USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=13 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 252 CYS SG : rot -10:sc= -10.5! USER MOD Set 1.2: A 309 HIS : no HE2:sc= -25.1! C(o=-36!,f=-39!) USER MOD Single : A 249 MET CE :methyl -161:sc= -0.354 (180deg=-1.14) USER MOD Single : A 251 GLN : amide:sc= -0.544 K(o=-0.54,f=-7.9!) USER MOD Single : A 254 SER OG : rot -167:sc= 0.449 USER MOD Single : A 260 GLN : amide:sc= -0.255 X(o=-0.26,f=-0.065) USER MOD Single : A 263 THR OG1 : rot 97:sc= 1.28 USER MOD Single : A 267 GLN : amide:sc= -4.2! C(o=-4.2!,f=-9.7!) USER MOD Single : A 275 SER OG : rot -36:sc= -2.89 USER MOD Single : A 276 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 278 THR OG1 : rot 180:sc= -0.041 USER MOD Single : A 279 THR OG1 : rot 180:sc= 0.0143 USER MOD Single : A 280 ASN : amide:sc= -0.0359 X(o=-0.036,f=-0.036) USER MOD Single : A 281 ASN : amide:sc= -1.48 K(o=-1.5,f=-0.83!) USER MOD Single : A 284 ASN : amide:sc= -1.17 K(o=-1.2,f=-2.5!) USER MOD Single : A 292 LYS NZ :NH3+ -139:sc= -0.198 (180deg=-0.737) USER MOD Single : A 294 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 ASN : amide:sc= -0.0491 K(o=-0.049,f=-1) USER MOD Single : A 299 SER OG : rot 180:sc= 0 USER MOD Single : A 300 THR OG1 : rot 70:sc= 0.789 USER MOD Single : A 302 ASN : amide:sc= -0.0462 X(o=-0.046,f=-0.29) 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 Single : A 310 THR OG1 : rot -64:sc= 0.0752 USER MOD Single : A 311 ASN : amide:sc= -2 K(o=-2,f=-1.5) USER MOD Single : A 312 CYS SG : rot 21:sc= -0.2 USER MOD ----------------------------------------------------------------- ATOM 75 N ARG A 247 -5.387 -14.962 3.829 1.00 0.00 N ATOM 76 CA ARG A 247 -4.978 -14.309 2.590 1.00 0.00 C ATOM 77 C ARG A 247 -5.259 -12.828 2.645 1.00 0.00 C ATOM 78 O ARG A 247 -5.932 -12.343 3.556 1.00 0.00 O ATOM 79 CB ARG A 247 -5.674 -14.945 1.386 1.00 0.00 C ATOM 80 CG ARG A 247 -4.974 -14.681 0.064 1.00 0.00 C ATOM 81 CD ARG A 247 -5.447 -15.638 -1.018 1.00 0.00 C ATOM 82 NE ARG A 247 -5.115 -17.026 -0.705 1.00 0.00 N ATOM 83 CZ ARG A 247 -5.165 -18.018 -1.591 1.00 0.00 C ATOM 84 NH1 ARG A 247 -5.532 -17.780 -2.844 1.00 0.00 N ATOM 85 NH2 ARG A 247 -4.845 -19.250 -1.223 1.00 0.00 N ATOM 0 HA ARG A 247 -3.903 -14.447 2.475 1.00 0.00 H new ATOM 0 HB2 ARG A 247 -5.740 -16.022 1.543 1.00 0.00 H new ATOM 0 HB3 ARG A 247 -6.695 -14.568 1.327 1.00 0.00 H new ATOM 0 HG2 ARG A 247 -5.162 -13.654 -0.250 1.00 0.00 H new ATOM 0 HG3 ARG A 247 -3.897 -14.782 0.195 1.00 0.00 H new ATOM 0 HD2 ARG A 247 -6.526 -15.542 -1.140 1.00 0.00 H new ATOM 0 HD3 ARG A 247 -4.993 -15.362 -1.970 1.00 0.00 H new ATOM 0 HE ARG A 247 -4.828 -17.248 0.248 1.00 0.00 H new ATOM 0 HH11 ARG A 247 -5.778 -16.833 -3.132 1.00 0.00 H new ATOM 0 HH12 ARG A 247 -5.568 -18.544 -3.519 1.00 0.00 H new ATOM 0 HH21 ARG A 247 -4.561 -19.437 -0.262 1.00 0.00 H new ATOM 0 HH22 ARG A 247 -4.883 -20.011 -1.901 1.00 0.00 H new ATOM 99 N TRP A 248 -4.694 -12.100 1.695 1.00 0.00 N ATOM 100 CA TRP A 248 -4.849 -10.662 1.690 1.00 0.00 C ATOM 101 C TRP A 248 -4.656 -10.016 0.327 1.00 0.00 C ATOM 102 O TRP A 248 -4.208 -10.639 -0.631 1.00 0.00 O ATOM 103 CB TRP A 248 -3.833 -10.083 2.650 1.00 0.00 C ATOM 104 CG TRP A 248 -4.284 -10.046 4.064 1.00 0.00 C ATOM 105 CD1 TRP A 248 -3.894 -10.881 5.064 1.00 0.00 C ATOM 106 CD2 TRP A 248 -5.214 -9.131 4.630 1.00 0.00 C ATOM 107 NE1 TRP A 248 -4.486 -10.498 6.247 1.00 0.00 N ATOM 108 CE2 TRP A 248 -5.312 -9.422 5.999 1.00 0.00 C ATOM 109 CE3 TRP A 248 -5.960 -8.079 4.107 1.00 0.00 C ATOM 110 CZ2 TRP A 248 -6.134 -8.680 6.850 1.00 0.00 C ATOM 111 CZ3 TRP A 248 -6.779 -7.359 4.947 1.00 0.00 C ATOM 112 CH2 TRP A 248 -6.856 -7.658 6.307 1.00 0.00 C ATOM 0 H TRP A 248 -4.133 -12.477 0.931 1.00 0.00 H new ATOM 0 HA TRP A 248 -5.877 -10.450 1.983 1.00 0.00 H new ATOM 0 HB2 TRP A 248 -2.916 -10.669 2.588 1.00 0.00 H new ATOM 0 HB3 TRP A 248 -3.586 -9.070 2.333 1.00 0.00 H new ATOM 0 HD1 TRP A 248 -3.222 -11.718 4.948 1.00 0.00 H new ATOM 0 HE1 TRP A 248 -4.338 -10.937 7.156 1.00 0.00 H new ATOM 0 HE3 TRP A 248 -5.897 -7.831 3.058 1.00 0.00 H new ATOM 0 HZ2 TRP A 248 -6.196 -8.908 7.904 1.00 0.00 H new ATOM 0 HZ3 TRP A 248 -7.371 -6.550 4.546 1.00 0.00 H new ATOM 0 HH2 TRP A 248 -7.500 -7.069 6.943 1.00 0.00 H new ATOM 123 N MET A 249 -4.983 -8.728 0.305 1.00 0.00 N ATOM 124 CA MET A 249 -4.858 -7.862 -0.863 1.00 0.00 C ATOM 125 C MET A 249 -4.935 -6.419 -0.375 1.00 0.00 C ATOM 126 O MET A 249 -5.992 -5.792 -0.415 1.00 0.00 O ATOM 127 CB MET A 249 -5.964 -8.102 -1.877 1.00 0.00 C ATOM 128 CG MET A 249 -6.440 -9.544 -1.968 1.00 0.00 C ATOM 129 SD MET A 249 -7.746 -9.767 -3.191 1.00 0.00 S ATOM 130 CE MET A 249 -8.890 -8.478 -2.703 1.00 0.00 C ATOM 0 H MET A 249 -5.353 -8.244 1.123 1.00 0.00 H new ATOM 0 HA MET A 249 -3.911 -8.075 -1.359 1.00 0.00 H new ATOM 0 HB2 MET A 249 -6.814 -7.468 -1.624 1.00 0.00 H new ATOM 0 HB3 MET A 249 -5.612 -7.787 -2.859 1.00 0.00 H new ATOM 0 HG2 MET A 249 -5.596 -10.186 -2.222 1.00 0.00 H new ATOM 0 HG3 MET A 249 -6.803 -9.865 -0.992 1.00 0.00 H new ATOM 0 HE1 MET A 249 -9.874 -8.688 -3.121 1.00 0.00 H new ATOM 0 HE2 MET A 249 -8.957 -8.444 -1.616 1.00 0.00 H new ATOM 0 HE3 MET A 249 -8.535 -7.517 -3.075 1.00 0.00 H new ATOM 140 N VAL A 250 -3.826 -5.929 0.135 1.00 0.00 N ATOM 141 CA VAL A 250 -3.764 -4.583 0.706 1.00 0.00 C ATOM 142 C VAL A 250 -4.132 -3.494 -0.280 1.00 0.00 C ATOM 143 O VAL A 250 -3.980 -3.645 -1.493 1.00 0.00 O ATOM 144 CB VAL A 250 -2.380 -4.261 1.284 1.00 0.00 C ATOM 145 CG1 VAL A 250 -1.331 -4.173 0.194 1.00 0.00 C ATOM 146 CG2 VAL A 250 -2.441 -2.961 2.069 1.00 0.00 C ATOM 0 H VAL A 250 -2.944 -6.440 0.170 1.00 0.00 H new ATOM 0 HA VAL A 250 -4.506 -4.594 1.505 1.00 0.00 H new ATOM 0 HB VAL A 250 -2.092 -5.072 1.952 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -0.363 -3.944 0.639 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -1.272 -5.126 -0.332 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -1.603 -3.386 -0.510 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -1.456 -2.736 2.478 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -2.753 -2.152 1.409 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -3.158 -3.061 2.884 1.00 0.00 H new ATOM 156 N GLN A 251 -4.598 -2.380 0.270 1.00 0.00 N ATOM 157 CA GLN A 251 -4.973 -1.233 -0.527 1.00 0.00 C ATOM 158 C GLN A 251 -5.048 -0.004 0.372 1.00 0.00 C ATOM 159 O GLN A 251 -5.947 0.110 1.203 1.00 0.00 O ATOM 160 CB GLN A 251 -6.316 -1.483 -1.200 1.00 0.00 C ATOM 161 CG GLN A 251 -6.710 -0.411 -2.203 1.00 0.00 C ATOM 162 CD GLN A 251 -7.877 0.434 -1.728 1.00 0.00 C ATOM 163 OE1 GLN A 251 -7.758 1.193 -0.767 1.00 0.00 O ATOM 164 NE2 GLN A 251 -9.014 0.304 -2.402 1.00 0.00 N ATOM 0 H GLN A 251 -4.724 -2.252 1.274 1.00 0.00 H new ATOM 0 HA GLN A 251 -4.227 -1.065 -1.303 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -6.283 -2.447 -1.707 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -7.088 -1.552 -0.434 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -5.853 0.235 -2.394 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -6.970 -0.883 -3.150 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -9.067 -0.338 -3.193 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -9.834 0.846 -2.129 1.00 0.00 H new ATOM 173 N CYS A 252 -4.084 0.894 0.228 1.00 0.00 N ATOM 174 CA CYS A 252 -4.033 2.092 1.061 1.00 0.00 C ATOM 175 C CYS A 252 -4.876 3.221 0.501 1.00 0.00 C ATOM 176 O CYS A 252 -4.676 4.384 0.850 1.00 0.00 O ATOM 177 CB CYS A 252 -2.583 2.562 1.218 1.00 0.00 C ATOM 178 SG CYS A 252 -1.393 1.214 1.359 1.00 0.00 S ATOM 0 H CYS A 252 -3.329 0.819 -0.454 1.00 0.00 H new ATOM 0 HA CYS A 252 -4.446 1.824 2.034 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -2.317 3.181 0.361 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -2.509 3.194 2.103 1.00 0.00 H new ATOM 0 HG CYS A 252 -2.027 0.090 1.513 1.00 0.00 H new ATOM 184 N GLY A 253 -5.812 2.885 -0.361 1.00 0.00 N ATOM 185 CA GLY A 253 -6.648 3.905 -0.950 1.00 0.00 C ATOM 186 C GLY A 253 -5.833 4.835 -1.813 1.00 0.00 C ATOM 187 O GLY A 253 -4.645 4.606 -2.008 1.00 0.00 O ATOM 0 H GLY A 253 -6.010 1.931 -0.664 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -7.431 3.439 -1.549 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -7.144 4.473 -0.163 1.00 0.00 H new ATOM 191 N SER A 254 -6.452 5.886 -2.323 1.00 0.00 N ATOM 192 CA SER A 254 -5.741 6.843 -3.159 1.00 0.00 C ATOM 193 C SER A 254 -5.498 8.137 -2.392 1.00 0.00 C ATOM 194 O SER A 254 -6.433 8.747 -1.874 1.00 0.00 O ATOM 195 CB SER A 254 -6.523 7.108 -4.439 1.00 0.00 C ATOM 196 OG SER A 254 -7.904 6.849 -4.250 1.00 0.00 O ATOM 0 H SER A 254 -7.439 6.099 -2.175 1.00 0.00 H new ATOM 0 HA SER A 254 -4.773 6.422 -3.432 1.00 0.00 H new ATOM 0 HB2 SER A 254 -6.382 8.144 -4.748 1.00 0.00 H new ATOM 0 HB3 SER A 254 -6.138 6.480 -5.242 1.00 0.00 H new ATOM 0 HG SER A 254 -8.355 6.826 -5.120 1.00 0.00 H new ATOM 202 N PHE A 255 -4.230 8.526 -2.282 1.00 0.00 N ATOM 203 CA PHE A 255 -3.861 9.722 -1.526 1.00 0.00 C ATOM 204 C PHE A 255 -3.529 10.921 -2.413 1.00 0.00 C ATOM 205 O PHE A 255 -3.025 10.775 -3.527 1.00 0.00 O ATOM 206 CB PHE A 255 -2.660 9.405 -0.612 1.00 0.00 C ATOM 207 CG PHE A 255 -2.174 7.983 -0.745 1.00 0.00 C ATOM 208 CD1 PHE A 255 -3.034 6.933 -0.467 1.00 0.00 C ATOM 209 CD2 PHE A 255 -0.882 7.690 -1.177 1.00 0.00 C ATOM 210 CE1 PHE A 255 -2.624 5.627 -0.610 1.00 0.00 C ATOM 211 CE2 PHE A 255 -0.475 6.384 -1.324 1.00 0.00 C ATOM 212 CZ PHE A 255 -1.345 5.350 -1.041 1.00 0.00 C ATOM 0 H PHE A 255 -3.443 8.033 -2.705 1.00 0.00 H new ATOM 0 HA PHE A 255 -4.733 10.002 -0.934 1.00 0.00 H new ATOM 0 HB2 PHE A 255 -1.842 10.086 -0.848 1.00 0.00 H new ATOM 0 HB3 PHE A 255 -2.941 9.591 0.425 1.00 0.00 H new ATOM 0 HD1 PHE A 255 -4.040 7.142 -0.134 1.00 0.00 H new ATOM 0 HD2 PHE A 255 -0.195 8.494 -1.398 1.00 0.00 H new ATOM 0 HE1 PHE A 255 -3.305 4.819 -0.384 1.00 0.00 H new ATOM 0 HE2 PHE A 255 0.528 6.167 -1.662 1.00 0.00 H new ATOM 0 HZ PHE A 255 -1.023 4.326 -1.157 1.00 0.00 H new ATOM 222 N ARG A 256 -3.799 12.115 -1.875 1.00 0.00 N ATOM 223 CA ARG A 256 -3.518 13.371 -2.570 1.00 0.00 C ATOM 224 C ARG A 256 -2.022 13.556 -2.742 1.00 0.00 C ATOM 225 O ARG A 256 -1.572 14.303 -3.608 1.00 0.00 O ATOM 226 CB ARG A 256 -4.081 14.556 -1.782 1.00 0.00 C ATOM 227 CG ARG A 256 -3.638 14.592 -0.327 1.00 0.00 C ATOM 228 CD ARG A 256 -4.759 15.061 0.587 1.00 0.00 C ATOM 229 NE ARG A 256 -5.026 14.109 1.662 1.00 0.00 N ATOM 230 CZ ARG A 256 -6.153 14.085 2.369 1.00 0.00 C ATOM 231 NH1 ARG A 256 -7.122 14.957 2.118 1.00 0.00 N ATOM 232 NH2 ARG A 256 -6.314 13.185 3.331 1.00 0.00 N ATOM 0 H ARG A 256 -4.216 12.236 -0.952 1.00 0.00 H new ATOM 0 HA ARG A 256 -3.994 13.329 -3.550 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -3.775 15.482 -2.268 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -5.170 14.521 -1.820 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -3.310 13.599 -0.021 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -2.781 15.257 -0.223 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -4.496 16.028 1.016 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -5.666 15.209 0.001 1.00 0.00 H new ATOM 0 HE ARG A 256 -4.306 13.422 1.884 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -7.005 15.651 1.379 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -7.983 14.933 2.664 1.00 0.00 H new ATOM 0 HH21 ARG A 256 -5.574 12.512 3.528 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -7.178 13.167 3.873 1.00 0.00 H new ATOM 246 N GLY A 257 -1.268 12.863 -1.903 1.00 0.00 N ATOM 247 CA GLY A 257 0.174 12.928 -1.946 1.00 0.00 C ATOM 248 C GLY A 257 0.722 12.339 -3.228 1.00 0.00 C ATOM 249 O GLY A 257 1.493 11.394 -3.193 1.00 0.00 O ATOM 0 H GLY A 257 -1.640 12.246 -1.181 1.00 0.00 H new ATOM 0 HA2 GLY A 257 0.495 13.966 -1.856 1.00 0.00 H new ATOM 0 HA3 GLY A 257 0.588 12.391 -1.092 1.00 0.00 H new ATOM 253 N ALA A 258 0.306 12.898 -4.359 1.00 0.00 N ATOM 254 CA ALA A 258 0.740 12.426 -5.675 1.00 0.00 C ATOM 255 C ALA A 258 2.211 12.035 -5.671 1.00 0.00 C ATOM 256 O ALA A 258 2.601 11.032 -6.269 1.00 0.00 O ATOM 257 CB ALA A 258 0.478 13.492 -6.728 1.00 0.00 C ATOM 0 H ALA A 258 -0.339 13.688 -4.393 1.00 0.00 H new ATOM 0 HA ALA A 258 0.161 11.535 -5.918 1.00 0.00 H new ATOM 0 HB1 ALA A 258 0.805 13.129 -7.702 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -0.588 13.715 -6.763 1.00 0.00 H new ATOM 0 HB3 ALA A 258 1.029 14.397 -6.474 1.00 0.00 H new ATOM 263 N GLU A 259 3.018 12.823 -4.978 1.00 0.00 N ATOM 264 CA GLU A 259 4.444 12.545 -4.878 1.00 0.00 C ATOM 265 C GLU A 259 4.677 11.436 -3.863 1.00 0.00 C ATOM 266 O GLU A 259 5.448 10.507 -4.102 1.00 0.00 O ATOM 267 CB GLU A 259 5.216 13.804 -4.479 1.00 0.00 C ATOM 268 CG GLU A 259 4.760 15.055 -5.213 1.00 0.00 C ATOM 269 CD GLU A 259 5.919 15.929 -5.651 1.00 0.00 C ATOM 270 OE1 GLU A 259 6.845 16.140 -4.838 1.00 0.00 O ATOM 271 OE2 GLU A 259 5.902 16.404 -6.805 1.00 0.00 O ATOM 0 H GLU A 259 2.712 13.658 -4.478 1.00 0.00 H new ATOM 0 HA GLU A 259 4.809 12.222 -5.853 1.00 0.00 H new ATOM 0 HB2 GLU A 259 5.107 13.962 -3.406 1.00 0.00 H new ATOM 0 HB3 GLU A 259 6.277 13.646 -4.672 1.00 0.00 H new ATOM 0 HG2 GLU A 259 4.177 14.766 -6.087 1.00 0.00 H new ATOM 0 HG3 GLU A 259 4.100 15.631 -4.565 1.00 0.00 H new ATOM 278 N GLN A 260 3.979 11.529 -2.737 1.00 0.00 N ATOM 279 CA GLN A 260 4.078 10.524 -1.692 1.00 0.00 C ATOM 280 C GLN A 260 3.395 9.235 -2.144 1.00 0.00 C ATOM 281 O GLN A 260 3.710 8.154 -1.657 1.00 0.00 O ATOM 282 CB GLN A 260 3.440 11.034 -0.396 1.00 0.00 C ATOM 283 CG GLN A 260 4.383 11.013 0.795 1.00 0.00 C ATOM 284 CD GLN A 260 4.063 12.092 1.811 1.00 0.00 C ATOM 285 OE1 GLN A 260 3.882 11.811 2.996 1.00 0.00 O ATOM 286 NE2 GLN A 260 3.993 13.336 1.352 1.00 0.00 N ATOM 0 H GLN A 260 3.337 12.293 -2.527 1.00 0.00 H new ATOM 0 HA GLN A 260 5.132 10.320 -1.501 1.00 0.00 H new ATOM 0 HB2 GLN A 260 3.087 12.053 -0.551 1.00 0.00 H new ATOM 0 HB3 GLN A 260 2.565 10.425 -0.167 1.00 0.00 H new ATOM 0 HG2 GLN A 260 4.331 10.037 1.278 1.00 0.00 H new ATOM 0 HG3 GLN A 260 5.407 11.141 0.445 1.00 0.00 H new ATOM 0 HE21 GLN A 260 4.150 13.524 0.362 1.00 0.00 H new ATOM 0 HE22 GLN A 260 3.782 14.104 1.990 1.00 0.00 H new ATOM 295 N ALA A 261 2.466 9.370 -3.091 1.00 0.00 N ATOM 296 CA ALA A 261 1.732 8.239 -3.641 1.00 0.00 C ATOM 297 C ALA A 261 2.631 7.441 -4.574 1.00 0.00 C ATOM 298 O ALA A 261 2.773 6.227 -4.432 1.00 0.00 O ATOM 299 CB ALA A 261 0.494 8.727 -4.367 1.00 0.00 C ATOM 0 H ALA A 261 2.204 10.269 -3.496 1.00 0.00 H new ATOM 0 HA ALA A 261 1.415 7.586 -2.828 1.00 0.00 H new ATOM 0 HB1 ALA A 261 -0.048 7.874 -4.775 1.00 0.00 H new ATOM 0 HB2 ALA A 261 -0.148 9.266 -3.670 1.00 0.00 H new ATOM 0 HB3 ALA A 261 0.787 9.393 -5.179 1.00 0.00 H new ATOM 305 N GLU A 262 3.268 8.141 -5.511 1.00 0.00 N ATOM 306 CA GLU A 262 4.189 7.499 -6.439 1.00 0.00 C ATOM 307 C GLU A 262 5.362 6.956 -5.647 1.00 0.00 C ATOM 308 O GLU A 262 5.792 5.819 -5.843 1.00 0.00 O ATOM 309 CB GLU A 262 4.671 8.495 -7.496 1.00 0.00 C ATOM 310 CG GLU A 262 3.851 8.467 -8.776 1.00 0.00 C ATOM 311 CD GLU A 262 4.460 7.571 -9.837 1.00 0.00 C ATOM 312 OE1 GLU A 262 5.455 7.989 -10.468 1.00 0.00 O ATOM 313 OE2 GLU A 262 3.942 6.453 -10.039 1.00 0.00 O ATOM 0 H GLU A 262 3.163 9.147 -5.645 1.00 0.00 H new ATOM 0 HA GLU A 262 3.683 6.686 -6.959 1.00 0.00 H new ATOM 0 HB2 GLU A 262 4.640 9.501 -7.077 1.00 0.00 H new ATOM 0 HB3 GLU A 262 5.712 8.281 -7.737 1.00 0.00 H new ATOM 0 HG2 GLU A 262 2.842 8.122 -8.550 1.00 0.00 H new ATOM 0 HG3 GLU A 262 3.761 9.480 -9.168 1.00 0.00 H new ATOM 320 N THR A 263 5.841 7.767 -4.709 1.00 0.00 N ATOM 321 CA THR A 263 6.926 7.358 -3.838 1.00 0.00 C ATOM 322 C THR A 263 6.421 6.255 -2.918 1.00 0.00 C ATOM 323 O THR A 263 7.181 5.393 -2.483 1.00 0.00 O ATOM 324 CB THR A 263 7.437 8.542 -3.016 1.00 0.00 C ATOM 325 OG1 THR A 263 7.790 9.623 -3.861 1.00 0.00 O ATOM 326 CG2 THR A 263 8.647 8.206 -2.171 1.00 0.00 C ATOM 0 H THR A 263 5.492 8.710 -4.536 1.00 0.00 H new ATOM 0 HA THR A 263 7.756 6.989 -4.440 1.00 0.00 H new ATOM 0 HB THR A 263 6.614 8.811 -2.353 1.00 0.00 H new ATOM 0 HG1 THR A 263 7.048 10.262 -3.902 1.00 0.00 H new ATOM 0 HG21 THR A 263 8.958 9.089 -1.614 1.00 0.00 H new ATOM 0 HG22 THR A 263 8.393 7.408 -1.474 1.00 0.00 H new ATOM 0 HG23 THR A 263 9.462 7.879 -2.817 1.00 0.00 H new ATOM 334 N VAL A 264 5.112 6.282 -2.651 1.00 0.00 N ATOM 335 CA VAL A 264 4.478 5.279 -1.809 1.00 0.00 C ATOM 336 C VAL A 264 4.667 3.899 -2.432 1.00 0.00 C ATOM 337 O VAL A 264 5.115 2.959 -1.775 1.00 0.00 O ATOM 338 CB VAL A 264 2.961 5.574 -1.617 1.00 0.00 C ATOM 339 CG1 VAL A 264 2.104 4.381 -2.034 1.00 0.00 C ATOM 340 CG2 VAL A 264 2.681 5.975 -0.176 1.00 0.00 C ATOM 0 H VAL A 264 4.474 6.992 -3.010 1.00 0.00 H new ATOM 0 HA VAL A 264 4.949 5.308 -0.827 1.00 0.00 H new ATOM 0 HB VAL A 264 2.691 6.407 -2.266 1.00 0.00 H new ATOM 0 HG11 VAL A 264 1.051 4.621 -1.887 1.00 0.00 H new ATOM 0 HG12 VAL A 264 2.282 4.155 -3.085 1.00 0.00 H new ATOM 0 HG13 VAL A 264 2.367 3.514 -1.427 1.00 0.00 H new ATOM 0 HG21 VAL A 264 1.617 6.179 -0.055 1.00 0.00 H new ATOM 0 HG22 VAL A 264 2.973 5.164 0.491 1.00 0.00 H new ATOM 0 HG23 VAL A 264 3.252 6.870 0.070 1.00 0.00 H new ATOM 350 N ARG A 265 4.323 3.797 -3.712 1.00 0.00 N ATOM 351 CA ARG A 265 4.452 2.549 -4.452 1.00 0.00 C ATOM 352 C ARG A 265 5.877 2.021 -4.352 1.00 0.00 C ATOM 353 O ARG A 265 6.103 0.901 -3.895 1.00 0.00 O ATOM 354 CB ARG A 265 4.051 2.779 -5.918 1.00 0.00 C ATOM 355 CG ARG A 265 4.620 1.756 -6.892 1.00 0.00 C ATOM 356 CD ARG A 265 4.072 0.365 -6.621 1.00 0.00 C ATOM 357 NE ARG A 265 4.404 -0.574 -7.691 1.00 0.00 N ATOM 358 CZ ARG A 265 5.586 -1.173 -7.812 1.00 0.00 C ATOM 359 NH1 ARG A 265 6.552 -0.934 -6.933 1.00 0.00 N ATOM 360 NH2 ARG A 265 5.804 -2.012 -8.814 1.00 0.00 N ATOM 0 H ARG A 265 3.950 4.571 -4.261 1.00 0.00 H new ATOM 0 HA ARG A 265 3.787 1.801 -4.021 1.00 0.00 H new ATOM 0 HB2 ARG A 265 2.964 2.767 -5.991 1.00 0.00 H new ATOM 0 HB3 ARG A 265 4.380 3.773 -6.221 1.00 0.00 H new ATOM 0 HG2 ARG A 265 4.379 2.051 -7.913 1.00 0.00 H new ATOM 0 HG3 ARG A 265 5.707 1.742 -6.813 1.00 0.00 H new ATOM 0 HD2 ARG A 265 4.473 -0.005 -5.677 1.00 0.00 H new ATOM 0 HD3 ARG A 265 2.989 0.418 -6.508 1.00 0.00 H new ATOM 0 HE ARG A 265 3.687 -0.782 -8.386 1.00 0.00 H new ATOM 0 HH11 ARG A 265 6.390 -0.288 -6.160 1.00 0.00 H new ATOM 0 HH12 ARG A 265 7.456 -1.396 -7.031 1.00 0.00 H new ATOM 0 HH21 ARG A 265 5.066 -2.199 -9.493 1.00 0.00 H new ATOM 0 HH22 ARG A 265 6.710 -2.471 -8.907 1.00 0.00 H new ATOM 374 N ALA A 266 6.836 2.841 -4.763 1.00 0.00 N ATOM 375 CA ALA A 266 8.235 2.454 -4.695 1.00 0.00 C ATOM 376 C ALA A 266 8.635 2.217 -3.246 1.00 0.00 C ATOM 377 O ALA A 266 9.421 1.320 -2.946 1.00 0.00 O ATOM 378 CB ALA A 266 9.115 3.522 -5.327 1.00 0.00 C ATOM 0 H ALA A 266 6.670 3.772 -5.144 1.00 0.00 H new ATOM 0 HA ALA A 266 8.373 1.528 -5.253 1.00 0.00 H new ATOM 0 HB1 ALA A 266 10.159 3.215 -5.267 1.00 0.00 H new ATOM 0 HB2 ALA A 266 8.835 3.653 -6.372 1.00 0.00 H new ATOM 0 HB3 ALA A 266 8.982 4.464 -4.795 1.00 0.00 H new ATOM 384 N GLN A 267 8.074 3.024 -2.349 1.00 0.00 N ATOM 385 CA GLN A 267 8.358 2.906 -0.926 1.00 0.00 C ATOM 386 C GLN A 267 7.939 1.536 -0.404 1.00 0.00 C ATOM 387 O GLN A 267 8.617 0.952 0.437 1.00 0.00 O ATOM 388 CB GLN A 267 7.641 4.010 -0.143 1.00 0.00 C ATOM 389 CG GLN A 267 8.446 5.295 -0.027 1.00 0.00 C ATOM 390 CD GLN A 267 7.629 6.450 0.519 1.00 0.00 C ATOM 391 OE1 GLN A 267 6.415 6.509 0.332 1.00 0.00 O ATOM 392 NE2 GLN A 267 8.295 7.376 1.200 1.00 0.00 N ATOM 0 H GLN A 267 7.418 3.768 -2.586 1.00 0.00 H new ATOM 0 HA GLN A 267 9.433 3.017 -0.784 1.00 0.00 H new ATOM 0 HB2 GLN A 267 6.690 4.229 -0.629 1.00 0.00 H new ATOM 0 HB3 GLN A 267 7.411 3.644 0.857 1.00 0.00 H new ATOM 0 HG2 GLN A 267 9.305 5.124 0.622 1.00 0.00 H new ATOM 0 HG3 GLN A 267 8.837 5.564 -1.008 1.00 0.00 H new ATOM 0 HE21 GLN A 267 9.303 7.287 1.331 1.00 0.00 H new ATOM 0 HE22 GLN A 267 7.799 8.176 1.592 1.00 0.00 H new ATOM 401 N LEU A 268 6.826 1.018 -0.918 1.00 0.00 N ATOM 402 CA LEU A 268 6.339 -0.295 -0.507 1.00 0.00 C ATOM 403 C LEU A 268 7.371 -1.359 -0.848 1.00 0.00 C ATOM 404 O LEU A 268 7.679 -2.222 -0.030 1.00 0.00 O ATOM 405 CB LEU A 268 4.992 -0.614 -1.188 1.00 0.00 C ATOM 406 CG LEU A 268 3.717 -0.030 -0.534 1.00 0.00 C ATOM 407 CD1 LEU A 268 2.863 -1.120 0.118 1.00 0.00 C ATOM 408 CD2 LEU A 268 4.048 1.056 0.479 1.00 0.00 C ATOM 0 H LEU A 268 6.247 1.485 -1.616 1.00 0.00 H new ATOM 0 HA LEU A 268 6.181 -0.287 0.571 1.00 0.00 H new ATOM 0 HB2 LEU A 268 5.039 -0.256 -2.216 1.00 0.00 H new ATOM 0 HB3 LEU A 268 4.884 -1.698 -1.233 1.00 0.00 H new ATOM 0 HG LEU A 268 3.136 0.422 -1.338 1.00 0.00 H new ATOM 0 HD11 LEU A 268 1.977 -0.669 0.566 1.00 0.00 H new ATOM 0 HD12 LEU A 268 2.559 -1.844 -0.637 1.00 0.00 H new ATOM 0 HD13 LEU A 268 3.444 -1.624 0.891 1.00 0.00 H new ATOM 0 HD21 LEU A 268 3.126 1.440 0.915 1.00 0.00 H new ATOM 0 HD22 LEU A 268 4.676 0.640 1.267 1.00 0.00 H new ATOM 0 HD23 LEU A 268 4.580 1.867 -0.018 1.00 0.00 H new ATOM 420 N ALA A 269 7.911 -1.281 -2.055 1.00 0.00 N ATOM 421 CA ALA A 269 8.920 -2.232 -2.500 1.00 0.00 C ATOM 422 C ALA A 269 10.292 -1.884 -1.936 1.00 0.00 C ATOM 423 O ALA A 269 11.139 -2.760 -1.760 1.00 0.00 O ATOM 424 CB ALA A 269 8.967 -2.276 -4.021 1.00 0.00 C ATOM 0 H ALA A 269 7.668 -0.569 -2.744 1.00 0.00 H new ATOM 0 HA ALA A 269 8.644 -3.218 -2.126 1.00 0.00 H new ATOM 0 HB1 ALA A 269 9.725 -2.991 -4.341 1.00 0.00 H new ATOM 0 HB2 ALA A 269 7.994 -2.582 -4.406 1.00 0.00 H new ATOM 0 HB3 ALA A 269 9.215 -1.287 -4.406 1.00 0.00 H new ATOM 430 N PHE A 270 10.509 -0.604 -1.654 1.00 0.00 N ATOM 431 CA PHE A 270 11.782 -0.156 -1.109 1.00 0.00 C ATOM 432 C PHE A 270 11.827 -0.352 0.403 1.00 0.00 C ATOM 433 O PHE A 270 12.904 -0.487 0.985 1.00 0.00 O ATOM 434 CB PHE A 270 12.035 1.315 -1.453 1.00 0.00 C ATOM 435 CG PHE A 270 13.464 1.618 -1.816 1.00 0.00 C ATOM 436 CD1 PHE A 270 14.503 0.853 -1.309 1.00 0.00 C ATOM 437 CD2 PHE A 270 13.764 2.671 -2.665 1.00 0.00 C ATOM 438 CE1 PHE A 270 15.816 1.134 -1.644 1.00 0.00 C ATOM 439 CE2 PHE A 270 15.074 2.955 -3.002 1.00 0.00 C ATOM 440 CZ PHE A 270 16.100 2.186 -2.491 1.00 0.00 C ATOM 0 H PHE A 270 9.822 0.137 -1.793 1.00 0.00 H new ATOM 0 HA PHE A 270 12.567 -0.761 -1.562 1.00 0.00 H new ATOM 0 HB2 PHE A 270 11.391 1.600 -2.285 1.00 0.00 H new ATOM 0 HB3 PHE A 270 11.748 1.932 -0.602 1.00 0.00 H new ATOM 0 HD1 PHE A 270 14.285 0.029 -0.646 1.00 0.00 H new ATOM 0 HD2 PHE A 270 12.966 3.276 -3.068 1.00 0.00 H new ATOM 0 HE1 PHE A 270 16.617 0.531 -1.243 1.00 0.00 H new ATOM 0 HE2 PHE A 270 15.295 3.778 -3.665 1.00 0.00 H new ATOM 0 HZ PHE A 270 17.124 2.407 -2.754 1.00 0.00 H new ATOM 450 N GLU A 271 10.658 -0.369 1.042 1.00 0.00 N ATOM 451 CA GLU A 271 10.601 -0.551 2.485 1.00 0.00 C ATOM 452 C GLU A 271 10.655 -2.032 2.853 1.00 0.00 C ATOM 453 O GLU A 271 10.921 -2.381 4.005 1.00 0.00 O ATOM 454 CB GLU A 271 9.338 0.092 3.060 1.00 0.00 C ATOM 455 CG GLU A 271 9.454 1.595 3.279 1.00 0.00 C ATOM 456 CD GLU A 271 10.250 2.294 2.191 1.00 0.00 C ATOM 457 OE1 GLU A 271 11.460 2.012 2.066 1.00 0.00 O ATOM 458 OE2 GLU A 271 9.663 3.123 1.467 1.00 0.00 O ATOM 0 H GLU A 271 9.751 -0.260 0.588 1.00 0.00 H new ATOM 0 HA GLU A 271 11.472 -0.059 2.919 1.00 0.00 H new ATOM 0 HB2 GLU A 271 8.504 -0.104 2.386 1.00 0.00 H new ATOM 0 HB3 GLU A 271 9.099 -0.386 4.010 1.00 0.00 H new ATOM 0 HG2 GLU A 271 8.455 2.028 3.325 1.00 0.00 H new ATOM 0 HG3 GLU A 271 9.927 1.781 4.243 1.00 0.00 H new ATOM 465 N GLY A 272 10.416 -2.902 1.874 1.00 0.00 N ATOM 466 CA GLY A 272 10.462 -4.330 2.134 1.00 0.00 C ATOM 467 C GLY A 272 9.169 -5.047 1.793 1.00 0.00 C ATOM 468 O GLY A 272 8.973 -6.194 2.195 1.00 0.00 O ATOM 0 H GLY A 272 10.193 -2.645 0.912 1.00 0.00 H new ATOM 0 HA2 GLY A 272 11.276 -4.771 1.558 1.00 0.00 H new ATOM 0 HA3 GLY A 272 10.692 -4.493 3.187 1.00 0.00 H new ATOM 472 N PHE A 273 8.288 -4.386 1.049 1.00 0.00 N ATOM 473 CA PHE A 273 7.022 -5.001 0.666 1.00 0.00 C ATOM 474 C PHE A 273 6.620 -4.628 -0.761 1.00 0.00 C ATOM 475 O PHE A 273 5.941 -3.629 -0.988 1.00 0.00 O ATOM 476 CB PHE A 273 5.907 -4.630 1.647 1.00 0.00 C ATOM 477 CG PHE A 273 5.994 -3.252 2.264 1.00 0.00 C ATOM 478 CD1 PHE A 273 6.991 -2.922 3.176 1.00 0.00 C ATOM 479 CD2 PHE A 273 5.036 -2.298 1.963 1.00 0.00 C ATOM 480 CE1 PHE A 273 7.017 -1.664 3.769 1.00 0.00 C ATOM 481 CE2 PHE A 273 5.068 -1.050 2.548 1.00 0.00 C ATOM 482 CZ PHE A 273 6.051 -0.735 3.451 1.00 0.00 C ATOM 0 H PHE A 273 8.424 -3.436 0.703 1.00 0.00 H new ATOM 0 HA PHE A 273 7.169 -6.080 0.702 1.00 0.00 H new ATOM 0 HB2 PHE A 273 4.952 -4.714 1.128 1.00 0.00 H new ATOM 0 HB3 PHE A 273 5.899 -5.366 2.451 1.00 0.00 H new ATOM 0 HD1 PHE A 273 7.751 -3.648 3.426 1.00 0.00 H new ATOM 0 HD2 PHE A 273 4.252 -2.535 1.259 1.00 0.00 H new ATOM 0 HE1 PHE A 273 7.793 -1.416 4.478 1.00 0.00 H new ATOM 0 HE2 PHE A 273 4.316 -0.318 2.294 1.00 0.00 H new ATOM 0 HZ PHE A 273 6.068 0.241 3.913 1.00 0.00 H new ATOM 492 N ASP A 274 7.048 -5.448 -1.720 1.00 0.00 N ATOM 493 CA ASP A 274 6.747 -5.219 -3.133 1.00 0.00 C ATOM 494 C ASP A 274 5.244 -5.083 -3.379 1.00 0.00 C ATOM 495 O ASP A 274 4.532 -6.077 -3.498 1.00 0.00 O ATOM 496 CB ASP A 274 7.308 -6.361 -3.983 1.00 0.00 C ATOM 497 CG ASP A 274 6.761 -7.714 -3.567 1.00 0.00 C ATOM 498 OD1 ASP A 274 6.271 -7.830 -2.424 1.00 0.00 O ATOM 499 OD2 ASP A 274 6.823 -8.655 -4.386 1.00 0.00 O ATOM 0 H ASP A 274 7.608 -6.282 -1.543 1.00 0.00 H new ATOM 0 HA ASP A 274 7.220 -4.280 -3.421 1.00 0.00 H new ATOM 0 HB2 ASP A 274 7.068 -6.182 -5.031 1.00 0.00 H new ATOM 0 HB3 ASP A 274 8.395 -6.371 -3.902 1.00 0.00 H new ATOM 504 N SER A 275 4.783 -3.840 -3.469 1.00 0.00 N ATOM 505 CA SER A 275 3.371 -3.535 -3.713 1.00 0.00 C ATOM 506 C SER A 275 3.157 -3.091 -5.154 1.00 0.00 C ATOM 507 O SER A 275 4.108 -2.829 -5.892 1.00 0.00 O ATOM 508 CB SER A 275 2.925 -2.406 -2.786 1.00 0.00 C ATOM 509 OG SER A 275 3.302 -1.138 -3.296 1.00 0.00 O ATOM 0 H SER A 275 5.374 -3.014 -3.375 1.00 0.00 H new ATOM 0 HA SER A 275 2.789 -4.437 -3.524 1.00 0.00 H new ATOM 0 HB2 SER A 275 1.843 -2.442 -2.661 1.00 0.00 H new ATOM 0 HB3 SER A 275 3.365 -2.548 -1.799 1.00 0.00 H new ATOM 0 HG SER A 275 4.174 -1.209 -3.738 1.00 0.00 H new ATOM 515 N LYS A 276 1.896 -2.980 -5.527 1.00 0.00 N ATOM 516 CA LYS A 276 1.511 -2.532 -6.864 1.00 0.00 C ATOM 517 C LYS A 276 0.811 -1.176 -6.775 1.00 0.00 C ATOM 518 O LYS A 276 0.133 -0.886 -5.791 1.00 0.00 O ATOM 519 CB LYS A 276 0.590 -3.554 -7.534 1.00 0.00 C ATOM 520 CG LYS A 276 0.302 -3.248 -8.995 1.00 0.00 C ATOM 521 CD LYS A 276 1.414 -3.756 -9.900 1.00 0.00 C ATOM 522 CE LYS A 276 1.052 -3.595 -11.368 1.00 0.00 C ATOM 523 NZ LYS A 276 1.664 -2.374 -11.962 1.00 0.00 N ATOM 0 H LYS A 276 1.107 -3.196 -4.918 1.00 0.00 H new ATOM 0 HA LYS A 276 2.412 -2.433 -7.469 1.00 0.00 H new ATOM 0 HB2 LYS A 276 1.044 -4.542 -7.461 1.00 0.00 H new ATOM 0 HB3 LYS A 276 -0.352 -3.595 -6.987 1.00 0.00 H new ATOM 0 HG2 LYS A 276 -0.643 -3.708 -9.285 1.00 0.00 H new ATOM 0 HG3 LYS A 276 0.187 -2.172 -9.127 1.00 0.00 H new ATOM 0 HD2 LYS A 276 2.334 -3.211 -9.689 1.00 0.00 H new ATOM 0 HD3 LYS A 276 1.609 -4.807 -9.685 1.00 0.00 H new ATOM 0 HE2 LYS A 276 1.384 -4.473 -11.922 1.00 0.00 H new ATOM 0 HE3 LYS A 276 -0.032 -3.544 -11.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 1.393 -2.302 -12.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 1.328 -1.533 -11.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 2.700 -2.433 -11.888 1.00 0.00 H new ATOM 537 N ILE A 277 0.987 -0.339 -7.794 1.00 0.00 N ATOM 538 CA ILE A 277 0.377 0.990 -7.795 1.00 0.00 C ATOM 539 C ILE A 277 -0.841 1.069 -8.713 1.00 0.00 C ATOM 540 O ILE A 277 -0.994 0.271 -9.638 1.00 0.00 O ATOM 541 CB ILE A 277 1.394 2.074 -8.211 1.00 0.00 C ATOM 542 CG1 ILE A 277 0.830 3.469 -7.928 1.00 0.00 C ATOM 543 CG2 ILE A 277 1.764 1.932 -9.680 1.00 0.00 C ATOM 544 CD1 ILE A 277 1.892 4.500 -7.604 1.00 0.00 C ATOM 0 H ILE A 277 1.541 -0.553 -8.623 1.00 0.00 H new ATOM 0 HA ILE A 277 0.049 1.172 -6.772 1.00 0.00 H new ATOM 0 HB ILE A 277 2.300 1.941 -7.620 1.00 0.00 H new ATOM 0 HG12 ILE A 277 0.263 3.805 -8.796 1.00 0.00 H new ATOM 0 HG13 ILE A 277 0.130 3.406 -7.094 1.00 0.00 H new ATOM 0 HG21 ILE A 277 2.482 2.706 -9.951 1.00 0.00 H new ATOM 0 HG22 ILE A 277 2.207 0.951 -9.850 1.00 0.00 H new ATOM 0 HG23 ILE A 277 0.869 2.037 -10.293 1.00 0.00 H new ATOM 0 HD11 ILE A 277 1.418 5.463 -7.415 1.00 0.00 H new ATOM 0 HD12 ILE A 277 2.444 4.187 -6.718 1.00 0.00 H new ATOM 0 HD13 ILE A 277 2.578 4.592 -8.446 1.00 0.00 H new ATOM 556 N THR A 278 -1.699 2.050 -8.443 1.00 0.00 N ATOM 557 CA THR A 278 -2.910 2.264 -9.230 1.00 0.00 C ATOM 558 C THR A 278 -3.585 3.573 -8.821 1.00 0.00 C ATOM 559 O THR A 278 -3.510 3.982 -7.663 1.00 0.00 O ATOM 560 CB THR A 278 -3.879 1.094 -9.047 1.00 0.00 C ATOM 561 OG1 THR A 278 -3.623 0.419 -7.828 1.00 0.00 O ATOM 562 CG2 THR A 278 -3.802 0.074 -10.161 1.00 0.00 C ATOM 0 H THR A 278 -1.576 2.714 -7.679 1.00 0.00 H new ATOM 0 HA THR A 278 -2.631 2.326 -10.282 1.00 0.00 H new ATOM 0 HB THR A 278 -4.874 1.538 -9.052 1.00 0.00 H new ATOM 0 HG1 THR A 278 -4.253 -0.325 -7.727 1.00 0.00 H new ATOM 0 HG21 THR A 278 -4.514 -0.728 -9.969 1.00 0.00 H new ATOM 0 HG22 THR A 278 -4.042 0.553 -11.110 1.00 0.00 H new ATOM 0 HG23 THR A 278 -2.794 -0.339 -10.207 1.00 0.00 H new ATOM 570 N THR A 279 -4.238 4.230 -9.776 1.00 0.00 N ATOM 571 CA THR A 279 -4.918 5.495 -9.503 1.00 0.00 C ATOM 572 C THR A 279 -6.424 5.287 -9.377 1.00 0.00 C ATOM 573 O THR A 279 -6.989 4.386 -9.998 1.00 0.00 O ATOM 574 CB THR A 279 -4.623 6.505 -10.613 1.00 0.00 C ATOM 575 OG1 THR A 279 -4.370 5.843 -11.839 1.00 0.00 O ATOM 576 CG2 THR A 279 -3.434 7.391 -10.313 1.00 0.00 C ATOM 0 H THR A 279 -4.311 3.910 -10.742 1.00 0.00 H new ATOM 0 HA THR A 279 -4.543 5.884 -8.557 1.00 0.00 H new ATOM 0 HB THR A 279 -5.513 7.130 -10.680 1.00 0.00 H new ATOM 0 HG1 THR A 279 -4.185 6.506 -12.537 1.00 0.00 H new ATOM 0 HG21 THR A 279 -3.279 8.084 -11.140 1.00 0.00 H new ATOM 0 HG22 THR A 279 -3.621 7.953 -9.398 1.00 0.00 H new ATOM 0 HG23 THR A 279 -2.544 6.775 -10.185 1.00 0.00 H new ATOM 584 N ASN A 280 -7.074 6.125 -8.570 1.00 0.00 N ATOM 585 CA ASN A 280 -8.515 6.024 -8.368 1.00 0.00 C ATOM 586 C ASN A 280 -9.020 7.126 -7.442 1.00 0.00 C ATOM 587 O ASN A 280 -8.311 7.564 -6.537 1.00 0.00 O ATOM 588 CB ASN A 280 -8.875 4.656 -7.787 1.00 0.00 C ATOM 589 CG ASN A 280 -10.372 4.418 -7.755 1.00 0.00 C ATOM 590 OD1 ASN A 280 -10.983 4.097 -8.774 1.00 0.00 O ATOM 591 ND2 ASN A 280 -10.971 4.574 -6.579 1.00 0.00 N ATOM 0 H ASN A 280 -6.626 6.878 -8.048 1.00 0.00 H new ATOM 0 HA ASN A 280 -8.997 6.142 -9.338 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -8.398 3.875 -8.380 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -8.475 4.577 -6.776 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -11.977 4.427 -6.495 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -10.425 4.841 -5.760 1.00 0.00 H new ATOM 598 N ASN A 281 -10.255 7.564 -7.673 1.00 0.00 N ATOM 599 CA ASN A 281 -10.871 8.609 -6.858 1.00 0.00 C ATOM 600 C ASN A 281 -10.171 9.959 -7.024 1.00 0.00 C ATOM 601 O ASN A 281 -10.487 10.916 -6.319 1.00 0.00 O ATOM 602 CB ASN A 281 -10.862 8.203 -5.384 1.00 0.00 C ATOM 603 CG ASN A 281 -11.946 8.901 -4.585 1.00 0.00 C ATOM 604 OD1 ASN A 281 -12.325 10.032 -4.888 1.00 0.00 O ATOM 605 ND2 ASN A 281 -12.450 8.228 -3.557 1.00 0.00 N ATOM 0 H ASN A 281 -10.851 7.210 -8.421 1.00 0.00 H new ATOM 0 HA ASN A 281 -11.898 8.723 -7.204 1.00 0.00 H new ATOM 0 HB2 ASN A 281 -10.995 7.124 -5.306 1.00 0.00 H new ATOM 0 HB3 ASN A 281 -9.889 8.436 -4.952 1.00 0.00 H new ATOM 0 HD21 ASN A 281 -13.181 8.647 -2.983 1.00 0.00 H new ATOM 0 HD22 ASN A 281 -12.106 7.292 -3.342 1.00 0.00 H new ATOM 612 N GLY A 282 -9.228 10.038 -7.959 1.00 0.00 N ATOM 613 CA GLY A 282 -8.522 11.286 -8.188 1.00 0.00 C ATOM 614 C GLY A 282 -7.109 11.284 -7.632 1.00 0.00 C ATOM 615 O GLY A 282 -6.276 12.086 -8.050 1.00 0.00 O ATOM 0 H GLY A 282 -8.942 9.264 -8.559 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -8.484 11.483 -9.259 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -9.083 12.102 -7.733 1.00 0.00 H new ATOM 619 N TRP A 283 -6.833 10.384 -6.690 1.00 0.00 N ATOM 620 CA TRP A 283 -5.515 10.295 -6.091 1.00 0.00 C ATOM 621 C TRP A 283 -4.867 8.949 -6.396 1.00 0.00 C ATOM 622 O TRP A 283 -5.522 8.014 -6.859 1.00 0.00 O ATOM 623 CB TRP A 283 -5.572 10.512 -4.572 1.00 0.00 C ATOM 624 CG TRP A 283 -6.950 10.650 -3.973 1.00 0.00 C ATOM 625 CD1 TRP A 283 -8.009 9.812 -4.134 1.00 0.00 C ATOM 626 CD2 TRP A 283 -7.393 11.674 -3.078 1.00 0.00 C ATOM 627 NE1 TRP A 283 -9.090 10.264 -3.419 1.00 0.00 N ATOM 628 CE2 TRP A 283 -8.736 11.405 -2.758 1.00 0.00 C ATOM 629 CE3 TRP A 283 -6.784 12.795 -2.526 1.00 0.00 C ATOM 630 CZ2 TRP A 283 -9.476 12.220 -1.907 1.00 0.00 C ATOM 631 CZ3 TRP A 283 -7.514 13.602 -1.679 1.00 0.00 C ATOM 632 CH2 TRP A 283 -8.849 13.312 -1.374 1.00 0.00 C ATOM 0 H TRP A 283 -7.508 9.709 -6.330 1.00 0.00 H new ATOM 0 HA TRP A 283 -4.908 11.087 -6.529 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -5.069 9.676 -4.087 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -5.002 11.409 -4.332 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -8.001 8.917 -4.739 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -10.008 9.820 -3.387 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -5.755 13.030 -2.757 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -10.507 11.998 -1.676 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -7.047 14.473 -1.243 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -9.394 13.962 -0.706 1.00 0.00 H new ATOM 643 N ASN A 284 -3.573 8.867 -6.124 1.00 0.00 N ATOM 644 CA ASN A 284 -2.805 7.646 -6.354 1.00 0.00 C ATOM 645 C ASN A 284 -2.994 6.665 -5.200 1.00 0.00 C ATOM 646 O ASN A 284 -2.851 7.036 -4.035 1.00 0.00 O ATOM 647 CB ASN A 284 -1.322 7.981 -6.517 1.00 0.00 C ATOM 648 CG ASN A 284 -0.877 7.960 -7.966 1.00 0.00 C ATOM 649 OD1 ASN A 284 -0.975 6.938 -8.644 1.00 0.00 O ATOM 650 ND2 ASN A 284 -0.383 9.096 -8.446 1.00 0.00 N ATOM 0 H ASN A 284 -3.026 9.638 -5.740 1.00 0.00 H new ATOM 0 HA ASN A 284 -3.168 7.178 -7.269 1.00 0.00 H new ATOM 0 HB2 ASN A 284 -1.127 8.967 -6.095 1.00 0.00 H new ATOM 0 HB3 ASN A 284 -0.727 7.267 -5.947 1.00 0.00 H new ATOM 0 HD21 ASN A 284 -0.066 9.145 -9.414 1.00 0.00 H new ATOM 0 HD22 ASN A 284 -0.321 9.919 -7.846 1.00 0.00 H new ATOM 657 N ARG A 285 -3.323 5.418 -5.528 1.00 0.00 N ATOM 658 CA ARG A 285 -3.543 4.398 -4.507 1.00 0.00 C ATOM 659 C ARG A 285 -2.636 3.189 -4.701 1.00 0.00 C ATOM 660 O ARG A 285 -2.462 2.705 -5.819 1.00 0.00 O ATOM 661 CB ARG A 285 -5.003 3.937 -4.532 1.00 0.00 C ATOM 662 CG ARG A 285 -5.422 3.299 -5.846 1.00 0.00 C ATOM 663 CD ARG A 285 -6.679 2.458 -5.686 1.00 0.00 C ATOM 664 NE ARG A 285 -6.544 1.148 -6.318 1.00 0.00 N ATOM 665 CZ ARG A 285 -7.576 0.382 -6.665 1.00 0.00 C ATOM 666 NH1 ARG A 285 -8.820 0.788 -6.442 1.00 0.00 N ATOM 667 NH2 ARG A 285 -7.364 -0.795 -7.238 1.00 0.00 N ATOM 0 H ARG A 285 -3.442 5.091 -6.487 1.00 0.00 H new ATOM 0 HA ARG A 285 -3.306 4.850 -3.544 1.00 0.00 H new ATOM 0 HB2 ARG A 285 -5.163 3.222 -3.725 1.00 0.00 H new ATOM 0 HB3 ARG A 285 -5.648 4.793 -4.332 1.00 0.00 H new ATOM 0 HG2 ARG A 285 -5.597 4.077 -6.589 1.00 0.00 H new ATOM 0 HG3 ARG A 285 -4.612 2.675 -6.222 1.00 0.00 H new ATOM 0 HD2 ARG A 285 -6.896 2.329 -4.626 1.00 0.00 H new ATOM 0 HD3 ARG A 285 -7.527 2.986 -6.123 1.00 0.00 H new ATOM 0 HE ARG A 285 -5.604 0.800 -6.504 1.00 0.00 H new ATOM 0 HH11 ARG A 285 -8.990 1.692 -6.002 1.00 0.00 H new ATOM 0 HH12 ARG A 285 -9.606 0.196 -6.711 1.00 0.00 H new ATOM 0 HH21 ARG A 285 -6.411 -1.113 -7.413 1.00 0.00 H new ATOM 0 HH22 ARG A 285 -8.154 -1.382 -7.504 1.00 0.00 H new ATOM 681 N VAL A 286 -2.074 2.687 -3.601 1.00 0.00 N ATOM 682 CA VAL A 286 -1.214 1.518 -3.667 1.00 0.00 C ATOM 683 C VAL A 286 -1.938 0.277 -3.193 1.00 0.00 C ATOM 684 O VAL A 286 -2.819 0.329 -2.337 1.00 0.00 O ATOM 685 CB VAL A 286 0.079 1.676 -2.853 1.00 0.00 C ATOM 686 CG1 VAL A 286 -0.213 1.956 -1.385 1.00 0.00 C ATOM 687 CG2 VAL A 286 0.968 0.449 -2.999 1.00 0.00 C ATOM 0 H VAL A 286 -2.200 3.071 -2.665 1.00 0.00 H new ATOM 0 HA VAL A 286 -0.944 1.415 -4.718 1.00 0.00 H new ATOM 0 HB VAL A 286 0.613 2.537 -3.255 1.00 0.00 H new ATOM 0 HG11 VAL A 286 0.726 2.062 -0.841 1.00 0.00 H new ATOM 0 HG12 VAL A 286 -0.789 2.877 -1.298 1.00 0.00 H new ATOM 0 HG13 VAL A 286 -0.785 1.129 -0.964 1.00 0.00 H new ATOM 0 HG21 VAL A 286 1.877 0.586 -2.413 1.00 0.00 H new ATOM 0 HG22 VAL A 286 0.435 -0.431 -2.641 1.00 0.00 H new ATOM 0 HG23 VAL A 286 1.230 0.312 -4.048 1.00 0.00 H new ATOM 697 N VAL A 287 -1.521 -0.828 -3.764 1.00 0.00 N ATOM 698 CA VAL A 287 -2.068 -2.143 -3.454 1.00 0.00 C ATOM 699 C VAL A 287 -1.032 -3.204 -3.805 1.00 0.00 C ATOM 700 O VAL A 287 -0.368 -3.088 -4.828 1.00 0.00 O ATOM 701 CB VAL A 287 -3.338 -2.454 -4.275 1.00 0.00 C ATOM 702 CG1 VAL A 287 -4.516 -1.604 -3.828 1.00 0.00 C ATOM 703 CG2 VAL A 287 -3.069 -2.269 -5.761 1.00 0.00 C ATOM 0 H VAL A 287 -0.783 -0.848 -4.467 1.00 0.00 H new ATOM 0 HA VAL A 287 -2.321 -2.148 -2.394 1.00 0.00 H new ATOM 0 HB VAL A 287 -3.603 -3.496 -4.097 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -5.391 -1.851 -4.429 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -4.729 -1.801 -2.777 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -4.273 -0.549 -3.957 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -3.974 -2.492 -6.325 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -2.768 -1.239 -5.951 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -2.272 -2.943 -6.073 1.00 0.00 H new ATOM 713 N ILE A 288 -0.907 -4.246 -2.997 1.00 0.00 N ATOM 714 CA ILE A 288 0.052 -5.306 -3.303 1.00 0.00 C ATOM 715 C ILE A 288 -0.680 -6.537 -3.803 1.00 0.00 C ATOM 716 O ILE A 288 -1.812 -6.797 -3.393 1.00 0.00 O ATOM 717 CB ILE A 288 0.908 -5.726 -2.088 1.00 0.00 C ATOM 718 CG1 ILE A 288 1.356 -4.529 -1.251 1.00 0.00 C ATOM 719 CG2 ILE A 288 2.109 -6.536 -2.543 1.00 0.00 C ATOM 720 CD1 ILE A 288 1.594 -4.876 0.202 1.00 0.00 C ATOM 0 H ILE A 288 -1.444 -4.383 -2.141 1.00 0.00 H new ATOM 0 HA ILE A 288 0.718 -4.897 -4.063 1.00 0.00 H new ATOM 0 HB ILE A 288 0.279 -6.346 -1.449 1.00 0.00 H new ATOM 0 HG12 ILE A 288 2.273 -4.119 -1.675 1.00 0.00 H new ATOM 0 HG13 ILE A 288 0.599 -3.747 -1.312 1.00 0.00 H new ATOM 0 HG21 ILE A 288 2.703 -6.825 -1.676 1.00 0.00 H new ATOM 0 HG22 ILE A 288 1.768 -7.431 -3.064 1.00 0.00 H new ATOM 0 HG23 ILE A 288 2.719 -5.935 -3.217 1.00 0.00 H new ATOM 0 HD11 ILE A 288 1.910 -3.984 0.742 1.00 0.00 H new ATOM 0 HD12 ILE A 288 0.672 -5.258 0.640 1.00 0.00 H new ATOM 0 HD13 ILE A 288 2.372 -5.637 0.272 1.00 0.00 H new ATOM 732 N GLY A 289 -0.033 -7.309 -4.673 1.00 0.00 N ATOM 733 CA GLY A 289 -0.658 -8.517 -5.175 1.00 0.00 C ATOM 734 C GLY A 289 -1.234 -9.333 -4.036 1.00 0.00 C ATOM 735 O GLY A 289 -0.623 -9.405 -2.971 1.00 0.00 O ATOM 0 H GLY A 289 0.902 -7.121 -5.035 1.00 0.00 H new ATOM 0 HA2 GLY A 289 -1.448 -8.258 -5.880 1.00 0.00 H new ATOM 0 HA3 GLY A 289 0.074 -9.112 -5.721 1.00 0.00 H new ATOM 739 N PRO A 290 -2.416 -9.947 -4.211 1.00 0.00 N ATOM 740 CA PRO A 290 -3.054 -10.736 -3.166 1.00 0.00 C ATOM 741 C PRO A 290 -2.037 -11.522 -2.338 1.00 0.00 C ATOM 742 O PRO A 290 -1.519 -12.547 -2.779 1.00 0.00 O ATOM 743 CB PRO A 290 -3.984 -11.683 -3.943 1.00 0.00 C ATOM 744 CG PRO A 290 -3.921 -11.256 -5.383 1.00 0.00 C ATOM 745 CD PRO A 290 -3.234 -9.917 -5.422 1.00 0.00 C ATOM 0 HA PRO A 290 -3.582 -10.113 -2.444 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -3.664 -12.719 -3.831 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -5.004 -11.622 -3.564 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -3.373 -11.987 -5.977 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -4.922 -11.187 -5.808 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -2.627 -9.798 -6.319 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -3.948 -9.094 -5.409 1.00 0.00 H new ATOM 753 N VAL A 291 -1.751 -11.019 -1.141 1.00 0.00 N ATOM 754 CA VAL A 291 -0.789 -11.652 -0.250 1.00 0.00 C ATOM 755 C VAL A 291 -1.462 -12.704 0.623 1.00 0.00 C ATOM 756 O VAL A 291 -2.649 -12.980 0.466 1.00 0.00 O ATOM 757 CB VAL A 291 -0.085 -10.611 0.648 1.00 0.00 C ATOM 758 CG1 VAL A 291 0.799 -9.691 -0.186 1.00 0.00 C ATOM 759 CG2 VAL A 291 -1.104 -9.803 1.444 1.00 0.00 C ATOM 0 H VAL A 291 -2.175 -10.171 -0.766 1.00 0.00 H new ATOM 0 HA VAL A 291 -0.041 -12.136 -0.878 1.00 0.00 H new ATOM 0 HB VAL A 291 0.549 -11.146 1.355 1.00 0.00 H new ATOM 0 HG11 VAL A 291 1.286 -8.965 0.466 1.00 0.00 H new ATOM 0 HG12 VAL A 291 1.557 -10.282 -0.700 1.00 0.00 H new ATOM 0 HG13 VAL A 291 0.188 -9.167 -0.920 1.00 0.00 H new ATOM 0 HG21 VAL A 291 -0.584 -9.077 2.069 1.00 0.00 H new ATOM 0 HG22 VAL A 291 -1.770 -9.280 0.758 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -1.687 -10.474 2.075 1.00 0.00 H new ATOM 769 N LYS A 292 -0.700 -13.294 1.538 1.00 0.00 N ATOM 770 CA LYS A 292 -1.239 -14.318 2.425 1.00 0.00 C ATOM 771 C LYS A 292 -0.320 -14.558 3.615 1.00 0.00 C ATOM 772 O LYS A 292 0.901 -14.452 3.504 1.00 0.00 O ATOM 773 CB LYS A 292 -1.451 -15.625 1.659 1.00 0.00 C ATOM 774 CG LYS A 292 -0.177 -16.187 1.049 1.00 0.00 C ATOM 775 CD LYS A 292 -0.392 -17.589 0.501 1.00 0.00 C ATOM 776 CE LYS A 292 -0.454 -18.620 1.618 1.00 0.00 C ATOM 777 NZ LYS A 292 0.768 -18.593 2.468 1.00 0.00 N ATOM 0 H LYS A 292 0.287 -13.082 1.684 1.00 0.00 H new ATOM 0 HA LYS A 292 -2.198 -13.962 2.801 1.00 0.00 H new ATOM 0 HB2 LYS A 292 -1.878 -16.367 2.334 1.00 0.00 H new ATOM 0 HB3 LYS A 292 -2.180 -15.458 0.866 1.00 0.00 H new ATOM 0 HG2 LYS A 292 0.164 -15.531 0.248 1.00 0.00 H new ATOM 0 HG3 LYS A 292 0.610 -16.207 1.803 1.00 0.00 H new ATOM 0 HD2 LYS A 292 -1.317 -17.618 -0.074 1.00 0.00 H new ATOM 0 HD3 LYS A 292 0.417 -17.841 -0.184 1.00 0.00 H new ATOM 0 HE2 LYS A 292 -1.331 -18.432 2.237 1.00 0.00 H new ATOM 0 HE3 LYS A 292 -0.575 -19.614 1.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 1.054 -19.567 2.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 1.538 -18.118 1.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 0.568 -18.076 3.348 1.00 0.00 H new ATOM 791 N GLY A 293 -0.919 -14.885 4.755 1.00 0.00 N ATOM 792 CA GLY A 293 -0.143 -15.140 5.952 1.00 0.00 C ATOM 793 C GLY A 293 -0.779 -14.561 7.201 1.00 0.00 C ATOM 794 O GLY A 293 -0.451 -14.973 8.314 1.00 0.00 O ATOM 0 H GLY A 293 -1.928 -14.978 4.870 1.00 0.00 H new ATOM 0 HA2 GLY A 293 -0.021 -16.216 6.078 1.00 0.00 H new ATOM 0 HA3 GLY A 293 0.855 -14.718 5.829 1.00 0.00 H new ATOM 798 N LYS A 294 -1.684 -13.597 7.026 1.00 0.00 N ATOM 799 CA LYS A 294 -2.350 -12.965 8.160 1.00 0.00 C ATOM 800 C LYS A 294 -1.346 -12.220 9.038 1.00 0.00 C ATOM 801 O LYS A 294 -1.667 -11.812 10.154 1.00 0.00 O ATOM 802 CB LYS A 294 -3.084 -14.015 8.993 1.00 0.00 C ATOM 803 CG LYS A 294 -4.557 -14.148 8.642 1.00 0.00 C ATOM 804 CD LYS A 294 -5.360 -12.964 9.156 1.00 0.00 C ATOM 805 CE LYS A 294 -5.997 -13.266 10.504 1.00 0.00 C ATOM 806 NZ LYS A 294 -6.666 -12.067 11.082 1.00 0.00 N ATOM 0 H LYS A 294 -1.970 -13.240 6.114 1.00 0.00 H new ATOM 0 HA LYS A 294 -3.070 -12.246 7.770 1.00 0.00 H new ATOM 0 HB2 LYS A 294 -2.598 -14.981 8.856 1.00 0.00 H new ATOM 0 HB3 LYS A 294 -2.992 -13.759 10.048 1.00 0.00 H new ATOM 0 HG2 LYS A 294 -4.669 -14.223 7.560 1.00 0.00 H new ATOM 0 HG3 LYS A 294 -4.952 -15.070 9.068 1.00 0.00 H new ATOM 0 HD2 LYS A 294 -4.710 -12.094 9.246 1.00 0.00 H new ATOM 0 HD3 LYS A 294 -6.136 -12.709 8.435 1.00 0.00 H new ATOM 0 HE2 LYS A 294 -6.725 -14.069 10.390 1.00 0.00 H new ATOM 0 HE3 LYS A 294 -5.233 -13.624 11.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 -7.088 -12.314 12.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 -5.966 -11.309 11.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 -7.412 -11.740 10.435 1.00 0.00 H new ATOM 820 N GLU A 295 -0.131 -12.049 8.527 1.00 0.00 N ATOM 821 CA GLU A 295 0.918 -11.358 9.263 1.00 0.00 C ATOM 822 C GLU A 295 1.738 -10.466 8.336 1.00 0.00 C ATOM 823 O GLU A 295 2.079 -9.339 8.693 1.00 0.00 O ATOM 824 CB GLU A 295 1.829 -12.367 9.968 1.00 0.00 C ATOM 825 CG GLU A 295 1.822 -12.236 11.482 1.00 0.00 C ATOM 826 CD GLU A 295 2.849 -11.240 11.985 1.00 0.00 C ATOM 827 OE1 GLU A 295 4.055 -11.459 11.747 1.00 0.00 O ATOM 828 OE2 GLU A 295 2.446 -10.241 12.616 1.00 0.00 O ATOM 0 H GLU A 295 0.150 -12.381 7.604 1.00 0.00 H new ATOM 0 HA GLU A 295 0.444 -10.726 10.014 1.00 0.00 H new ATOM 0 HB2 GLU A 295 1.518 -13.376 9.697 1.00 0.00 H new ATOM 0 HB3 GLU A 295 2.849 -12.239 9.605 1.00 0.00 H new ATOM 0 HG2 GLU A 295 0.830 -11.928 11.812 1.00 0.00 H new ATOM 0 HG3 GLU A 295 2.018 -13.211 11.928 1.00 0.00 H new ATOM 835 N ASN A 296 2.048 -10.968 7.144 1.00 0.00 N ATOM 836 CA ASN A 296 2.822 -10.198 6.179 1.00 0.00 C ATOM 837 C ASN A 296 2.081 -8.920 5.815 1.00 0.00 C ATOM 838 O ASN A 296 2.552 -7.818 6.096 1.00 0.00 O ATOM 839 CB ASN A 296 3.095 -11.028 4.923 1.00 0.00 C ATOM 840 CG ASN A 296 4.456 -11.694 4.954 1.00 0.00 C ATOM 841 OD1 ASN A 296 5.042 -11.884 6.020 1.00 0.00 O ATOM 842 ND2 ASN A 296 4.968 -12.052 3.782 1.00 0.00 N ATOM 0 H ASN A 296 1.777 -11.898 6.826 1.00 0.00 H new ATOM 0 HA ASN A 296 3.778 -9.935 6.632 1.00 0.00 H new ATOM 0 HB2 ASN A 296 2.323 -11.790 4.820 1.00 0.00 H new ATOM 0 HB3 ASN A 296 3.028 -10.386 4.045 1.00 0.00 H new ATOM 0 HD21 ASN A 296 5.882 -12.504 3.741 1.00 0.00 H new ATOM 0 HD22 ASN A 296 4.448 -11.875 2.923 1.00 0.00 H new ATOM 849 N ALA A 297 0.904 -9.072 5.214 1.00 0.00 N ATOM 850 CA ALA A 297 0.091 -7.920 4.847 1.00 0.00 C ATOM 851 C ALA A 297 -0.155 -7.058 6.084 1.00 0.00 C ATOM 852 O ALA A 297 -0.202 -5.832 6.010 1.00 0.00 O ATOM 853 CB ALA A 297 -1.231 -8.373 4.243 1.00 0.00 C ATOM 0 H ALA A 297 0.496 -9.975 4.973 1.00 0.00 H new ATOM 0 HA ALA A 297 0.621 -7.331 4.099 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -1.826 -7.500 3.974 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -1.038 -8.969 3.351 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -1.776 -8.974 4.970 1.00 0.00 H new ATOM 859 N ASP A 298 -0.295 -7.725 7.230 1.00 0.00 N ATOM 860 CA ASP A 298 -0.522 -7.039 8.496 1.00 0.00 C ATOM 861 C ASP A 298 0.675 -6.166 8.852 1.00 0.00 C ATOM 862 O ASP A 298 0.537 -4.961 9.056 1.00 0.00 O ATOM 863 CB ASP A 298 -0.781 -8.052 9.612 1.00 0.00 C ATOM 864 CG ASP A 298 -1.703 -7.507 10.686 1.00 0.00 C ATOM 865 OD1 ASP A 298 -2.528 -6.624 10.368 1.00 0.00 O ATOM 866 OD2 ASP A 298 -1.601 -7.963 11.844 1.00 0.00 O ATOM 0 H ASP A 298 -0.255 -8.741 7.304 1.00 0.00 H new ATOM 0 HA ASP A 298 -1.400 -6.402 8.388 1.00 0.00 H new ATOM 0 HB2 ASP A 298 -1.219 -8.954 9.185 1.00 0.00 H new ATOM 0 HB3 ASP A 298 0.168 -8.341 10.064 1.00 0.00 H new ATOM 871 N SER A 299 1.857 -6.779 8.910 1.00 0.00 N ATOM 872 CA SER A 299 3.075 -6.041 9.223 1.00 0.00 C ATOM 873 C SER A 299 3.316 -4.988 8.158 1.00 0.00 C ATOM 874 O SER A 299 3.734 -3.870 8.456 1.00 0.00 O ATOM 875 CB SER A 299 4.271 -6.991 9.311 1.00 0.00 C ATOM 876 OG SER A 299 4.542 -7.348 10.655 1.00 0.00 O ATOM 0 H SER A 299 1.994 -7.776 8.746 1.00 0.00 H new ATOM 0 HA SER A 299 2.956 -5.553 10.191 1.00 0.00 H new ATOM 0 HB2 SER A 299 4.070 -7.889 8.727 1.00 0.00 H new ATOM 0 HB3 SER A 299 5.149 -6.516 8.874 1.00 0.00 H new ATOM 0 HG SER A 299 5.309 -7.957 10.683 1.00 0.00 H new ATOM 882 N THR A 300 3.014 -5.343 6.911 1.00 0.00 N ATOM 883 CA THR A 300 3.166 -4.412 5.807 1.00 0.00 C ATOM 884 C THR A 300 2.297 -3.186 6.059 1.00 0.00 C ATOM 885 O THR A 300 2.645 -2.082 5.656 1.00 0.00 O ATOM 886 CB THR A 300 2.788 -5.073 4.484 1.00 0.00 C ATOM 887 OG1 THR A 300 3.411 -6.339 4.360 1.00 0.00 O ATOM 888 CG2 THR A 300 3.183 -4.251 3.278 1.00 0.00 C ATOM 0 H THR A 300 2.665 -6.264 6.646 1.00 0.00 H new ATOM 0 HA THR A 300 4.210 -4.107 5.740 1.00 0.00 H new ATOM 0 HB THR A 300 1.702 -5.168 4.505 1.00 0.00 H new ATOM 0 HG1 THR A 300 3.004 -6.967 4.993 1.00 0.00 H new ATOM 0 HG21 THR A 300 2.888 -4.774 2.369 1.00 0.00 H new ATOM 0 HG22 THR A 300 2.684 -3.283 3.318 1.00 0.00 H new ATOM 0 HG23 THR A 300 4.263 -4.103 3.277 1.00 0.00 H new ATOM 896 N LEU A 301 1.180 -3.387 6.768 1.00 0.00 N ATOM 897 CA LEU A 301 0.286 -2.285 7.111 1.00 0.00 C ATOM 898 C LEU A 301 1.062 -1.255 7.914 1.00 0.00 C ATOM 899 O LEU A 301 1.252 -0.122 7.478 1.00 0.00 O ATOM 900 CB LEU A 301 -0.912 -2.786 7.919 1.00 0.00 C ATOM 901 CG LEU A 301 -2.075 -1.798 8.031 1.00 0.00 C ATOM 902 CD1 LEU A 301 -2.586 -1.416 6.650 1.00 0.00 C ATOM 903 CD2 LEU A 301 -3.196 -2.389 8.872 1.00 0.00 C ATOM 0 H LEU A 301 0.878 -4.299 7.112 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.093 -1.834 6.194 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -1.279 -3.706 7.464 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -0.573 -3.040 8.923 1.00 0.00 H new ATOM 0 HG LEU A 301 -1.714 -0.895 8.524 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -3.413 -0.713 6.750 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -1.781 -0.952 6.080 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -2.930 -2.310 6.129 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -4.015 -1.673 8.941 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -3.555 -3.307 8.407 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -2.823 -2.611 9.872 1.00 0.00 H new ATOM 915 N ASN A 302 1.559 -1.677 9.071 1.00 0.00 N ATOM 916 CA ASN A 302 2.373 -0.807 9.907 1.00 0.00 C ATOM 917 C ASN A 302 3.568 -0.332 9.094 1.00 0.00 C ATOM 918 O ASN A 302 4.124 0.739 9.335 1.00 0.00 O ATOM 919 CB ASN A 302 2.843 -1.563 11.153 1.00 0.00 C ATOM 920 CG ASN A 302 1.922 -1.350 12.339 1.00 0.00 C ATOM 921 OD1 ASN A 302 1.563 -0.220 12.666 1.00 0.00 O ATOM 922 ND2 ASN A 302 1.537 -2.441 12.992 1.00 0.00 N ATOM 0 H ASN A 302 1.413 -2.613 9.449 1.00 0.00 H new ATOM 0 HA ASN A 302 1.786 0.052 10.232 1.00 0.00 H new ATOM 0 HB2 ASN A 302 2.901 -2.628 10.928 1.00 0.00 H new ATOM 0 HB3 ASN A 302 3.850 -1.237 11.415 1.00 0.00 H new ATOM 0 HD21 ASN A 302 0.919 -2.361 13.800 1.00 0.00 H new ATOM 0 HD22 ASN A 302 1.859 -3.359 12.686 1.00 0.00 H new ATOM 929 N ARG A 303 3.935 -1.145 8.105 1.00 0.00 N ATOM 930 CA ARG A 303 5.034 -0.832 7.216 1.00 0.00 C ATOM 931 C ARG A 303 4.597 0.236 6.213 1.00 0.00 C ATOM 932 O ARG A 303 5.400 1.063 5.790 1.00 0.00 O ATOM 933 CB ARG A 303 5.501 -2.103 6.509 1.00 0.00 C ATOM 934 CG ARG A 303 6.938 -2.489 6.835 1.00 0.00 C ATOM 935 CD ARG A 303 6.997 -3.735 7.704 1.00 0.00 C ATOM 936 NE ARG A 303 8.063 -3.660 8.701 1.00 0.00 N ATOM 937 CZ ARG A 303 7.942 -3.037 9.871 1.00 0.00 C ATOM 938 NH1 ARG A 303 6.808 -2.426 10.193 1.00 0.00 N ATOM 939 NH2 ARG A 303 8.959 -3.023 10.721 1.00 0.00 N ATOM 0 H ARG A 303 3.476 -2.034 7.904 1.00 0.00 H new ATOM 0 HA ARG A 303 5.872 -0.435 7.789 1.00 0.00 H new ATOM 0 HB2 ARG A 303 4.841 -2.926 6.785 1.00 0.00 H new ATOM 0 HB3 ARG A 303 5.406 -1.966 5.432 1.00 0.00 H new ATOM 0 HG2 ARG A 303 7.488 -2.663 5.910 1.00 0.00 H new ATOM 0 HG3 ARG A 303 7.430 -1.663 7.348 1.00 0.00 H new ATOM 0 HD2 ARG A 303 6.040 -3.871 8.207 1.00 0.00 H new ATOM 0 HD3 ARG A 303 7.153 -4.610 7.073 1.00 0.00 H new ATOM 0 HE ARG A 303 8.952 -4.112 8.488 1.00 0.00 H new ATOM 0 HH11 ARG A 303 6.023 -2.432 9.542 1.00 0.00 H new ATOM 0 HH12 ARG A 303 6.722 -1.951 11.091 1.00 0.00 H new ATOM 0 HH21 ARG A 303 9.833 -3.489 10.478 1.00 0.00 H new ATOM 0 HH22 ARG A 303 8.868 -2.546 11.618 1.00 0.00 H new ATOM 953 N LEU A 304 3.302 0.247 5.875 1.00 0.00 N ATOM 954 CA LEU A 304 2.759 1.259 4.970 1.00 0.00 C ATOM 955 C LEU A 304 3.065 2.627 5.555 1.00 0.00 C ATOM 956 O LEU A 304 3.355 3.581 4.832 1.00 0.00 O ATOM 957 CB LEU A 304 1.249 1.058 4.778 1.00 0.00 C ATOM 958 CG LEU A 304 0.859 -0.176 3.954 1.00 0.00 C ATOM 959 CD1 LEU A 304 -0.652 -0.335 3.908 1.00 0.00 C ATOM 960 CD2 LEU A 304 1.437 -0.096 2.544 1.00 0.00 C ATOM 0 H LEU A 304 2.618 -0.429 6.213 1.00 0.00 H new ATOM 0 HA LEU A 304 3.219 1.172 3.986 1.00 0.00 H new ATOM 0 HB2 LEU A 304 0.780 0.984 5.759 1.00 0.00 H new ATOM 0 HB3 LEU A 304 0.838 1.944 4.294 1.00 0.00 H new ATOM 0 HG LEU A 304 1.281 -1.055 4.441 1.00 0.00 H new ATOM 0 HD11 LEU A 304 -0.907 -1.216 3.319 1.00 0.00 H new ATOM 0 HD12 LEU A 304 -1.037 -0.452 4.921 1.00 0.00 H new ATOM 0 HD13 LEU A 304 -1.097 0.549 3.451 1.00 0.00 H new ATOM 0 HD21 LEU A 304 1.146 -0.983 1.981 1.00 0.00 H new ATOM 0 HD22 LEU A 304 1.054 0.794 2.044 1.00 0.00 H new ATOM 0 HD23 LEU A 304 2.524 -0.042 2.599 1.00 0.00 H new ATOM 972 N LYS A 305 3.065 2.691 6.882 1.00 0.00 N ATOM 973 CA LYS A 305 3.406 3.915 7.580 1.00 0.00 C ATOM 974 C LYS A 305 4.855 4.276 7.255 1.00 0.00 C ATOM 975 O LYS A 305 5.218 5.449 7.179 1.00 0.00 O ATOM 976 CB LYS A 305 3.218 3.731 9.090 1.00 0.00 C ATOM 977 CG LYS A 305 2.375 4.820 9.735 1.00 0.00 C ATOM 978 CD LYS A 305 1.964 4.446 11.152 1.00 0.00 C ATOM 979 CE LYS A 305 0.474 4.161 11.244 1.00 0.00 C ATOM 980 NZ LYS A 305 0.153 2.756 10.872 1.00 0.00 N ATOM 0 H LYS A 305 2.832 1.907 7.492 1.00 0.00 H new ATOM 0 HA LYS A 305 2.750 4.724 7.257 1.00 0.00 H new ATOM 0 HB2 LYS A 305 2.750 2.764 9.274 1.00 0.00 H new ATOM 0 HB3 LYS A 305 4.197 3.709 9.570 1.00 0.00 H new ATOM 0 HG2 LYS A 305 2.938 5.753 9.753 1.00 0.00 H new ATOM 0 HG3 LYS A 305 1.484 4.996 9.132 1.00 0.00 H new ATOM 0 HD2 LYS A 305 2.524 3.568 11.474 1.00 0.00 H new ATOM 0 HD3 LYS A 305 2.223 5.257 11.833 1.00 0.00 H new ATOM 0 HE2 LYS A 305 0.129 4.355 12.260 1.00 0.00 H new ATOM 0 HE3 LYS A 305 -0.067 4.843 10.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -0.873 2.603 10.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 0.458 2.577 9.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 0.649 2.105 11.514 1.00 0.00 H new ATOM 994 N MET A 306 5.668 3.238 7.034 1.00 0.00 N ATOM 995 CA MET A 306 7.072 3.410 6.678 1.00 0.00 C ATOM 996 C MET A 306 7.179 4.149 5.350 1.00 0.00 C ATOM 997 O MET A 306 8.113 4.920 5.127 1.00 0.00 O ATOM 998 CB MET A 306 7.775 2.045 6.585 1.00 0.00 C ATOM 999 CG MET A 306 9.286 2.131 6.732 1.00 0.00 C ATOM 1000 SD MET A 306 10.084 0.516 6.656 1.00 0.00 S ATOM 1001 CE MET A 306 11.266 0.659 7.994 1.00 0.00 C ATOM 0 H MET A 306 5.371 2.264 7.097 1.00 0.00 H new ATOM 0 HA MET A 306 7.563 3.997 7.454 1.00 0.00 H new ATOM 0 HB2 MET A 306 7.379 1.388 7.359 1.00 0.00 H new ATOM 0 HB3 MET A 306 7.537 1.587 5.625 1.00 0.00 H new ATOM 0 HG2 MET A 306 9.688 2.768 5.944 1.00 0.00 H new ATOM 0 HG3 MET A 306 9.528 2.607 7.682 1.00 0.00 H new ATOM 0 HE1 MET A 306 11.839 -0.265 8.074 1.00 0.00 H new ATOM 0 HE2 MET A 306 11.943 1.489 7.794 1.00 0.00 H new ATOM 0 HE3 MET A 306 10.737 0.840 8.929 1.00 0.00 H new ATOM 1011 N ALA A 307 6.202 3.913 4.477 1.00 0.00 N ATOM 1012 CA ALA A 307 6.164 4.562 3.173 1.00 0.00 C ATOM 1013 C ALA A 307 5.596 5.970 3.298 1.00 0.00 C ATOM 1014 O ALA A 307 6.285 6.954 3.031 1.00 0.00 O ATOM 1015 CB ALA A 307 5.336 3.740 2.199 1.00 0.00 C ATOM 0 H ALA A 307 5.425 3.275 4.652 1.00 0.00 H new ATOM 0 HA ALA A 307 7.182 4.633 2.789 1.00 0.00 H new ATOM 0 HB1 ALA A 307 5.316 4.237 1.229 1.00 0.00 H new ATOM 0 HB2 ALA A 307 5.779 2.750 2.091 1.00 0.00 H new ATOM 0 HB3 ALA A 307 4.319 3.643 2.578 1.00 0.00 H new ATOM 1021 N GLY A 308 4.338 6.060 3.724 1.00 0.00 N ATOM 1022 CA GLY A 308 3.709 7.356 3.894 1.00 0.00 C ATOM 1023 C GLY A 308 2.413 7.512 3.117 1.00 0.00 C ATOM 1024 O GLY A 308 2.327 8.342 2.213 1.00 0.00 O ATOM 0 H GLY A 308 3.747 5.261 3.953 1.00 0.00 H new ATOM 0 HA2 GLY A 308 3.509 7.517 4.953 1.00 0.00 H new ATOM 0 HA3 GLY A 308 4.406 8.133 3.580 1.00 0.00 H new ATOM 1028 N HIS A 309 1.393 6.736 3.479 1.00 0.00 N ATOM 1029 CA HIS A 309 0.096 6.835 2.810 1.00 0.00 C ATOM 1030 C HIS A 309 -0.945 7.421 3.755 1.00 0.00 C ATOM 1031 O HIS A 309 -1.221 6.847 4.809 1.00 0.00 O ATOM 1032 CB HIS A 309 -0.409 5.472 2.311 1.00 0.00 C ATOM 1033 CG HIS A 309 0.655 4.444 2.045 1.00 0.00 C ATOM 1034 ND1 HIS A 309 0.970 4.033 0.775 1.00 0.00 N ATOM 1035 CD2 HIS A 309 1.445 3.708 2.877 1.00 0.00 C ATOM 1036 CE1 HIS A 309 1.894 3.098 0.828 1.00 0.00 C ATOM 1037 NE2 HIS A 309 2.203 2.884 2.091 1.00 0.00 N ATOM 0 H HIS A 309 1.437 6.039 4.223 1.00 0.00 H new ATOM 0 HA HIS A 309 0.239 7.487 1.948 1.00 0.00 H new ATOM 0 HB2 HIS A 309 -1.102 5.069 3.049 1.00 0.00 H new ATOM 0 HB3 HIS A 309 -0.976 5.628 1.393 1.00 0.00 H new ATOM 0 HD1 HIS A 309 0.551 4.397 -0.081 1.00 0.00 H new ATOM 0 HD2 HIS A 309 1.468 3.765 3.955 1.00 0.00 H new ATOM 0 HE1 HIS A 309 2.327 2.591 -0.022 1.00 0.00 H new ATOM 1046 N THR A 310 -1.533 8.557 3.385 1.00 0.00 N ATOM 1047 CA THR A 310 -2.550 9.177 4.231 1.00 0.00 C ATOM 1048 C THR A 310 -3.862 8.388 4.179 1.00 0.00 C ATOM 1049 O THR A 310 -4.904 8.919 3.793 1.00 0.00 O ATOM 1050 CB THR A 310 -2.784 10.632 3.816 1.00 0.00 C ATOM 1051 OG1 THR A 310 -3.618 11.292 4.751 1.00 0.00 O ATOM 1052 CG2 THR A 310 -3.422 10.779 2.452 1.00 0.00 C ATOM 0 H THR A 310 -1.328 9.059 2.521 1.00 0.00 H new ATOM 0 HA THR A 310 -2.186 9.164 5.258 1.00 0.00 H new ATOM 0 HB THR A 310 -1.791 11.080 3.782 1.00 0.00 H new ATOM 0 HG1 THR A 310 -4.503 10.872 4.753 1.00 0.00 H new ATOM 0 HG21 THR A 310 -3.557 11.837 2.226 1.00 0.00 H new ATOM 0 HG22 THR A 310 -2.778 10.326 1.698 1.00 0.00 H new ATOM 0 HG23 THR A 310 -4.391 10.280 2.448 1.00 0.00 H new ATOM 1060 N ASN A 311 -3.803 7.114 4.575 1.00 0.00 N ATOM 1061 CA ASN A 311 -4.982 6.246 4.577 1.00 0.00 C ATOM 1062 C ASN A 311 -4.608 4.824 4.997 1.00 0.00 C ATOM 1063 O ASN A 311 -4.841 4.424 6.136 1.00 0.00 O ATOM 1064 CB ASN A 311 -5.637 6.231 3.193 1.00 0.00 C ATOM 1065 CG ASN A 311 -6.861 7.122 3.122 1.00 0.00 C ATOM 1066 OD1 ASN A 311 -7.829 6.927 3.858 1.00 0.00 O ATOM 1067 ND2 ASN A 311 -6.825 8.107 2.233 1.00 0.00 N ATOM 0 H ASN A 311 -2.949 6.660 4.899 1.00 0.00 H new ATOM 0 HA ASN A 311 -5.695 6.643 5.300 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -4.911 6.556 2.447 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -5.920 5.209 2.939 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -7.620 8.739 2.140 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -6.002 8.232 1.643 1.00 0.00 H new ATOM 1074 N CYS A 312 -4.021 4.078 4.059 1.00 0.00 N ATOM 1075 CA CYS A 312 -3.584 2.692 4.282 1.00 0.00 C ATOM 1076 C CYS A 312 -4.607 1.845 5.033 1.00 0.00 C ATOM 1077 O CYS A 312 -5.015 2.171 6.147 1.00 0.00 O ATOM 1078 CB CYS A 312 -2.229 2.652 4.992 1.00 0.00 C ATOM 1079 SG CYS A 312 -2.073 3.760 6.414 1.00 0.00 S ATOM 0 H CYS A 312 -3.833 4.418 3.116 1.00 0.00 H new ATOM 0 HA CYS A 312 -3.483 2.247 3.292 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -2.041 1.631 5.324 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -1.451 2.901 4.270 1.00 0.00 H new ATOM 0 HG CYS A 312 -3.256 4.076 6.850 1.00 0.00 H new ATOM 1085 N ILE A 313 -5.006 0.734 4.409 1.00 0.00 N ATOM 1086 CA ILE A 313 -5.966 -0.175 5.013 1.00 0.00 C ATOM 1087 C ILE A 313 -5.879 -1.550 4.368 1.00 0.00 C ATOM 1088 O ILE A 313 -6.184 -1.715 3.187 1.00 0.00 O ATOM 1089 CB ILE A 313 -7.408 0.348 4.885 1.00 0.00 C ATOM 1090 CG1 ILE A 313 -7.681 0.824 3.456 1.00 0.00 C ATOM 1091 CG2 ILE A 313 -7.654 1.470 5.881 1.00 0.00 C ATOM 1092 CD1 ILE A 313 -9.080 1.366 3.256 1.00 0.00 C ATOM 0 H ILE A 313 -4.676 0.448 3.487 1.00 0.00 H new ATOM 0 HA ILE A 313 -5.715 -0.245 6.071 1.00 0.00 H new ATOM 0 HB ILE A 313 -8.095 -0.468 5.110 1.00 0.00 H new ATOM 0 HG12 ILE A 313 -6.959 1.598 3.196 1.00 0.00 H new ATOM 0 HG13 ILE A 313 -7.520 -0.006 2.768 1.00 0.00 H new ATOM 0 HG21 ILE A 313 -8.678 1.830 5.778 1.00 0.00 H new ATOM 0 HG22 ILE A 313 -7.500 1.098 6.894 1.00 0.00 H new ATOM 0 HG23 ILE A 313 -6.961 2.288 5.686 1.00 0.00 H new ATOM 0 HD11 ILE A 313 -9.202 1.684 2.221 1.00 0.00 H new ATOM 0 HD12 ILE A 313 -9.808 0.588 3.485 1.00 0.00 H new ATOM 0 HD13 ILE A 313 -9.239 2.217 3.918 1.00 0.00 H new ATOM 1104 N ARG A 314 -5.464 -2.535 5.152 1.00 0.00 N ATOM 1105 CA ARG A 314 -5.340 -3.901 4.659 1.00 0.00 C ATOM 1106 C ARG A 314 -6.674 -4.394 4.125 1.00 0.00 C ATOM 1107 O ARG A 314 -7.668 -4.451 4.848 1.00 0.00 O ATOM 1108 CB ARG A 314 -4.829 -4.829 5.774 1.00 0.00 C ATOM 1109 CG ARG A 314 -3.511 -5.525 5.456 1.00 0.00 C ATOM 1110 CD ARG A 314 -2.457 -4.580 4.882 1.00 0.00 C ATOM 1111 NE ARG A 314 -1.594 -5.275 3.947 1.00 0.00 N ATOM 1112 CZ ARG A 314 -0.409 -4.830 3.569 1.00 0.00 C ATOM 1113 NH1 ARG A 314 0.053 -3.676 4.041 1.00 0.00 N ATOM 1114 NH2 ARG A 314 0.312 -5.540 2.718 1.00 0.00 N ATOM 0 H ARG A 314 -5.207 -2.415 6.132 1.00 0.00 H new ATOM 0 HA ARG A 314 -4.617 -3.912 3.843 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -4.708 -4.247 6.688 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -5.587 -5.586 5.976 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -3.122 -5.985 6.364 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.695 -6.330 4.744 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -2.946 -3.745 4.380 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -1.860 -4.160 5.691 1.00 0.00 H new ATOM 0 HE ARG A 314 -1.921 -6.159 3.558 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -0.508 -3.132 4.697 1.00 0.00 H new ATOM 0 HH12 ARG A 314 0.968 -3.335 3.747 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -0.048 -6.424 2.358 1.00 0.00 H new ATOM 0 HH22 ARG A 314 1.228 -5.204 2.421 1.00 0.00 H new ATOM 1128 N LEU A 315 -6.675 -4.761 2.853 1.00 0.00 N ATOM 1129 CA LEU A 315 -7.867 -5.272 2.201 1.00 0.00 C ATOM 1130 C LEU A 315 -7.745 -6.777 2.029 1.00 0.00 C ATOM 1131 O LEU A 315 -6.909 -7.259 1.269 1.00 0.00 O ATOM 1132 CB LEU A 315 -8.080 -4.615 0.843 1.00 0.00 C ATOM 1133 CG LEU A 315 -9.352 -3.775 0.718 1.00 0.00 C ATOM 1134 CD1 LEU A 315 -9.037 -2.294 0.879 1.00 0.00 C ATOM 1135 CD2 LEU A 315 -10.036 -4.038 -0.619 1.00 0.00 C ATOM 0 H LEU A 315 -5.855 -4.713 2.248 1.00 0.00 H new ATOM 0 HA LEU A 315 -8.727 -5.038 2.828 1.00 0.00 H new ATOM 0 HB2 LEU A 315 -7.221 -3.979 0.626 1.00 0.00 H new ATOM 0 HB3 LEU A 315 -8.101 -5.393 0.080 1.00 0.00 H new ATOM 0 HG LEU A 315 -10.035 -4.066 1.516 1.00 0.00 H new ATOM 0 HD11 LEU A 315 -9.956 -1.715 0.787 1.00 0.00 H new ATOM 0 HD12 LEU A 315 -8.596 -2.120 1.860 1.00 0.00 H new ATOM 0 HD13 LEU A 315 -8.334 -1.985 0.105 1.00 0.00 H new ATOM 0 HD21 LEU A 315 -10.939 -3.432 -0.691 1.00 0.00 H new ATOM 0 HD22 LEU A 315 -9.358 -3.777 -1.432 1.00 0.00 H new ATOM 0 HD23 LEU A 315 -10.300 -5.093 -0.691 1.00 0.00 H new ATOM 1147 N ALA A 316 -8.563 -7.514 2.751 1.00 0.00 N ATOM 1148 CA ALA A 316 -8.517 -8.967 2.691 1.00 0.00 C ATOM 1149 C ALA A 316 -9.443 -9.525 1.620 1.00 0.00 C ATOM 1150 O ALA A 316 -10.494 -8.954 1.326 1.00 0.00 O ATOM 1151 CB ALA A 316 -8.844 -9.559 4.051 1.00 0.00 C ATOM 0 H ALA A 316 -9.267 -7.136 3.385 1.00 0.00 H new ATOM 0 HA ALA A 316 -7.502 -9.254 2.415 1.00 0.00 H new ATOM 0 HB1 ALA A 316 -8.806 -10.647 3.993 1.00 0.00 H new ATOM 0 HB2 ALA A 316 -8.117 -9.209 4.784 1.00 0.00 H new ATOM 0 HB3 ALA A 316 -9.843 -9.246 4.353 1.00 0.00 H new ATOM 1157 N ALA A 317 -9.035 -10.646 1.039 1.00 0.00 N ATOM 1158 CA ALA A 317 -9.806 -11.300 -0.006 1.00 0.00 C ATOM 1159 C ALA A 317 -10.847 -12.244 0.588 1.00 0.00 C ATOM 1160 O ALA A 317 -10.513 -13.151 1.351 1.00 0.00 O ATOM 1161 CB ALA A 317 -8.872 -12.054 -0.940 1.00 0.00 C ATOM 0 H ALA A 317 -8.166 -11.123 1.278 1.00 0.00 H new ATOM 0 HA ALA A 317 -10.337 -10.536 -0.574 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -9.455 -12.542 -1.721 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -8.170 -11.355 -1.394 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -8.321 -12.806 -0.375 1.00 0.00 H new