 C GLY A 289 -1.618 -9.290 -3.884 1.00 0.00 C ATOM 735 O GLY A 289 -1.208 -9.091 -2.741 1.00 0.00 O ATOM 0 H GLY A 289 0.085 -6.712 -4.986 1.00 0.00 H new ATOM 0 HA2 GLY A 289 -2.039 -8.221 -5.690 1.00 0.00 H new ATOM 0 HA3 GLY A 289 -0.402 -8.838 -5.587 1.00 0.00 H new ATOM 739 N PRO A 290 -2.444 -10.309 -4.167 1.00 0.00 N ATOM 740 CA PRO A 290 -2.906 -11.242 -3.144 1.00 0.00 C ATOM 741 C PRO A 290 -1.780 -11.672 -2.211 1.00 0.00 C ATOM 742 O PRO A 290 -0.955 -12.517 -2.557 1.00 0.00 O ATOM 743 CB PRO A 290 -3.421 -12.424 -3.961 1.00 0.00 C ATOM 744 CG PRO A 290 -3.887 -11.818 -5.241 1.00 0.00 C ATOM 745 CD PRO A 290 -2.997 -10.627 -5.498 1.00 0.00 C ATOM 0 HA PRO A 290 -3.659 -10.804 -2.489 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -2.636 -13.160 -4.133 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -4.233 -12.938 -3.447 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -3.820 -12.536 -6.058 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -4.931 -11.514 -5.169 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -2.209 -10.863 -6.213 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -3.559 -9.788 -5.909 1.00 0.00 H new ATOM 753 N VAL A 291 -1.754 -11.073 -1.028 1.00 0.00 N ATOM 754 CA VAL A 291 -0.727 -11.375 -0.033 1.00 0.00 C ATOM 755 C VAL A 291 -1.118 -12.586 0.807 1.00 0.00 C ATOM 756 O VAL A 291 -2.140 -13.222 0.554 1.00 0.00 O ATOM 757 CB VAL A 291 -0.439 -10.172 0.904 1.00 0.00 C ATOM 758 CG1 VAL A 291 0.772 -9.394 0.415 1.00 0.00 C ATOM 759 CG2 VAL A 291 -1.646 -9.248 1.027 1.00 0.00 C ATOM 0 H VAL A 291 -2.433 -10.373 -0.731 1.00 0.00 H new ATOM 0 HA VAL A 291 0.183 -11.596 -0.591 1.00 0.00 H new ATOM 0 HB VAL A 291 -0.227 -10.574 1.895 1.00 0.00 H new ATOM 0 HG11 VAL A 291 0.959 -8.554 1.084 1.00 0.00 H new ATOM 0 HG12 VAL A 291 1.644 -10.048 0.401 1.00 0.00 H new ATOM 0 HG13 VAL A 291 0.583 -9.021 -0.592 1.00 0.00 H new ATOM 0 HG21 VAL A 291 -1.403 -8.419 1.691 1.00 0.00 H new ATOM 0 HG22 VAL A 291 -1.909 -8.860 0.043 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -2.490 -9.804 1.435 1.00 0.00 H new ATOM 769 N LYS A 292 -0.295 -12.905 1.802 1.00 0.00 N ATOM 770 CA LYS A 292 -0.558 -14.047 2.671 1.00 0.00 C ATOM 771 C LYS A 292 -0.817 -13.604 4.104 1.00 0.00 C ATOM 772 O LYS A 292 -0.131 -12.726 4.629 1.00 0.00 O ATOM 773 CB LYS A 292 0.619 -15.023 2.636 1.00 0.00 C ATOM 774 CG LYS A 292 0.587 -15.975 1.450 1.00 0.00 C ATOM 775 CD LYS A 292 0.144 -17.371 1.862 1.00 0.00 C ATOM 776 CE LYS A 292 -1.146 -17.775 1.166 1.00 0.00 C ATOM 777 NZ LYS A 292 -0.938 -18.037 -0.287 1.00 0.00 N ATOM 0 H LYS A 292 0.557 -12.390 2.026 1.00 0.00 H new ATOM 0 HA LYS A 292 -1.453 -14.547 2.300 1.00 0.00 H new ATOM 0 HB2 LYS A 292 1.550 -14.456 2.611 1.00 0.00 H new ATOM 0 HB3 LYS A 292 0.625 -15.605 3.558 1.00 0.00 H new ATOM 0 HG2 LYS A 292 -0.091 -15.587 0.690 1.00 0.00 H new ATOM 0 HG3 LYS A 292 1.577 -16.026 0.997 1.00 0.00 H new ATOM 0 HD2 LYS A 292 0.928 -18.088 1.621 1.00 0.00 H new ATOM 0 HD3 LYS A 292 0.002 -17.405 2.942 1.00 0.00 H new ATOM 0 HE2 LYS A 292 -1.550 -18.669 1.641 1.00 0.00 H new ATOM 0 HE3 LYS A 292 -1.887 -16.986 1.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 -1.363 -17.268 -0.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 0.081 -18.087 -0.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 -1.387 -18.939 -0.545 1.00 0.00 H new ATOM 791 N GLY A 293 -1.811 -14.222 4.734 1.00 0.00 N ATOM 792 CA GLY A 293 -2.146 -13.886 6.104 1.00 0.00 C ATOM 793 C GLY A 293 -1.162 -14.467 7.095 1.00 0.00 C ATOM 794 O GLY A 293 -1.158 -15.673 7.346 1.00 0.00 O ATOM 0 H GLY A 293 -2.391 -14.951 4.318 1.00 0.00 H new ATOM 0 HA2 GLY A 293 -2.172 -12.802 6.214 1.00 0.00 H new ATOM 0 HA3 GLY A 293 -3.147 -14.253 6.331 1.00 0.00 H new ATOM 798 N LYS A 294 -0.323 -13.608 7.660 1.00 0.00 N ATOM 799 CA LYS A 294 0.674 -14.039 8.630 1.00 0.00 C ATOM 800 C LYS A 294 1.256 -12.844 9.374 1.00 0.00 C ATOM 801 O LYS A 294 1.337 -12.844 10.602 1.00 0.00 O ATOM 802 CB LYS A 294 1.793 -14.818 7.936 1.00 0.00 C ATOM 803 CG LYS A 294 2.386 -15.926 8.794 1.00 0.00 C ATOM 804 CD LYS A 294 1.941 -17.302 8.322 1.00 0.00 C ATOM 805 CE LYS A 294 1.324 -18.110 9.453 1.00 0.00 C ATOM 806 NZ LYS A 294 0.328 -19.097 8.952 1.00 0.00 N ATOM 0 H LYS A 294 -0.314 -12.607 7.462 1.00 0.00 H new ATOM 0 HA LYS A 294 0.184 -14.692 9.352 1.00 0.00 H new ATOM 0 HB2 LYS A 294 1.405 -15.252 7.014 1.00 0.00 H new ATOM 0 HB3 LYS A 294 2.586 -14.125 7.653 1.00 0.00 H new ATOM 0 HG2 LYS A 294 3.474 -15.866 8.765 1.00 0.00 H new ATOM 0 HG3 LYS A 294 2.086 -15.783 9.832 1.00 0.00 H new ATOM 0 HD2 LYS A 294 1.217 -17.194 7.515 1.00 0.00 H new ATOM 0 HD3 LYS A 294 2.796 -17.841 7.913 1.00 0.00 H new ATOM 0 HE2 LYS A 294 2.111 -18.633 9.997 1.00 0.00 H new ATOM 0 HE3 LYS A 294 0.842 -17.435 10.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 -0.069 -19.627 9.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 -0.437 -18.597 8.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 0.793 -19.757 8.297 1.00 0.00 H new ATOM 820 N GLU A 295 1.662 -11.825 8.621 1.00 0.00 N ATOM 821 CA GLU A 295 2.239 -10.623 9.210 1.00 0.00 C ATOM 822 C GLU A 295 2.666 -9.615 8.143 1.00 0.00 C ATOM 823 O GLU A 295 2.795 -8.426 8.427 1.00 0.00 O ATOM 824 CB GLU A 295 3.440 -10.995 10.079 1.00 0.00 C ATOM 825 CG GLU A 295 3.149 -10.952 11.570 1.00 0.00 C ATOM 826 CD GLU A 295 4.324 -10.434 12.378 1.00 0.00 C ATOM 827 OE1 GLU A 295 4.406 -9.206 12.585 1.00 0.00 O ATOM 828 OE2 GLU A 295 5.161 -11.258 12.803 1.00 0.00 O ATOM 0 H GLU A 295 1.602 -11.809 7.603 1.00 0.00 H new ATOM 0 HA GLU A 295 1.470 -10.153 9.823 1.00 0.00 H new ATOM 0 HB2 GLU A 295 3.775 -11.997 9.811 1.00 0.00 H new ATOM 0 HB3 GLU A 295 4.262 -10.315 9.858 1.00 0.00 H new ATOM 0 HG2 GLU A 295 2.281 -10.317 11.749 1.00 0.00 H new ATOM 0 HG3 GLU A 295 2.888 -11.953 11.915 1.00 0.00 H new ATOM 835 N ASN A 296 2.896 -10.088 6.921 1.00 0.00 N ATOM 836 CA ASN A 296 3.317 -9.208 5.836 1.00 0.00 C ATOM 837 C ASN A 296 2.267 -8.140 5.554 1.00 0.00 C ATOM 838 O ASN A 296 2.549 -6.948 5.646 1.00 0.00 O ATOM 839 CB ASN A 296 3.601 -10.018 4.570 1.00 0.00 C ATOM 840 CG ASN A 296 4.911 -10.777 4.655 1.00 0.00 C ATOM 841 OD1 ASN A 296 5.220 -11.393 5.675 1.00 0.00 O ATOM 842 ND2 ASN A 296 5.690 -10.734 3.581 1.00 0.00 N ATOM 0 H ASN A 296 2.799 -11.069 6.659 1.00 0.00 H new ATOM 0 HA ASN A 296 4.234 -8.708 6.148 1.00 0.00 H new ATOM 0 HB2 ASN A 296 2.786 -10.722 4.401 1.00 0.00 H new ATOM 0 HB3 ASN A 296 3.627 -9.348 3.711 1.00 0.00 H new ATOM 0 HD21 ASN A 296 6.585 -11.224 3.580 1.00 0.00 H new ATOM 0 HD22 ASN A 296 5.394 -10.211 2.757 1.00 0.00 H new ATOM 849 N ALA A 297 1.054 -8.567 5.219 1.00 0.00 N ATOM 850 CA ALA A 297 -0.030 -7.629 4.939 1.00 0.00 C ATOM 851 C ALA A 297 -0.253 -6.707 6.138 1.00 0.00 C ATOM 852 O ALA A 297 -0.359 -5.491 5.990 1.00 0.00 O ATOM 853 CB ALA A 297 -1.309 -8.384 4.607 1.00 0.00 C ATOM 0 H ALA A 297 0.796 -9.550 5.135 1.00 0.00 H new ATOM 0 HA ALA A 297 0.247 -7.021 4.078 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -2.108 -7.672 4.401 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -1.145 -9.010 3.730 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -1.591 -9.011 5.453 1.00 0.00 H new ATOM 859 N ASP A 298 -0.315 -7.296 7.332 1.00 0.00 N ATOM 860 CA ASP A 298 -0.516 -6.526 8.557 1.00 0.00 C ATOM 861 C ASP A 298 0.660 -5.590 8.805 1.00 0.00 C ATOM 862 O ASP A 298 0.472 -4.419 9.132 1.00 0.00 O ATOM 863 CB ASP A 298 -0.701 -7.465 9.751 1.00 0.00 C ATOM 864 CG ASP A 298 -1.768 -6.976 10.712 1.00 0.00 C ATOM 865 OD1 ASP A 298 -1.689 -5.807 11.141 1.00 0.00 O ATOM 866 OD2 ASP A 298 -2.681 -7.765 11.035 1.00 0.00 O ATOM 0 H ASP A 298 -0.229 -8.302 7.476 1.00 0.00 H new ATOM 0 HA ASP A 298 -1.417 -5.925 8.438 1.00 0.00 H new ATOM 0 HB2 ASP A 298 -0.968 -8.458 9.390 1.00 0.00 H new ATOM 0 HB3 ASP A 298 0.245 -7.563 10.283 1.00 0.00 H new ATOM 871 N SER A 299 1.874 -6.101 8.628 1.00 0.00 N ATOM 872 CA SER A 299 3.067 -5.288 8.816 1.00 0.00 C ATOM 873 C SER A 299 3.118 -4.224 7.735 1.00 0.00 C ATOM 874 O SER A 299 3.518 -3.090 7.977 1.00 0.00 O ATOM 875 CB SER A 299 4.325 -6.156 8.764 1.00 0.00 C ATOM 876 OG SER A 299 4.457 -6.936 9.939 1.00 0.00 O ATOM 0 H SER A 299 2.056 -7.067 8.357 1.00 0.00 H new ATOM 0 HA SER A 299 3.026 -4.812 9.796 1.00 0.00 H new ATOM 0 HB2 SER A 299 4.283 -6.810 7.893 1.00 0.00 H new ATOM 0 HB3 SER A 299 5.203 -5.522 8.645 1.00 0.00 H new ATOM 0 HG SER A 299 3.987 -7.788 9.821 1.00 0.00 H new ATOM 882 N THR A 300 2.678 -4.611 6.543 1.00 0.00 N ATOM 883 CA THR A 300 2.633 -3.717 5.396 1.00 0.00 C ATOM 884 C THR A 300 1.776 -2.498 5.713 1.00 0.00 C ATOM 885 O THR A 300 2.023 -1.405 5.207 1.00 0.00 O ATOM 886 CB THR A 300 2.072 -4.476 4.191 1.00 0.00 C ATOM 887 OG1 THR A 300 3.029 -5.390 3.687 1.00 0.00 O ATOM 888 CG2 THR A 300 1.648 -3.587 3.047 1.00 0.00 C ATOM 0 H THR A 300 2.343 -5.554 6.346 1.00 0.00 H new ATOM 0 HA THR A 300 3.639 -3.370 5.162 1.00 0.00 H new ATOM 0 HB THR A 300 1.187 -4.987 4.570 1.00 0.00 H new ATOM 0 HG1 THR A 300 3.329 -5.981 4.409 1.00 0.00 H new ATOM 0 HG21 THR A 300 1.262 -4.201 2.233 1.00 0.00 H new ATOM 0 HG22 THR A 300 0.870 -2.904 3.386 1.00 0.00 H new ATOM 0 HG23 THR A 300 2.506 -3.014 2.694 1.00 0.00 H new ATOM 896 N LEU A 301 0.775 -2.689 6.566 1.00 0.00 N ATOM 897 CA LEU A 301 -0.100 -1.595 6.961 1.00 0.00 C ATOM 898 C LEU A 301 0.697 -0.578 7.764 1.00 0.00 C ATOM 899 O LEU A 301 0.605 0.627 7.534 1.00 0.00 O ATOM 900 CB LEU A 301 -1.281 -2.126 7.780 1.00 0.00 C ATOM 901 CG LEU A 301 -2.073 -1.072 8.559 1.00 0.00 C ATOM 902 CD1 LEU A 301 -2.395 0.136 7.683 1.00 0.00 C ATOM 903 CD2 LEU A 301 -3.346 -1.688 9.123 1.00 0.00 C ATOM 0 H LEU A 301 0.551 -3.587 6.994 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.499 -1.111 6.070 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -1.964 -2.643 7.106 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -0.907 -2.868 8.485 1.00 0.00 H new ATOM 0 HG LEU A 301 -1.457 -0.721 9.387 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -2.958 0.867 8.264 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -1.468 0.588 7.331 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -2.990 -0.183 6.827 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -3.903 -0.931 9.675 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -3.960 -2.066 8.306 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -3.088 -2.509 9.792 1.00 0.00 H new ATOM 915 N ASN A 302 1.506 -1.084 8.688 1.00 0.00 N ATOM 916 CA ASN A 302 2.357 -0.236 9.509 1.00 0.00 C ATOM 917 C ASN A 302 3.587 0.174 8.709 1.00 0.00 C ATOM 918 O ASN A 302 4.181 1.223 8.953 1.00 0.00 O ATOM 919 CB ASN A 302 2.769 -0.977 10.784 1.00 0.00 C ATOM 920 CG ASN A 302 3.720 -0.168 11.646 1.00 0.00 C ATOM 921 OD1 ASN A 302 3.296 0.687 12.424 1.00 0.00 O ATOM 922 ND2 ASN A 302 5.014 -0.434 11.509 1.00 0.00 N ATOM 0 H ASN A 302 1.589 -2.081 8.886 1.00 0.00 H new ATOM 0 HA ASN A 302 1.805 0.659 9.797 1.00 0.00 H new ATOM 0 HB2 ASN A 302 1.878 -1.221 11.362 1.00 0.00 H new ATOM 0 HB3 ASN A 302 3.242 -1.921 10.515 1.00 0.00 H new ATOM 0 HD21 ASN A 302 5.701 0.079 12.061 1.00 0.00 H new ATOM 0 HD22 ASN A 302 5.320 -1.151 10.852 1.00 0.00 H new ATOM 929 N ARG A 303 3.946 -0.659 7.736 1.00 0.00 N ATOM 930 CA ARG A 303 5.084 -0.386 6.878 1.00 0.00 C ATOM 931 C ARG A 303 4.712 0.695 5.869 1.00 0.00 C ATOM 932 O ARG A 303 5.513 1.573 5.563 1.00 0.00 O ATOM 933 CB ARG A 303 5.538 -1.664 6.170 1.00 0.00 C ATOM 934 CG ARG A 303 7.027 -1.943 6.317 1.00 0.00 C ATOM 935 CD ARG A 303 7.294 -3.408 6.623 1.00 0.00 C ATOM 936 NE ARG A 303 8.472 -3.585 7.468 1.00 0.00 N ATOM 937 CZ ARG A 303 9.126 -4.738 7.597 1.00 0.00 C ATOM 938 NH1 ARG A 303 8.718 -5.818 6.943 1.00 0.00 N ATOM 939 NH2 ARG A 303 10.190 -4.811 8.385 1.00 0.00 N ATOM 0 H ARG A 303 3.460 -1.531 7.525 1.00 0.00 H new ATOM 0 HA ARG A 303 5.916 -0.028 7.485 1.00 0.00 H new ATOM 0 HB2 ARG A 303 4.977 -2.509 6.568 1.00 0.00 H new ATOM 0 HB3 ARG A 303 5.293 -1.590 5.110 1.00 0.00 H new ATOM 0 HG2 ARG A 303 7.543 -1.663 5.399 1.00 0.00 H new ATOM 0 HG3 ARG A 303 7.437 -1.323 7.115 1.00 0.00 H new ATOM 0 HD2 ARG A 303 6.424 -3.839 7.119 1.00 0.00 H new ATOM 0 HD3 ARG A 303 7.432 -3.954 5.690 1.00 0.00 H new ATOM 0 HE ARG A 303 8.814 -2.778 7.990 1.00 0.00 H new ATOM 0 HH11 ARG A 303 7.899 -5.768 6.337 1.00 0.00 H new ATOM 0 HH12 ARG A 303 9.223 -6.698 7.046 1.00 0.00 H new ATOM 0 HH21 ARG A 303 10.507 -3.985 8.892 1.00 0.00 H new ATOM 0 HH22 ARG A 303 10.691 -5.694 8.484 1.00 0.00 H new ATOM 953 N LEU A 304 3.468 0.648 5.386 1.00 0.00 N ATOM 954 CA LEU A 304 2.967 1.651 4.448 1.00 0.00 C ATOM 955 C LEU A 304 3.173 3.037 5.044 1.00 0.00 C ATOM 956 O LEU A 304 3.402 4.008 4.324 1.00 0.00 O ATOM 957 CB LEU A 304 1.491 1.399 4.156 1.00 0.00 C ATOM 958 CG LEU A 304 1.198 0.529 2.920 1.00 0.00 C ATOM 959 CD1 LEU A 304 -0.279 0.198 2.847 1.00 0.00 C ATOM 960 CD2 LEU A 304 1.658 1.210 1.627 1.00 0.00 C ATOM 0 H LEU A 304 2.791 -0.074 5.630 1.00 0.00 H new ATOM 0 HA LEU A 304 3.514 1.585 3.507 1.00 0.00 H new ATOM 0 HB2 LEU A 304 1.042 0.923 5.028 1.00 0.00 H new ATOM 0 HB3 LEU A 304 0.995 2.361 4.027 1.00 0.00 H new ATOM 0 HG LEU A 304 1.764 -0.396 3.025 1.00 0.00 H new ATOM 0 HD11 LEU A 304 -0.471 -0.417 1.968 1.00 0.00 H new ATOM 0 HD12 LEU A 304 -0.574 -0.347 3.743 1.00 0.00 H new ATOM 0 HD13 LEU A 304 -0.856 1.120 2.777 1.00 0.00 H new ATOM 0 HD21 LEU A 304 1.434 0.566 0.777 1.00 0.00 H new ATOM 0 HD22 LEU A 304 1.135 2.159 1.510 1.00 0.00 H new ATOM 0 HD23 LEU A 304 2.732 1.390 1.673 1.00 0.00 H new ATOM 972 N LYS A 305 3.132 3.107 6.372 1.00 0.00 N ATOM 973 CA LYS A 305 3.362 4.359 7.072 1.00 0.00 C ATOM 974 C LYS A 305 4.809 4.787 6.853 1.00 0.00 C ATOM 975 O LYS A 305 5.118 5.977 6.775 1.00 0.00 O ATOM 976 CB LYS A 305 3.068 4.199 8.567 1.00 0.00 C ATOM 977 CG LYS A 305 1.725 4.774 8.988 1.00 0.00 C ATOM 978 CD LYS A 305 1.692 6.286 8.839 1.00 0.00 C ATOM 979 CE LYS A 305 0.267 6.815 8.846 1.00 0.00 C ATOM 980 NZ LYS A 305 -0.273 6.945 10.228 1.00 0.00 N ATOM 0 H LYS A 305 2.942 2.311 6.980 1.00 0.00 H new ATOM 0 HA LYS A 305 2.693 5.125 6.680 1.00 0.00 H new ATOM 0 HB2 LYS A 305 3.097 3.140 8.823 1.00 0.00 H new ATOM 0 HB3 LYS A 305 3.858 4.687 9.138 1.00 0.00 H new ATOM 0 HG2 LYS A 305 0.933 4.331 8.384 1.00 0.00 H new ATOM 0 HG3 LYS A 305 1.523 4.506 10.025 1.00 0.00 H new ATOM 0 HD2 LYS A 305 2.256 6.745 9.651 1.00 0.00 H new ATOM 0 HD3 LYS A 305 2.183 6.572 7.909 1.00 0.00 H new ATOM 0 HE2 LYS A 305 0.239 7.787 8.353 1.00 0.00 H new ATOM 0 HE3 LYS A 305 -0.371 6.146 8.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -1.246 7.309 10.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 -0.270 6.014 10.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 0.320 7.604 10.772 1.00 0.00 H new ATOM 994 N MET A 306 5.690 3.792 6.725 1.00 0.00 N ATOM 995 CA MET A 306 7.106 4.034 6.480 1.00 0.00 C ATOM 996 C MET A 306 7.280 4.799 5.175 1.00 0.00 C ATOM 997 O MET A 306 8.214 5.585 5.017 1.00 0.00 O ATOM 998 CB MET A 306 7.875 2.705 6.416 1.00 0.00 C ATOM 999 CG MET A 306 7.634 1.804 7.618 1.00 0.00 C ATOM 1000 SD MET A 306 8.785 2.125 8.968 1.00 0.00 S ATOM 1001 CE MET A 306 7.911 1.383 10.343 1.00 0.00 C ATOM 0 H MET A 306 5.441 2.805 6.788 1.00 0.00 H new ATOM 0 HA MET A 306 7.507 4.628 7.301 1.00 0.00 H new ATOM 0 HB2 MET A 306 7.588 2.172 5.510 1.00 0.00 H new ATOM 0 HB3 MET A 306 8.942 2.915 6.338 1.00 0.00 H new ATOM 0 HG2 MET A 306 6.614 1.945 7.974 1.00 0.00 H new ATOM 0 HG3 MET A 306 7.723 0.762 7.310 1.00 0.00 H new ATOM 0 HE1 MET A 306 8.498 1.501 11.254 1.00 0.00 H new ATOM 0 HE2 MET A 306 6.946 1.874 10.468 1.00 0.00 H new ATOM 0 HE3 MET A 306 7.756 0.322 10.146 1.00 0.00 H new ATOM 1011 N ALA A 307 6.361 4.560 4.243 1.00 0.00 N ATOM 1012 CA ALA A 307 6.388 5.221 2.947 1.00 0.00 C ATOM 1013 C ALA A 307 5.838 6.644 3.036 1.00 0.00 C ATOM 1014 O ALA A 307 6.010 7.442 2.116 1.00 0.00 O ATOM 1015 CB ALA A 307 5.600 4.403 1.930 1.00 0.00 C ATOM 0 H ALA A 307 5.585 3.909 4.365 1.00 0.00 H new ATOM 0 HA ALA A 307 7.426 5.290 2.620 1.00 0.00 H new ATOM 0 HB1 ALA A 307 5.625 4.904 0.962 1.00 0.00 H new ATOM 0 HB2 ALA A 307 6.045 3.412 1.837 1.00 0.00 H new ATOM 0 HB3 ALA A 307 4.566 4.307 2.263 1.00 0.00 H new ATOM 1021 N GLY A 308 5.170 6.956 4.147 1.00 0.00 N ATOM 1022 CA GLY A 308 4.606 8.282 4.322 1.00 0.00 C ATOM 1023 C GLY A 308 3.425 8.516 3.407 1.00 0.00 C ATOM 1024 O GLY A 308 3.516 9.272 2.441 1.00 0.00 O ATOM 0 H GLY A 308 5.011 6.315 4.925 1.00 0.00 H new ATOM 0 HA2 GLY A 308 4.294 8.410 5.358 1.00 0.00 H new ATOM 0 HA3 GLY A 308 5.372 9.032 4.125 1.00 0.00 H new ATOM 1028 N HIS A 309 2.317 7.846 3.703 1.00 0.00 N ATOM 1029 CA HIS A 309 1.114 7.969 2.888 1.00 0.00 C ATOM 1030 C HIS A 309 -0.148 7.962 3.750 1.00 0.00 C ATOM 1031 O HIS A 309 -0.135 7.466 4.876 1.00 0.00 O ATOM 1032 CB HIS A 309 1.070 6.820 1.873 1.00 0.00 C ATOM 1033 CG HIS A 309 0.393 5.581 2.379 1.00 0.00 C ATOM 1034 ND1 HIS A 309 -0.944 5.550 2.699 1.00 0.00 N ATOM 1035 CD2 HIS A 309 0.853 4.317 2.582 1.00 0.00 C ATOM 1036 CE1 HIS A 309 -1.280 4.338 3.071 1.00 0.00 C ATOM 1037 NE2 HIS A 309 -0.219 3.566 3.005 1.00 0.00 N ATOM 0 H HIS A 309 2.227 7.214 4.499 1.00 0.00 H new ATOM 0 HA HIS A 309 1.148 8.924 2.363 1.00 0.00 H new ATOM 0 HB2 HIS A 309 0.554 7.162 0.976 1.00 0.00 H new ATOM 0 HB3 HIS A 309 2.089 6.570 1.579 1.00 0.00 H new ATOM 0 HD1 HIS A 309 -1.578 6.348 2.654 1.00 0.00 H new ATOM 0 HD2 HIS A 309 1.866 3.970 2.439 1.00 0.00 H new ATOM 0 HE1 HIS A 309 -2.266 4.026 3.381 1.00 0.00 H new ATOM 1046 N THR A 310 -1.242 8.510 3.213 1.00 0.00 N ATOM 1047 CA THR A 310 -2.509 8.547 3.955 1.00 0.00 C ATOM 1048 C THR A 310 -3.589 7.655 3.318 1.00 0.00 C ATOM 1049 O THR A 310 -3.965 7.860 2.166 1.00 0.00 O ATOM 1050 CB THR A 310 -3.018 9.986 4.052 1.00 0.00 C ATOM 1051 OG1 THR A 310 -4.296 10.025 4.662 1.00 0.00 O ATOM 1052 CG2 THR A 310 -3.131 10.674 2.710 1.00 0.00 C ATOM 0 H THR A 310 -1.279 8.928 2.283 1.00 0.00 H new ATOM 0 HA THR A 310 -2.309 8.155 4.952 1.00 0.00 H new ATOM 0 HB THR A 310 -2.276 10.514 4.651 1.00 0.00 H new ATOM 0 HG1 THR A 310 -4.926 9.489 4.136 1.00 0.00 H new ATOM 0 HG21 THR A 310 -3.498 11.691 2.852 1.00 0.00 H new ATOM 0 HG22 THR A 310 -2.151 10.705 2.233 1.00 0.00 H new ATOM 0 HG23 THR A 310 -3.826 10.123 2.076 1.00 0.00 H new ATOM 1060 N ASN A 311 -4.094 6.682 4.103 1.00 0.00 N ATOM 1061 CA ASN A 311 -5.159 5.744 3.674 1.00 0.00 C ATOM 1062 C ASN A 311 -4.605 4.381 3.243 1.00 0.00 C ATOM 1063 O ASN A 311 -3.962 4.261 2.200 1.00 0.00 O ATOM 1064 CB ASN A 311 -6.016 6.330 2.544 1.00 0.00 C ATOM 1065 CG ASN A 311 -6.554 7.707 2.878 1.00 0.00 C ATOM 1066 OD1 ASN A 311 -6.362 8.211 3.984 1.00 0.00 O ATOM 1067 ND2 ASN A 311 -7.235 8.323 1.918 1.00 0.00 N ATOM 0 H ASN A 311 -3.775 6.521 5.058 1.00 0.00 H new ATOM 0 HA ASN A 311 -5.787 5.593 4.552 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -5.420 6.387 1.633 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -6.849 5.658 2.338 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -7.623 9.252 2.083 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -7.370 7.867 1.016 1.00 0.00 H new ATOM 1074 N CYS A 312 -4.878 3.353 4.057 1.00 0.00 N ATOM 1075 CA CYS A 312 -4.425 1.983 3.779 1.00 0.00 C ATOM 1076 C CYS A 312 -5.279 0.966 4.539 1.00 0.00 C ATOM 1077 O CYS A 312 -5.634 1.204 5.693 1.00 0.00 O ATOM 1078 CB CYS A 312 -2.954 1.810 4.187 1.00 0.00 C ATOM 1079 SG CYS A 312 -2.464 2.764 5.645 1.00 0.00 S ATOM 0 H CYS A 312 -5.414 3.445 4.920 1.00 0.00 H new ATOM 0 HA CYS A 312 -4.528 1.808 2.708 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -2.765 0.754 4.379 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -2.321 2.100 3.349 1.00 0.00 H new ATOM 0 HG CYS A 312 -1.209 2.546 5.904 1.00 0.00 H new ATOM 1085 N ILE A 313 -5.607 -0.176 3.913 1.00 0.00 N ATOM 1086 CA ILE A 313 -6.409 -1.188 4.594 1.00 0.00 C ATOM 1087 C ILE A 313 -6.270 -2.557 3.939 1.00 0.00 C ATOM 1088 O ILE A 313 -6.683 -2.752 2.797 1.00 0.00 O ATOM 1089 CB ILE A 313 -7.902 -0.807 4.624 1.00 0.00 C ATOM 1090 CG1 ILE A 313 -8.351 -0.286 3.257 1.00 0.00 C ATOM 1091 CG2 ILE A 313 -8.167 0.230 5.707 1.00 0.00 C ATOM 1092 CD1 ILE A 313 -9.840 -0.032 3.165 1.00 0.00 C ATOM 0 H ILE A 313 -5.334 -0.413 2.959 1.00 0.00 H new ATOM 0 HA ILE A 313 -6.027 -1.237 5.614 1.00 0.00 H new ATOM 0 HB ILE A 313 -8.481 -1.701 4.857 1.00 0.00 H new ATOM 0 HG12 ILE A 313 -7.819 0.640 3.037 1.00 0.00 H new ATOM 0 HG13 ILE A 313 -8.066 -1.007 2.491 1.00 0.00 H new ATOM 0 HG21 ILE A 313 -9.226 0.487 5.713 1.00 0.00 H new ATOM 0 HG22 ILE A 313 -7.887 -0.178 6.678 1.00 0.00 H new ATOM 0 HG23 ILE A 313 -7.578 1.125 5.506 1.00 0.00 H new ATOM 0 HD11 ILE A 313 -10.086 0.336 2.169 1.00 0.00 H new ATOM 0 HD12 ILE A 313 -10.380 -0.960 3.353 1.00 0.00 H new ATOM 0 HD13 ILE A 313 -10.129 0.712 3.907 1.00 0.00 H new ATOM 1104 N ARG A 314 -5.706 -3.512 4.677 1.00 0.00 N ATOM 1105 CA ARG A 314 -5.543 -4.866 4.159 1.00 0.00 C ATOM 1106 C ARG A 314 -6.904 -5.504 3.967 1.00 0.00 C ATOM 1107 O ARG A 314 -7.621 -5.761 4.933 1.00 0.00 O ATOM 1108 CB ARG A 314 -4.688 -5.739 5.100 1.00 0.00 C ATOM 1109 CG ARG A 314 -3.244 -5.917 4.628 1.00 0.00 C ATOM 1110 CD ARG A 314 -2.566 -4.576 4.358 1.00 0.00 C ATOM 1111 NE ARG A 314 -3.077 -3.530 5.239 1.00 0.00 N ATOM 1112 CZ ARG A 314 -3.025 -2.237 4.958 1.00 0.00 C ATOM 1113 NH1 ARG A 314 -2.343 -1.808 3.905 1.00 0.00 N ATOM 1114 NH2 ARG A 314 -3.625 -1.369 5.758 1.00 0.00 N ATOM 0 H ARG A 314 -5.358 -3.374 5.626 1.00 0.00 H new ATOM 0 HA ARG A 314 -5.024 -4.799 3.203 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -4.684 -5.291 6.094 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -5.154 -6.720 5.195 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -2.680 -6.464 5.383 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.230 -6.521 3.720 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -1.490 -4.677 4.498 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -2.727 -4.289 3.319 1.00 0.00 H new ATOM 0 HE ARG A 314 -3.499 -3.812 6.124 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -1.855 -2.475 3.307 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -2.306 -0.811 3.693 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -4.123 -1.698 6.585 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -3.589 -0.372 5.547 1.00 0.00 H new ATOM 1128 N LEU A 315 -7.248 -5.769 2.716 1.00 0.00 N ATOM 1129 CA LEU A 315 -8.511 -6.402 2.398 1.00 0.00 C ATOM 1130 C LEU A 315 -8.276 -7.881 2.184 1.00 0.00 C ATOM 1131 O LEU A 315 -7.453 -8.283 1.364 1.00 0.00 O ATOM 1132 CB LEU A 315 -9.158 -5.782 1.168 1.00 0.00 C ATOM 1133 CG LEU A 315 -10.378 -6.528 0.620 1.00 0.00 C ATOM 1134 CD1 LEU A 315 -11.663 -5.919 1.157 1.00 0.00 C ATOM 1135 CD2 LEU A 315 -10.372 -6.513 -0.902 1.00 0.00 C ATOM 0 H LEU A 315 -6.667 -5.554 1.906 1.00 0.00 H new ATOM 0 HA LEU A 315 -9.198 -6.250 3.231 1.00 0.00 H new ATOM 0 HB2 LEU A 315 -9.456 -4.762 1.411 1.00 0.00 H new ATOM 0 HB3 LEU A 315 -8.409 -5.716 0.379 1.00 0.00 H new ATOM 0 HG LEU A 315 -10.326 -7.564 0.953 1.00 0.00 H new ATOM 0 HD11 LEU A 315 -12.519 -6.463 0.756 1.00 0.00 H new ATOM 0 HD12 LEU A 315 -11.669 -5.984 2.245 1.00 0.00 H new ATOM 0 HD13 LEU A 315 -11.724 -4.873 0.855 1.00 0.00 H new ATOM 0 HD21 LEU A 315 -11.246 -7.048 -1.275 1.00 0.00 H new ATOM 0 HD22 LEU A 315 -10.399 -5.482 -1.256 1.00 0.00 H new ATOM 0 HD23 LEU A 315 -9.467 -6.998 -1.267 1.00 0.00 H new ATOM 1147 N ALA A 316 -8.976 -8.683 2.949 1.00 0.00 N ATOM 1148 CA ALA A 316 -8.814 -10.127 2.876 1.00 0.00 C ATOM 1149 C ALA A 316 -9.781 -10.770 1.895 1.00 0.00 C ATOM 1150 O ALA A 316 -10.889 -10.281 1.673 1.00 0.00 O ATOM 1151 CB ALA A 316 -8.954 -10.739 4.257 1.00 0.00 C ATOM 0 H ALA A 316 -9.665 -8.367 3.631 1.00 0.00 H new ATOM 0 HA ALA A 316 -7.811 -10.325 2.499 1.00 0.00 H new ATOM 0 HB1 ALA A 316 -8.831 -11.820 4.190 1.00 0.00 H new ATOM 0 HB2 ALA A 316 -8.190 -10.327 4.917 1.00 0.00 H new ATOM 0 HB3 ALA A 316 -9.941 -10.510 4.658 1.00 0.00 H new ATOM 1157 N ALA A 317 -9.336 -11.874 1.307 1.00 0.00 N ATOM 1158 CA ALA A 317 -10.129 -12.612 0.338 1.00 0.00 C ATOM 1159 C ALA A 317 -11.042 -13.622 1.026 1.00 0.00 C ATOM 1160 O ALA A 317 -10.988 -13.792 2.244 1.00 0.00 O ATOM 1161 CB ALA A 317 -9.202 -13.307 -0.647 1.00 0.00 C ATOM 0 H ALA A 317 -8.418 -12.280 1.489 1.00 0.00 H new ATOM 0 HA ALA A 317 -10.767 -11.911 -0.201 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -9.794 -13.861 -1.375 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -8.596 -12.563 -1.164 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -8.550 -13.996 -0.109 1.00 0.00 H new