USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 900 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 805 CYS SG : rot 180:sc= -6.23! USER MOD Set 1.2: A 833 THR OG1 : rot 178:sc= 1.15 USER MOD Set 2.1: A 813 GLN :FLIP amide:sc= -0.151 F(o=-3.7,f=-1.7) USER MOD Set 2.2: A 815 MET CE :methyl -171:sc= -1.57 (180deg=-1.64) USER MOD Set 3.1: A 797 CYS SG : rot 31:sc= 0.231 USER MOD Set 3.2: A 818 CYS SG : rot -170:sc= -2.21! USER MOD Set 4.1: A 721 CYS SG : rot 47:sc= -1.69! USER MOD Set 4.2: A 743 CYS SG : rot -63:sc= 1.17 USER MOD Set 5.1: A 728 CYS SG : rot 169:sc= 0.679 USER MOD Set 5.2: A 763 CYS SG : rot -13:sc= 0.882 USER MOD Set 6.1: A 724 SER OG : rot -51:sc= -1.19 USER MOD Set 6.2: A 741 THR OG1 : rot 180:sc= -0.726 USER MOD Set 7.1: A 702 CYS SG : rot -43:sc= 1.35 USER MOD Set 7.2: A 713 CYS SG : rot -138:sc= 1.4 USER MOD Single : A 701 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0437) USER MOD Single : A 703 GLN : amide:sc= -0.449 X(o=-0.45,f=-0.033) USER MOD Single : A 707 LYS NZ :NH3+ 172:sc= -0.0126 (180deg=-0.109) USER MOD Single : A 709 GLN : amide:sc= -0.572 K(o=-0.57,f=-1.4) USER MOD Single : A 710 ASN : amide:sc= 0 X(o=0,f=0.0056) USER MOD Single : A 711 SER OG : rot 180:sc= 0 USER MOD Single : A 715 CYS SG : rot 180:sc= 0 USER MOD Single : A 716 LYS NZ :NH3+ 171:sc= 1.21 (180deg=1.15) USER MOD Single : A 717 MET CE :methyl -172:sc= -0.179 (180deg=-0.289) USER MOD Single : A 719 TYR OH : rot 180:sc= 0 USER MOD Single : A 730 GLN : amide:sc= 0.909 K(o=0.91,f=-0.45) USER MOD Single : A 734 SER OG : rot -78:sc= -0.378! USER MOD Single : A 735 LYS NZ :NH3+ -160:sc= 1.27 (180deg=0.733) USER MOD Single : A 744 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 745 MET CE :methyl 153:sc= -0.208 (180deg=-1.39) USER MOD Single : A 746 HIS : no HD1:sc= -0.531 K(o=-0.53,f=-6.3!) USER MOD Single : A 749 HIS : no HD1:sc= 0 X(o=0,f=-0.0019) USER MOD Single : A 750 CYS SG : rot -4:sc= -2.27! USER MOD Single : A 751 GLN : amide:sc= 0.0947 K(o=0.095,f=-0.74) USER MOD Single : A 754 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 755 TYR OH : rot 180:sc= 0 USER MOD Single : A 756 THR OG1 : rot 148:sc= 0.949 USER MOD Single : A 758 THR OG1 : rot -120:sc= 0 USER MOD Single : A 762 SER OG : rot -130:sc= 0 USER MOD Single : A 764 THR OG1 : rot 180:sc= 0 USER MOD Single : A 791 CYS SG : rot 28:sc= -0.262 USER MOD Single : A 795 SER OG : rot 180:sc= 0 USER MOD Single : A 803 SER OG : rot 180:sc= 0 USER MOD Single : A 809 ASN : amide:sc= -0.36 X(o=-0.36,f=0) USER MOD Single : A 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 814 THR OG1 : rot 180:sc= -0.536 USER MOD Single : A 816 SER OG : rot 180:sc= 0 USER MOD Single : A 825 CYS SG : rot 180:sc= -2.52! USER MOD Single : A 828 GLN : amide:sc= -1.13 K(o=-1.1,f=-6.4!) USER MOD Single : A 829 SER OG : rot 180:sc= 0 USER MOD Single : A 831 SER OG : rot 180:sc= 0 USER MOD Single : A 834 SER OG : rot 160:sc= -0.908 USER MOD Single : A 838 CYS SG : rot 180:sc= -0.329 USER MOD ----------------------------------------------------------------- ATOM 174 N LYS A 701 58.632 -5.603 -14.947 1.00 0.00 N ATOM 175 CA LYS A 701 57.427 -6.366 -14.760 1.00 0.00 C ATOM 176 C LYS A 701 57.454 -7.029 -13.402 1.00 0.00 C ATOM 177 O LYS A 701 58.459 -7.632 -13.022 1.00 0.00 O ATOM 178 CB LYS A 701 57.309 -7.426 -15.846 1.00 0.00 C ATOM 179 CG LYS A 701 57.289 -6.860 -17.251 1.00 0.00 C ATOM 180 CD LYS A 701 57.243 -7.967 -18.275 1.00 0.00 C ATOM 181 CE LYS A 701 57.346 -7.437 -19.706 1.00 0.00 C ATOM 182 NZ LYS A 701 56.233 -6.527 -20.055 1.00 0.00 N ATOM 0 HA LYS A 701 56.568 -5.698 -14.821 1.00 0.00 H new ATOM 0 HB2 LYS A 701 58.144 -8.120 -15.756 1.00 0.00 H new ATOM 0 HB3 LYS A 701 56.397 -8.001 -15.683 1.00 0.00 H new ATOM 0 HG2 LYS A 701 56.423 -6.209 -17.373 1.00 0.00 H new ATOM 0 HG3 LYS A 701 58.175 -6.246 -17.413 1.00 0.00 H new ATOM 0 HD2 LYS A 701 58.059 -8.666 -18.089 1.00 0.00 H new ATOM 0 HD3 LYS A 701 56.313 -8.525 -18.162 1.00 0.00 H new ATOM 0 HE2 LYS A 701 58.293 -6.911 -19.828 1.00 0.00 H new ATOM 0 HE3 LYS A 701 57.356 -8.277 -20.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 701 56.302 -6.263 -21.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 701 55.326 -7.007 -19.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 701 56.287 -5.671 -19.467 1.00 0.00 H new ATOM 196 N CYS A 702 56.389 -6.915 -12.679 1.00 0.00 N ATOM 197 CA CYS A 702 56.299 -7.529 -11.377 1.00 0.00 C ATOM 198 C CYS A 702 55.222 -8.576 -11.439 1.00 0.00 C ATOM 199 O CYS A 702 54.273 -8.433 -12.230 1.00 0.00 O ATOM 200 CB CYS A 702 55.923 -6.477 -10.326 1.00 0.00 C ATOM 201 SG CYS A 702 56.946 -4.970 -10.373 1.00 0.00 S ATOM 0 H CYS A 702 55.556 -6.399 -12.963 1.00 0.00 H new ATOM 0 HA CYS A 702 57.256 -7.971 -11.101 1.00 0.00 H new ATOM 0 HB2 CYS A 702 54.879 -6.198 -10.466 1.00 0.00 H new ATOM 0 HB3 CYS A 702 56.003 -6.925 -9.336 1.00 0.00 H new ATOM 0 HG CYS A 702 58.195 -5.298 -10.523 1.00 0.00 H new ATOM 206 N GLN A 703 55.349 -9.635 -10.663 1.00 0.00 N ATOM 207 CA GLN A 703 54.296 -10.621 -10.602 1.00 0.00 C ATOM 208 C GLN A 703 53.139 -10.020 -9.815 1.00 0.00 C ATOM 209 O GLN A 703 53.271 -8.946 -9.268 1.00 0.00 O ATOM 210 CB GLN A 703 54.778 -11.922 -9.963 1.00 0.00 C ATOM 211 CG GLN A 703 55.981 -12.569 -10.659 1.00 0.00 C ATOM 212 CD GLN A 703 55.755 -12.934 -12.129 1.00 0.00 C ATOM 213 OE1 GLN A 703 56.688 -12.915 -12.929 1.00 0.00 O ATOM 214 NE2 GLN A 703 54.553 -13.291 -12.494 1.00 0.00 N ATOM 0 H GLN A 703 56.159 -9.830 -10.075 1.00 0.00 H new ATOM 0 HA GLN A 703 53.974 -10.876 -11.611 1.00 0.00 H new ATOM 0 HB2 GLN A 703 55.039 -11.725 -8.923 1.00 0.00 H new ATOM 0 HB3 GLN A 703 53.953 -12.635 -9.955 1.00 0.00 H new ATOM 0 HG2 GLN A 703 56.829 -11.887 -10.595 1.00 0.00 H new ATOM 0 HG3 GLN A 703 56.256 -13.472 -10.114 1.00 0.00 H new ATOM 0 HE21 GLN A 703 53.794 -13.299 -11.812 1.00 0.00 H new ATOM 0 HE22 GLN A 703 54.373 -13.562 -13.461 1.00 0.00 H new ATOM 223 N ARG A 704 52.037 -10.702 -9.730 1.00 0.00 N ATOM 224 CA ARG A 704 50.843 -10.125 -9.112 1.00 0.00 C ATOM 225 C ARG A 704 50.958 -9.850 -7.611 1.00 0.00 C ATOM 226 O ARG A 704 50.294 -8.964 -7.080 1.00 0.00 O ATOM 227 CB ARG A 704 49.627 -10.947 -9.446 1.00 0.00 C ATOM 228 CG ARG A 704 49.254 -10.935 -10.921 1.00 0.00 C ATOM 229 CD ARG A 704 48.893 -9.536 -11.416 1.00 0.00 C ATOM 230 NE ARG A 704 50.084 -8.676 -11.627 1.00 0.00 N ATOM 231 CZ ARG A 704 50.287 -7.474 -11.051 1.00 0.00 C ATOM 232 NH1 ARG A 704 49.377 -6.978 -10.219 1.00 0.00 N ATOM 233 NH2 ARG A 704 51.404 -6.787 -11.301 1.00 0.00 N ATOM 0 H ARG A 704 51.922 -11.655 -10.074 1.00 0.00 H new ATOM 0 HA ARG A 704 50.734 -9.133 -9.551 1.00 0.00 H new ATOM 0 HB2 ARG A 704 49.802 -11.977 -9.135 1.00 0.00 H new ATOM 0 HB3 ARG A 704 48.782 -10.578 -8.866 1.00 0.00 H new ATOM 0 HG2 ARG A 704 50.087 -11.322 -11.507 1.00 0.00 H new ATOM 0 HG3 ARG A 704 48.410 -11.605 -11.086 1.00 0.00 H new ATOM 0 HD2 ARG A 704 48.339 -9.618 -12.351 1.00 0.00 H new ATOM 0 HD3 ARG A 704 48.230 -9.060 -10.694 1.00 0.00 H new ATOM 0 HE ARG A 704 50.807 -9.022 -12.258 1.00 0.00 H new ATOM 0 HH11 ARG A 704 48.528 -7.506 -10.018 1.00 0.00 H new ATOM 0 HH12 ARG A 704 49.528 -6.069 -9.782 1.00 0.00 H new ATOM 0 HH21 ARG A 704 52.109 -7.171 -11.930 1.00 0.00 H new ATOM 0 HH22 ARG A 704 51.553 -5.878 -10.863 1.00 0.00 H new ATOM 247 N TRP A 705 51.804 -10.586 -6.958 1.00 0.00 N ATOM 248 CA TRP A 705 52.043 -10.459 -5.530 1.00 0.00 C ATOM 249 C TRP A 705 53.233 -9.546 -5.292 1.00 0.00 C ATOM 250 O TRP A 705 53.679 -9.325 -4.163 1.00 0.00 O ATOM 251 CB TRP A 705 52.258 -11.854 -4.932 1.00 0.00 C ATOM 252 CG TRP A 705 53.217 -12.709 -5.715 1.00 0.00 C ATOM 253 CD1 TRP A 705 54.543 -12.872 -5.485 1.00 0.00 C ATOM 254 CD2 TRP A 705 52.912 -13.507 -6.878 1.00 0.00 C ATOM 255 NE1 TRP A 705 55.077 -13.714 -6.421 1.00 0.00 N ATOM 256 CE2 TRP A 705 54.100 -14.124 -7.278 1.00 0.00 C ATOM 257 CE3 TRP A 705 51.744 -13.759 -7.607 1.00 0.00 C ATOM 258 CZ2 TRP A 705 54.167 -14.977 -8.381 1.00 0.00 C ATOM 259 CZ3 TRP A 705 51.812 -14.599 -8.701 1.00 0.00 C ATOM 260 CH2 TRP A 705 53.012 -15.204 -9.074 1.00 0.00 C ATOM 0 H TRP A 705 52.367 -11.312 -7.402 1.00 0.00 H new ATOM 0 HA TRP A 705 51.182 -10.010 -5.036 1.00 0.00 H new ATOM 0 HB2 TRP A 705 52.629 -11.749 -3.912 1.00 0.00 H new ATOM 0 HB3 TRP A 705 51.297 -12.365 -4.871 1.00 0.00 H new ATOM 0 HD1 TRP A 705 55.095 -12.406 -4.682 1.00 0.00 H new ATOM 0 HE1 TRP A 705 56.057 -13.993 -6.470 1.00 0.00 H new ATOM 0 HE3 TRP A 705 50.807 -13.305 -7.319 1.00 0.00 H new ATOM 0 HZ2 TRP A 705 55.097 -15.440 -8.675 1.00 0.00 H new ATOM 0 HZ3 TRP A 705 50.920 -14.791 -9.278 1.00 0.00 H new ATOM 0 HH2 TRP A 705 53.028 -15.865 -9.928 1.00 0.00 H new ATOM 271 N GLU A 706 53.706 -8.996 -6.369 1.00 0.00 N ATOM 272 CA GLU A 706 54.785 -8.086 -6.375 1.00 0.00 C ATOM 273 C GLU A 706 54.256 -6.775 -6.910 1.00 0.00 C ATOM 274 O GLU A 706 53.190 -6.743 -7.523 1.00 0.00 O ATOM 275 CB GLU A 706 55.923 -8.600 -7.268 1.00 0.00 C ATOM 276 CG GLU A 706 56.516 -9.936 -6.869 1.00 0.00 C ATOM 277 CD GLU A 706 57.634 -10.331 -7.795 1.00 0.00 C ATOM 278 OE1 GLU A 706 58.726 -10.721 -7.313 1.00 0.00 O ATOM 279 OE2 GLU A 706 57.462 -10.209 -9.027 1.00 0.00 O ATOM 0 H GLU A 706 53.329 -9.183 -7.298 1.00 0.00 H new ATOM 0 HA GLU A 706 55.188 -7.965 -5.369 1.00 0.00 H new ATOM 0 HB2 GLU A 706 55.552 -8.678 -8.290 1.00 0.00 H new ATOM 0 HB3 GLU A 706 56.720 -7.856 -7.274 1.00 0.00 H new ATOM 0 HG2 GLU A 706 56.889 -9.881 -5.846 1.00 0.00 H new ATOM 0 HG3 GLU A 706 55.740 -10.701 -6.884 1.00 0.00 H new ATOM 286 N LYS A 707 54.948 -5.709 -6.663 1.00 0.00 N ATOM 287 CA LYS A 707 54.528 -4.436 -7.164 1.00 0.00 C ATOM 288 C LYS A 707 55.712 -3.529 -7.375 1.00 0.00 C ATOM 289 O LYS A 707 56.762 -3.695 -6.727 1.00 0.00 O ATOM 290 CB LYS A 707 53.412 -3.811 -6.285 1.00 0.00 C ATOM 291 CG LYS A 707 53.773 -3.437 -4.839 1.00 0.00 C ATOM 292 CD LYS A 707 54.374 -2.030 -4.712 1.00 0.00 C ATOM 293 CE LYS A 707 53.409 -0.940 -5.214 1.00 0.00 C ATOM 294 NZ LYS A 707 52.063 -1.019 -4.572 1.00 0.00 N ATOM 0 H LYS A 707 55.809 -5.693 -6.116 1.00 0.00 H new ATOM 0 HA LYS A 707 54.073 -4.581 -8.144 1.00 0.00 H new ATOM 0 HB2 LYS A 707 53.054 -2.911 -6.786 1.00 0.00 H new ATOM 0 HB3 LYS A 707 52.577 -4.511 -6.253 1.00 0.00 H new ATOM 0 HG2 LYS A 707 52.878 -3.500 -4.220 1.00 0.00 H new ATOM 0 HG3 LYS A 707 54.483 -4.166 -4.448 1.00 0.00 H new ATOM 0 HD2 LYS A 707 54.627 -1.837 -3.669 1.00 0.00 H new ATOM 0 HD3 LYS A 707 55.303 -1.981 -5.280 1.00 0.00 H new ATOM 0 HE2 LYS A 707 53.843 0.041 -5.019 1.00 0.00 H new ATOM 0 HE3 LYS A 707 53.297 -1.030 -6.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 707 51.500 -0.187 -4.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 707 51.578 -1.883 -4.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 707 52.172 -1.042 -3.538 1.00 0.00 H new ATOM 308 N LEU A 708 55.552 -2.602 -8.278 1.00 0.00 N ATOM 309 CA LEU A 708 56.602 -1.697 -8.658 1.00 0.00 C ATOM 310 C LEU A 708 56.627 -0.480 -7.751 1.00 0.00 C ATOM 311 O LEU A 708 55.660 0.287 -7.695 1.00 0.00 O ATOM 312 CB LEU A 708 56.407 -1.273 -10.126 1.00 0.00 C ATOM 313 CG LEU A 708 57.417 -0.274 -10.700 1.00 0.00 C ATOM 314 CD1 LEU A 708 58.826 -0.829 -10.640 1.00 0.00 C ATOM 315 CD2 LEU A 708 57.051 0.087 -12.130 1.00 0.00 C ATOM 0 H LEU A 708 54.676 -2.451 -8.778 1.00 0.00 H new ATOM 0 HA LEU A 708 57.560 -2.207 -8.554 1.00 0.00 H new ATOM 0 HB2 LEU A 708 56.429 -2.171 -10.744 1.00 0.00 H new ATOM 0 HB3 LEU A 708 55.411 -0.842 -10.225 1.00 0.00 H new ATOM 0 HG LEU A 708 57.383 0.629 -10.091 1.00 0.00 H new ATOM 0 HD11 LEU A 708 59.522 -0.100 -11.054 1.00 0.00 H new ATOM 0 HD12 LEU A 708 59.091 -1.037 -9.603 1.00 0.00 H new ATOM 0 HD13 LEU A 708 58.879 -1.751 -11.220 1.00 0.00 H new ATOM 0 HD21 LEU A 708 57.778 0.797 -12.523 1.00 0.00 H new ATOM 0 HD22 LEU A 708 57.054 -0.813 -12.745 1.00 0.00 H new ATOM 0 HD23 LEU A 708 56.058 0.536 -12.149 1.00 0.00 H new ATOM 327 N GLN A 709 57.697 -0.335 -7.014 1.00 0.00 N ATOM 328 CA GLN A 709 57.907 0.833 -6.194 1.00 0.00 C ATOM 329 C GLN A 709 59.385 1.080 -6.138 1.00 0.00 C ATOM 330 O GLN A 709 60.157 0.121 -6.218 1.00 0.00 O ATOM 331 CB GLN A 709 57.348 0.660 -4.760 1.00 0.00 C ATOM 332 CG GLN A 709 58.145 -0.287 -3.867 1.00 0.00 C ATOM 333 CD GLN A 709 57.533 -0.466 -2.490 1.00 0.00 C ATOM 334 OE1 GLN A 709 56.313 -0.385 -2.315 1.00 0.00 O ATOM 335 NE2 GLN A 709 58.361 -0.698 -1.507 1.00 0.00 N ATOM 0 H GLN A 709 58.449 -1.023 -6.964 1.00 0.00 H new ATOM 0 HA GLN A 709 57.373 1.676 -6.634 1.00 0.00 H new ATOM 0 HB2 GLN A 709 57.307 1.639 -4.282 1.00 0.00 H new ATOM 0 HB3 GLN A 709 56.323 0.295 -4.827 1.00 0.00 H new ATOM 0 HG2 GLN A 709 58.219 -1.259 -4.354 1.00 0.00 H new ATOM 0 HG3 GLN A 709 59.161 0.094 -3.760 1.00 0.00 H new ATOM 0 HE21 GLN A 709 59.363 -0.759 -1.688 1.00 0.00 H new ATOM 0 HE22 GLN A 709 58.006 -0.819 -0.559 1.00 0.00 H new ATOM 344 N ASN A 710 59.783 2.342 -6.099 1.00 0.00 N ATOM 345 CA ASN A 710 61.196 2.742 -5.923 1.00 0.00 C ATOM 346 C ASN A 710 62.032 2.205 -7.104 1.00 0.00 C ATOM 347 O ASN A 710 63.235 1.962 -6.985 1.00 0.00 O ATOM 348 CB ASN A 710 61.712 2.190 -4.566 1.00 0.00 C ATOM 349 CG ASN A 710 62.912 2.942 -3.978 1.00 0.00 C ATOM 350 OD1 ASN A 710 63.740 3.510 -4.688 1.00 0.00 O ATOM 351 ND2 ASN A 710 63.009 2.938 -2.668 1.00 0.00 N ATOM 0 H ASN A 710 59.143 3.131 -6.188 1.00 0.00 H new ATOM 0 HA ASN A 710 61.287 3.828 -5.911 1.00 0.00 H new ATOM 0 HB2 ASN A 710 60.895 2.218 -3.845 1.00 0.00 H new ATOM 0 HB3 ASN A 710 61.986 1.143 -4.697 1.00 0.00 H new ATOM 0 HD21 ASN A 710 63.787 3.415 -2.213 1.00 0.00 H new ATOM 0 HD22 ASN A 710 62.306 2.458 -2.106 1.00 0.00 H new ATOM 358 N SER A 711 61.348 2.034 -8.255 1.00 0.00 N ATOM 359 CA SER A 711 61.925 1.537 -9.503 1.00 0.00 C ATOM 360 C SER A 711 62.356 0.055 -9.412 1.00 0.00 C ATOM 361 O SER A 711 63.154 -0.419 -10.226 1.00 0.00 O ATOM 362 CB SER A 711 63.096 2.422 -9.933 1.00 0.00 C ATOM 363 OG SER A 711 62.678 3.768 -10.122 1.00 0.00 O ATOM 0 H SER A 711 60.353 2.246 -8.335 1.00 0.00 H new ATOM 0 HA SER A 711 61.144 1.585 -10.262 1.00 0.00 H new ATOM 0 HB2 SER A 711 63.881 2.384 -9.178 1.00 0.00 H new ATOM 0 HB3 SER A 711 63.525 2.038 -10.858 1.00 0.00 H new ATOM 0 HG SER A 711 63.445 4.314 -10.395 1.00 0.00 H new ATOM 369 N ARG A 712 61.796 -0.679 -8.467 1.00 0.00 N ATOM 370 CA ARG A 712 62.134 -2.076 -8.303 1.00 0.00 C ATOM 371 C ARG A 712 60.893 -2.924 -8.099 1.00 0.00 C ATOM 372 O ARG A 712 59.802 -2.400 -7.814 1.00 0.00 O ATOM 373 CB ARG A 712 63.113 -2.278 -7.139 1.00 0.00 C ATOM 374 CG ARG A 712 62.626 -1.742 -5.808 1.00 0.00 C ATOM 375 CD ARG A 712 63.620 -2.032 -4.701 1.00 0.00 C ATOM 376 NE ARG A 712 63.243 -1.411 -3.420 1.00 0.00 N ATOM 377 CZ ARG A 712 63.952 -0.447 -2.803 1.00 0.00 C ATOM 378 NH1 ARG A 712 65.028 0.076 -3.387 1.00 0.00 N ATOM 379 NH2 ARG A 712 63.559 0.016 -1.629 1.00 0.00 N ATOM 0 H ARG A 712 61.106 -0.328 -7.803 1.00 0.00 H new ATOM 0 HA ARG A 712 62.622 -2.400 -9.222 1.00 0.00 H new ATOM 0 HB2 ARG A 712 63.318 -3.343 -7.034 1.00 0.00 H new ATOM 0 HB3 ARG A 712 64.058 -1.794 -7.387 1.00 0.00 H new ATOM 0 HG2 ARG A 712 62.466 -0.666 -5.883 1.00 0.00 H new ATOM 0 HG3 ARG A 712 61.664 -2.191 -5.563 1.00 0.00 H new ATOM 0 HD2 ARG A 712 63.703 -3.110 -4.566 1.00 0.00 H new ATOM 0 HD3 ARG A 712 64.604 -1.671 -4.999 1.00 0.00 H new ATOM 0 HE ARG A 712 62.386 -1.733 -2.970 1.00 0.00 H new ATOM 0 HH11 ARG A 712 65.320 -0.253 -4.307 1.00 0.00 H new ATOM 0 HH12 ARG A 712 65.561 0.806 -2.914 1.00 0.00 H new ATOM 0 HH21 ARG A 712 62.718 -0.357 -1.189 1.00 0.00 H new ATOM 0 HH22 ARG A 712 64.097 0.746 -1.163 1.00 0.00 H new ATOM 393 N CYS A 713 61.065 -4.215 -8.221 1.00 0.00 N ATOM 394 CA CYS A 713 59.994 -5.153 -8.029 1.00 0.00 C ATOM 395 C CYS A 713 60.107 -5.698 -6.623 1.00 0.00 C ATOM 396 O CYS A 713 61.124 -6.298 -6.257 1.00 0.00 O ATOM 397 CB CYS A 713 60.127 -6.312 -9.027 1.00 0.00 C ATOM 398 SG CYS A 713 60.253 -5.805 -10.775 1.00 0.00 S ATOM 0 H CYS A 713 61.959 -4.646 -8.458 1.00 0.00 H new ATOM 0 HA CYS A 713 59.033 -4.663 -8.184 1.00 0.00 H new ATOM 0 HB2 CYS A 713 61.010 -6.896 -8.768 1.00 0.00 H new ATOM 0 HB3 CYS A 713 59.265 -6.970 -8.915 1.00 0.00 H new ATOM 0 HG CYS A 713 59.521 -6.590 -11.508 1.00 0.00 H new ATOM 403 N VAL A 714 59.118 -5.435 -5.821 1.00 0.00 N ATOM 404 CA VAL A 714 59.103 -5.894 -4.445 1.00 0.00 C ATOM 405 C VAL A 714 57.857 -6.695 -4.223 1.00 0.00 C ATOM 406 O VAL A 714 56.965 -6.646 -5.045 1.00 0.00 O ATOM 407 CB VAL A 714 59.116 -4.705 -3.443 1.00 0.00 C ATOM 408 CG1 VAL A 714 60.330 -3.841 -3.662 1.00 0.00 C ATOM 409 CG2 VAL A 714 57.843 -3.867 -3.548 1.00 0.00 C ATOM 0 H VAL A 714 58.295 -4.897 -6.093 1.00 0.00 H new ATOM 0 HA VAL A 714 59.997 -6.494 -4.274 1.00 0.00 H new ATOM 0 HB VAL A 714 59.158 -5.124 -2.438 1.00 0.00 H new ATOM 0 HG11 VAL A 714 60.321 -3.014 -2.952 1.00 0.00 H new ATOM 0 HG12 VAL A 714 61.231 -4.436 -3.515 1.00 0.00 H new ATOM 0 HG13 VAL A 714 60.317 -3.446 -4.678 1.00 0.00 H new ATOM 0 HG21 VAL A 714 57.888 -3.046 -2.833 1.00 0.00 H new ATOM 0 HG22 VAL A 714 57.754 -3.465 -4.557 1.00 0.00 H new ATOM 0 HG23 VAL A 714 56.977 -4.492 -3.329 1.00 0.00 H new ATOM 419 N CYS A 715 57.766 -7.376 -3.122 1.00 0.00 N ATOM 420 CA CYS A 715 56.567 -8.120 -2.817 1.00 0.00 C ATOM 421 C CYS A 715 55.646 -7.177 -2.084 1.00 0.00 C ATOM 422 O CYS A 715 56.111 -6.389 -1.248 1.00 0.00 O ATOM 423 CB CYS A 715 56.886 -9.353 -1.935 1.00 0.00 C ATOM 424 SG CYS A 715 58.087 -10.513 -2.676 1.00 0.00 S ATOM 0 H CYS A 715 58.501 -7.437 -2.417 1.00 0.00 H new ATOM 0 HA CYS A 715 56.106 -8.493 -3.731 1.00 0.00 H new ATOM 0 HB2 CYS A 715 57.274 -9.009 -0.976 1.00 0.00 H new ATOM 0 HB3 CYS A 715 55.959 -9.889 -1.730 1.00 0.00 H new ATOM 0 HG CYS A 715 58.288 -11.507 -1.863 1.00 0.00 H new ATOM 429 N LYS A 716 54.371 -7.191 -2.412 1.00 0.00 N ATOM 430 CA LYS A 716 53.446 -6.316 -1.729 1.00 0.00 C ATOM 431 C LYS A 716 53.161 -6.860 -0.338 1.00 0.00 C ATOM 432 O LYS A 716 53.705 -7.896 0.052 1.00 0.00 O ATOM 433 CB LYS A 716 52.150 -6.069 -2.526 1.00 0.00 C ATOM 434 CG LYS A 716 51.374 -7.316 -2.888 1.00 0.00 C ATOM 435 CD LYS A 716 49.983 -6.993 -3.427 1.00 0.00 C ATOM 436 CE LYS A 716 50.018 -6.155 -4.696 1.00 0.00 C ATOM 437 NZ LYS A 716 48.651 -5.817 -5.141 1.00 0.00 N ATOM 0 H LYS A 716 53.959 -7.785 -3.132 1.00 0.00 H new ATOM 0 HA LYS A 716 53.919 -5.338 -1.638 1.00 0.00 H new ATOM 0 HB2 LYS A 716 51.503 -5.413 -1.944 1.00 0.00 H new ATOM 0 HB3 LYS A 716 52.401 -5.537 -3.443 1.00 0.00 H new ATOM 0 HG2 LYS A 716 51.929 -7.883 -3.635 1.00 0.00 H new ATOM 0 HG3 LYS A 716 51.282 -7.953 -2.008 1.00 0.00 H new ATOM 0 HD2 LYS A 716 49.452 -7.923 -3.627 1.00 0.00 H new ATOM 0 HD3 LYS A 716 49.417 -6.461 -2.662 1.00 0.00 H new ATOM 0 HE2 LYS A 716 50.583 -5.240 -4.517 1.00 0.00 H new ATOM 0 HE3 LYS A 716 50.537 -6.702 -5.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 716 48.699 -5.123 -5.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 716 48.173 -6.677 -5.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 716 48.117 -5.412 -4.346 1.00 0.00 H new ATOM 451 N MET A 717 52.333 -6.193 0.402 1.00 0.00 N ATOM 452 CA MET A 717 52.107 -6.586 1.769 1.00 0.00 C ATOM 453 C MET A 717 50.726 -7.216 1.954 1.00 0.00 C ATOM 454 O MET A 717 49.768 -6.790 1.318 1.00 0.00 O ATOM 455 CB MET A 717 52.322 -5.404 2.694 1.00 0.00 C ATOM 456 CG MET A 717 53.755 -4.875 2.690 1.00 0.00 C ATOM 457 SD MET A 717 54.979 -6.100 3.239 1.00 0.00 S ATOM 458 CE MET A 717 54.533 -6.321 4.962 1.00 0.00 C ATOM 0 H MET A 717 51.803 -5.379 0.092 1.00 0.00 H new ATOM 0 HA MET A 717 52.833 -7.355 2.031 1.00 0.00 H new ATOM 0 HB2 MET A 717 51.646 -4.599 2.404 1.00 0.00 H new ATOM 0 HB3 MET A 717 52.054 -5.695 3.710 1.00 0.00 H new ATOM 0 HG2 MET A 717 54.009 -4.545 1.683 1.00 0.00 H new ATOM 0 HG3 MET A 717 53.813 -4.000 3.337 1.00 0.00 H new ATOM 0 HE1 MET A 717 55.286 -6.935 5.457 1.00 0.00 H new ATOM 0 HE2 MET A 717 54.479 -5.349 5.451 1.00 0.00 H new ATOM 0 HE3 MET A 717 53.563 -6.814 5.026 1.00 0.00 H new ATOM 468 N PRO A 718 50.596 -8.211 2.888 1.00 0.00 N ATOM 469 CA PRO A 718 49.355 -9.015 3.062 1.00 0.00 C ATOM 470 C PRO A 718 48.145 -8.203 3.514 1.00 0.00 C ATOM 471 O PRO A 718 47.008 -8.626 3.358 1.00 0.00 O ATOM 472 CB PRO A 718 49.716 -10.039 4.149 1.00 0.00 C ATOM 473 CG PRO A 718 51.201 -9.990 4.286 1.00 0.00 C ATOM 474 CD PRO A 718 51.637 -8.627 3.848 1.00 0.00 C ATOM 0 HA PRO A 718 49.059 -9.451 2.108 1.00 0.00 H new ATOM 0 HB2 PRO A 718 49.229 -9.794 5.093 1.00 0.00 H new ATOM 0 HB3 PRO A 718 49.383 -11.038 3.869 1.00 0.00 H new ATOM 0 HG2 PRO A 718 51.499 -10.177 5.318 1.00 0.00 H new ATOM 0 HG3 PRO A 718 51.670 -10.760 3.674 1.00 0.00 H new ATOM 0 HD2 PRO A 718 51.701 -7.938 4.691 1.00 0.00 H new ATOM 0 HD3 PRO A 718 52.622 -8.653 3.382 1.00 0.00 H new ATOM 482 N TYR A 719 48.392 -7.036 4.042 1.00 0.00 N ATOM 483 CA TYR A 719 47.326 -6.193 4.552 1.00 0.00 C ATOM 484 C TYR A 719 46.776 -5.298 3.453 1.00 0.00 C ATOM 485 O TYR A 719 45.784 -4.592 3.630 1.00 0.00 O ATOM 486 CB TYR A 719 47.794 -5.389 5.780 1.00 0.00 C ATOM 487 CG TYR A 719 49.075 -4.603 5.582 1.00 0.00 C ATOM 488 CD1 TYR A 719 50.311 -5.165 5.879 1.00 0.00 C ATOM 489 CD2 TYR A 719 49.050 -3.300 5.120 1.00 0.00 C ATOM 490 CE1 TYR A 719 51.475 -4.448 5.716 1.00 0.00 C ATOM 491 CE2 TYR A 719 50.211 -2.582 4.949 1.00 0.00 C ATOM 492 CZ TYR A 719 51.417 -3.154 5.248 1.00 0.00 C ATOM 493 OH TYR A 719 52.576 -2.434 5.060 1.00 0.00 O ATOM 0 H TYR A 719 49.326 -6.638 4.134 1.00 0.00 H new ATOM 0 HA TYR A 719 46.509 -6.833 4.887 1.00 0.00 H new ATOM 0 HB2 TYR A 719 47.002 -4.697 6.066 1.00 0.00 H new ATOM 0 HB3 TYR A 719 47.933 -6.077 6.614 1.00 0.00 H new ATOM 0 HD1 TYR A 719 50.359 -6.180 6.244 1.00 0.00 H new ATOM 0 HD2 TYR A 719 48.102 -2.837 4.889 1.00 0.00 H new ATOM 0 HE1 TYR A 719 52.428 -4.898 5.954 1.00 0.00 H new ATOM 0 HE2 TYR A 719 50.170 -1.568 4.579 1.00 0.00 H new ATOM 0 HH TYR A 719 52.355 -1.540 4.724 1.00 0.00 H new ATOM 503 N GLU A 720 47.413 -5.361 2.311 1.00 0.00 N ATOM 504 CA GLU A 720 47.007 -4.615 1.141 1.00 0.00 C ATOM 505 C GLU A 720 46.216 -5.539 0.214 1.00 0.00 C ATOM 506 O GLU A 720 45.790 -5.154 -0.880 1.00 0.00 O ATOM 507 CB GLU A 720 48.251 -4.098 0.415 1.00 0.00 C ATOM 508 CG GLU A 720 49.057 -3.057 1.181 1.00 0.00 C ATOM 509 CD GLU A 720 48.265 -1.808 1.462 1.00 0.00 C ATOM 510 OE1 GLU A 720 47.940 -1.542 2.631 1.00 0.00 O ATOM 511 OE2 GLU A 720 47.936 -1.076 0.515 1.00 0.00 O ATOM 0 H GLU A 720 48.240 -5.939 2.163 1.00 0.00 H new ATOM 0 HA GLU A 720 46.384 -3.770 1.434 1.00 0.00 H new ATOM 0 HB2 GLU A 720 48.900 -4.944 0.190 1.00 0.00 H new ATOM 0 HB3 GLU A 720 47.944 -3.669 -0.539 1.00 0.00 H new ATOM 0 HG2 GLU A 720 49.398 -3.487 2.123 1.00 0.00 H new ATOM 0 HG3 GLU A 720 49.947 -2.798 0.608 1.00 0.00 H new ATOM 518 N CYS A 721 46.013 -6.752 0.666 1.00 0.00 N ATOM 519 CA CYS A 721 45.359 -7.762 -0.123 1.00 0.00 C ATOM 520 C CYS A 721 43.851 -7.759 0.094 1.00 0.00 C ATOM 521 O CYS A 721 43.327 -8.500 0.931 1.00 0.00 O ATOM 522 CB CYS A 721 45.937 -9.128 0.202 1.00 0.00 C ATOM 523 SG CYS A 721 47.743 -9.229 0.013 1.00 0.00 S ATOM 0 H CYS A 721 46.298 -7.066 1.594 1.00 0.00 H new ATOM 0 HA CYS A 721 45.539 -7.535 -1.174 1.00 0.00 H new ATOM 0 HB2 CYS A 721 45.674 -9.388 1.227 1.00 0.00 H new ATOM 0 HB3 CYS A 721 45.472 -9.872 -0.445 1.00 0.00 H new ATOM 0 HG CYS A 721 48.297 -8.200 0.583 1.00 0.00 H new ATOM 528 N GLY A 722 43.173 -6.892 -0.612 1.00 0.00 N ATOM 529 CA GLY A 722 41.733 -6.825 -0.513 1.00 0.00 C ATOM 530 C GLY A 722 41.066 -7.535 -1.676 1.00 0.00 C ATOM 531 O GLY A 722 40.665 -8.703 -1.545 1.00 0.00 O ATOM 0 H GLY A 722 43.590 -6.224 -1.260 1.00 0.00 H new ATOM 0 HA2 GLY A 722 41.410 -7.276 0.425 1.00 0.00 H new ATOM 0 HA3 GLY A 722 41.416 -5.782 -0.491 1.00 0.00 H new ATOM 535 N PRO A 723 40.933 -6.856 -2.833 1.00 0.00 N ATOM 536 CA PRO A 723 40.333 -7.437 -4.048 1.00 0.00 C ATOM 537 C PRO A 723 41.072 -8.690 -4.519 1.00 0.00 C ATOM 538 O PRO A 723 42.217 -8.605 -4.985 1.00 0.00 O ATOM 539 CB PRO A 723 40.481 -6.319 -5.097 1.00 0.00 C ATOM 540 CG PRO A 723 41.497 -5.386 -4.527 1.00 0.00 C ATOM 541 CD PRO A 723 41.325 -5.453 -3.050 1.00 0.00 C ATOM 0 HA PRO A 723 39.303 -7.751 -3.876 1.00 0.00 H new ATOM 0 HB2 PRO A 723 40.807 -6.719 -6.057 1.00 0.00 H new ATOM 0 HB3 PRO A 723 39.532 -5.811 -5.269 1.00 0.00 H new ATOM 0 HG2 PRO A 723 42.505 -5.681 -4.817 1.00 0.00 H new ATOM 0 HG3 PRO A 723 41.344 -4.371 -4.893 1.00 0.00 H new ATOM 0 HD2 PRO A 723 42.246 -5.204 -2.523 1.00 0.00 H new ATOM 0 HD3 PRO A 723 40.560 -4.760 -2.700 1.00 0.00 H new ATOM 549 N SER A 724 40.434 -9.842 -4.353 1.00 0.00 N ATOM 550 CA SER A 724 40.981 -11.103 -4.730 1.00 0.00 C ATOM 551 C SER A 724 39.922 -12.190 -4.614 1.00 0.00 C ATOM 552 O SER A 724 38.909 -12.001 -3.930 1.00 0.00 O ATOM 553 CB SER A 724 42.202 -11.412 -3.863 1.00 0.00 C ATOM 554 OG SER A 724 41.981 -11.087 -2.496 1.00 0.00 O ATOM 0 H SER A 724 39.503 -9.908 -3.942 1.00 0.00 H new ATOM 0 HA SER A 724 41.303 -11.067 -5.771 1.00 0.00 H new ATOM 0 HB2 SER A 724 42.449 -12.470 -3.949 1.00 0.00 H new ATOM 0 HB3 SER A 724 43.061 -10.853 -4.234 1.00 0.00 H new ATOM 0 HG SER A 724 41.649 -10.167 -2.428 1.00 0.00 H new ATOM 560 N LEU A 725 40.128 -13.281 -5.309 1.00 0.00 N ATOM 561 CA LEU A 725 39.226 -14.423 -5.252 1.00 0.00 C ATOM 562 C LEU A 725 39.474 -15.260 -4.024 1.00 0.00 C ATOM 563 O LEU A 725 40.615 -15.554 -3.688 1.00 0.00 O ATOM 564 CB LEU A 725 39.362 -15.294 -6.495 1.00 0.00 C ATOM 565 CG LEU A 725 38.652 -14.811 -7.744 1.00 0.00 C ATOM 566 CD1 LEU A 725 39.101 -15.619 -8.943 1.00 0.00 C ATOM 567 CD2 LEU A 725 37.161 -14.973 -7.564 1.00 0.00 C ATOM 0 H LEU A 725 40.924 -13.410 -5.933 1.00 0.00 H new ATOM 0 HA LEU A 725 38.212 -14.025 -5.206 1.00 0.00 H new ATOM 0 HB2 LEU A 725 40.423 -15.397 -6.724 1.00 0.00 H new ATOM 0 HB3 LEU A 725 38.990 -16.290 -6.255 1.00 0.00 H new ATOM 0 HG LEU A 725 38.895 -13.761 -7.909 1.00 0.00 H new ATOM 0 HD11 LEU A 725 38.585 -15.264 -9.835 1.00 0.00 H new ATOM 0 HD12 LEU A 725 40.177 -15.505 -9.077 1.00 0.00 H new ATOM 0 HD13 LEU A 725 38.865 -16.671 -8.782 1.00 0.00 H new ATOM 0 HD21 LEU A 725 36.647 -14.627 -8.460 1.00 0.00 H new ATOM 0 HD22 LEU A 725 36.927 -16.024 -7.395 1.00 0.00 H new ATOM 0 HD23 LEU A 725 36.832 -14.385 -6.707 1.00 0.00 H new ATOM 579 N ASP A 726 38.409 -15.617 -3.348 1.00 0.00 N ATOM 580 CA ASP A 726 38.488 -16.461 -2.169 1.00 0.00 C ATOM 581 C ASP A 726 38.745 -17.894 -2.566 1.00 0.00 C ATOM 582 O ASP A 726 38.136 -18.404 -3.538 1.00 0.00 O ATOM 583 CB ASP A 726 37.206 -16.380 -1.328 1.00 0.00 C ATOM 584 CG ASP A 726 36.945 -15.010 -0.768 1.00 0.00 C ATOM 585 OD1 ASP A 726 37.408 -14.711 0.333 1.00 0.00 O ATOM 586 OD2 ASP A 726 36.257 -14.222 -1.424 1.00 0.00 O ATOM 0 H ASP A 726 37.461 -15.333 -3.595 1.00 0.00 H new ATOM 0 HA ASP A 726 39.317 -16.097 -1.561 1.00 0.00 H new ATOM 0 HB2 ASP A 726 36.358 -16.681 -1.943 1.00 0.00 H new ATOM 0 HB3 ASP A 726 37.273 -17.093 -0.507 1.00 0.00 H new ATOM 591 N VAL A 727 39.656 -18.528 -1.845 1.00 0.00 N ATOM 592 CA VAL A 727 40.055 -19.921 -2.051 1.00 0.00 C ATOM 593 C VAL A 727 40.356 -20.605 -0.706 1.00 0.00 C ATOM 594 O VAL A 727 40.609 -19.932 0.302 1.00 0.00 O ATOM 595 CB VAL A 727 41.301 -20.046 -2.967 1.00 0.00 C ATOM 596 CG1 VAL A 727 40.965 -19.663 -4.399 1.00 0.00 C ATOM 597 CG2 VAL A 727 42.455 -19.189 -2.434 1.00 0.00 C ATOM 0 H VAL A 727 40.156 -18.079 -1.077 1.00 0.00 H new ATOM 0 HA VAL A 727 39.216 -20.414 -2.542 1.00 0.00 H new ATOM 0 HB VAL A 727 41.618 -21.089 -2.962 1.00 0.00 H new ATOM 0 HG11 VAL A 727 41.856 -19.759 -5.020 1.00 0.00 H new ATOM 0 HG12 VAL A 727 40.185 -20.323 -4.779 1.00 0.00 H new ATOM 0 HG13 VAL A 727 40.613 -18.632 -4.427 1.00 0.00 H new ATOM 0 HG21 VAL A 727 43.318 -19.292 -3.091 1.00 0.00 H new ATOM 0 HG22 VAL A 727 42.147 -18.144 -2.400 1.00 0.00 H new ATOM 0 HG23 VAL A 727 42.722 -19.521 -1.431 1.00 0.00 H new ATOM 607 N CYS A 728 40.332 -21.915 -0.695 1.00 0.00 N ATOM 608 CA CYS A 728 40.579 -22.677 0.518 1.00 0.00 C ATOM 609 C CYS A 728 42.019 -23.151 0.520 1.00 0.00 C ATOM 610 O CYS A 728 42.476 -23.787 -0.448 1.00 0.00 O ATOM 611 CB CYS A 728 39.644 -23.887 0.574 1.00 0.00 C ATOM 612 SG CYS A 728 37.890 -23.486 0.300 1.00 0.00 S ATOM 0 H CYS A 728 40.142 -22.486 -1.518 1.00 0.00 H new ATOM 0 HA CYS A 728 40.395 -22.045 1.387 1.00 0.00 H new ATOM 0 HB2 CYS A 728 39.961 -24.612 -0.176 1.00 0.00 H new ATOM 0 HB3 CYS A 728 39.748 -24.368 1.547 1.00 0.00 H new ATOM 0 HG CYS A 728 37.216 -24.584 0.123 1.00 0.00 H new ATOM 617 N ALA A 729 42.736 -22.846 1.564 1.00 0.00 N ATOM 618 CA ALA A 729 44.116 -23.215 1.648 1.00 0.00 C ATOM 619 C ALA A 729 44.398 -23.903 2.959 1.00 0.00 C ATOM 620 O ALA A 729 43.685 -23.717 3.931 1.00 0.00 O ATOM 621 CB ALA A 729 44.995 -21.992 1.487 1.00 0.00 C ATOM 0 H ALA A 729 42.382 -22.338 2.374 1.00 0.00 H new ATOM 0 HA ALA A 729 44.342 -23.912 0.841 1.00 0.00 H new ATOM 0 HB1 ALA A 729 46.043 -22.286 1.553 1.00 0.00 H new ATOM 0 HB2 ALA A 729 44.807 -21.534 0.516 1.00 0.00 H new ATOM 0 HB3 ALA A 729 44.769 -21.275 2.276 1.00 0.00 H new ATOM 627 N GLN A 730 45.410 -24.694 2.972 1.00 0.00 N ATOM 628 CA GLN A 730 45.826 -25.395 4.142 1.00 0.00 C ATOM 629 C GLN A 730 47.087 -24.764 4.683 1.00 0.00 C ATOM 630 O GLN A 730 48.031 -24.466 3.932 1.00 0.00 O ATOM 631 CB GLN A 730 46.073 -26.874 3.848 1.00 0.00 C ATOM 632 CG GLN A 730 46.476 -27.672 5.081 1.00 0.00 C ATOM 633 CD GLN A 730 46.707 -29.136 4.807 1.00 0.00 C ATOM 634 OE1 GLN A 730 47.099 -29.529 3.711 1.00 0.00 O ATOM 635 NE2 GLN A 730 46.463 -29.964 5.790 1.00 0.00 N ATOM 0 H GLN A 730 45.988 -24.879 2.152 1.00 0.00 H new ATOM 0 HA GLN A 730 45.029 -25.329 4.882 1.00 0.00 H new ATOM 0 HB2 GLN A 730 45.169 -27.309 3.421 1.00 0.00 H new ATOM 0 HB3 GLN A 730 46.856 -26.962 3.094 1.00 0.00 H new ATOM 0 HG2 GLN A 730 47.386 -27.242 5.500 1.00 0.00 H new ATOM 0 HG3 GLN A 730 45.698 -27.572 5.838 1.00 0.00 H new ATOM 0 HE21 GLN A 730 46.138 -29.607 6.689 1.00 0.00 H new ATOM 0 HE22 GLN A 730 46.597 -30.966 5.658 1.00 0.00 H new ATOM 644 N ASP A 731 47.089 -24.545 5.957 1.00 0.00 N ATOM 645 CA ASP A 731 48.223 -23.996 6.656 1.00 0.00 C ATOM 646 C ASP A 731 49.203 -25.109 6.953 1.00 0.00 C ATOM 647 O ASP A 731 48.835 -26.084 7.571 1.00 0.00 O ATOM 648 CB ASP A 731 47.752 -23.375 7.962 1.00 0.00 C ATOM 649 CG ASP A 731 48.877 -22.813 8.782 1.00 0.00 C ATOM 650 OD1 ASP A 731 49.195 -23.387 9.831 1.00 0.00 O ATOM 651 OD2 ASP A 731 49.449 -21.794 8.404 1.00 0.00 O ATOM 0 H ASP A 731 46.291 -24.744 6.560 1.00 0.00 H new ATOM 0 HA ASP A 731 48.705 -23.234 6.043 1.00 0.00 H new ATOM 0 HB2 ASP A 731 47.037 -22.582 7.744 1.00 0.00 H new ATOM 0 HB3 ASP A 731 47.224 -24.128 8.547 1.00 0.00 H new ATOM 656 N GLU A 732 50.440 -24.974 6.529 1.00 0.00 N ATOM 657 CA GLU A 732 51.431 -26.029 6.743 1.00 0.00 C ATOM 658 C GLU A 732 51.920 -26.133 8.182 1.00 0.00 C ATOM 659 O GLU A 732 52.622 -27.083 8.531 1.00 0.00 O ATOM 660 CB GLU A 732 52.610 -25.893 5.790 1.00 0.00 C ATOM 661 CG GLU A 732 52.256 -26.217 4.357 1.00 0.00 C ATOM 662 CD GLU A 732 51.702 -27.608 4.231 1.00 0.00 C ATOM 663 OE1 GLU A 732 50.535 -27.764 3.864 1.00 0.00 O ATOM 664 OE2 GLU A 732 52.423 -28.575 4.515 1.00 0.00 O ATOM 0 H GLU A 732 50.791 -24.153 6.036 1.00 0.00 H new ATOM 0 HA GLU A 732 50.906 -26.960 6.527 1.00 0.00 H new ATOM 0 HB2 GLU A 732 52.995 -24.875 5.841 1.00 0.00 H new ATOM 0 HB3 GLU A 732 53.412 -26.554 6.118 1.00 0.00 H new ATOM 0 HG2 GLU A 732 51.524 -25.497 3.990 1.00 0.00 H new ATOM 0 HG3 GLU A 732 53.142 -26.118 3.730 1.00 0.00 H new ATOM 671 N ARG A 733 51.555 -25.185 9.006 1.00 0.00 N ATOM 672 CA ARG A 733 52.000 -25.180 10.370 1.00 0.00 C ATOM 673 C ARG A 733 51.007 -25.931 11.272 1.00 0.00 C ATOM 674 O ARG A 733 51.403 -26.750 12.104 1.00 0.00 O ATOM 675 CB ARG A 733 52.199 -23.734 10.845 1.00 0.00 C ATOM 676 CG ARG A 733 52.833 -23.597 12.219 1.00 0.00 C ATOM 677 CD ARG A 733 54.199 -24.254 12.249 1.00 0.00 C ATOM 678 NE ARG A 733 55.092 -23.707 11.218 1.00 0.00 N ATOM 679 CZ ARG A 733 56.077 -24.388 10.610 1.00 0.00 C ATOM 680 NH1 ARG A 733 56.308 -25.665 10.919 1.00 0.00 N ATOM 681 NH2 ARG A 733 56.824 -23.790 9.696 1.00 0.00 N ATOM 0 H ARG A 733 50.949 -24.405 8.752 1.00 0.00 H new ATOM 0 HA ARG A 733 52.956 -25.700 10.433 1.00 0.00 H new ATOM 0 HB2 ARG A 733 52.821 -23.210 10.119 1.00 0.00 H new ATOM 0 HB3 ARG A 733 51.231 -23.233 10.855 1.00 0.00 H new ATOM 0 HG2 ARG A 733 52.926 -22.542 12.478 1.00 0.00 H new ATOM 0 HG3 ARG A 733 52.188 -24.054 12.969 1.00 0.00 H new ATOM 0 HD2 ARG A 733 54.649 -24.112 13.232 1.00 0.00 H new ATOM 0 HD3 ARG A 733 54.089 -25.328 12.101 1.00 0.00 H new ATOM 0 HE ARG A 733 54.953 -22.735 10.943 1.00 0.00 H new ATOM 0 HH11 ARG A 733 55.734 -26.131 11.622 1.00 0.00 H new ATOM 0 HH12 ARG A 733 57.058 -26.175 10.452 1.00 0.00 H new ATOM 0 HH21 ARG A 733 56.651 -22.814 9.455 1.00 0.00 H new ATOM 0 HH22 ARG A 733 57.573 -24.305 9.233 1.00 0.00 H new ATOM 695 N SER A 734 49.740 -25.650 11.101 1.00 0.00 N ATOM 696 CA SER A 734 48.693 -26.267 11.899 1.00 0.00 C ATOM 697 C SER A 734 47.997 -27.412 11.150 1.00 0.00 C ATOM 698 O SER A 734 47.307 -28.247 11.762 1.00 0.00 O ATOM 699 CB SER A 734 47.670 -25.196 12.278 1.00 0.00 C ATOM 700 OG SER A 734 47.191 -24.535 11.114 1.00 0.00 O ATOM 0 H SER A 734 49.398 -24.987 10.406 1.00 0.00 H new ATOM 0 HA SER A 734 49.148 -26.696 12.792 1.00 0.00 H new ATOM 0 HB2 SER A 734 46.837 -25.652 12.813 1.00 0.00 H new ATOM 0 HB3 SER A 734 48.125 -24.472 12.954 1.00 0.00 H new ATOM 0 HG SER A 734 47.859 -23.887 10.808 1.00 0.00 H new ATOM 706 N LYS A 735 48.179 -27.440 9.825 1.00 0.00 N ATOM 707 CA LYS A 735 47.553 -28.393 8.924 1.00 0.00 C ATOM 708 C LYS A 735 46.052 -28.187 8.791 1.00 0.00 C ATOM 709 O LYS A 735 45.353 -29.054 8.276 1.00 0.00 O ATOM 710 CB LYS A 735 47.906 -29.846 9.259 1.00 0.00 C ATOM 711 CG LYS A 735 49.351 -30.215 8.980 1.00 0.00 C ATOM 712 CD LYS A 735 49.707 -29.958 7.525 1.00 0.00 C ATOM 713 CE LYS A 735 50.957 -30.719 7.135 1.00 0.00 C ATOM 714 NZ LYS A 735 51.262 -30.632 5.692 1.00 0.00 N ATOM 0 H LYS A 735 48.786 -26.777 9.343 1.00 0.00 H new ATOM 0 HA LYS A 735 47.979 -28.188 7.942 1.00 0.00 H new ATOM 0 HB2 LYS A 735 47.694 -30.026 10.313 1.00 0.00 H new ATOM 0 HB3 LYS A 735 47.257 -30.507 8.686 1.00 0.00 H new ATOM 0 HG2 LYS A 735 50.010 -29.636 9.627 1.00 0.00 H new ATOM 0 HG3 LYS A 735 49.514 -31.266 9.218 1.00 0.00 H new ATOM 0 HD2 LYS A 735 48.878 -30.259 6.884 1.00 0.00 H new ATOM 0 HD3 LYS A 735 49.861 -28.891 7.367 1.00 0.00 H new ATOM 0 HE2 LYS A 735 51.803 -30.332 7.703 1.00 0.00 H new ATOM 0 HE3 LYS A 735 50.839 -31.766 7.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 735 51.895 -31.412 5.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 735 50.379 -30.698 5.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 735 51.727 -29.724 5.490 1.00 0.00 H new ATOM 728 N ARG A 736 45.570 -27.016 9.168 1.00 0.00 N ATOM 729 CA ARG A 736 44.154 -26.752 9.076 1.00 0.00 C ATOM 730 C ARG A 736 43.836 -26.117 7.746 1.00 0.00 C ATOM 731 O ARG A 736 44.720 -25.546 7.094 1.00 0.00 O ATOM 732 CB ARG A 736 43.668 -25.817 10.172 1.00 0.00 C ATOM 733 CG ARG A 736 44.167 -24.402 10.038 1.00 0.00 C ATOM 734 CD ARG A 736 43.252 -23.460 10.755 1.00 0.00 C ATOM 735 NE ARG A 736 41.897 -23.478 10.174 1.00 0.00 N ATOM 736 CZ ARG A 736 40.788 -23.081 10.796 1.00 0.00 C ATOM 737 NH1 ARG A 736 40.843 -22.568 12.025 1.00 0.00 N ATOM 738 NH2 ARG A 736 39.620 -23.192 10.179 1.00 0.00 N ATOM 0 H ARG A 736 46.131 -26.247 9.534 1.00 0.00 H new ATOM 0 HA ARG A 736 43.648 -27.711 9.186 1.00 0.00 H new ATOM 0 HB2 ARG A 736 42.578 -25.808 10.171 1.00 0.00 H new ATOM 0 HB3 ARG A 736 43.983 -26.212 11.138 1.00 0.00 H new ATOM 0 HG2 ARG A 736 45.174 -24.324 10.447 1.00 0.00 H new ATOM 0 HG3 ARG A 736 44.229 -24.129 8.985 1.00 0.00 H new ATOM 0 HD2 ARG A 736 43.201 -23.732 11.809 1.00 0.00 H new ATOM 0 HD3 ARG A 736 43.657 -22.449 10.706 1.00 0.00 H new ATOM 0 HE ARG A 736 41.801 -23.822 9.219 1.00 0.00 H new ATOM 0 HH11 ARG A 736 41.741 -22.476 12.499 1.00 0.00 H new ATOM 0 HH12 ARG A 736 39.987 -22.267 12.491 1.00 0.00 H new ATOM 0 HH21 ARG A 736 39.576 -23.579 9.236 1.00 0.00 H new ATOM 0 HH22 ARG A 736 38.765 -22.891 10.647 1.00 0.00 H new ATOM 752 N ILE A 737 42.600 -26.196 7.356 1.00 0.00 N ATOM 753 CA ILE A 737 42.144 -25.552 6.164 1.00 0.00 C ATOM 754 C ILE A 737 41.573 -24.208 6.574 1.00 0.00 C ATOM 755 O ILE A 737 40.755 -24.132 7.511 1.00 0.00 O ATOM 756 CB ILE A 737 41.011 -26.344 5.476 1.00 0.00 C ATOM 757 CG1 ILE A 737 41.345 -27.846 5.366 1.00 0.00 C ATOM 758 CG2 ILE A 737 40.753 -25.758 4.088 1.00 0.00 C ATOM 759 CD1 ILE A 737 42.515 -28.164 4.476 1.00 0.00 C ATOM 0 H ILE A 737 41.877 -26.711 7.858 1.00 0.00 H new ATOM 0 HA ILE A 737 42.979 -25.470 5.469 1.00 0.00 H new ATOM 0 HB ILE A 737 40.114 -26.255 6.089 1.00 0.00 H new ATOM 0 HG12 ILE A 737 41.549 -28.233 6.364 1.00 0.00 H new ATOM 0 HG13 ILE A 737 40.467 -28.373 4.992 1.00 0.00 H new ATOM 0 HG21 ILE A 737 39.953 -26.316 3.600 1.00 0.00 H new ATOM 0 HG22 ILE A 737 40.460 -24.712 4.183 1.00 0.00 H new ATOM 0 HG23 ILE A 737 41.661 -25.827 3.489 1.00 0.00 H new ATOM 0 HD11 ILE A 737 42.677 -29.242 4.459 1.00 0.00 H new ATOM 0 HD12 ILE A 737 42.310 -27.812 3.465 1.00 0.00 H new ATOM 0 HD13 ILE A 737 43.408 -27.669 4.858 1.00 0.00 H new ATOM 771 N LEU A 738 42.021 -23.171 5.958 1.00 0.00 N ATOM 772 CA LEU A 738 41.507 -21.862 6.225 1.00 0.00 C ATOM 773 C LEU A 738 41.205 -21.140 4.925 1.00 0.00 C ATOM 774 O LEU A 738 41.844 -21.389 3.890 1.00 0.00 O ATOM 775 CB LEU A 738 42.425 -20.993 7.144 1.00 0.00 C ATOM 776 CG LEU A 738 43.780 -20.540 6.599 1.00 0.00 C ATOM 777 CD1 LEU A 738 44.400 -19.533 7.544 1.00 0.00 C ATOM 778 CD2 LEU A 738 44.694 -21.716 6.449 1.00 0.00 C ATOM 0 H LEU A 738 42.756 -23.200 5.252 1.00 0.00 H new ATOM 0 HA LEU A 738 40.584 -22.007 6.787 1.00 0.00 H new ATOM 0 HB2 LEU A 738 41.865 -20.101 7.424 1.00 0.00 H new ATOM 0 HB3 LEU A 738 42.607 -21.556 8.059 1.00 0.00 H new ATOM 0 HG LEU A 738 43.631 -20.078 5.623 1.00 0.00 H new ATOM 0 HD11 LEU A 738 45.365 -19.213 7.152 1.00 0.00 H new ATOM 0 HD12 LEU A 738 43.742 -18.669 7.638 1.00 0.00 H new ATOM 0 HD13 LEU A 738 44.540 -19.991 8.523 1.00 0.00 H new ATOM 0 HD21 LEU A 738 45.656 -21.382 6.060 1.00 0.00 H new ATOM 0 HD22 LEU A 738 44.840 -22.190 7.420 1.00 0.00 H new ATOM 0 HD23 LEU A 738 44.253 -22.434 5.758 1.00 0.00 H new ATOM 790 N PRO A 739 40.202 -20.295 4.949 1.00 0.00 N ATOM 791 CA PRO A 739 39.834 -19.472 3.815 1.00 0.00 C ATOM 792 C PRO A 739 40.829 -18.298 3.618 1.00 0.00 C ATOM 793 O PRO A 739 41.122 -17.526 4.555 1.00 0.00 O ATOM 794 CB PRO A 739 38.442 -18.959 4.208 1.00 0.00 C ATOM 795 CG PRO A 739 38.471 -18.929 5.695 1.00 0.00 C ATOM 796 CD PRO A 739 39.318 -20.091 6.099 1.00 0.00 C ATOM 0 HA PRO A 739 39.846 -20.014 2.869 1.00 0.00 H new ATOM 0 HB2 PRO A 739 38.251 -17.969 3.793 1.00 0.00 H new ATOM 0 HB3 PRO A 739 37.656 -19.617 3.838 1.00 0.00 H new ATOM 0 HG2 PRO A 739 38.890 -17.992 6.061 1.00 0.00 H new ATOM 0 HG3 PRO A 739 37.466 -19.012 6.109 1.00 0.00 H new ATOM 0 HD2 PRO A 739 39.884 -19.878 7.006 1.00 0.00 H new ATOM 0 HD3 PRO A 739 38.714 -20.975 6.301 1.00 0.00 H new ATOM 804 N LEU A 740 41.359 -18.203 2.431 1.00 0.00 N ATOM 805 CA LEU A 740 42.264 -17.152 2.029 1.00 0.00 C ATOM 806 C LEU A 740 41.795 -16.602 0.712 1.00 0.00 C ATOM 807 O LEU A 740 40.769 -17.032 0.189 1.00 0.00 O ATOM 808 CB LEU A 740 43.687 -17.693 1.859 1.00 0.00 C ATOM 809 CG LEU A 740 44.433 -18.055 3.138 1.00 0.00 C ATOM 810 CD1 LEU A 740 45.799 -18.570 2.796 1.00 0.00 C ATOM 811 CD2 LEU A 740 44.558 -16.843 4.051 1.00 0.00 C ATOM 0 H LEU A 740 41.169 -18.876 1.688 1.00 0.00 H new ATOM 0 HA LEU A 740 42.275 -16.378 2.797 1.00 0.00 H new ATOM 0 HB2 LEU A 740 43.642 -18.580 1.227 1.00 0.00 H new ATOM 0 HB3 LEU A 740 44.273 -16.948 1.321 1.00 0.00 H new ATOM 0 HG LEU A 740 43.869 -18.827 3.661 1.00 0.00 H new ATOM 0 HD11 LEU A 740 46.330 -18.828 3.712 1.00 0.00 H new ATOM 0 HD12 LEU A 740 45.707 -19.456 2.168 1.00 0.00 H new ATOM 0 HD13 LEU A 740 46.354 -17.801 2.259 1.00 0.00 H new ATOM 0 HD21 LEU A 740 45.094 -17.124 4.958 1.00 0.00 H new ATOM 0 HD22 LEU A 740 45.106 -16.054 3.536 1.00 0.00 H new ATOM 0 HD23 LEU A 740 43.564 -16.482 4.314 1.00 0.00 H new ATOM 823 N THR A 741 42.490 -15.661 0.200 1.00 0.00 N ATOM 824 CA THR A 741 42.213 -15.131 -1.095 1.00 0.00 C ATOM 825 C THR A 741 43.450 -15.242 -1.940 1.00 0.00 C ATOM 826 O THR A 741 44.525 -15.440 -1.396 1.00 0.00 O ATOM 827 CB THR A 741 41.756 -13.682 -1.003 1.00 0.00 C ATOM 828 OG1 THR A 741 42.287 -13.077 0.170 1.00 0.00 O ATOM 829 CG2 THR A 741 40.272 -13.571 -1.000 1.00 0.00 C ATOM 0 H THR A 741 43.283 -15.224 0.669 1.00 0.00 H new ATOM 0 HA THR A 741 41.405 -15.702 -1.552 1.00 0.00 H new ATOM 0 HB THR A 741 42.129 -13.161 -1.885 1.00 0.00 H new ATOM 0 HG1 THR A 741 41.990 -12.145 0.220 1.00 0.00 H new ATOM 0 HG21 THR A 741 39.986 -12.521 -0.933 1.00 0.00 H new ATOM 0 HG22 THR A 741 39.873 -13.998 -1.920 1.00 0.00 H new ATOM 0 HG23 THR A 741 39.868 -14.112 -0.144 1.00 0.00 H new ATOM 837 N VAL A 742 43.301 -15.134 -3.246 1.00 0.00 N ATOM 838 CA VAL A 742 44.415 -15.252 -4.185 1.00 0.00 C ATOM 839 C VAL A 742 45.537 -14.296 -3.838 1.00 0.00 C ATOM 840 O VAL A 742 46.670 -14.721 -3.589 1.00 0.00 O ATOM 841 CB VAL A 742 43.983 -14.954 -5.621 1.00 0.00 C ATOM 842 CG1 VAL A 742 45.102 -15.139 -6.601 1.00 0.00 C ATOM 843 CG2 VAL A 742 42.789 -15.739 -6.021 1.00 0.00 C ATOM 0 H VAL A 742 42.401 -14.961 -3.694 1.00 0.00 H new ATOM 0 HA VAL A 742 44.760 -16.283 -4.108 1.00 0.00 H new ATOM 0 HB VAL A 742 43.704 -13.901 -5.641 1.00 0.00 H new ATOM 0 HG11 VAL A 742 44.746 -14.916 -7.607 1.00 0.00 H new ATOM 0 HG12 VAL A 742 45.922 -14.466 -6.349 1.00 0.00 H new ATOM 0 HG13 VAL A 742 45.454 -16.170 -6.561 1.00 0.00 H new ATOM 0 HG21 VAL A 742 42.520 -15.494 -7.048 1.00 0.00 H new ATOM 0 HG22 VAL A 742 43.012 -16.803 -5.949 1.00 0.00 H new ATOM 0 HG23 VAL A 742 41.957 -15.497 -5.360 1.00 0.00 H new ATOM 853 N CYS A 743 45.215 -13.015 -3.835 1.00 0.00 N ATOM 854 CA CYS A 743 46.169 -11.975 -3.520 1.00 0.00 C ATOM 855 C CYS A 743 46.758 -12.199 -2.143 1.00 0.00 C ATOM 856 O CYS A 743 47.978 -12.210 -1.987 1.00 0.00 O ATOM 857 CB CYS A 743 45.517 -10.581 -3.619 1.00 0.00 C ATOM 858 SG CYS A 743 46.649 -9.175 -3.347 1.00 0.00 S ATOM 0 H CYS A 743 44.280 -12.669 -4.052 1.00 0.00 H new ATOM 0 HA CYS A 743 46.977 -12.018 -4.251 1.00 0.00 H new ATOM 0 HB2 CYS A 743 45.065 -10.478 -4.605 1.00 0.00 H new ATOM 0 HB3 CYS A 743 44.709 -10.523 -2.890 1.00 0.00 H new ATOM 0 HG CYS A 743 47.109 -9.217 -2.132 1.00 0.00 H new ATOM 863 N LYS A 744 45.887 -12.493 -1.173 1.00 0.00 N ATOM 864 CA LYS A 744 46.299 -12.653 0.203 1.00 0.00 C ATOM 865 C LYS A 744 47.250 -13.821 0.338 1.00 0.00 C ATOM 866 O LYS A 744 48.357 -13.626 0.746 1.00 0.00 O ATOM 867 CB LYS A 744 45.065 -12.829 1.073 1.00 0.00 C ATOM 868 CG LYS A 744 45.234 -12.684 2.581 1.00 0.00 C ATOM 869 CD LYS A 744 43.844 -12.571 3.219 1.00 0.00 C ATOM 870 CE LYS A 744 43.869 -12.320 4.723 1.00 0.00 C ATOM 871 NZ LYS A 744 44.304 -13.495 5.503 1.00 0.00 N ATOM 0 H LYS A 744 44.887 -12.624 -1.329 1.00 0.00 H new ATOM 0 HA LYS A 744 46.834 -11.764 0.535 1.00 0.00 H new ATOM 0 HB2 LYS A 744 44.319 -12.103 0.748 1.00 0.00 H new ATOM 0 HB3 LYS A 744 44.654 -13.819 0.875 1.00 0.00 H new ATOM 0 HG2 LYS A 744 45.768 -13.543 2.986 1.00 0.00 H new ATOM 0 HG3 LYS A 744 45.830 -11.801 2.812 1.00 0.00 H new ATOM 0 HD2 LYS A 744 43.298 -11.761 2.735 1.00 0.00 H new ATOM 0 HD3 LYS A 744 43.290 -13.489 3.024 1.00 0.00 H new ATOM 0 HE2 LYS A 744 44.537 -11.485 4.934 1.00 0.00 H new ATOM 0 HE3 LYS A 744 42.873 -12.023 5.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 744 44.300 -13.260 6.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 744 43.654 -14.288 5.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 744 45.266 -13.766 5.215 1.00 0.00 H new ATOM 885 N MET A 745 46.823 -15.006 -0.121 1.00 0.00 N ATOM 886 CA MET A 745 47.587 -16.261 0.006 1.00 0.00 C ATOM 887 C MET A 745 48.878 -16.211 -0.813 1.00 0.00 C ATOM 888 O MET A 745 49.850 -16.833 -0.450 1.00 0.00 O ATOM 889 CB MET A 745 46.704 -17.475 -0.404 1.00 0.00 C ATOM 890 CG MET A 745 46.901 -18.043 -1.815 1.00 0.00 C ATOM 891 SD MET A 745 48.255 -19.255 -1.919 1.00 0.00 S ATOM 892 CE MET A 745 47.641 -20.559 -0.841 1.00 0.00 C ATOM 0 H MET A 745 45.928 -15.124 -0.596 1.00 0.00 H new ATOM 0 HA MET A 745 47.872 -16.383 1.051 1.00 0.00 H new ATOM 0 HB2 MET A 745 46.882 -18.278 0.311 1.00 0.00 H new ATOM 0 HB3 MET A 745 45.659 -17.182 -0.301 1.00 0.00 H new ATOM 0 HG2 MET A 745 45.974 -18.515 -2.142 1.00 0.00 H new ATOM 0 HG3 MET A 745 47.102 -17.223 -2.505 1.00 0.00 H new ATOM 0 HE1 MET A 745 48.064 -21.515 -1.149 1.00 0.00 H new ATOM 0 HE2 MET A 745 47.933 -20.348 0.188 1.00 0.00 H new ATOM 0 HE3 MET A 745 46.554 -20.604 -0.908 1.00 0.00 H new ATOM 902 N HIS A 746 48.888 -15.449 -1.903 1.00 0.00 N ATOM 903 CA HIS A 746 50.107 -15.329 -2.717 1.00 0.00 C ATOM 904 C HIS A 746 51.150 -14.498 -2.021 1.00 0.00 C ATOM 905 O HIS A 746 52.314 -14.880 -1.968 1.00 0.00 O ATOM 906 CB HIS A 746 49.848 -14.720 -4.072 1.00 0.00 C ATOM 907 CG HIS A 746 49.696 -15.676 -5.201 1.00 0.00 C ATOM 908 ND1 HIS A 746 50.741 -16.413 -5.714 1.00 0.00 N ATOM 909 CD2 HIS A 746 48.638 -15.947 -5.978 1.00 0.00 C ATOM 910 CE1 HIS A 746 50.327 -17.087 -6.763 1.00 0.00 C ATOM 911 NE2 HIS A 746 49.054 -16.817 -6.945 1.00 0.00 N ATOM 0 H HIS A 746 48.089 -14.914 -2.243 1.00 0.00 H new ATOM 0 HA HIS A 746 50.465 -16.349 -2.854 1.00 0.00 H new ATOM 0 HB2 HIS A 746 48.943 -14.116 -4.009 1.00 0.00 H new ATOM 0 HB3 HIS A 746 50.668 -14.041 -4.305 1.00 0.00 H new ATOM 0 HD2 HIS A 746 47.640 -15.550 -5.861 1.00 0.00 H new ATOM 0 HE1 HIS A 746 50.928 -17.748 -7.370 1.00 0.00 H new ATOM 0 HE2 HIS A 746 48.470 -17.197 -7.690 1.00 0.00 H new ATOM 920 N VAL A 747 50.736 -13.362 -1.506 1.00 0.00 N ATOM 921 CA VAL A 747 51.628 -12.480 -0.779 1.00 0.00 C ATOM 922 C VAL A 747 52.091 -13.189 0.479 1.00 0.00 C ATOM 923 O VAL A 747 53.267 -13.240 0.779 1.00 0.00 O ATOM 924 CB VAL A 747 50.925 -11.155 -0.462 1.00 0.00 C ATOM 925 CG1 VAL A 747 51.774 -10.279 0.436 1.00 0.00 C ATOM 926 CG2 VAL A 747 50.620 -10.437 -1.763 1.00 0.00 C ATOM 0 H VAL A 747 49.777 -13.023 -1.577 1.00 0.00 H new ATOM 0 HA VAL A 747 52.501 -12.240 -1.386 1.00 0.00 H new ATOM 0 HB VAL A 747 49.999 -11.367 0.072 1.00 0.00 H new ATOM 0 HG11 VAL A 747 51.246 -9.348 0.641 1.00 0.00 H new ATOM 0 HG12 VAL A 747 51.969 -10.800 1.374 1.00 0.00 H new ATOM 0 HG13 VAL A 747 52.719 -10.058 -0.059 1.00 0.00 H new ATOM 0 HG21 VAL A 747 50.120 -9.493 -1.549 1.00 0.00 H new ATOM 0 HG22 VAL A 747 51.550 -10.242 -2.298 1.00 0.00 H new ATOM 0 HG23 VAL A 747 49.971 -11.060 -2.379 1.00 0.00 H new ATOM 936 N LEU A 748 51.141 -13.786 1.136 1.00 0.00 N ATOM 937 CA LEU A 748 51.309 -14.683 2.274 1.00 0.00 C ATOM 938 C LEU A 748 52.440 -15.701 1.935 1.00 0.00 C ATOM 939 O LEU A 748 53.399 -15.884 2.694 1.00 0.00 O ATOM 940 CB LEU A 748 49.898 -15.344 2.368 1.00 0.00 C ATOM 941 CG LEU A 748 49.504 -16.476 3.298 1.00 0.00 C ATOM 942 CD1 LEU A 748 50.294 -17.708 3.093 1.00 0.00 C ATOM 943 CD2 LEU A 748 49.366 -16.056 4.732 1.00 0.00 C ATOM 0 H LEU A 748 50.160 -13.661 0.886 1.00 0.00 H new ATOM 0 HA LEU A 748 51.604 -14.219 3.215 1.00 0.00 H new ATOM 0 HB2 LEU A 748 49.206 -14.530 2.585 1.00 0.00 H new ATOM 0 HB3 LEU A 748 49.671 -15.697 1.362 1.00 0.00 H new ATOM 0 HG LEU A 748 48.492 -16.753 3.004 1.00 0.00 H new ATOM 0 HD11 LEU A 748 49.959 -18.475 3.791 1.00 0.00 H new ATOM 0 HD12 LEU A 748 50.157 -18.062 2.071 1.00 0.00 H new ATOM 0 HD13 LEU A 748 51.349 -17.496 3.265 1.00 0.00 H new ATOM 0 HD21 LEU A 748 49.083 -16.917 5.338 1.00 0.00 H new ATOM 0 HD22 LEU A 748 50.317 -15.659 5.088 1.00 0.00 H new ATOM 0 HD23 LEU A 748 48.598 -15.287 4.813 1.00 0.00 H new ATOM 955 N HIS A 749 52.336 -16.268 0.755 1.00 0.00 N ATOM 956 CA HIS A 749 53.233 -17.292 0.265 1.00 0.00 C ATOM 957 C HIS A 749 54.637 -16.727 -0.027 1.00 0.00 C ATOM 958 O HIS A 749 55.635 -17.369 0.283 1.00 0.00 O ATOM 959 CB HIS A 749 52.636 -17.899 -1.010 1.00 0.00 C ATOM 960 CG HIS A 749 53.159 -19.235 -1.379 1.00 0.00 C ATOM 961 ND1 HIS A 749 54.073 -19.450 -2.373 1.00 0.00 N ATOM 962 CD2 HIS A 749 52.841 -20.445 -0.898 1.00 0.00 C ATOM 963 CE1 HIS A 749 54.290 -20.735 -2.487 1.00 0.00 C ATOM 964 NE2 HIS A 749 53.558 -21.362 -1.603 1.00 0.00 N ATOM 0 H HIS A 749 51.603 -16.023 0.089 1.00 0.00 H new ATOM 0 HA HIS A 749 53.344 -18.056 1.034 1.00 0.00 H new ATOM 0 HB2 HIS A 749 51.555 -17.971 -0.887 1.00 0.00 H new ATOM 0 HB3 HIS A 749 52.818 -17.214 -1.838 1.00 0.00 H new ATOM 0 HD2 HIS A 749 52.145 -20.654 -0.099 1.00 0.00 H new ATOM 0 HE1 HIS A 749 54.962 -21.200 -3.193 1.00 0.00 H new ATOM 0 HE2 HIS A 749 53.529 -22.372 -1.465 1.00 0.00 H new ATOM 973 N CYS A 750 54.715 -15.530 -0.598 1.00 0.00 N ATOM 974 CA CYS A 750 56.011 -14.961 -0.979 1.00 0.00 C ATOM 975 C CYS A 750 56.704 -14.292 0.205 1.00 0.00 C ATOM 976 O CYS A 750 57.931 -14.151 0.220 1.00 0.00 O ATOM 977 CB CYS A 750 55.888 -13.996 -2.175 1.00 0.00 C ATOM 978 SG CYS A 750 54.813 -12.549 -1.898 1.00 0.00 S ATOM 0 H CYS A 750 53.911 -14.939 -0.807 1.00 0.00 H new ATOM 0 HA CYS A 750 56.638 -15.793 -1.299 1.00 0.00 H new ATOM 0 HB2 CYS A 750 56.884 -13.643 -2.440 1.00 0.00 H new ATOM 0 HB3 CYS A 750 55.508 -14.552 -3.032 1.00 0.00 H new ATOM 0 HG CYS A 750 54.265 -12.634 -0.722 1.00 0.00 H new ATOM 983 N GLN A 751 55.922 -13.913 1.214 1.00 0.00 N ATOM 984 CA GLN A 751 56.454 -13.311 2.430 1.00 0.00 C ATOM 985 C GLN A 751 57.246 -14.345 3.228 1.00 0.00 C ATOM 986 O GLN A 751 58.101 -14.004 4.039 1.00 0.00 O ATOM 987 CB GLN A 751 55.317 -12.739 3.288 1.00 0.00 C ATOM 988 CG GLN A 751 54.672 -11.474 2.729 1.00 0.00 C ATOM 989 CD GLN A 751 55.586 -10.267 2.748 1.00 0.00 C ATOM 990 OE1 GLN A 751 56.466 -10.145 3.603 1.00 0.00 O ATOM 991 NE2 GLN A 751 55.378 -9.352 1.834 1.00 0.00 N ATOM 0 H GLN A 751 54.907 -14.015 1.210 1.00 0.00 H new ATOM 0 HA GLN A 751 57.121 -12.496 2.149 1.00 0.00 H new ATOM 0 HB2 GLN A 751 54.548 -13.502 3.403 1.00 0.00 H new ATOM 0 HB3 GLN A 751 55.704 -12.524 4.284 1.00 0.00 H new ATOM 0 HG2 GLN A 751 54.353 -11.662 1.704 1.00 0.00 H new ATOM 0 HG3 GLN A 751 53.775 -11.249 3.305 1.00 0.00 H new ATOM 0 HE21 GLN A 751 54.642 -9.482 1.140 1.00 0.00 H new ATOM 0 HE22 GLN A 751 55.952 -8.509 1.816 1.00 0.00 H new ATOM 1000 N GLY A 752 56.963 -15.607 2.972 1.00 0.00 N ATOM 1001 CA GLY A 752 57.662 -16.668 3.644 1.00 0.00 C ATOM 1002 C GLY A 752 56.748 -17.509 4.497 1.00 0.00 C ATOM 1003 O GLY A 752 57.123 -17.926 5.598 1.00 0.00 O ATOM 0 H GLY A 752 56.256 -15.915 2.305 1.00 0.00 H new ATOM 0 HA2 GLY A 752 58.150 -17.303 2.905 1.00 0.00 H new ATOM 0 HA3 GLY A 752 58.448 -16.243 4.268 1.00 0.00 H new ATOM 1007 N ARG A 753 55.531 -17.713 4.038 1.00 0.00 N ATOM 1008 CA ARG A 753 54.597 -18.575 4.735 1.00 0.00 C ATOM 1009 C ARG A 753 54.196 -19.701 3.808 1.00 0.00 C ATOM 1010 O ARG A 753 53.871 -19.467 2.633 1.00 0.00 O ATOM 1011 CB ARG A 753 53.355 -17.807 5.200 1.00 0.00 C ATOM 1012 CG ARG A 753 53.647 -16.594 6.062 1.00 0.00 C ATOM 1013 CD ARG A 753 54.452 -16.970 7.291 1.00 0.00 C ATOM 1014 NE ARG A 753 54.732 -15.813 8.130 1.00 0.00 N ATOM 1015 CZ ARG A 753 55.952 -15.402 8.493 1.00 0.00 C ATOM 1016 NH1 ARG A 753 57.043 -15.999 7.993 1.00 0.00 N ATOM 1017 NH2 ARG A 753 56.078 -14.380 9.334 1.00 0.00 N ATOM 0 H ARG A 753 55.164 -17.293 3.184 1.00 0.00 H new ATOM 0 HA ARG A 753 55.083 -18.971 5.626 1.00 0.00 H new ATOM 0 HB2 ARG A 753 52.793 -17.486 4.323 1.00 0.00 H new ATOM 0 HB3 ARG A 753 52.712 -18.487 5.759 1.00 0.00 H new ATOM 0 HG2 ARG A 753 54.195 -15.854 5.478 1.00 0.00 H new ATOM 0 HG3 ARG A 753 52.710 -16.128 6.367 1.00 0.00 H new ATOM 0 HD2 ARG A 753 53.905 -17.715 7.870 1.00 0.00 H new ATOM 0 HD3 ARG A 753 55.390 -17.431 6.983 1.00 0.00 H new ATOM 0 HE ARG A 753 53.935 -15.273 8.467 1.00 0.00 H new ATOM 0 HH11 ARG A 753 56.945 -16.770 7.333 1.00 0.00 H new ATOM 0 HH12 ARG A 753 57.971 -15.682 8.273 1.00 0.00 H new ATOM 0 HH21 ARG A 753 55.247 -13.914 9.699 1.00 0.00 H new ATOM 0 HH22 ARG A 753 57.006 -14.062 9.615 1.00 0.00 H new ATOM 1031 N ASN A 754 54.227 -20.904 4.312 1.00 0.00 N ATOM 1032 CA ASN A 754 53.934 -22.068 3.505 1.00 0.00 C ATOM 1033 C ASN A 754 52.514 -22.493 3.672 1.00 0.00 C ATOM 1034 O ASN A 754 52.075 -22.875 4.778 1.00 0.00 O ATOM 1035 CB ASN A 754 54.863 -23.237 3.822 1.00 0.00 C ATOM 1036 CG ASN A 754 56.312 -22.926 3.561 1.00 0.00 C ATOM 1037 OD1 ASN A 754 56.815 -23.108 2.451 1.00 0.00 O ATOM 1038 ND2 ASN A 754 56.996 -22.495 4.573 1.00 0.00 N ATOM 0 H ASN A 754 54.454 -21.110 5.285 1.00 0.00 H new ATOM 0 HA ASN A 754 54.100 -21.777 2.468 1.00 0.00 H new ATOM 0 HB2 ASN A 754 54.740 -23.518 4.868 1.00 0.00 H new ATOM 0 HB3 ASN A 754 54.569 -24.100 3.224 1.00 0.00 H new ATOM 0 HD21 ASN A 754 57.990 -22.293 4.468 1.00 0.00 H new ATOM 0 HD22 ASN A 754 56.540 -22.358 5.475 1.00 0.00 H new ATOM 1045 N TYR A 755 51.784 -22.384 2.603 1.00 0.00 N ATOM 1046 CA TYR A 755 50.403 -22.765 2.544 1.00 0.00 C ATOM 1047 C TYR A 755 50.177 -23.548 1.295 1.00 0.00 C ATOM 1048 O TYR A 755 50.725 -23.222 0.232 1.00 0.00 O ATOM 1049 CB TYR A 755 49.468 -21.554 2.551 1.00 0.00 C ATOM 1050 CG TYR A 755 49.241 -20.870 3.898 1.00 0.00 C ATOM 1051 CD1 TYR A 755 50.292 -20.474 4.707 1.00 0.00 C ATOM 1052 CD2 TYR A 755 47.970 -20.561 4.312 1.00 0.00 C ATOM 1053 CE1 TYR A 755 50.080 -19.791 5.876 1.00 0.00 C ATOM 1054 CE2 TYR A 755 47.745 -19.883 5.489 1.00 0.00 C ATOM 1055 CZ TYR A 755 48.806 -19.497 6.265 1.00 0.00 C ATOM 1056 OH TYR A 755 48.594 -18.791 7.429 1.00 0.00 O ATOM 0 H TYR A 755 52.142 -22.017 1.721 1.00 0.00 H new ATOM 0 HA TYR A 755 50.179 -23.360 3.429 1.00 0.00 H new ATOM 0 HB2 TYR A 755 49.865 -20.814 1.856 1.00 0.00 H new ATOM 0 HB3 TYR A 755 48.500 -21.869 2.162 1.00 0.00 H new ATOM 0 HD1 TYR A 755 51.303 -20.709 4.410 1.00 0.00 H new ATOM 0 HD2 TYR A 755 47.129 -20.856 3.702 1.00 0.00 H new ATOM 0 HE1 TYR A 755 50.918 -19.487 6.486 1.00 0.00 H new ATOM 0 HE2 TYR A 755 46.736 -19.656 5.799 1.00 0.00 H new ATOM 0 HH TYR A 755 47.632 -18.663 7.563 1.00 0.00 H new ATOM 1066 N THR A 756 49.392 -24.539 1.422 1.00 0.00 N ATOM 1067 CA THR A 756 49.061 -25.436 0.369 1.00 0.00 C ATOM 1068 C THR A 756 47.614 -25.180 -0.030 1.00 0.00 C ATOM 1069 O THR A 756 46.857 -24.669 0.766 1.00 0.00 O ATOM 1070 CB THR A 756 49.213 -26.859 0.934 1.00 0.00 C ATOM 1071 OG1 THR A 756 50.567 -27.069 1.349 1.00 0.00 O ATOM 1072 CG2 THR A 756 48.802 -27.919 -0.048 1.00 0.00 C ATOM 0 H THR A 756 48.934 -24.768 2.304 1.00 0.00 H new ATOM 0 HA THR A 756 49.700 -25.306 -0.504 1.00 0.00 H new ATOM 0 HB THR A 756 48.542 -26.944 1.789 1.00 0.00 H new ATOM 0 HG1 THR A 756 50.583 -27.673 2.121 1.00 0.00 H new ATOM 0 HG21 THR A 756 48.930 -28.903 0.404 1.00 0.00 H new ATOM 0 HG22 THR A 756 47.756 -27.778 -0.319 1.00 0.00 H new ATOM 0 HG23 THR A 756 49.422 -27.847 -0.942 1.00 0.00 H new ATOM 1080 N LEU A 757 47.236 -25.459 -1.249 1.00 0.00 N ATOM 1081 CA LEU A 757 45.854 -25.329 -1.590 1.00 0.00 C ATOM 1082 C LEU A 757 45.175 -26.648 -1.541 1.00 0.00 C ATOM 1083 O LEU A 757 45.766 -27.682 -1.872 1.00 0.00 O ATOM 1084 CB LEU A 757 45.607 -24.669 -2.921 1.00 0.00 C ATOM 1085 CG LEU A 757 45.972 -23.217 -3.003 1.00 0.00 C ATOM 1086 CD1 LEU A 757 47.382 -23.021 -3.543 1.00 0.00 C ATOM 1087 CD2 LEU A 757 44.926 -22.473 -3.787 1.00 0.00 C ATOM 0 H LEU A 757 47.851 -25.769 -2.002 1.00 0.00 H new ATOM 0 HA LEU A 757 45.430 -24.664 -0.838 1.00 0.00 H new ATOM 0 HB2 LEU A 757 46.168 -25.210 -3.684 1.00 0.00 H new ATOM 0 HB3 LEU A 757 44.550 -24.774 -3.168 1.00 0.00 H new ATOM 0 HG LEU A 757 45.988 -22.795 -1.998 1.00 0.00 H new ATOM 0 HD11 LEU A 757 47.610 -21.956 -3.588 1.00 0.00 H new ATOM 0 HD12 LEU A 757 48.096 -23.517 -2.886 1.00 0.00 H new ATOM 0 HD13 LEU A 757 47.451 -23.449 -4.543 1.00 0.00 H new ATOM 0 HD21 LEU A 757 45.196 -21.418 -3.844 1.00 0.00 H new ATOM 0 HD22 LEU A 757 44.863 -22.886 -4.794 1.00 0.00 H new ATOM 0 HD23 LEU A 757 43.960 -22.574 -3.292 1.00 0.00 H new ATOM 1099 N THR A 758 43.954 -26.628 -1.147 1.00 0.00 N ATOM 1100 CA THR A 758 43.184 -27.822 -1.015 1.00 0.00 C ATOM 1101 C THR A 758 41.942 -27.724 -1.879 1.00 0.00 C ATOM 1102 O THR A 758 41.873 -26.865 -2.774 1.00 0.00 O ATOM 1103 CB THR A 758 42.812 -28.036 0.462 1.00 0.00 C ATOM 1104 OG1 THR A 758 42.263 -26.817 0.998 1.00 0.00 O ATOM 1105 CG2 THR A 758 44.037 -28.460 1.265 1.00 0.00 C ATOM 0 H THR A 758 43.450 -25.775 -0.903 1.00 0.00 H new ATOM 0 HA THR A 758 43.770 -28.678 -1.350 1.00 0.00 H new ATOM 0 HB THR A 758 42.067 -28.829 0.531 1.00 0.00 H new ATOM 0 HG1 THR A 758 42.814 -26.513 1.749 1.00 0.00 H new ATOM 0 HG21 THR A 758 43.756 -28.607 2.308 1.00 0.00 H new ATOM 0 HG22 THR A 758 44.432 -29.392 0.861 1.00 0.00 H new ATOM 0 HG23 THR A 758 44.800 -27.684 1.201 1.00 0.00 H new ATOM 1113 N GLY A 759 40.991 -28.594 -1.646 1.00 0.00 N ATOM 1114 CA GLY A 759 39.764 -28.554 -2.384 1.00 0.00 C ATOM 1115 C GLY A 759 38.901 -27.389 -1.946 1.00 0.00 C ATOM 1116 O GLY A 759 39.128 -26.803 -0.873 1.00 0.00 O ATOM 0 H GLY A 759 41.048 -29.337 -0.950 1.00 0.00 H new ATOM 0 HA2 GLY A 759 39.979 -28.470 -3.449 1.00 0.00 H new ATOM 0 HA3 GLY A 759 39.220 -29.487 -2.241 1.00 0.00 H new ATOM 1120 N ARG A 760 37.903 -27.067 -2.730 1.00 0.00 N ATOM 1121 CA ARG A 760 37.044 -25.933 -2.441 1.00 0.00 C ATOM 1122 C ARG A 760 36.056 -26.308 -1.320 1.00 0.00 C ATOM 1123 O ARG A 760 35.487 -25.453 -0.664 1.00 0.00 O ATOM 1124 CB ARG A 760 36.317 -25.465 -3.741 1.00 0.00 C ATOM 1125 CG ARG A 760 35.116 -26.314 -4.154 1.00 0.00 C ATOM 1126 CD ARG A 760 33.834 -25.732 -3.582 1.00 0.00 C ATOM 1127 NE ARG A 760 32.823 -26.737 -3.308 1.00 0.00 N ATOM 1128 CZ ARG A 760 31.548 -26.467 -3.036 1.00 0.00 C ATOM 1129 NH1 ARG A 760 31.032 -25.271 -3.343 1.00 0.00 N ATOM 1130 NH2 ARG A 760 30.785 -27.397 -2.470 1.00 0.00 N ATOM 0 H ARG A 760 37.660 -27.575 -3.581 1.00 0.00 H new ATOM 0 HA ARG A 760 37.642 -25.092 -2.088 1.00 0.00 H new ATOM 0 HB2 ARG A 760 35.984 -24.436 -3.602 1.00 0.00 H new ATOM 0 HB3 ARG A 760 37.037 -25.460 -4.559 1.00 0.00 H new ATOM 0 HG2 ARG A 760 35.050 -26.357 -5.241 1.00 0.00 H new ATOM 0 HG3 ARG A 760 35.247 -27.337 -3.802 1.00 0.00 H new ATOM 0 HD2 ARG A 760 34.065 -25.197 -2.661 1.00 0.00 H new ATOM 0 HD3 ARG A 760 33.430 -25.001 -4.282 1.00 0.00 H new ATOM 0 HE ARG A 760 33.109 -27.716 -3.325 1.00 0.00 H new ATOM 0 HH11 ARG A 760 31.616 -24.562 -3.787 1.00 0.00 H new ATOM 0 HH12 ARG A 760 30.055 -25.068 -3.133 1.00 0.00 H new ATOM 0 HH21 ARG A 760 31.177 -28.312 -2.246 1.00 0.00 H new ATOM 0 HH22 ARG A 760 29.807 -27.196 -2.259 1.00 0.00 H new ATOM 1144 N ASP A 761 35.878 -27.604 -1.117 1.00 0.00 N ATOM 1145 CA ASP A 761 34.980 -28.128 -0.082 1.00 0.00 C ATOM 1146 C ASP A 761 35.718 -28.331 1.224 1.00 0.00 C ATOM 1147 O ASP A 761 35.159 -28.854 2.182 1.00 0.00 O ATOM 1148 CB ASP A 761 34.356 -29.477 -0.502 1.00 0.00 C ATOM 1149 CG ASP A 761 33.286 -29.369 -1.563 1.00 0.00 C ATOM 1150 OD1 ASP A 761 33.613 -29.244 -2.764 1.00 0.00 O ATOM 1151 OD2 ASP A 761 32.077 -29.422 -1.228 1.00 0.00 O ATOM 0 H ASP A 761 36.348 -28.327 -1.661 1.00 0.00 H new ATOM 0 HA ASP A 761 34.189 -27.389 0.048 1.00 0.00 H new ATOM 0 HB2 ASP A 761 35.148 -30.131 -0.868 1.00 0.00 H new ATOM 0 HB3 ASP A 761 33.929 -29.955 0.379 1.00 0.00 H new ATOM 1156 N SER A 762 36.965 -27.918 1.276 1.00 0.00 N ATOM 1157 CA SER A 762 37.771 -28.136 2.454 1.00 0.00 C ATOM 1158 C SER A 762 37.444 -27.168 3.609 1.00 0.00 C ATOM 1159 O SER A 762 37.707 -27.479 4.760 1.00 0.00 O ATOM 1160 CB SER A 762 39.249 -28.141 2.091 1.00 0.00 C ATOM 1161 OG SER A 762 39.518 -29.152 1.116 1.00 0.00 O ATOM 0 H SER A 762 37.441 -27.430 0.517 1.00 0.00 H new ATOM 0 HA SER A 762 37.516 -29.122 2.842 1.00 0.00 H new ATOM 0 HB2 SER A 762 39.538 -27.165 1.702 1.00 0.00 H new ATOM 0 HB3 SER A 762 39.849 -28.318 2.984 1.00 0.00 H new ATOM 0 HG SER A 762 40.280 -29.694 1.409 1.00 0.00 H new ATOM 1167 N CYS A 763 36.882 -26.014 3.314 1.00 0.00 N ATOM 1168 CA CYS A 763 36.467 -25.099 4.372 1.00 0.00 C ATOM 1169 C CYS A 763 35.311 -24.249 3.888 1.00 0.00 C ATOM 1170 O CYS A 763 34.904 -24.368 2.732 1.00 0.00 O ATOM 1171 CB CYS A 763 37.630 -24.214 4.865 1.00 0.00 C ATOM 1172 SG CYS A 763 38.288 -23.037 3.643 1.00 0.00 S ATOM 0 H CYS A 763 36.701 -25.685 2.366 1.00 0.00 H new ATOM 0 HA CYS A 763 36.144 -25.696 5.225 1.00 0.00 H new ATOM 0 HB2 CYS A 763 37.294 -23.655 5.738 1.00 0.00 H new ATOM 0 HB3 CYS A 763 38.442 -24.862 5.195 1.00 0.00 H new ATOM 0 HG CYS A 763 37.838 -23.341 2.462 1.00 0.00 H new ATOM 1177 N THR A 764 34.778 -23.422 4.758 1.00 0.00 N ATOM 1178 CA THR A 764 33.682 -22.560 4.417 1.00 0.00 C ATOM 1179 C THR A 764 34.224 -21.273 3.833 1.00 0.00 C ATOM 1180 O THR A 764 34.831 -20.447 4.538 1.00 0.00 O ATOM 1181 CB THR A 764 32.821 -22.278 5.656 1.00 0.00 C ATOM 1182 OG1 THR A 764 32.508 -23.535 6.286 1.00 0.00 O ATOM 1183 CG2 THR A 764 31.523 -21.574 5.271 1.00 0.00 C ATOM 0 H THR A 764 35.097 -23.332 5.723 1.00 0.00 H new ATOM 0 HA THR A 764 33.050 -23.048 3.675 1.00 0.00 H new ATOM 0 HB THR A 764 33.374 -21.629 6.335 1.00 0.00 H new ATOM 0 HG1 THR A 764 31.959 -23.374 7.082 1.00 0.00 H new ATOM 0 HG21 THR A 764 30.932 -21.386 6.167 1.00 0.00 H new ATOM 0 HG22 THR A 764 31.754 -20.627 4.783 1.00 0.00 H new ATOM 0 HG23 THR A 764 30.955 -22.206 4.588 1.00 0.00 H new ATOM 1191 N LEU A 765 34.047 -21.136 2.557 1.00 0.00 N ATOM 1192 CA LEU A 765 34.569 -20.039 1.835 1.00 0.00 C ATOM 1193 C LEU A 765 33.512 -18.939 1.726 1.00 0.00 C ATOM 1194 O LEU A 765 32.330 -19.236 1.505 1.00 0.00 O ATOM 1195 CB LEU A 765 34.965 -20.533 0.459 1.00 0.00 C ATOM 1196 CG LEU A 765 35.982 -19.706 -0.275 1.00 0.00 C ATOM 1197 CD1 LEU A 765 37.274 -19.722 0.508 1.00 0.00 C ATOM 1198 CD2 LEU A 765 36.194 -20.253 -1.671 1.00 0.00 C ATOM 0 H LEU A 765 33.525 -21.800 1.985 1.00 0.00 H new ATOM 0 HA LEU A 765 35.438 -19.622 2.345 1.00 0.00 H new ATOM 0 HB2 LEU A 765 35.354 -21.546 0.558 1.00 0.00 H new ATOM 0 HB3 LEU A 765 34.066 -20.595 -0.155 1.00 0.00 H new ATOM 0 HG LEU A 765 35.628 -18.679 -0.370 1.00 0.00 H new ATOM 0 HD11 LEU A 765 38.023 -19.125 -0.013 1.00 0.00 H new ATOM 0 HD12 LEU A 765 37.103 -19.304 1.500 1.00 0.00 H new ATOM 0 HD13 LEU A 765 37.629 -20.748 0.603 1.00 0.00 H new ATOM 0 HD21 LEU A 765 36.933 -19.644 -2.192 1.00 0.00 H new ATOM 0 HD22 LEU A 765 36.550 -21.282 -1.609 1.00 0.00 H new ATOM 0 HD23 LEU A 765 35.252 -20.227 -2.219 1.00 0.00 H new ATOM 1210 N PRO A 766 33.910 -17.660 1.912 1.00 0.00 N ATOM 1211 CA PRO A 766 32.990 -16.539 1.808 1.00 0.00 C ATOM 1212 C PRO A 766 32.399 -16.400 0.401 1.00 0.00 C ATOM 1213 O PRO A 766 31.174 -16.485 0.220 1.00 0.00 O ATOM 1214 CB PRO A 766 33.811 -15.298 2.174 1.00 0.00 C ATOM 1215 CG PRO A 766 35.213 -15.750 2.421 1.00 0.00 C ATOM 1216 CD PRO A 766 35.273 -17.243 2.278 1.00 0.00 C ATOM 0 HA PRO A 766 32.136 -16.680 2.471 1.00 0.00 H new ATOM 0 HB2 PRO A 766 33.780 -14.565 1.368 1.00 0.00 H new ATOM 0 HB3 PRO A 766 33.401 -14.814 3.061 1.00 0.00 H new ATOM 0 HG2 PRO A 766 35.893 -15.276 1.713 1.00 0.00 H new ATOM 0 HG3 PRO A 766 35.535 -15.453 3.419 1.00 0.00 H new ATOM 0 HD2 PRO A 766 35.991 -17.535 1.512 1.00 0.00 H new ATOM 0 HD3 PRO A 766 35.590 -17.714 3.209 1.00 0.00 H new ATOM 1353 N LEU A 778 36.112 -5.591 -8.075 1.00 0.00 N ATOM 1354 CA LEU A 778 36.923 -5.845 -9.243 1.00 0.00 C ATOM 1355 C LEU A 778 36.169 -6.567 -10.351 1.00 0.00 C ATOM 1356 O LEU A 778 36.509 -6.438 -11.512 1.00 0.00 O ATOM 1357 CB LEU A 778 38.235 -6.575 -8.905 1.00 0.00 C ATOM 1358 CG LEU A 778 38.180 -8.002 -8.307 1.00 0.00 C ATOM 1359 CD1 LEU A 778 39.554 -8.672 -8.407 1.00 0.00 C ATOM 1360 CD2 LEU A 778 37.741 -7.987 -6.844 1.00 0.00 C ATOM 0 HA LEU A 778 37.184 -4.859 -9.626 1.00 0.00 H new ATOM 0 HB2 LEU A 778 38.825 -6.627 -9.820 1.00 0.00 H new ATOM 0 HB3 LEU A 778 38.787 -5.948 -8.204 1.00 0.00 H new ATOM 0 HG LEU A 778 37.446 -8.565 -8.883 1.00 0.00 H new ATOM 0 HD11 LEU A 778 39.502 -9.675 -7.983 1.00 0.00 H new ATOM 0 HD12 LEU A 778 39.852 -8.736 -9.453 1.00 0.00 H new ATOM 0 HD13 LEU A 778 40.287 -8.083 -7.856 1.00 0.00 H new ATOM 0 HD21 LEU A 778 37.715 -9.007 -6.461 1.00 0.00 H new ATOM 0 HD22 LEU A 778 38.447 -7.398 -6.258 1.00 0.00 H new ATOM 0 HD23 LEU A 778 36.748 -7.545 -6.767 1.00 0.00 H new ATOM 1372 N TRP A 779 35.168 -7.328 -9.991 1.00 0.00 N ATOM 1373 CA TRP A 779 34.404 -8.083 -10.981 1.00 0.00 C ATOM 1374 C TRP A 779 32.944 -7.714 -10.925 1.00 0.00 C ATOM 1375 O TRP A 779 32.107 -8.192 -11.712 1.00 0.00 O ATOM 1376 CB TRP A 779 34.591 -9.592 -10.774 1.00 0.00 C ATOM 1377 CG TRP A 779 34.300 -10.102 -9.380 1.00 0.00 C ATOM 1378 CD1 TRP A 779 33.088 -10.169 -8.752 1.00 0.00 C ATOM 1379 CD2 TRP A 779 35.246 -10.666 -8.472 1.00 0.00 C ATOM 1380 NE1 TRP A 779 33.240 -10.703 -7.497 1.00 0.00 N ATOM 1381 CE2 TRP A 779 34.554 -11.018 -7.304 1.00 0.00 C ATOM 1382 CE3 TRP A 779 36.617 -10.895 -8.532 1.00 0.00 C ATOM 1383 CZ2 TRP A 779 35.189 -11.585 -6.206 1.00 0.00 C ATOM 1384 CZ3 TRP A 779 37.244 -11.457 -7.444 1.00 0.00 C ATOM 1385 CH2 TRP A 779 36.530 -11.795 -6.297 1.00 0.00 C ATOM 0 H TRP A 779 34.855 -7.449 -9.028 1.00 0.00 H new ATOM 0 HA TRP A 779 34.781 -7.825 -11.971 1.00 0.00 H new ATOM 0 HB2 TRP A 779 33.946 -10.120 -11.476 1.00 0.00 H new ATOM 0 HB3 TRP A 779 35.619 -9.851 -11.029 1.00 0.00 H new ATOM 0 HD1 TRP A 779 32.149 -9.849 -9.180 1.00 0.00 H new ATOM 0 HE1 TRP A 779 32.492 -10.842 -6.818 1.00 0.00 H new ATOM 0 HE3 TRP A 779 37.179 -10.636 -9.417 1.00 0.00 H new ATOM 0 HZ2 TRP A 779 34.639 -11.849 -5.315 1.00 0.00 H new ATOM 0 HZ3 TRP A 779 38.308 -11.639 -7.480 1.00 0.00 H new ATOM 0 HH2 TRP A 779 37.053 -12.234 -5.460 1.00 0.00 H new ATOM 1396 N GLY A 780 32.636 -6.874 -9.999 1.00 0.00 N ATOM 1397 CA GLY A 780 31.291 -6.488 -9.795 1.00 0.00 C ATOM 1398 C GLY A 780 31.206 -5.050 -9.474 1.00 0.00 C ATOM 1399 O GLY A 780 32.124 -4.484 -8.870 1.00 0.00 O ATOM 0 H GLY A 780 33.308 -6.439 -9.367 1.00 0.00 H new ATOM 0 HA2 GLY A 780 30.706 -6.702 -10.690 1.00 0.00 H new ATOM 0 HA3 GLY A 780 30.858 -7.073 -8.984 1.00 0.00 H new ATOM 1526 N VAL A 790 26.011 -5.982 -9.046 1.00 0.00 N ATOM 1527 CA VAL A 790 25.788 -6.258 -10.428 1.00 0.00 C ATOM 1528 C VAL A 790 27.080 -6.798 -10.988 1.00 0.00 C ATOM 1529 O VAL A 790 28.167 -6.278 -10.693 1.00 0.00 O ATOM 1530 CB VAL A 790 25.326 -4.976 -11.176 1.00 0.00 C ATOM 1531 CG1 VAL A 790 25.340 -5.138 -12.687 1.00 0.00 C ATOM 1532 CG2 VAL A 790 23.930 -4.577 -10.721 1.00 0.00 C ATOM 0 HA VAL A 790 24.992 -6.992 -10.557 1.00 0.00 H new ATOM 0 HB VAL A 790 26.041 -4.193 -10.925 1.00 0.00 H new ATOM 0 HG11 VAL A 790 25.008 -4.211 -13.155 1.00 0.00 H new ATOM 0 HG12 VAL A 790 26.352 -5.370 -13.019 1.00 0.00 H new ATOM 0 HG13 VAL A 790 24.670 -5.949 -12.972 1.00 0.00 H new ATOM 0 HG21 VAL A 790 23.617 -3.678 -11.252 1.00 0.00 H new ATOM 0 HG22 VAL A 790 23.232 -5.386 -10.936 1.00 0.00 H new ATOM 0 HG23 VAL A 790 23.939 -4.381 -9.649 1.00 0.00 H new ATOM 1542 N CYS A 791 26.975 -7.813 -11.783 1.00 0.00 N ATOM 1543 CA CYS A 791 28.137 -8.489 -12.268 1.00 0.00 C ATOM 1544 C CYS A 791 28.479 -7.979 -13.621 1.00 0.00 C ATOM 1545 O CYS A 791 27.624 -7.882 -14.514 1.00 0.00 O ATOM 1546 CB CYS A 791 27.944 -10.012 -12.284 1.00 0.00 C ATOM 1547 SG CYS A 791 26.531 -10.612 -13.268 1.00 0.00 S ATOM 0 H CYS A 791 26.089 -8.196 -12.113 1.00 0.00 H new ATOM 0 HA CYS A 791 28.964 -8.284 -11.589 1.00 0.00 H new ATOM 0 HB2 CYS A 791 28.854 -10.472 -12.669 1.00 0.00 H new ATOM 0 HB3 CYS A 791 27.822 -10.356 -11.257 1.00 0.00 H new ATOM 0 HG CYS A 791 26.286 -9.774 -14.232 1.00 0.00 H new ATOM 1552 N ARG A 792 29.696 -7.612 -13.761 1.00 0.00 N ATOM 1553 CA ARG A 792 30.187 -7.048 -14.956 1.00 0.00 C ATOM 1554 C ARG A 792 31.048 -8.029 -15.702 1.00 0.00 C ATOM 1555 O ARG A 792 31.181 -9.171 -15.278 1.00 0.00 O ATOM 1556 CB ARG A 792 30.882 -5.731 -14.683 1.00 0.00 C ATOM 1557 CG ARG A 792 29.927 -4.572 -14.376 1.00 0.00 C ATOM 1558 CD ARG A 792 28.953 -4.353 -15.541 1.00 0.00 C ATOM 1559 NE ARG A 792 29.672 -4.256 -16.817 1.00 0.00 N ATOM 1560 CZ ARG A 792 29.262 -4.721 -17.996 1.00 0.00 C ATOM 1561 NH1 ARG A 792 27.982 -5.046 -18.197 1.00 0.00 N ATOM 1562 NH2 ARG A 792 30.147 -4.823 -18.996 1.00 0.00 N ATOM 0 H ARG A 792 30.397 -7.699 -13.025 1.00 0.00 H new ATOM 0 HA ARG A 792 29.345 -6.823 -15.611 1.00 0.00 H new ATOM 0 HB2 ARG A 792 31.563 -5.859 -13.842 1.00 0.00 H new ATOM 0 HB3 ARG A 792 31.490 -5.467 -15.548 1.00 0.00 H new ATOM 0 HG2 ARG A 792 29.370 -4.785 -13.464 1.00 0.00 H new ATOM 0 HG3 ARG A 792 30.498 -3.661 -14.196 1.00 0.00 H new ATOM 0 HD2 ARG A 792 28.240 -5.176 -15.583 1.00 0.00 H new ATOM 0 HD3 ARG A 792 28.379 -3.442 -15.373 1.00 0.00 H new ATOM 0 HE ARG A 792 30.577 -3.785 -16.799 1.00 0.00 H new ATOM 0 HH11 ARG A 792 27.304 -4.939 -17.442 1.00 0.00 H new ATOM 0 HH12 ARG A 792 27.682 -5.401 -19.105 1.00 0.00 H new ATOM 0 HH21 ARG A 792 31.118 -4.547 -18.848 1.00 0.00 H new ATOM 0 HH22 ARG A 792 29.850 -5.177 -19.905 1.00 0.00 H new ATOM 1576 N GLU A 793 31.555 -7.617 -16.834 1.00 0.00 N ATOM 1577 CA GLU A 793 32.327 -8.486 -17.671 1.00 0.00 C ATOM 1578 C GLU A 793 33.806 -8.335 -17.373 1.00 0.00 C ATOM 1579 O GLU A 793 34.203 -7.610 -16.461 1.00 0.00 O ATOM 1580 CB GLU A 793 32.053 -8.176 -19.137 1.00 0.00 C ATOM 1581 CG GLU A 793 30.606 -8.350 -19.533 1.00 0.00 C ATOM 1582 CD GLU A 793 30.384 -8.133 -20.998 1.00 0.00 C ATOM 1583 OE1 GLU A 793 30.225 -9.126 -21.741 1.00 0.00 O ATOM 1584 OE2 GLU A 793 30.344 -6.962 -21.437 1.00 0.00 O ATOM 0 H GLU A 793 31.443 -6.671 -17.198 1.00 0.00 H new ATOM 0 HA GLU A 793 32.036 -9.516 -17.465 1.00 0.00 H new ATOM 0 HB2 GLU A 793 32.357 -7.150 -19.345 1.00 0.00 H new ATOM 0 HB3 GLU A 793 32.671 -8.824 -19.758 1.00 0.00 H new ATOM 0 HG2 GLU A 793 30.277 -9.353 -19.263 1.00 0.00 H new ATOM 0 HG3 GLU A 793 29.991 -7.650 -18.968 1.00 0.00 H new ATOM 1591 N ALA A 794 34.616 -8.994 -18.170 1.00 0.00 N ATOM 1592 CA ALA A 794 36.053 -8.969 -18.007 1.00 0.00 C ATOM 1593 C ALA A 794 36.647 -7.675 -18.557 1.00 0.00 C ATOM 1594 O ALA A 794 37.845 -7.401 -18.393 1.00 0.00 O ATOM 1595 CB ALA A 794 36.661 -10.157 -18.703 1.00 0.00 C ATOM 0 H ALA A 794 34.296 -9.565 -18.953 1.00 0.00 H new ATOM 0 HA ALA A 794 36.281 -9.016 -16.942 1.00 0.00 H new ATOM 0 HB1 ALA A 794 37.744 -10.136 -18.579 1.00 0.00 H new ATOM 0 HB2 ALA A 794 36.264 -11.075 -18.270 1.00 0.00 H new ATOM 0 HB3 ALA A 794 36.417 -10.121 -19.765 1.00 0.00 H new ATOM 1601 N SER A 795 35.807 -6.893 -19.208 1.00 0.00 N ATOM 1602 CA SER A 795 36.197 -5.630 -19.777 1.00 0.00 C ATOM 1603 C SER A 795 36.607 -4.674 -18.664 1.00 0.00 C ATOM 1604 O SER A 795 37.618 -3.975 -18.753 1.00 0.00 O ATOM 1605 CB SER A 795 35.018 -5.065 -20.548 1.00 0.00 C ATOM 1606 OG SER A 795 34.490 -6.046 -21.443 1.00 0.00 O ATOM 0 H SER A 795 34.825 -7.125 -19.355 1.00 0.00 H new ATOM 0 HA SER A 795 37.044 -5.763 -20.450 1.00 0.00 H new ATOM 0 HB2 SER A 795 34.242 -4.743 -19.853 1.00 0.00 H new ATOM 0 HB3 SER A 795 35.331 -4.184 -21.108 1.00 0.00 H new ATOM 0 HG SER A 795 33.729 -5.667 -21.932 1.00 0.00 H new ATOM 1612 N GLU A 796 35.866 -4.706 -17.585 1.00 0.00 N ATOM 1613 CA GLU A 796 36.143 -3.854 -16.460 1.00 0.00 C ATOM 1614 C GLU A 796 37.058 -4.510 -15.454 1.00 0.00 C ATOM 1615 O GLU A 796 36.824 -4.493 -14.251 1.00 0.00 O ATOM 1616 CB GLU A 796 34.888 -3.285 -15.800 1.00 0.00 C ATOM 1617 CG GLU A 796 33.720 -4.225 -15.716 1.00 0.00 C ATOM 1618 CD GLU A 796 32.845 -4.143 -16.940 1.00 0.00 C ATOM 1619 OE1 GLU A 796 32.888 -5.026 -17.811 1.00 0.00 O ATOM 1620 OE2 GLU A 796 32.064 -3.173 -17.033 1.00 0.00 O ATOM 0 H GLU A 796 35.060 -5.319 -17.463 1.00 0.00 H new ATOM 0 HA GLU A 796 36.677 -2.998 -16.873 1.00 0.00 H new ATOM 0 HB2 GLU A 796 35.144 -2.960 -14.792 1.00 0.00 H new ATOM 0 HB3 GLU A 796 34.579 -2.397 -16.352 1.00 0.00 H new ATOM 0 HG2 GLU A 796 34.083 -5.246 -15.597 1.00 0.00 H new ATOM 0 HG3 GLU A 796 33.129 -3.992 -14.831 1.00 0.00 H new ATOM 1627 N CYS A 797 38.132 -5.043 -15.948 1.00 0.00 N ATOM 1628 CA CYS A 797 39.160 -5.610 -15.121 1.00 0.00 C ATOM 1629 C CYS A 797 40.087 -4.454 -14.695 1.00 0.00 C ATOM 1630 O CYS A 797 41.267 -4.367 -15.064 1.00 0.00 O ATOM 1631 CB CYS A 797 39.877 -6.710 -15.911 1.00 0.00 C ATOM 1632 SG CYS A 797 41.197 -7.615 -15.037 1.00 0.00 S ATOM 0 H CYS A 797 38.325 -5.099 -16.948 1.00 0.00 H new ATOM 0 HA CYS A 797 38.769 -6.082 -14.220 1.00 0.00 H new ATOM 0 HB2 CYS A 797 39.131 -7.432 -16.243 1.00 0.00 H new ATOM 0 HB3 CYS A 797 40.307 -6.261 -16.806 1.00 0.00 H new ATOM 0 HG CYS A 797 40.917 -7.672 -13.769 1.00 0.00 H new ATOM 1637 N GLU A 798 39.471 -3.539 -13.972 1.00 0.00 N ATOM 1638 CA GLU A 798 40.048 -2.278 -13.539 1.00 0.00 C ATOM 1639 C GLU A 798 41.060 -2.434 -12.406 1.00 0.00 C ATOM 1640 O GLU A 798 42.063 -1.710 -12.360 1.00 0.00 O ATOM 1641 CB GLU A 798 38.917 -1.309 -13.153 1.00 0.00 C ATOM 1642 CG GLU A 798 37.927 -1.881 -12.136 1.00 0.00 C ATOM 1643 CD GLU A 798 36.808 -0.932 -11.814 1.00 0.00 C ATOM 1644 OE1 GLU A 798 36.996 -0.053 -10.957 1.00 0.00 O ATOM 1645 OE2 GLU A 798 35.717 -1.044 -12.405 1.00 0.00 O ATOM 0 H GLU A 798 38.509 -3.659 -13.655 1.00 0.00 H new ATOM 0 HA GLU A 798 40.614 -1.868 -14.376 1.00 0.00 H new ATOM 0 HB2 GLU A 798 39.356 -0.399 -12.745 1.00 0.00 H new ATOM 0 HB3 GLU A 798 38.373 -1.024 -14.054 1.00 0.00 H new ATOM 0 HG2 GLU A 798 37.509 -2.809 -12.526 1.00 0.00 H new ATOM 0 HG3 GLU A 798 38.460 -2.132 -11.219 1.00 0.00 H new ATOM 1652 N GLU A 799 40.822 -3.369 -11.526 1.00 0.00 N ATOM 1653 CA GLU A 799 41.711 -3.605 -10.410 1.00 0.00 C ATOM 1654 C GLU A 799 42.886 -4.454 -10.907 1.00 0.00 C ATOM 1655 O GLU A 799 42.850 -4.909 -12.060 1.00 0.00 O ATOM 1656 CB GLU A 799 40.919 -4.272 -9.267 1.00 0.00 C ATOM 1657 CG GLU A 799 41.680 -4.479 -7.966 1.00 0.00 C ATOM 1658 CD GLU A 799 42.338 -3.218 -7.464 1.00 0.00 C ATOM 1659 OE1 GLU A 799 43.579 -3.161 -7.455 1.00 0.00 O ATOM 1660 OE2 GLU A 799 41.626 -2.237 -7.128 1.00 0.00 O ATOM 0 H GLU A 799 40.012 -3.988 -11.558 1.00 0.00 H new ATOM 0 HA GLU A 799 42.119 -2.677 -10.010 1.00 0.00 H new ATOM 0 HB2 GLU A 799 40.038 -3.664 -9.058 1.00 0.00 H new ATOM 0 HB3 GLU A 799 40.562 -5.241 -9.615 1.00 0.00 H new ATOM 0 HG2 GLU A 799 40.994 -4.853 -7.205 1.00 0.00 H new ATOM 0 HG3 GLU A 799 42.441 -5.246 -8.114 1.00 0.00 H new ATOM 1667 N GLU A 800 43.934 -4.625 -10.084 1.00 0.00 N ATOM 1668 CA GLU A 800 45.100 -5.402 -10.489 1.00 0.00 C ATOM 1669 C GLU A 800 44.724 -6.778 -11.003 1.00 0.00 C ATOM 1670 O GLU A 800 44.958 -7.064 -12.179 1.00 0.00 O ATOM 1671 CB GLU A 800 46.176 -5.493 -9.403 1.00 0.00 C ATOM 1672 CG GLU A 800 46.858 -4.169 -9.101 1.00 0.00 C ATOM 1673 CD GLU A 800 48.110 -4.344 -8.281 1.00 0.00 C ATOM 1674 OE1 GLU A 800 48.099 -4.090 -7.063 1.00 0.00 O ATOM 1675 OE2 GLU A 800 49.141 -4.745 -8.844 1.00 0.00 O ATOM 0 H GLU A 800 43.991 -4.236 -9.143 1.00 0.00 H new ATOM 0 HA GLU A 800 45.541 -4.847 -11.317 1.00 0.00 H new ATOM 0 HB2 GLU A 800 45.724 -5.875 -8.488 1.00 0.00 H new ATOM 0 HB3 GLU A 800 46.930 -6.217 -9.712 1.00 0.00 H new ATOM 0 HG2 GLU A 800 47.107 -3.669 -10.037 1.00 0.00 H new ATOM 0 HG3 GLU A 800 46.165 -3.519 -8.567 1.00 0.00 H new ATOM 1682 N GLY A 801 44.128 -7.614 -10.149 1.00 0.00 N ATOM 1683 CA GLY A 801 43.689 -8.906 -10.563 1.00 0.00 C ATOM 1684 C GLY A 801 44.830 -9.875 -10.834 1.00 0.00 C ATOM 1685 O GLY A 801 45.723 -9.621 -11.666 1.00 0.00 O ATOM 0 H GLY A 801 43.948 -7.398 -9.168 1.00 0.00 H new ATOM 0 HA2 GLY A 801 43.042 -9.325 -9.793 1.00 0.00 H new ATOM 0 HA3 GLY A 801 43.086 -8.805 -11.466 1.00 0.00 H new ATOM 1689 N PHE A 802 44.828 -10.950 -10.135 1.00 0.00 N ATOM 1690 CA PHE A 802 45.801 -11.982 -10.336 1.00 0.00 C ATOM 1691 C PHE A 802 45.447 -12.853 -11.507 1.00 0.00 C ATOM 1692 O PHE A 802 44.373 -12.734 -12.080 1.00 0.00 O ATOM 1693 CB PHE A 802 45.957 -12.839 -9.096 1.00 0.00 C ATOM 1694 CG PHE A 802 46.738 -12.208 -7.999 1.00 0.00 C ATOM 1695 CD1 PHE A 802 47.668 -12.943 -7.325 1.00 0.00 C ATOM 1696 CD2 PHE A 802 46.561 -10.885 -7.656 1.00 0.00 C ATOM 1697 CE1 PHE A 802 48.408 -12.391 -6.331 1.00 0.00 C ATOM 1698 CE2 PHE A 802 47.296 -10.318 -6.665 1.00 0.00 C ATOM 1699 CZ PHE A 802 48.230 -11.073 -5.990 1.00 0.00 C ATOM 0 H PHE A 802 44.150 -11.149 -9.399 1.00 0.00 H new ATOM 0 HA PHE A 802 46.749 -11.486 -10.545 1.00 0.00 H new ATOM 0 HB2 PHE A 802 44.966 -13.092 -8.719 1.00 0.00 H new ATOM 0 HB3 PHE A 802 46.440 -13.775 -9.376 1.00 0.00 H new ATOM 0 HD1 PHE A 802 47.818 -13.980 -7.586 1.00 0.00 H new ATOM 0 HD2 PHE A 802 45.828 -10.291 -8.182 1.00 0.00 H new ATOM 0 HE1 PHE A 802 49.139 -12.989 -5.807 1.00 0.00 H new ATOM 0 HE2 PHE A 802 47.149 -9.280 -6.407 1.00 0.00 H new ATOM 0 HZ PHE A 802 48.818 -10.632 -5.199 1.00 0.00 H new ATOM 1709 N SER A 803 46.347 -13.709 -11.865 1.00 0.00 N ATOM 1710 CA SER A 803 46.110 -14.644 -12.902 1.00 0.00 C ATOM 1711 C SER A 803 46.052 -16.031 -12.266 1.00 0.00 C ATOM 1712 O SER A 803 47.047 -16.511 -11.709 1.00 0.00 O ATOM 1713 CB SER A 803 47.226 -14.561 -13.933 1.00 0.00 C ATOM 1714 OG SER A 803 47.459 -13.207 -14.327 1.00 0.00 O ATOM 0 H SER A 803 47.272 -13.775 -11.440 1.00 0.00 H new ATOM 0 HA SER A 803 45.171 -14.433 -13.415 1.00 0.00 H new ATOM 0 HB2 SER A 803 48.141 -14.986 -13.519 1.00 0.00 H new ATOM 0 HB3 SER A 803 46.964 -15.158 -14.807 1.00 0.00 H new ATOM 0 HG SER A 803 48.181 -13.179 -14.989 1.00 0.00 H new ATOM 1720 N ILE A 804 44.894 -16.636 -12.295 1.00 0.00 N ATOM 1721 CA ILE A 804 44.694 -17.934 -11.682 1.00 0.00 C ATOM 1722 C ILE A 804 44.326 -18.947 -12.740 1.00 0.00 C ATOM 1723 O ILE A 804 43.980 -18.578 -13.864 1.00 0.00 O ATOM 1724 CB ILE A 804 43.597 -17.948 -10.546 1.00 0.00 C ATOM 1725 CG1 ILE A 804 42.145 -17.724 -11.068 1.00 0.00 C ATOM 1726 CG2 ILE A 804 43.926 -16.926 -9.471 1.00 0.00 C ATOM 1727 CD1 ILE A 804 41.821 -16.323 -11.566 1.00 0.00 C ATOM 0 H ILE A 804 44.062 -16.249 -12.741 1.00 0.00 H new ATOM 0 HA ILE A 804 45.640 -18.189 -11.204 1.00 0.00 H new ATOM 0 HB ILE A 804 43.621 -18.953 -10.124 1.00 0.00 H new ATOM 0 HG12 ILE A 804 41.960 -18.428 -11.879 1.00 0.00 H new ATOM 0 HG13 ILE A 804 41.450 -17.972 -10.266 1.00 0.00 H new ATOM 0 HG21 ILE A 804 43.158 -16.951 -8.698 1.00 0.00 H new ATOM 0 HG22 ILE A 804 44.894 -17.162 -9.029 1.00 0.00 H new ATOM 0 HG23 ILE A 804 43.962 -15.931 -9.914 1.00 0.00 H new ATOM 0 HD11 ILE A 804 40.785 -16.287 -11.903 1.00 0.00 H new ATOM 0 HD12 ILE A 804 41.964 -15.607 -10.757 1.00 0.00 H new ATOM 0 HD13 ILE A 804 42.482 -16.070 -12.395 1.00 0.00 H new ATOM 1739 N CYS A 805 44.395 -20.189 -12.400 1.00 0.00 N ATOM 1740 CA CYS A 805 44.052 -21.244 -13.315 1.00 0.00 C ATOM 1741 C CYS A 805 42.708 -21.778 -12.944 1.00 0.00 C ATOM 1742 O CYS A 805 42.468 -22.202 -11.793 1.00 0.00 O ATOM 1743 CB CYS A 805 45.103 -22.344 -13.279 1.00 0.00 C ATOM 1744 SG CYS A 805 44.755 -23.747 -14.377 1.00 0.00 S ATOM 0 H CYS A 805 44.691 -20.511 -11.478 1.00 0.00 H new ATOM 0 HA CYS A 805 44.020 -20.855 -14.333 1.00 0.00 H new ATOM 0 HB2 CYS A 805 46.068 -21.917 -13.550 1.00 0.00 H new ATOM 0 HB3 CYS A 805 45.192 -22.711 -12.257 1.00 0.00 H new ATOM 0 HG CYS A 805 45.708 -24.625 -14.274 1.00 0.00 H new ATOM 1749 N VAL A 806 41.824 -21.739 -13.875 1.00 0.00 N ATOM 1750 CA VAL A 806 40.502 -22.164 -13.626 1.00 0.00 C ATOM 1751 C VAL A 806 40.018 -23.132 -14.706 1.00 0.00 C ATOM 1752 O VAL A 806 40.152 -22.874 -15.912 1.00 0.00 O ATOM 1753 CB VAL A 806 39.569 -20.927 -13.451 1.00 0.00 C ATOM 1754 CG1 VAL A 806 39.598 -20.050 -14.657 1.00 0.00 C ATOM 1755 CG2 VAL A 806 38.156 -21.309 -13.109 1.00 0.00 C ATOM 0 H VAL A 806 41.999 -21.413 -14.825 1.00 0.00 H new ATOM 0 HA VAL A 806 40.475 -22.724 -12.691 1.00 0.00 H new ATOM 0 HB VAL A 806 39.963 -20.366 -12.604 1.00 0.00 H new ATOM 0 HG11 VAL A 806 38.937 -19.197 -14.503 1.00 0.00 H new ATOM 0 HG12 VAL A 806 40.615 -19.695 -14.825 1.00 0.00 H new ATOM 0 HG13 VAL A 806 39.263 -20.616 -15.526 1.00 0.00 H new ATOM 0 HG21 VAL A 806 37.552 -20.408 -12.999 1.00 0.00 H new ATOM 0 HG22 VAL A 806 37.743 -21.928 -13.906 1.00 0.00 H new ATOM 0 HG23 VAL A 806 38.147 -21.868 -12.174 1.00 0.00 H new ATOM 1765 N GLU A 807 39.505 -24.255 -14.263 1.00 0.00 N ATOM 1766 CA GLU A 807 38.964 -25.251 -15.125 1.00 0.00 C ATOM 1767 C GLU A 807 37.565 -24.840 -15.472 1.00 0.00 C ATOM 1768 O GLU A 807 36.696 -24.755 -14.617 1.00 0.00 O ATOM 1769 CB GLU A 807 38.940 -26.616 -14.443 1.00 0.00 C ATOM 1770 CG GLU A 807 38.373 -27.719 -15.317 1.00 0.00 C ATOM 1771 CD GLU A 807 38.110 -28.972 -14.548 1.00 0.00 C ATOM 1772 OE1 GLU A 807 38.962 -29.884 -14.556 1.00 0.00 O ATOM 1773 OE2 GLU A 807 37.049 -29.064 -13.899 1.00 0.00 O ATOM 0 H GLU A 807 39.456 -24.496 -13.273 1.00 0.00 H new ATOM 0 HA GLU A 807 39.583 -25.337 -16.018 1.00 0.00 H new ATOM 0 HB2 GLU A 807 39.954 -26.883 -14.147 1.00 0.00 H new ATOM 0 HB3 GLU A 807 38.349 -26.547 -13.530 1.00 0.00 H new ATOM 0 HG2 GLU A 807 37.446 -27.376 -15.776 1.00 0.00 H new ATOM 0 HG3 GLU A 807 39.070 -27.932 -16.127 1.00 0.00 H new ATOM 1780 N VAL A 808 37.371 -24.530 -16.683 1.00 0.00 N ATOM 1781 CA VAL A 808 36.110 -24.126 -17.189 1.00 0.00 C ATOM 1782 C VAL A 808 35.908 -24.903 -18.458 1.00 0.00 C ATOM 1783 O VAL A 808 36.838 -25.008 -19.255 1.00 0.00 O ATOM 1784 CB VAL A 808 36.104 -22.618 -17.507 1.00 0.00 C ATOM 1785 CG1 VAL A 808 34.786 -22.143 -18.038 1.00 0.00 C ATOM 1786 CG2 VAL A 808 36.571 -21.785 -16.340 1.00 0.00 C ATOM 0 H VAL A 808 38.108 -24.547 -17.388 1.00 0.00 H new ATOM 0 HA VAL A 808 35.321 -24.311 -16.460 1.00 0.00 H new ATOM 0 HB VAL A 808 36.829 -22.478 -18.309 1.00 0.00 H new ATOM 0 HG11 VAL A 808 34.841 -21.074 -18.244 1.00 0.00 H new ATOM 0 HG12 VAL A 808 34.550 -22.678 -18.958 1.00 0.00 H new ATOM 0 HG13 VAL A 808 34.007 -22.331 -17.299 1.00 0.00 H new ATOM 0 HG21 VAL A 808 36.549 -20.730 -16.614 1.00 0.00 H new ATOM 0 HG22 VAL A 808 35.913 -21.952 -15.487 1.00 0.00 H new ATOM 0 HG23 VAL A 808 37.589 -22.069 -16.074 1.00 0.00 H new ATOM 1796 N ASN A 809 34.740 -25.524 -18.609 1.00 0.00 N ATOM 1797 CA ASN A 809 34.412 -26.341 -19.797 1.00 0.00 C ATOM 1798 C ASN A 809 35.227 -27.624 -19.821 1.00 0.00 C ATOM 1799 O ASN A 809 35.276 -28.336 -20.835 1.00 0.00 O ATOM 1800 CB ASN A 809 34.625 -25.548 -21.103 1.00 0.00 C ATOM 1801 CG ASN A 809 33.439 -24.703 -21.555 1.00 0.00 C ATOM 1802 OD1 ASN A 809 33.283 -24.452 -22.753 1.00 0.00 O ATOM 1803 ND2 ASN A 809 32.609 -24.258 -20.635 1.00 0.00 N ATOM 0 H ASN A 809 33.990 -25.481 -17.919 1.00 0.00 H new ATOM 0 HA ASN A 809 33.356 -26.603 -19.728 1.00 0.00 H new ATOM 0 HB2 ASN A 809 35.488 -24.894 -20.975 1.00 0.00 H new ATOM 0 HB3 ASN A 809 34.873 -26.251 -21.899 1.00 0.00 H new ATOM 0 HD21 ASN A 809 31.808 -23.687 -20.904 1.00 0.00 H new ATOM 0 HD22 ASN A 809 32.767 -24.484 -19.653 1.00 0.00 H new ATOM 1810 N GLY A 810 35.842 -27.931 -18.695 1.00 0.00 N ATOM 1811 CA GLY A 810 36.691 -29.087 -18.600 1.00 0.00 C ATOM 1812 C GLY A 810 38.091 -28.778 -19.070 1.00 0.00 C ATOM 1813 O GLY A 810 38.895 -29.678 -19.303 1.00 0.00 O ATOM 0 H GLY A 810 35.765 -27.389 -17.834 1.00 0.00 H new ATOM 0 HA2 GLY A 810 36.720 -29.436 -17.568 1.00 0.00 H new ATOM 0 HA3 GLY A 810 36.274 -29.897 -19.199 1.00 0.00 H new ATOM 1817 N LYS A 811 38.364 -27.506 -19.266 1.00 0.00 N ATOM 1818 CA LYS A 811 39.666 -27.052 -19.702 1.00 0.00 C ATOM 1819 C LYS A 811 40.204 -26.041 -18.728 1.00 0.00 C ATOM 1820 O LYS A 811 39.451 -25.260 -18.179 1.00 0.00 O ATOM 1821 CB LYS A 811 39.549 -26.414 -21.071 1.00 0.00 C ATOM 1822 CG LYS A 811 39.047 -27.360 -22.134 1.00 0.00 C ATOM 1823 CD LYS A 811 38.915 -26.682 -23.471 1.00 0.00 C ATOM 1824 CE LYS A 811 40.253 -26.177 -23.980 1.00 0.00 C ATOM 1825 NZ LYS A 811 40.135 -25.582 -25.326 1.00 0.00 N ATOM 0 H LYS A 811 37.687 -26.756 -19.127 1.00 0.00 H new ATOM 0 HA LYS A 811 40.343 -27.904 -19.752 1.00 0.00 H new ATOM 0 HB2 LYS A 811 38.875 -25.559 -21.009 1.00 0.00 H new ATOM 0 HB3 LYS A 811 40.525 -26.030 -21.369 1.00 0.00 H new ATOM 0 HG2 LYS A 811 39.731 -28.204 -22.221 1.00 0.00 H new ATOM 0 HG3 LYS A 811 38.080 -27.763 -21.834 1.00 0.00 H new ATOM 0 HD2 LYS A 811 38.491 -27.380 -24.193 1.00 0.00 H new ATOM 0 HD3 LYS A 811 38.219 -25.847 -23.388 1.00 0.00 H new ATOM 0 HE2 LYS A 811 40.649 -25.435 -23.287 1.00 0.00 H new ATOM 0 HE3 LYS A 811 40.967 -27.001 -24.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 41.068 -25.248 -25.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 39.780 -26.298 -25.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 39.473 -24.780 -25.294 1.00 0.00 H new ATOM 1839 N GLU A 812 41.473 -26.034 -18.524 1.00 0.00 N ATOM 1840 CA GLU A 812 42.055 -25.107 -17.588 1.00 0.00 C ATOM 1841 C GLU A 812 42.607 -23.899 -18.294 1.00 0.00 C ATOM 1842 O GLU A 812 43.578 -23.987 -19.048 1.00 0.00 O ATOM 1843 CB GLU A 812 43.103 -25.777 -16.716 1.00 0.00 C ATOM 1844 CG GLU A 812 42.514 -26.788 -15.750 1.00 0.00 C ATOM 1845 CD GLU A 812 43.558 -27.521 -14.971 1.00 0.00 C ATOM 1846 OE1 GLU A 812 44.026 -27.007 -13.938 1.00 0.00 O ATOM 1847 OE2 GLU A 812 43.926 -28.646 -15.369 1.00 0.00 O ATOM 0 H GLU A 812 42.138 -26.655 -18.986 1.00 0.00 H new ATOM 0 HA GLU A 812 41.261 -24.764 -16.925 1.00 0.00 H new ATOM 0 HB2 GLU A 812 43.833 -26.275 -17.354 1.00 0.00 H new ATOM 0 HB3 GLU A 812 43.640 -25.014 -16.152 1.00 0.00 H new ATOM 0 HG2 GLU A 812 41.844 -26.276 -15.059 1.00 0.00 H new ATOM 0 HG3 GLU A 812 41.911 -27.506 -16.306 1.00 0.00 H new ATOM 1854 N GLN A 813 41.950 -22.786 -18.111 1.00 0.00 N ATOM 1855 CA GLN A 813 42.396 -21.553 -18.684 1.00 0.00 C ATOM 1856 C GLN A 813 42.839 -20.604 -17.584 1.00 0.00 C ATOM 1857 O GLN A 813 42.263 -20.590 -16.496 1.00 0.00 O ATOM 1858 CB GLN A 813 41.283 -20.923 -19.542 1.00 0.00 C ATOM 1859 CG GLN A 813 41.625 -19.533 -20.078 1.00 0.00 C ATOM 1860 CD GLN A 813 40.561 -18.930 -20.985 1.00 0.00 C ATOM 1861 OE1 GLN A 813 39.327 -19.306 -20.787 1.00 0.00 O flip ATOM 1862 NE2 GLN A 813 40.868 -18.130 -21.876 1.00 0.00 N flip ATOM 0 H GLN A 813 41.094 -22.712 -17.562 1.00 0.00 H new ATOM 0 HA GLN A 813 43.248 -21.750 -19.335 1.00 0.00 H new ATOM 0 HB2 GLN A 813 41.068 -21.583 -20.383 1.00 0.00 H new ATOM 0 HB3 GLN A 813 40.372 -20.858 -18.947 1.00 0.00 H new ATOM 0 HG2 GLN A 813 41.789 -18.862 -19.235 1.00 0.00 H new ATOM 0 HG3 GLN A 813 42.564 -19.590 -20.628 1.00 0.00 H new ATOM 0 HE21 GLN A 813 41.843 -17.858 -22.003 1.00 0.00 H new ATOM 0 HE22 GLN A 813 40.147 -17.742 -22.484 1.00 0.00 H new ATOM 1871 N THR A 814 43.887 -19.866 -17.841 1.00 0.00 N ATOM 1872 CA THR A 814 44.330 -18.857 -16.924 1.00 0.00 C ATOM 1873 C THR A 814 43.401 -17.661 -17.084 1.00 0.00 C ATOM 1874 O THR A 814 43.108 -17.251 -18.214 1.00 0.00 O ATOM 1875 CB THR A 814 45.754 -18.387 -17.270 1.00 0.00 C ATOM 1876 OG1 THR A 814 46.625 -19.508 -17.480 1.00 0.00 O ATOM 1877 CG2 THR A 814 46.323 -17.512 -16.161 1.00 0.00 C ATOM 0 H THR A 814 44.452 -19.949 -18.686 1.00 0.00 H new ATOM 0 HA THR A 814 44.323 -19.261 -15.912 1.00 0.00 H new ATOM 0 HB THR A 814 45.691 -17.804 -18.189 1.00 0.00 H new ATOM 0 HG1 THR A 814 47.524 -19.187 -17.700 1.00 0.00 H new ATOM 0 HG21 THR A 814 47.330 -17.193 -16.430 1.00 0.00 H new ATOM 0 HG22 THR A 814 45.688 -16.636 -16.027 1.00 0.00 H new ATOM 0 HG23 THR A 814 46.358 -18.080 -15.231 1.00 0.00 H new ATOM 1885 N MET A 815 42.905 -17.137 -16.008 1.00 0.00 N ATOM 1886 CA MET A 815 42.075 -15.965 -16.085 1.00 0.00 C ATOM 1887 C MET A 815 42.555 -14.957 -15.134 1.00 0.00 C ATOM 1888 O MET A 815 43.273 -15.273 -14.185 1.00 0.00 O ATOM 1889 CB MET A 815 40.604 -16.244 -15.785 1.00 0.00 C ATOM 1890 CG MET A 815 40.017 -17.300 -16.642 1.00 0.00 C ATOM 1891 SD MET A 815 38.255 -17.433 -16.538 1.00 0.00 S ATOM 1892 CE MET A 815 38.086 -18.822 -17.629 1.00 0.00 C ATOM 0 H MET A 815 43.057 -17.497 -15.066 1.00 0.00 H new ATOM 0 HA MET A 815 42.142 -15.610 -17.113 1.00 0.00 H new ATOM 0 HB2 MET A 815 40.504 -16.537 -14.740 1.00 0.00 H new ATOM 0 HB3 MET A 815 40.034 -15.324 -15.914 1.00 0.00 H new ATOM 0 HG2 MET A 815 40.294 -17.105 -17.678 1.00 0.00 H new ATOM 0 HG3 MET A 815 40.458 -18.259 -16.369 1.00 0.00 H new ATOM 0 HE1 MET A 815 37.031 -18.990 -17.844 1.00 0.00 H new ATOM 0 HE2 MET A 815 38.618 -18.621 -18.559 1.00 0.00 H new ATOM 0 HE3 MET A 815 38.505 -19.710 -17.155 1.00 0.00 H new ATOM 1902 N SER A 816 42.197 -13.765 -15.387 1.00 0.00 N ATOM 1903 CA SER A 816 42.448 -12.707 -14.497 1.00 0.00 C ATOM 1904 C SER A 816 41.362 -12.746 -13.417 1.00 0.00 C ATOM 1905 O SER A 816 40.243 -13.188 -13.695 1.00 0.00 O ATOM 1906 CB SER A 816 42.409 -11.416 -15.290 1.00 0.00 C ATOM 1907 OG SER A 816 43.390 -11.454 -16.330 1.00 0.00 O ATOM 0 H SER A 816 41.709 -13.489 -16.239 1.00 0.00 H new ATOM 0 HA SER A 816 43.422 -12.785 -14.015 1.00 0.00 H new ATOM 0 HB2 SER A 816 41.417 -11.272 -15.719 1.00 0.00 H new ATOM 0 HB3 SER A 816 42.597 -10.568 -14.631 1.00 0.00 H new ATOM 0 HG SER A 816 43.359 -10.618 -16.840 1.00 0.00 H new ATOM 1913 N GLU A 817 41.700 -12.347 -12.203 1.00 0.00 N ATOM 1914 CA GLU A 817 40.766 -12.334 -11.067 1.00 0.00 C ATOM 1915 C GLU A 817 39.437 -11.691 -11.370 1.00 0.00 C ATOM 1916 O GLU A 817 38.395 -12.233 -11.026 1.00 0.00 O ATOM 1917 CB GLU A 817 41.397 -11.697 -9.851 1.00 0.00 C ATOM 1918 CG GLU A 817 42.179 -12.664 -9.030 1.00 0.00 C ATOM 1919 CD GLU A 817 42.674 -12.070 -7.764 1.00 0.00 C ATOM 1920 OE1 GLU A 817 43.383 -11.054 -7.826 1.00 0.00 O ATOM 1921 OE2 GLU A 817 42.384 -12.628 -6.703 1.00 0.00 O ATOM 0 H GLU A 817 42.636 -12.018 -11.966 1.00 0.00 H new ATOM 0 HA GLU A 817 40.553 -13.382 -10.857 1.00 0.00 H new ATOM 0 HB2 GLU A 817 42.052 -10.886 -10.170 1.00 0.00 H new ATOM 0 HB3 GLU A 817 40.616 -11.252 -9.234 1.00 0.00 H new ATOM 0 HG2 GLU A 817 41.555 -13.528 -8.802 1.00 0.00 H new ATOM 0 HG3 GLU A 817 43.026 -13.027 -9.612 1.00 0.00 H new ATOM 1928 N CYS A 818 39.465 -10.572 -12.051 1.00 0.00 N ATOM 1929 CA CYS A 818 38.244 -9.869 -12.383 1.00 0.00 C ATOM 1930 C CYS A 818 37.403 -10.669 -13.395 1.00 0.00 C ATOM 1931 O CYS A 818 36.219 -10.530 -13.444 1.00 0.00 O ATOM 1932 CB CYS A 818 38.569 -8.487 -12.931 1.00 0.00 C ATOM 1933 SG CYS A 818 39.731 -7.532 -11.892 1.00 0.00 S ATOM 0 H CYS A 818 40.318 -10.126 -12.388 1.00 0.00 H new ATOM 0 HA CYS A 818 37.654 -9.757 -11.473 1.00 0.00 H new ATOM 0 HB2 CYS A 818 38.993 -8.593 -13.929 1.00 0.00 H new ATOM 0 HB3 CYS A 818 37.643 -7.922 -13.037 1.00 0.00 H new ATOM 0 HG CYS A 818 39.786 -6.305 -12.318 1.00 0.00 H new ATOM 1938 N GLU A 819 38.045 -11.556 -14.147 1.00 0.00 N ATOM 1939 CA GLU A 819 37.366 -12.353 -15.166 1.00 0.00 C ATOM 1940 C GLU A 819 36.765 -13.588 -14.534 1.00 0.00 C ATOM 1941 O GLU A 819 35.552 -13.771 -14.554 1.00 0.00 O ATOM 1942 CB GLU A 819 38.356 -12.750 -16.247 1.00 0.00 C ATOM 1943 CG GLU A 819 37.793 -13.531 -17.407 1.00 0.00 C ATOM 1944 CD GLU A 819 38.847 -13.751 -18.446 1.00 0.00 C ATOM 1945 OE1 GLU A 819 39.362 -12.751 -18.996 1.00 0.00 O ATOM 1946 OE2 GLU A 819 39.210 -14.906 -18.725 1.00 0.00 O ATOM 0 H GLU A 819 39.045 -11.743 -14.070 1.00 0.00 H new ATOM 0 HA GLU A 819 36.568 -11.762 -15.614 1.00 0.00 H new ATOM 0 HB2 GLU A 819 38.820 -11.844 -16.636 1.00 0.00 H new ATOM 0 HB3 GLU A 819 39.148 -13.342 -15.787 1.00 0.00 H new ATOM 0 HG2 GLU A 819 37.412 -14.490 -17.057 1.00 0.00 H new ATOM 0 HG3 GLU A 819 36.951 -12.993 -17.842 1.00 0.00 H new ATOM 1953 N ALA A 820 37.628 -14.410 -13.921 1.00 0.00 N ATOM 1954 CA ALA A 820 37.208 -15.634 -13.248 1.00 0.00 C ATOM 1955 C ALA A 820 36.170 -15.300 -12.169 1.00 0.00 C ATOM 1956 O ALA A 820 35.211 -16.049 -11.925 1.00 0.00 O ATOM 1957 CB ALA A 820 38.401 -16.290 -12.591 1.00 0.00 C ATOM 0 H ALA A 820 38.633 -14.240 -13.881 1.00 0.00 H new ATOM 0 HA ALA A 820 36.773 -16.311 -13.983 1.00 0.00 H new ATOM 0 HB1 ALA A 820 38.083 -17.204 -12.089 1.00 0.00 H new ATOM 0 HB2 ALA A 820 39.146 -16.532 -13.349 1.00 0.00 H new ATOM 0 HB3 ALA A 820 38.835 -15.607 -11.861 1.00 0.00 H new ATOM 1963 N GLY A 821 36.370 -14.145 -11.539 1.00 0.00 N ATOM 1964 CA GLY A 821 35.484 -13.673 -10.521 1.00 0.00 C ATOM 1965 C GLY A 821 34.186 -13.160 -11.078 1.00 0.00 C ATOM 1966 O GLY A 821 33.139 -13.372 -10.470 1.00 0.00 O ATOM 0 H GLY A 821 37.155 -13.523 -11.732 1.00 0.00 H new ATOM 0 HA2 GLY A 821 35.280 -14.481 -9.819 1.00 0.00 H new ATOM 0 HA3 GLY A 821 35.973 -12.878 -9.958 1.00 0.00 H new ATOM 1970 N ALA A 822 34.236 -12.484 -12.229 1.00 0.00 N ATOM 1971 CA ALA A 822 33.021 -11.990 -12.878 1.00 0.00 C ATOM 1972 C ALA A 822 32.167 -13.162 -13.259 1.00 0.00 C ATOM 1973 O ALA A 822 30.939 -13.146 -13.111 1.00 0.00 O ATOM 1974 CB ALA A 822 33.350 -11.136 -14.102 1.00 0.00 C ATOM 0 H ALA A 822 35.099 -12.268 -12.727 1.00 0.00 H new ATOM 0 HA ALA A 822 32.479 -11.351 -12.181 1.00 0.00 H new ATOM 0 HB1 ALA A 822 32.425 -10.785 -14.560 1.00 0.00 H new ATOM 0 HB2 ALA A 822 33.951 -10.280 -13.797 1.00 0.00 H new ATOM 0 HB3 ALA A 822 33.908 -11.733 -14.823 1.00 0.00 H new ATOM 1980 N LEU A 823 32.831 -14.198 -13.692 1.00 0.00 N ATOM 1981 CA LEU A 823 32.207 -15.434 -14.024 1.00 0.00 C ATOM 1982 C LEU A 823 31.566 -16.067 -12.770 1.00 0.00 C ATOM 1983 O LEU A 823 30.396 -16.461 -12.809 1.00 0.00 O ATOM 1984 CB LEU A 823 33.220 -16.333 -14.731 1.00 0.00 C ATOM 1985 CG LEU A 823 33.750 -15.751 -16.064 1.00 0.00 C ATOM 1986 CD1 LEU A 823 34.891 -16.567 -16.623 1.00 0.00 C ATOM 1987 CD2 LEU A 823 32.632 -15.615 -17.101 1.00 0.00 C ATOM 0 H LEU A 823 33.842 -14.199 -13.824 1.00 0.00 H new ATOM 0 HA LEU A 823 31.385 -15.278 -14.722 1.00 0.00 H new ATOM 0 HB2 LEU A 823 34.063 -16.511 -14.063 1.00 0.00 H new ATOM 0 HB3 LEU A 823 32.758 -17.301 -14.926 1.00 0.00 H new ATOM 0 HG LEU A 823 34.132 -14.755 -15.840 1.00 0.00 H new ATOM 0 HD11 LEU A 823 35.232 -16.123 -17.558 1.00 0.00 H new ATOM 0 HD12 LEU A 823 35.713 -16.581 -15.907 1.00 0.00 H new ATOM 0 HD13 LEU A 823 34.553 -17.587 -16.808 1.00 0.00 H new ATOM 0 HD21 LEU A 823 33.040 -15.203 -18.024 1.00 0.00 H new ATOM 0 HD22 LEU A 823 32.200 -16.595 -17.301 1.00 0.00 H new ATOM 0 HD23 LEU A 823 31.859 -14.949 -16.717 1.00 0.00 H new ATOM 1999 N ARG A 824 32.294 -16.100 -11.641 1.00 0.00 N ATOM 2000 CA ARG A 824 31.703 -16.578 -10.371 1.00 0.00 C ATOM 2001 C ARG A 824 30.521 -15.709 -9.955 1.00 0.00 C ATOM 2002 O ARG A 824 29.547 -16.192 -9.381 1.00 0.00 O ATOM 2003 CB ARG A 824 32.712 -16.574 -9.221 1.00 0.00 C ATOM 2004 CG ARG A 824 33.778 -17.637 -9.265 1.00 0.00 C ATOM 2005 CD ARG A 824 34.639 -17.551 -8.040 1.00 0.00 C ATOM 2006 NE ARG A 824 35.582 -18.653 -7.947 1.00 0.00 N ATOM 2007 CZ ARG A 824 36.367 -18.919 -6.870 1.00 0.00 C ATOM 2008 NH1 ARG A 824 36.377 -18.100 -5.809 1.00 0.00 N ATOM 2009 NH2 ARG A 824 37.112 -20.006 -6.856 1.00 0.00 N ATOM 0 H ARG A 824 33.270 -15.810 -11.576 1.00 0.00 H new ATOM 0 HA ARG A 824 31.379 -17.601 -10.561 1.00 0.00 H new ATOM 0 HB2 ARG A 824 33.201 -15.600 -9.198 1.00 0.00 H new ATOM 0 HB3 ARG A 824 32.164 -16.678 -8.285 1.00 0.00 H new ATOM 0 HG2 ARG A 824 33.318 -18.623 -9.327 1.00 0.00 H new ATOM 0 HG3 ARG A 824 34.390 -17.514 -10.159 1.00 0.00 H new ATOM 0 HD2 ARG A 824 35.186 -16.608 -8.049 1.00 0.00 H new ATOM 0 HD3 ARG A 824 34.005 -17.543 -7.153 1.00 0.00 H new ATOM 0 HE ARG A 824 35.661 -19.275 -8.752 1.00 0.00 H new ATOM 0 HH11 ARG A 824 35.791 -17.265 -5.803 1.00 0.00 H new ATOM 0 HH12 ARG A 824 36.971 -18.311 -5.007 1.00 0.00 H new ATOM 0 HH21 ARG A 824 37.098 -20.644 -7.652 1.00 0.00 H new ATOM 0 HH22 ARG A 824 37.703 -20.209 -6.050 1.00 0.00 H new ATOM 2023 N CYS A 825 30.618 -14.440 -10.237 1.00 0.00 N ATOM 2024 CA CYS A 825 29.607 -13.492 -9.861 1.00 0.00 C ATOM 2025 C CYS A 825 28.327 -13.688 -10.692 1.00 0.00 C ATOM 2026 O CYS A 825 27.233 -13.683 -10.147 1.00 0.00 O ATOM 2027 CB CYS A 825 30.156 -12.062 -9.981 1.00 0.00 C ATOM 2028 SG CYS A 825 29.115 -10.773 -9.230 1.00 0.00 S ATOM 0 H CYS A 825 31.407 -14.031 -10.738 1.00 0.00 H new ATOM 0 HA CYS A 825 29.335 -13.662 -8.819 1.00 0.00 H new ATOM 0 HB2 CYS A 825 31.142 -12.027 -9.517 1.00 0.00 H new ATOM 0 HB3 CYS A 825 30.292 -11.829 -11.037 1.00 0.00 H new ATOM 0 HG CYS A 825 29.678 -9.612 -9.391 1.00 0.00 H new ATOM 2033 N ARG A 826 28.473 -13.926 -11.997 1.00 0.00 N ATOM 2034 CA ARG A 826 27.311 -14.102 -12.878 1.00 0.00 C ATOM 2035 C ARG A 826 26.642 -15.462 -12.733 1.00 0.00 C ATOM 2036 O ARG A 826 25.495 -15.638 -13.160 1.00 0.00 O ATOM 2037 CB ARG A 826 27.654 -13.871 -14.350 1.00 0.00 C ATOM 2038 CG ARG A 826 28.758 -14.739 -14.888 1.00 0.00 C ATOM 2039 CD ARG A 826 28.837 -14.661 -16.397 1.00 0.00 C ATOM 2040 NE ARG A 826 27.616 -15.195 -17.021 1.00 0.00 N ATOM 2041 CZ ARG A 826 27.476 -15.502 -18.312 1.00 0.00 C ATOM 2042 NH1 ARG A 826 28.472 -15.310 -19.167 1.00 0.00 N ATOM 2043 NH2 ARG A 826 26.327 -15.996 -18.741 1.00 0.00 N ATOM 0 H ARG A 826 29.375 -14.001 -12.467 1.00 0.00 H new ATOM 0 HA ARG A 826 26.605 -13.339 -12.550 1.00 0.00 H new ATOM 0 HB2 ARG A 826 26.757 -14.037 -14.947 1.00 0.00 H new ATOM 0 HB3 ARG A 826 27.936 -12.826 -14.482 1.00 0.00 H new ATOM 0 HG2 ARG A 826 29.710 -14.429 -14.456 1.00 0.00 H new ATOM 0 HG3 ARG A 826 28.591 -15.772 -14.584 1.00 0.00 H new ATOM 0 HD2 ARG A 826 28.982 -13.625 -16.703 1.00 0.00 H new ATOM 0 HD3 ARG A 826 29.703 -15.222 -16.748 1.00 0.00 H new ATOM 0 HE ARG A 826 26.809 -15.343 -16.416 1.00 0.00 H new ATOM 0 HH11 ARG A 826 29.358 -14.924 -18.840 1.00 0.00 H new ATOM 0 HH12 ARG A 826 28.352 -15.549 -20.151 1.00 0.00 H new ATOM 0 HH21 ARG A 826 25.558 -16.139 -18.087 1.00 0.00 H new ATOM 0 HH22 ARG A 826 26.210 -16.234 -19.726 1.00 0.00 H new ATOM 2057 N GLY A 827 27.346 -16.416 -12.174 1.00 0.00 N ATOM 2058 CA GLY A 827 26.785 -17.744 -12.036 1.00 0.00 C ATOM 2059 C GLY A 827 27.282 -18.671 -13.119 1.00 0.00 C ATOM 2060 O GLY A 827 26.668 -19.702 -13.407 1.00 0.00 O ATOM 0 H GLY A 827 28.293 -16.305 -11.812 1.00 0.00 H new ATOM 0 HA2 GLY A 827 27.047 -18.151 -11.059 1.00 0.00 H new ATOM 0 HA3 GLY A 827 25.697 -17.686 -12.076 1.00 0.00 H new ATOM 2064 N GLN A 828 28.382 -18.276 -13.735 1.00 0.00 N ATOM 2065 CA GLN A 828 29.056 -19.071 -14.751 1.00 0.00 C ATOM 2066 C GLN A 828 29.656 -20.302 -14.056 1.00 0.00 C ATOM 2067 O GLN A 828 29.979 -20.246 -12.869 1.00 0.00 O ATOM 2068 CB GLN A 828 30.206 -18.241 -15.330 1.00 0.00 C ATOM 2069 CG GLN A 828 30.914 -18.806 -16.553 1.00 0.00 C ATOM 2070 CD GLN A 828 30.218 -18.443 -17.843 1.00 0.00 C ATOM 2071 OE1 GLN A 828 30.493 -17.412 -18.445 1.00 0.00 O ATOM 2072 NE2 GLN A 828 29.354 -19.258 -18.287 1.00 0.00 N ATOM 0 H GLN A 828 28.839 -17.385 -13.543 1.00 0.00 H new ATOM 0 HA GLN A 828 28.363 -19.364 -15.540 1.00 0.00 H new ATOM 0 HB2 GLN A 828 29.817 -17.256 -15.588 1.00 0.00 H new ATOM 0 HB3 GLN A 828 30.948 -18.095 -14.545 1.00 0.00 H new ATOM 0 HG2 GLN A 828 31.938 -18.435 -16.580 1.00 0.00 H new ATOM 0 HG3 GLN A 828 30.970 -19.891 -16.467 1.00 0.00 H new ATOM 0 HE21 GLN A 828 29.142 -20.110 -17.768 1.00 0.00 H new ATOM 0 HE22 GLN A 828 28.871 -19.062 -19.164 1.00 0.00 H new ATOM 2081 N SER A 829 29.800 -21.378 -14.761 1.00 0.00 N ATOM 2082 CA SER A 829 30.407 -22.544 -14.200 1.00 0.00 C ATOM 2083 C SER A 829 31.915 -22.524 -14.492 1.00 0.00 C ATOM 2084 O SER A 829 32.345 -22.653 -15.650 1.00 0.00 O ATOM 2085 CB SER A 829 29.737 -23.785 -14.769 1.00 0.00 C ATOM 2086 OG SER A 829 28.314 -23.696 -14.618 1.00 0.00 O ATOM 0 H SER A 829 29.504 -21.475 -15.732 1.00 0.00 H new ATOM 0 HA SER A 829 30.275 -22.558 -13.118 1.00 0.00 H new ATOM 0 HB2 SER A 829 29.992 -23.893 -15.823 1.00 0.00 H new ATOM 0 HB3 SER A 829 30.109 -24.674 -14.259 1.00 0.00 H new ATOM 0 HG SER A 829 27.895 -24.500 -14.990 1.00 0.00 H new ATOM 2092 N ILE A 830 32.685 -22.287 -13.447 1.00 0.00 N ATOM 2093 CA ILE A 830 34.144 -22.201 -13.491 1.00 0.00 C ATOM 2094 C ILE A 830 34.678 -22.904 -12.235 1.00 0.00 C ATOM 2095 O ILE A 830 34.084 -22.787 -11.147 1.00 0.00 O ATOM 2096 CB ILE A 830 34.668 -20.690 -13.486 1.00 0.00 C ATOM 2097 CG1 ILE A 830 34.344 -19.910 -12.159 1.00 0.00 C ATOM 2098 CG2 ILE A 830 34.141 -19.924 -14.697 1.00 0.00 C ATOM 2099 CD1 ILE A 830 32.880 -19.594 -11.940 1.00 0.00 C ATOM 0 H ILE A 830 32.306 -22.143 -12.511 1.00 0.00 H new ATOM 0 HA ILE A 830 34.493 -22.665 -14.413 1.00 0.00 H new ATOM 0 HB ILE A 830 35.754 -20.755 -13.544 1.00 0.00 H new ATOM 0 HG12 ILE A 830 34.703 -20.497 -11.314 1.00 0.00 H new ATOM 0 HG13 ILE A 830 34.905 -18.976 -12.159 1.00 0.00 H new ATOM 0 HG21 ILE A 830 34.512 -18.900 -14.669 1.00 0.00 H new ATOM 0 HG22 ILE A 830 34.483 -20.409 -15.611 1.00 0.00 H new ATOM 0 HG23 ILE A 830 33.051 -19.916 -14.676 1.00 0.00 H new ATOM 0 HD11 ILE A 830 32.761 -19.056 -11.000 1.00 0.00 H new ATOM 0 HD12 ILE A 830 32.514 -18.976 -12.760 1.00 0.00 H new ATOM 0 HD13 ILE A 830 32.309 -20.522 -11.902 1.00 0.00 H new ATOM 2111 N SER A 831 35.731 -23.635 -12.369 1.00 0.00 N ATOM 2112 CA SER A 831 36.302 -24.354 -11.270 1.00 0.00 C ATOM 2113 C SER A 831 37.777 -23.991 -11.079 1.00 0.00 C ATOM 2114 O SER A 831 38.630 -24.485 -11.792 1.00 0.00 O ATOM 2115 CB SER A 831 36.170 -25.830 -11.561 1.00 0.00 C ATOM 2116 OG SER A 831 34.808 -26.207 -11.725 1.00 0.00 O ATOM 0 H SER A 831 36.229 -23.755 -13.251 1.00 0.00 H new ATOM 0 HA SER A 831 35.777 -24.092 -10.351 1.00 0.00 H new ATOM 0 HB2 SER A 831 36.728 -26.076 -12.464 1.00 0.00 H new ATOM 0 HB3 SER A 831 36.612 -26.404 -10.747 1.00 0.00 H new ATOM 0 HG SER A 831 34.755 -27.167 -11.914 1.00 0.00 H new ATOM 2122 N VAL A 832 38.068 -23.093 -10.162 1.00 0.00 N ATOM 2123 CA VAL A 832 39.448 -22.688 -9.913 1.00 0.00 C ATOM 2124 C VAL A 832 40.250 -23.859 -9.346 1.00 0.00 C ATOM 2125 O VAL A 832 39.957 -24.358 -8.249 1.00 0.00 O ATOM 2126 CB VAL A 832 39.536 -21.441 -8.981 1.00 0.00 C ATOM 2127 CG1 VAL A 832 40.986 -21.109 -8.628 1.00 0.00 C ATOM 2128 CG2 VAL A 832 38.893 -20.236 -9.657 1.00 0.00 C ATOM 0 H VAL A 832 37.376 -22.627 -9.575 1.00 0.00 H new ATOM 0 HA VAL A 832 39.884 -22.396 -10.868 1.00 0.00 H new ATOM 0 HB VAL A 832 39.002 -21.677 -8.061 1.00 0.00 H new ATOM 0 HG11 VAL A 832 41.011 -20.235 -7.977 1.00 0.00 H new ATOM 0 HG12 VAL A 832 41.439 -21.957 -8.114 1.00 0.00 H new ATOM 0 HG13 VAL A 832 41.544 -20.898 -9.541 1.00 0.00 H new ATOM 0 HG21 VAL A 832 38.960 -19.370 -8.998 1.00 0.00 H new ATOM 0 HG22 VAL A 832 39.413 -20.022 -10.591 1.00 0.00 H new ATOM 0 HG23 VAL A 832 37.845 -20.452 -9.867 1.00 0.00 H new ATOM 2138 N THR A 833 41.227 -24.311 -10.109 1.00 0.00 N ATOM 2139 CA THR A 833 42.037 -25.429 -9.718 1.00 0.00 C ATOM 2140 C THR A 833 43.190 -24.971 -8.836 1.00 0.00 C ATOM 2141 O THR A 833 43.532 -25.628 -7.846 1.00 0.00 O ATOM 2142 CB THR A 833 42.546 -26.218 -10.953 1.00 0.00 C ATOM 2143 OG1 THR A 833 43.161 -25.324 -11.903 1.00 0.00 O ATOM 2144 CG2 THR A 833 41.399 -26.961 -11.629 1.00 0.00 C ATOM 0 H THR A 833 41.474 -23.909 -11.013 1.00 0.00 H new ATOM 0 HA THR A 833 41.416 -26.110 -9.135 1.00 0.00 H new ATOM 0 HB THR A 833 43.284 -26.942 -10.608 1.00 0.00 H new ATOM 0 HG1 THR A 833 43.501 -25.839 -12.664 1.00 0.00 H new ATOM 0 HG21 THR A 833 41.778 -27.508 -12.492 1.00 0.00 H new ATOM 0 HG22 THR A 833 40.953 -27.662 -10.923 1.00 0.00 H new ATOM 0 HG23 THR A 833 40.644 -26.246 -11.955 1.00 0.00 H new ATOM 2152 N SER A 834 43.760 -23.831 -9.162 1.00 0.00 N ATOM 2153 CA SER A 834 44.828 -23.287 -8.386 1.00 0.00 C ATOM 2154 C SER A 834 44.887 -21.797 -8.600 1.00 0.00 C ATOM 2155 O SER A 834 44.364 -21.272 -9.591 1.00 0.00 O ATOM 2156 CB SER A 834 46.170 -23.938 -8.748 1.00 0.00 C ATOM 2157 OG SER A 834 47.192 -23.555 -7.831 1.00 0.00 O ATOM 0 H SER A 834 43.491 -23.267 -9.968 1.00 0.00 H new ATOM 0 HA SER A 834 44.639 -23.497 -7.333 1.00 0.00 H new ATOM 0 HB2 SER A 834 46.063 -25.023 -8.746 1.00 0.00 H new ATOM 0 HB3 SER A 834 46.457 -23.648 -9.759 1.00 0.00 H new ATOM 0 HG SER A 834 47.928 -24.201 -7.873 1.00 0.00 H new ATOM 2163 N ILE A 835 45.532 -21.125 -7.691 1.00 0.00 N ATOM 2164 CA ILE A 835 45.629 -19.694 -7.724 1.00 0.00 C ATOM 2165 C ILE A 835 46.877 -19.217 -8.434 1.00 0.00 C ATOM 2166 O ILE A 835 47.189 -18.025 -8.456 1.00 0.00 O ATOM 2167 CB ILE A 835 45.465 -19.076 -6.311 1.00 0.00 C ATOM 2168 CG1 ILE A 835 46.400 -19.694 -5.260 1.00 0.00 C ATOM 2169 CG2 ILE A 835 44.055 -19.232 -5.864 1.00 0.00 C ATOM 2170 CD1 ILE A 835 47.822 -19.270 -5.341 1.00 0.00 C ATOM 0 H ILE A 835 46.009 -21.558 -6.900 1.00 0.00 H new ATOM 0 HA ILE A 835 44.793 -19.330 -8.321 1.00 0.00 H new ATOM 0 HB ILE A 835 45.737 -18.024 -6.396 1.00 0.00 H new ATOM 0 HG12 ILE A 835 46.020 -19.444 -4.269 1.00 0.00 H new ATOM 0 HG13 ILE A 835 46.357 -20.779 -5.354 1.00 0.00 H new ATOM 0 HG21 ILE A 835 43.938 -18.798 -4.871 1.00 0.00 H new ATOM 0 HG22 ILE A 835 43.393 -18.721 -6.563 1.00 0.00 H new ATOM 0 HG23 ILE A 835 43.799 -20.291 -5.830 1.00 0.00 H new ATOM 0 HD11 ILE A 835 48.394 -19.764 -4.556 1.00 0.00 H new ATOM 0 HD12 ILE A 835 48.229 -19.545 -6.314 1.00 0.00 H new ATOM 0 HD13 ILE A 835 47.887 -18.190 -5.213 1.00 0.00 H new ATOM 2182 N ARG A 836 47.594 -20.145 -8.980 1.00 0.00 N ATOM 2183 CA ARG A 836 48.732 -19.852 -9.780 1.00 0.00 C ATOM 2184 C ARG A 836 48.380 -20.069 -11.237 1.00 0.00 C ATOM 2185 O ARG A 836 47.553 -20.935 -11.544 1.00 0.00 O ATOM 2186 CB ARG A 836 49.956 -20.635 -9.328 1.00 0.00 C ATOM 2187 CG ARG A 836 49.770 -22.106 -9.140 1.00 0.00 C ATOM 2188 CD ARG A 836 51.050 -22.668 -8.624 1.00 0.00 C ATOM 2189 NE ARG A 836 50.962 -24.095 -8.280 1.00 0.00 N ATOM 2190 CZ ARG A 836 51.998 -24.864 -7.895 1.00 0.00 C ATOM 2191 NH1 ARG A 836 53.252 -24.378 -7.896 1.00 0.00 N ATOM 2192 NH2 ARG A 836 51.777 -26.116 -7.511 1.00 0.00 N ATOM 0 H ARG A 836 47.400 -21.141 -8.880 1.00 0.00 H new ATOM 0 HA ARG A 836 49.009 -18.805 -9.656 1.00 0.00 H new ATOM 0 HB2 ARG A 836 50.749 -20.481 -10.059 1.00 0.00 H new ATOM 0 HB3 ARG A 836 50.304 -20.211 -8.386 1.00 0.00 H new ATOM 0 HG2 ARG A 836 48.958 -22.301 -8.440 1.00 0.00 H new ATOM 0 HG3 ARG A 836 49.498 -22.580 -10.083 1.00 0.00 H new ATOM 0 HD2 ARG A 836 51.828 -22.530 -9.375 1.00 0.00 H new ATOM 0 HD3 ARG A 836 51.355 -22.107 -7.741 1.00 0.00 H new ATOM 0 HE ARG A 836 50.044 -24.537 -8.338 1.00 0.00 H new ATOM 0 HH11 ARG A 836 53.426 -23.417 -8.191 1.00 0.00 H new ATOM 0 HH12 ARG A 836 54.029 -24.970 -7.602 1.00 0.00 H new ATOM 0 HH21 ARG A 836 50.828 -26.489 -7.509 1.00 0.00 H new ATOM 0 HH22 ARG A 836 52.557 -26.705 -7.218 1.00 0.00 H new ATOM 2206 N PRO A 837 48.930 -19.248 -12.139 1.00 0.00 N ATOM 2207 CA PRO A 837 48.595 -19.295 -13.564 1.00 0.00 C ATOM 2208 C PRO A 837 48.915 -20.630 -14.235 1.00 0.00 C ATOM 2209 O PRO A 837 49.804 -21.382 -13.802 1.00 0.00 O ATOM 2210 CB PRO A 837 49.443 -18.172 -14.181 1.00 0.00 C ATOM 2211 CG PRO A 837 50.531 -17.938 -13.197 1.00 0.00 C ATOM 2212 CD PRO A 837 49.923 -18.195 -11.856 1.00 0.00 C ATOM 0 HA PRO A 837 47.521 -19.175 -13.707 1.00 0.00 H new ATOM 0 HB2 PRO A 837 49.843 -18.465 -15.152 1.00 0.00 H new ATOM 0 HB3 PRO A 837 48.851 -17.270 -14.339 1.00 0.00 H new ATOM 0 HG2 PRO A 837 51.374 -18.604 -13.379 1.00 0.00 H new ATOM 0 HG3 PRO A 837 50.910 -16.918 -13.267 1.00 0.00 H new ATOM 0 HD2 PRO A 837 50.667 -18.526 -11.132 1.00 0.00 H new ATOM 0 HD3 PRO A 837 49.456 -17.299 -11.446 1.00 0.00 H new ATOM 2220 N CYS A 838 48.177 -20.914 -15.276 1.00 0.00 N ATOM 2221 CA CYS A 838 48.369 -22.092 -16.066 1.00 0.00 C ATOM 2222 C CYS A 838 49.262 -21.709 -17.253 1.00 0.00 C ATOM 2223 O CYS A 838 49.571 -20.520 -17.453 1.00 0.00 O ATOM 2224 CB CYS A 838 46.984 -22.575 -16.555 1.00 0.00 C ATOM 2225 SG CYS A 838 46.955 -24.110 -17.538 1.00 0.00 S ATOM 0 H CYS A 838 47.414 -20.320 -15.600 1.00 0.00 H new ATOM 0 HA CYS A 838 48.841 -22.894 -15.498 1.00 0.00 H new ATOM 0 HB2 CYS A 838 46.345 -22.717 -15.683 1.00 0.00 H new ATOM 0 HB3 CYS A 838 46.537 -21.780 -17.152 1.00 0.00 H new ATOM 0 HG CYS A 838 45.730 -24.388 -17.873 1.00 0.00 H new ATOM 2230 N ALA A 839 49.678 -22.669 -18.030 1.00 0.00 N ATOM 2231 CA ALA A 839 50.449 -22.402 -19.228 1.00 0.00 C ATOM 2232 C ALA A 839 49.493 -22.278 -20.411 1.00 0.00 C ATOM 2233 O ALA A 839 49.856 -22.502 -21.557 1.00 0.00 O ATOM 2234 CB ALA A 839 51.465 -23.504 -19.461 1.00 0.00 C ATOM 0 H ALA A 839 49.497 -23.658 -17.858 1.00 0.00 H new ATOM 0 HA ALA A 839 50.999 -21.468 -19.113 1.00 0.00 H new ATOM 0 HB1 ALA A 839 52.035 -23.288 -20.364 1.00 0.00 H new ATOM 0 HB2 ALA A 839 52.142 -23.560 -18.609 1.00 0.00 H new ATOM 0 HB3 ALA A 839 50.948 -24.457 -19.577 1.00 0.00 H new ATOM 2240 N ALA A 840 48.282 -21.840 -20.111 1.00 0.00 N ATOM 2241 CA ALA A 840 47.210 -21.653 -21.082 1.00 0.00 C ATOM 2242 C ALA A 840 47.304 -20.259 -21.689 1.00 0.00 C ATOM 2243 O ALA A 840 46.311 -19.688 -22.151 1.00 0.00 O ATOM 2244 CB ALA A 840 45.870 -21.824 -20.382 1.00 0.00 C ATOM 0 H ALA A 840 48.007 -21.597 -19.159 1.00 0.00 H new ATOM 0 HA ALA A 840 47.302 -22.391 -21.878 1.00 0.00 H new ATOM 0 HB1 ALA A 840 45.063 -21.686 -21.102 1.00 0.00 H new ATOM 0 HB2 ALA A 840 45.808 -22.825 -19.955 1.00 0.00 H new ATOM 0 HB3 ALA A 840 45.778 -21.084 -19.587 1.00 0.00 H new