USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=41 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 833 THR OG1 : rot 168:sc= 1.34 USER MOD Set 1.2: A 834 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 813 GLN :FLIP amide:sc= 0 F(o=-2.7,f=-1.2) USER MOD Set 2.2: A 815 MET CE :methyl -144:sc= -1.25 (180deg=-1.83) USER MOD Set 3.1: A 805 CYS SG : rot 140:sc= -4.5! USER MOD Set 3.2: A 838 CYS SG : rot 126:sc= 1.05 USER MOD Set 4.1: A 797 CYS SG : rot -53:sc= -3.74! USER MOD Set 4.2: A 818 CYS SG : rot 123:sc= -2.13 USER MOD Set 5.1: A 716 LYS NZ :NH3+ -143:sc= 0.0513 (180deg=0) USER MOD Set 5.2: A 721 CYS SG : rot 45:sc= -2.59! USER MOD Set 5.3: A 743 CYS SG : rot -82:sc= 0.952 USER MOD Set 6.1: A 728 CYS SG : rot -83:sc= -4.09! USER MOD Set 6.2: A 763 CYS SG : rot -37:sc= -0.766 USER MOD Set 7.1: A 702 CYS SG : rot 107:sc= -2.25! USER MOD Set 7.2: A 713 CYS SG : rot -78:sc= 0.987 USER MOD Single : A 701 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 703 GLN : amide:sc= -0.108 X(o=-0.11,f=-0.49) USER MOD Single : A 707 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 709 GLN : amide:sc= -0.643 K(o=-0.64,f=-1.5) USER MOD Single : A 710 ASN : amide:sc= -0.178 K(o=-0.18,f=-1.2) USER MOD Single : A 711 SER OG : rot -38:sc= 0.517 USER MOD Single : A 715 CYS SG : rot 170:sc= 0 USER MOD Single : A 717 MET CE :methyl -158:sc= -0.453 (180deg=-0.617) USER MOD Single : A 719 TYR OH : rot 180:sc= 0 USER MOD Single : A 724 SER OG : rot -48:sc= -0.696! USER MOD Single : A 730 GLN : amide:sc= 0.529 K(o=0.53,f=-0.32) USER MOD Single : A 734 SER OG : rot 180:sc= 0 USER MOD Single : A 735 LYS NZ :NH3+ -177:sc= 1.21 (180deg=1.13) USER MOD Single : A 741 THR OG1 : rot 180:sc= -1.68! USER MOD Single : A 744 LYS NZ :NH3+ 170:sc= 1.15 (180deg=1.03) USER MOD Single : A 745 MET CE :methyl 147:sc= -0.1 (180deg=-2.77) USER MOD Single : A 746 HIS : no HD1:sc= -0.0652 K(o=-0.065,f=-5.4!) USER MOD Single : A 749 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 750 CYS SG : rot 173:sc= 1.83 USER MOD Single : A 751 GLN : amide:sc= -0.786 K(o=-0.79,f=-5.6!) USER MOD Single : A 754 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 755 TYR OH : rot -107:sc= 0.904 USER MOD Single : A 756 THR OG1 : rot 136:sc= 1.27 USER MOD Single : A 758 THR OG1 : rot 20:sc= 0.532 USER MOD Single : A 762 SER OG : rot 90:sc= 0 USER MOD Single : A 764 THR OG1 : rot 180:sc= 0 USER MOD Single : A 791 CYS SG : rot 24:sc= 0 USER MOD Single : A 795 SER OG : rot 180:sc= 0.0821 USER MOD Single : A 803 SER OG : rot 180:sc= 0 USER MOD Single : A 809 ASN :FLIP amide:sc= -0.939 F(o=-2.2!,f=-0.94) USER MOD Single : A 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 814 THR OG1 : rot 110:sc= 0.364 USER MOD Single : A 816 SER OG : rot 180:sc= 0 USER MOD Single : A 825 CYS SG : rot 134:sc= 1.59 USER MOD Single : A 828 GLN :FLIP amide:sc= 0 F(o=-2!,f=0) USER MOD Single : A 829 SER OG : rot 180:sc= 0 USER MOD Single : A 831 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 174 N LYS A 701 58.184 -4.881 -14.941 1.00 0.00 N ATOM 175 CA LYS A 701 56.952 -5.557 -14.634 1.00 0.00 C ATOM 176 C LYS A 701 57.182 -6.355 -13.381 1.00 0.00 C ATOM 177 O LYS A 701 58.210 -7.035 -13.255 1.00 0.00 O ATOM 178 CB LYS A 701 56.539 -6.516 -15.769 1.00 0.00 C ATOM 179 CG LYS A 701 56.224 -5.866 -17.114 1.00 0.00 C ATOM 180 CD LYS A 701 54.999 -4.962 -17.049 1.00 0.00 C ATOM 181 CE LYS A 701 54.634 -4.422 -18.430 1.00 0.00 C ATOM 182 NZ LYS A 701 53.467 -3.505 -18.387 1.00 0.00 N ATOM 0 HA LYS A 701 56.155 -4.824 -14.510 1.00 0.00 H new ATOM 0 HB2 LYS A 701 57.341 -7.239 -15.917 1.00 0.00 H new ATOM 0 HB3 LYS A 701 55.662 -7.075 -15.444 1.00 0.00 H new ATOM 0 HG2 LYS A 701 57.085 -5.284 -17.444 1.00 0.00 H new ATOM 0 HG3 LYS A 701 56.060 -6.643 -17.861 1.00 0.00 H new ATOM 0 HD2 LYS A 701 54.156 -5.518 -16.639 1.00 0.00 H new ATOM 0 HD3 LYS A 701 55.193 -4.131 -16.371 1.00 0.00 H new ATOM 0 HE2 LYS A 701 55.491 -3.896 -18.850 1.00 0.00 H new ATOM 0 HE3 LYS A 701 54.414 -5.256 -19.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 701 53.257 -3.165 -19.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 701 52.640 -4.012 -18.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 701 53.685 -2.695 -17.772 1.00 0.00 H new ATOM 196 N CYS A 702 56.280 -6.282 -12.471 1.00 0.00 N ATOM 197 CA CYS A 702 56.422 -7.018 -11.245 1.00 0.00 C ATOM 198 C CYS A 702 55.457 -8.149 -11.304 1.00 0.00 C ATOM 199 O CYS A 702 54.532 -8.123 -12.129 1.00 0.00 O ATOM 200 CB CYS A 702 56.092 -6.133 -10.040 1.00 0.00 C ATOM 201 SG CYS A 702 56.909 -4.508 -10.072 1.00 0.00 S ATOM 0 H CYS A 702 55.430 -5.722 -12.542 1.00 0.00 H new ATOM 0 HA CYS A 702 57.448 -7.370 -11.132 1.00 0.00 H new ATOM 0 HB2 CYS A 702 55.013 -5.985 -9.995 1.00 0.00 H new ATOM 0 HB3 CYS A 702 56.380 -6.656 -9.128 1.00 0.00 H new ATOM 0 HG CYS A 702 56.034 -3.588 -10.350 1.00 0.00 H new ATOM 206 N GLN A 703 55.646 -9.148 -10.498 1.00 0.00 N ATOM 207 CA GLN A 703 54.673 -10.192 -10.429 1.00 0.00 C ATOM 208 C GLN A 703 53.495 -9.685 -9.599 1.00 0.00 C ATOM 209 O GLN A 703 53.600 -8.650 -8.938 1.00 0.00 O ATOM 210 CB GLN A 703 55.271 -11.461 -9.840 1.00 0.00 C ATOM 211 CG GLN A 703 56.456 -12.007 -10.631 1.00 0.00 C ATOM 212 CD GLN A 703 56.107 -12.396 -12.060 1.00 0.00 C ATOM 213 OE1 GLN A 703 54.984 -12.820 -12.357 1.00 0.00 O ATOM 214 NE2 GLN A 703 57.050 -12.246 -12.950 1.00 0.00 N ATOM 0 H GLN A 703 56.454 -9.262 -9.886 1.00 0.00 H new ATOM 0 HA GLN A 703 54.329 -10.451 -11.430 1.00 0.00 H new ATOM 0 HB2 GLN A 703 55.590 -11.261 -8.817 1.00 0.00 H new ATOM 0 HB3 GLN A 703 54.497 -12.226 -9.788 1.00 0.00 H new ATOM 0 HG2 GLN A 703 57.246 -11.256 -10.650 1.00 0.00 H new ATOM 0 HG3 GLN A 703 56.857 -12.879 -10.114 1.00 0.00 H new ATOM 0 HE21 GLN A 703 57.965 -11.893 -12.669 1.00 0.00 H new ATOM 0 HE22 GLN A 703 56.872 -12.481 -13.926 1.00 0.00 H new ATOM 223 N ARG A 704 52.407 -10.401 -9.616 1.00 0.00 N ATOM 224 CA ARG A 704 51.169 -9.971 -8.949 1.00 0.00 C ATOM 225 C ARG A 704 51.332 -9.804 -7.432 1.00 0.00 C ATOM 226 O ARG A 704 50.670 -8.973 -6.805 1.00 0.00 O ATOM 227 CB ARG A 704 50.044 -10.946 -9.280 1.00 0.00 C ATOM 228 CG ARG A 704 49.686 -10.971 -10.748 1.00 0.00 C ATOM 229 CD ARG A 704 49.009 -9.692 -11.180 1.00 0.00 C ATOM 230 NE ARG A 704 49.088 -9.497 -12.627 1.00 0.00 N ATOM 231 CZ ARG A 704 48.065 -9.267 -13.454 1.00 0.00 C ATOM 232 NH1 ARG A 704 46.808 -9.299 -13.008 1.00 0.00 N ATOM 233 NH2 ARG A 704 48.305 -8.999 -14.727 1.00 0.00 N ATOM 0 H ARG A 704 52.333 -11.302 -10.087 1.00 0.00 H new ATOM 0 HA ARG A 704 50.916 -8.982 -9.331 1.00 0.00 H new ATOM 0 HB2 ARG A 704 50.338 -11.948 -8.968 1.00 0.00 H new ATOM 0 HB3 ARG A 704 49.159 -10.679 -8.702 1.00 0.00 H new ATOM 0 HG2 ARG A 704 50.588 -11.123 -11.340 1.00 0.00 H new ATOM 0 HG3 ARG A 704 49.028 -11.817 -10.948 1.00 0.00 H new ATOM 0 HD2 ARG A 704 47.963 -9.713 -10.873 1.00 0.00 H new ATOM 0 HD3 ARG A 704 49.473 -8.846 -10.673 1.00 0.00 H new ATOM 0 HE ARG A 704 50.017 -9.541 -13.046 1.00 0.00 H new ATOM 0 HH11 ARG A 704 46.620 -9.501 -12.026 1.00 0.00 H new ATOM 0 HH12 ARG A 704 46.035 -9.122 -13.649 1.00 0.00 H new ATOM 0 HH21 ARG A 704 49.265 -8.969 -15.070 1.00 0.00 H new ATOM 0 HH22 ARG A 704 47.530 -8.822 -15.366 1.00 0.00 H new ATOM 247 N TRP A 705 52.225 -10.570 -6.866 1.00 0.00 N ATOM 248 CA TRP A 705 52.491 -10.547 -5.441 1.00 0.00 C ATOM 249 C TRP A 705 53.685 -9.646 -5.143 1.00 0.00 C ATOM 250 O TRP A 705 54.172 -9.583 -4.009 1.00 0.00 O ATOM 251 CB TRP A 705 52.743 -11.979 -4.937 1.00 0.00 C ATOM 252 CG TRP A 705 53.837 -12.691 -5.677 1.00 0.00 C ATOM 253 CD1 TRP A 705 55.153 -12.768 -5.328 1.00 0.00 C ATOM 254 CD2 TRP A 705 53.707 -13.432 -6.902 1.00 0.00 C ATOM 255 NE1 TRP A 705 55.848 -13.460 -6.277 1.00 0.00 N ATOM 256 CE2 TRP A 705 54.986 -13.893 -7.245 1.00 0.00 C ATOM 257 CE3 TRP A 705 52.633 -13.739 -7.743 1.00 0.00 C ATOM 258 CZ2 TRP A 705 55.225 -14.646 -8.389 1.00 0.00 C ATOM 259 CZ3 TRP A 705 52.870 -14.489 -8.875 1.00 0.00 C ATOM 260 CH2 TRP A 705 54.156 -14.934 -9.190 1.00 0.00 C ATOM 0 H TRP A 705 52.798 -11.238 -7.382 1.00 0.00 H new ATOM 0 HA TRP A 705 51.624 -10.143 -4.918 1.00 0.00 H new ATOM 0 HB2 TRP A 705 52.996 -11.943 -3.877 1.00 0.00 H new ATOM 0 HB3 TRP A 705 51.821 -12.554 -5.026 1.00 0.00 H new ATOM 0 HD1 TRP A 705 55.582 -12.344 -4.432 1.00 0.00 H new ATOM 0 HE1 TRP A 705 56.854 -13.628 -6.266 1.00 0.00 H new ATOM 0 HE3 TRP A 705 51.636 -13.395 -7.510 1.00 0.00 H new ATOM 0 HZ2 TRP A 705 56.218 -14.990 -8.635 1.00 0.00 H new ATOM 0 HZ3 TRP A 705 52.047 -14.737 -9.529 1.00 0.00 H new ATOM 0 HH2 TRP A 705 54.309 -15.518 -10.086 1.00 0.00 H new ATOM 271 N GLU A 706 54.128 -8.936 -6.150 1.00 0.00 N ATOM 272 CA GLU A 706 55.257 -8.067 -6.031 1.00 0.00 C ATOM 273 C GLU A 706 54.851 -6.623 -6.213 1.00 0.00 C ATOM 274 O GLU A 706 53.813 -6.325 -6.800 1.00 0.00 O ATOM 275 CB GLU A 706 56.356 -8.436 -7.023 1.00 0.00 C ATOM 276 CG GLU A 706 56.966 -9.802 -6.813 1.00 0.00 C ATOM 277 CD GLU A 706 58.089 -10.066 -7.777 1.00 0.00 C ATOM 278 OE1 GLU A 706 59.107 -10.681 -7.377 1.00 0.00 O ATOM 279 OE2 GLU A 706 57.990 -9.647 -8.945 1.00 0.00 O ATOM 0 H GLU A 706 53.708 -8.949 -7.079 1.00 0.00 H new ATOM 0 HA GLU A 706 55.656 -8.192 -5.024 1.00 0.00 H new ATOM 0 HB2 GLU A 706 55.947 -8.388 -8.032 1.00 0.00 H new ATOM 0 HB3 GLU A 706 57.146 -7.688 -6.963 1.00 0.00 H new ATOM 0 HG2 GLU A 706 57.338 -9.881 -5.791 1.00 0.00 H new ATOM 0 HG3 GLU A 706 56.197 -10.566 -6.932 1.00 0.00 H new ATOM 286 N LYS A 707 55.649 -5.752 -5.680 1.00 0.00 N ATOM 287 CA LYS A 707 55.464 -4.336 -5.794 1.00 0.00 C ATOM 288 C LYS A 707 56.781 -3.712 -6.202 1.00 0.00 C ATOM 289 O LYS A 707 57.859 -4.219 -5.831 1.00 0.00 O ATOM 290 CB LYS A 707 54.931 -3.723 -4.479 1.00 0.00 C ATOM 291 CG LYS A 707 55.771 -4.015 -3.233 1.00 0.00 C ATOM 292 CD LYS A 707 55.210 -3.334 -1.982 1.00 0.00 C ATOM 293 CE LYS A 707 55.284 -1.810 -2.082 1.00 0.00 C ATOM 294 NZ LYS A 707 54.683 -1.136 -0.912 1.00 0.00 N ATOM 0 H LYS A 707 56.472 -6.012 -5.137 1.00 0.00 H new ATOM 0 HA LYS A 707 54.711 -4.129 -6.554 1.00 0.00 H new ATOM 0 HB2 LYS A 707 54.860 -2.643 -4.604 1.00 0.00 H new ATOM 0 HB3 LYS A 707 53.919 -4.092 -4.310 1.00 0.00 H new ATOM 0 HG2 LYS A 707 55.813 -5.092 -3.070 1.00 0.00 H new ATOM 0 HG3 LYS A 707 56.794 -3.678 -3.400 1.00 0.00 H new ATOM 0 HD2 LYS A 707 54.174 -3.639 -1.837 1.00 0.00 H new ATOM 0 HD3 LYS A 707 55.766 -3.668 -1.106 1.00 0.00 H new ATOM 0 HE2 LYS A 707 56.326 -1.506 -2.177 1.00 0.00 H new ATOM 0 HE3 LYS A 707 54.773 -1.483 -2.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 707 54.759 -0.105 -1.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 707 53.681 -1.403 -0.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 707 55.186 -1.425 -0.049 1.00 0.00 H new ATOM 308 N LEU A 708 56.709 -2.664 -6.972 1.00 0.00 N ATOM 309 CA LEU A 708 57.887 -2.003 -7.465 1.00 0.00 C ATOM 310 C LEU A 708 58.317 -0.907 -6.525 1.00 0.00 C ATOM 311 O LEU A 708 57.563 0.056 -6.269 1.00 0.00 O ATOM 312 CB LEU A 708 57.635 -1.424 -8.864 1.00 0.00 C ATOM 313 CG LEU A 708 58.815 -0.717 -9.542 1.00 0.00 C ATOM 314 CD1 LEU A 708 59.986 -1.670 -9.732 1.00 0.00 C ATOM 315 CD2 LEU A 708 58.381 -0.122 -10.872 1.00 0.00 C ATOM 0 H LEU A 708 55.832 -2.242 -7.277 1.00 0.00 H new ATOM 0 HA LEU A 708 58.686 -2.742 -7.528 1.00 0.00 H new ATOM 0 HB2 LEU A 708 57.306 -2.235 -9.513 1.00 0.00 H new ATOM 0 HB3 LEU A 708 56.809 -0.716 -8.795 1.00 0.00 H new ATOM 0 HG LEU A 708 59.147 0.093 -8.893 1.00 0.00 H new ATOM 0 HD11 LEU A 708 60.809 -1.143 -10.215 1.00 0.00 H new ATOM 0 HD12 LEU A 708 60.313 -2.042 -8.761 1.00 0.00 H new ATOM 0 HD13 LEU A 708 59.676 -2.508 -10.356 1.00 0.00 H new ATOM 0 HD21 LEU A 708 59.229 0.377 -11.342 1.00 0.00 H new ATOM 0 HD22 LEU A 708 58.020 -0.916 -11.525 1.00 0.00 H new ATOM 0 HD23 LEU A 708 57.583 0.601 -10.704 1.00 0.00 H new ATOM 327 N GLN A 709 59.482 -1.073 -5.964 1.00 0.00 N ATOM 328 CA GLN A 709 60.085 -0.059 -5.161 1.00 0.00 C ATOM 329 C GLN A 709 61.568 -0.183 -5.316 1.00 0.00 C ATOM 330 O GLN A 709 62.069 -1.290 -5.522 1.00 0.00 O ATOM 331 CB GLN A 709 59.701 -0.166 -3.671 1.00 0.00 C ATOM 332 CG GLN A 709 60.324 -1.325 -2.915 1.00 0.00 C ATOM 333 CD GLN A 709 59.857 -1.383 -1.478 1.00 0.00 C ATOM 334 OE1 GLN A 709 58.837 -1.995 -1.156 1.00 0.00 O ATOM 335 NE2 GLN A 709 60.574 -0.752 -0.608 1.00 0.00 N ATOM 0 H GLN A 709 60.039 -1.922 -6.055 1.00 0.00 H new ATOM 0 HA GLN A 709 59.725 0.913 -5.499 1.00 0.00 H new ATOM 0 HB2 GLN A 709 59.983 0.762 -3.174 1.00 0.00 H new ATOM 0 HB3 GLN A 709 58.617 -0.249 -3.599 1.00 0.00 H new ATOM 0 HG2 GLN A 709 60.073 -2.260 -3.415 1.00 0.00 H new ATOM 0 HG3 GLN A 709 61.410 -1.232 -2.939 1.00 0.00 H new ATOM 0 HE21 GLN A 709 61.414 -0.254 -0.904 1.00 0.00 H new ATOM 0 HE22 GLN A 709 60.301 -0.752 0.375 1.00 0.00 H new ATOM 344 N ASN A 710 62.253 0.933 -5.315 1.00 0.00 N ATOM 345 CA ASN A 710 63.720 0.965 -5.306 1.00 0.00 C ATOM 346 C ASN A 710 64.313 0.314 -6.585 1.00 0.00 C ATOM 347 O ASN A 710 65.431 -0.211 -6.572 1.00 0.00 O ATOM 348 CB ASN A 710 64.231 0.246 -4.031 1.00 0.00 C ATOM 349 CG ASN A 710 65.674 0.511 -3.732 1.00 0.00 C ATOM 350 OD1 ASN A 710 66.230 1.550 -4.104 1.00 0.00 O ATOM 351 ND2 ASN A 710 66.280 -0.382 -3.022 1.00 0.00 N ATOM 0 H ASN A 710 61.820 1.857 -5.320 1.00 0.00 H new ATOM 0 HA ASN A 710 64.051 2.004 -5.297 1.00 0.00 H new ATOM 0 HB2 ASN A 710 63.628 0.562 -3.180 1.00 0.00 H new ATOM 0 HB3 ASN A 710 64.083 -0.828 -4.146 1.00 0.00 H new ATOM 0 HD21 ASN A 710 67.253 -0.242 -2.749 1.00 0.00 H new ATOM 0 HD22 ASN A 710 65.786 -1.227 -2.735 1.00 0.00 H new ATOM 358 N SER A 711 63.535 0.344 -7.677 1.00 0.00 N ATOM 359 CA SER A 711 63.939 -0.187 -8.987 1.00 0.00 C ATOM 360 C SER A 711 64.025 -1.734 -8.960 1.00 0.00 C ATOM 361 O SER A 711 64.629 -2.361 -9.849 1.00 0.00 O ATOM 362 CB SER A 711 65.279 0.470 -9.449 1.00 0.00 C ATOM 363 OG SER A 711 65.663 0.079 -10.768 1.00 0.00 O ATOM 0 H SER A 711 62.596 0.743 -7.675 1.00 0.00 H new ATOM 0 HA SER A 711 63.175 0.072 -9.720 1.00 0.00 H new ATOM 0 HB2 SER A 711 65.178 1.555 -9.412 1.00 0.00 H new ATOM 0 HB3 SER A 711 66.071 0.199 -8.750 1.00 0.00 H new ATOM 0 HG SER A 711 65.448 -0.867 -10.904 1.00 0.00 H new ATOM 369 N ARG A 712 63.399 -2.342 -7.977 1.00 0.00 N ATOM 370 CA ARG A 712 63.397 -3.780 -7.854 1.00 0.00 C ATOM 371 C ARG A 712 61.992 -4.253 -7.544 1.00 0.00 C ATOM 372 O ARG A 712 61.139 -3.462 -7.106 1.00 0.00 O ATOM 373 CB ARG A 712 64.367 -4.251 -6.752 1.00 0.00 C ATOM 374 CG ARG A 712 64.011 -3.766 -5.353 1.00 0.00 C ATOM 375 CD ARG A 712 64.915 -4.368 -4.286 1.00 0.00 C ATOM 376 NE ARG A 712 66.313 -3.939 -4.426 1.00 0.00 N ATOM 377 CZ ARG A 712 67.230 -3.921 -3.439 1.00 0.00 C ATOM 378 NH1 ARG A 712 66.912 -4.329 -2.209 1.00 0.00 N ATOM 379 NH2 ARG A 712 68.464 -3.503 -3.697 1.00 0.00 N ATOM 0 H ARG A 712 62.880 -1.856 -7.245 1.00 0.00 H new ATOM 0 HA ARG A 712 63.733 -4.208 -8.798 1.00 0.00 H new ATOM 0 HB2 ARG A 712 64.394 -5.341 -6.750 1.00 0.00 H new ATOM 0 HB3 ARG A 712 65.372 -3.908 -6.998 1.00 0.00 H new ATOM 0 HG2 ARG A 712 64.085 -2.679 -5.318 1.00 0.00 H new ATOM 0 HG3 ARG A 712 62.974 -4.022 -5.135 1.00 0.00 H new ATOM 0 HD2 ARG A 712 64.548 -4.083 -3.300 1.00 0.00 H new ATOM 0 HD3 ARG A 712 64.865 -5.455 -4.343 1.00 0.00 H new ATOM 0 HE ARG A 712 66.615 -3.628 -5.349 1.00 0.00 H new ATOM 0 HH11 ARG A 712 65.968 -4.658 -2.009 1.00 0.00 H new ATOM 0 HH12 ARG A 712 67.613 -4.312 -1.469 1.00 0.00 H new ATOM 0 HH21 ARG A 712 68.713 -3.198 -4.638 1.00 0.00 H new ATOM 0 HH22 ARG A 712 69.163 -3.487 -2.954 1.00 0.00 H new ATOM 393 N CYS A 713 61.747 -5.498 -7.763 1.00 0.00 N ATOM 394 CA CYS A 713 60.466 -6.059 -7.471 1.00 0.00 C ATOM 395 C CYS A 713 60.564 -6.796 -6.154 1.00 0.00 C ATOM 396 O CYS A 713 61.318 -7.761 -6.028 1.00 0.00 O ATOM 397 CB CYS A 713 60.051 -7.020 -8.582 1.00 0.00 C ATOM 398 SG CYS A 713 59.987 -6.274 -10.246 1.00 0.00 S ATOM 0 H CYS A 713 62.423 -6.157 -8.148 1.00 0.00 H new ATOM 0 HA CYS A 713 59.716 -5.271 -7.404 1.00 0.00 H new ATOM 0 HB2 CYS A 713 60.749 -7.857 -8.600 1.00 0.00 H new ATOM 0 HB3 CYS A 713 59.069 -7.429 -8.343 1.00 0.00 H new ATOM 0 HG CYS A 713 58.898 -5.574 -10.366 1.00 0.00 H new ATOM 403 N VAL A 714 59.838 -6.331 -5.177 1.00 0.00 N ATOM 404 CA VAL A 714 59.829 -6.948 -3.864 1.00 0.00 C ATOM 405 C VAL A 714 58.460 -7.519 -3.624 1.00 0.00 C ATOM 406 O VAL A 714 57.545 -7.205 -4.361 1.00 0.00 O ATOM 407 CB VAL A 714 60.173 -5.934 -2.736 1.00 0.00 C ATOM 408 CG1 VAL A 714 61.577 -5.396 -2.898 1.00 0.00 C ATOM 409 CG2 VAL A 714 59.178 -4.789 -2.715 1.00 0.00 C ATOM 0 H VAL A 714 59.233 -5.514 -5.260 1.00 0.00 H new ATOM 0 HA VAL A 714 60.592 -7.726 -3.842 1.00 0.00 H new ATOM 0 HB VAL A 714 60.113 -6.466 -1.786 1.00 0.00 H new ATOM 0 HG11 VAL A 714 61.791 -4.689 -2.096 1.00 0.00 H new ATOM 0 HG12 VAL A 714 62.289 -6.220 -2.855 1.00 0.00 H new ATOM 0 HG13 VAL A 714 61.664 -4.890 -3.860 1.00 0.00 H new ATOM 0 HG21 VAL A 714 59.440 -4.094 -1.918 1.00 0.00 H new ATOM 0 HG22 VAL A 714 59.202 -4.269 -3.673 1.00 0.00 H new ATOM 0 HG23 VAL A 714 58.176 -5.181 -2.540 1.00 0.00 H new ATOM 419 N CYS A 715 58.290 -8.294 -2.606 1.00 0.00 N ATOM 420 CA CYS A 715 57.001 -8.892 -2.361 1.00 0.00 C ATOM 421 C CYS A 715 56.137 -7.979 -1.511 1.00 0.00 C ATOM 422 O CYS A 715 56.642 -7.250 -0.641 1.00 0.00 O ATOM 423 CB CYS A 715 57.151 -10.256 -1.692 1.00 0.00 C ATOM 424 SG CYS A 715 58.064 -11.487 -2.685 1.00 0.00 S ATOM 0 H CYS A 715 59.015 -8.533 -1.929 1.00 0.00 H new ATOM 0 HA CYS A 715 56.510 -9.035 -3.324 1.00 0.00 H new ATOM 0 HB2 CYS A 715 57.662 -10.125 -0.738 1.00 0.00 H new ATOM 0 HB3 CYS A 715 56.159 -10.649 -1.470 1.00 0.00 H new ATOM 0 HG CYS A 715 58.322 -12.530 -1.953 1.00 0.00 H new ATOM 429 N LYS A 716 54.847 -7.993 -1.795 1.00 0.00 N ATOM 430 CA LYS A 716 53.855 -7.207 -1.069 1.00 0.00 C ATOM 431 C LYS A 716 53.668 -7.786 0.336 1.00 0.00 C ATOM 432 O LYS A 716 54.359 -8.736 0.727 1.00 0.00 O ATOM 433 CB LYS A 716 52.522 -7.227 -1.853 1.00 0.00 C ATOM 434 CG LYS A 716 52.639 -6.629 -3.252 1.00 0.00 C ATOM 435 CD LYS A 716 51.451 -6.966 -4.164 1.00 0.00 C ATOM 436 CE LYS A 716 50.135 -6.337 -3.730 1.00 0.00 C ATOM 437 NZ LYS A 716 49.062 -6.601 -4.728 1.00 0.00 N ATOM 0 H LYS A 716 54.450 -8.557 -2.546 1.00 0.00 H new ATOM 0 HA LYS A 716 54.193 -6.175 -0.973 1.00 0.00 H new ATOM 0 HB2 LYS A 716 52.170 -8.256 -1.933 1.00 0.00 H new ATOM 0 HB3 LYS A 716 51.769 -6.675 -1.291 1.00 0.00 H new ATOM 0 HG2 LYS A 716 52.727 -5.546 -3.169 1.00 0.00 H new ATOM 0 HG3 LYS A 716 53.557 -6.989 -3.717 1.00 0.00 H new ATOM 0 HD2 LYS A 716 51.681 -6.638 -5.178 1.00 0.00 H new ATOM 0 HD3 LYS A 716 51.330 -8.049 -4.199 1.00 0.00 H new ATOM 0 HE2 LYS A 716 49.840 -6.736 -2.759 1.00 0.00 H new ATOM 0 HE3 LYS A 716 50.265 -5.262 -3.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 716 48.447 -5.766 -4.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 716 49.491 -6.802 -5.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 716 48.498 -7.420 -4.423 1.00 0.00 H new ATOM 451 N MET A 717 52.778 -7.225 1.098 1.00 0.00 N ATOM 452 CA MET A 717 52.521 -7.734 2.425 1.00 0.00 C ATOM 453 C MET A 717 51.135 -8.377 2.482 1.00 0.00 C ATOM 454 O MET A 717 50.252 -7.979 1.740 1.00 0.00 O ATOM 455 CB MET A 717 52.668 -6.629 3.467 1.00 0.00 C ATOM 456 CG MET A 717 54.081 -6.056 3.569 1.00 0.00 C ATOM 457 SD MET A 717 55.331 -7.311 3.957 1.00 0.00 S ATOM 458 CE MET A 717 54.808 -7.862 5.577 1.00 0.00 C ATOM 0 H MET A 717 52.216 -6.417 0.831 1.00 0.00 H new ATOM 0 HA MET A 717 53.260 -8.501 2.657 1.00 0.00 H new ATOM 0 HB2 MET A 717 51.976 -5.822 3.226 1.00 0.00 H new ATOM 0 HB3 MET A 717 52.374 -7.021 4.441 1.00 0.00 H new ATOM 0 HG2 MET A 717 54.340 -5.573 2.627 1.00 0.00 H new ATOM 0 HG3 MET A 717 54.099 -5.284 4.338 1.00 0.00 H new ATOM 0 HE1 MET A 717 55.652 -8.316 6.097 1.00 0.00 H new ATOM 0 HE2 MET A 717 54.444 -7.010 6.151 1.00 0.00 H new ATOM 0 HE3 MET A 717 54.009 -8.596 5.471 1.00 0.00 H new ATOM 468 N PRO A 718 50.914 -9.382 3.367 1.00 0.00 N ATOM 469 CA PRO A 718 49.627 -10.121 3.447 1.00 0.00 C ATOM 470 C PRO A 718 48.425 -9.234 3.805 1.00 0.00 C ATOM 471 O PRO A 718 47.279 -9.599 3.562 1.00 0.00 O ATOM 472 CB PRO A 718 49.871 -11.158 4.552 1.00 0.00 C ATOM 473 CG PRO A 718 51.352 -11.287 4.633 1.00 0.00 C ATOM 474 CD PRO A 718 51.896 -9.923 4.331 1.00 0.00 C ATOM 0 HA PRO A 718 49.366 -10.550 2.480 1.00 0.00 H new ATOM 0 HB2 PRO A 718 49.450 -10.830 5.502 1.00 0.00 H new ATOM 0 HB3 PRO A 718 49.404 -12.112 4.309 1.00 0.00 H new ATOM 0 HG2 PRO A 718 51.662 -11.622 5.623 1.00 0.00 H new ATOM 0 HG3 PRO A 718 51.721 -12.022 3.918 1.00 0.00 H new ATOM 0 HD2 PRO A 718 51.963 -9.307 5.228 1.00 0.00 H new ATOM 0 HD3 PRO A 718 52.897 -9.973 3.903 1.00 0.00 H new ATOM 482 N TYR A 719 48.696 -8.077 4.357 1.00 0.00 N ATOM 483 CA TYR A 719 47.653 -7.135 4.744 1.00 0.00 C ATOM 484 C TYR A 719 47.477 -6.049 3.673 1.00 0.00 C ATOM 485 O TYR A 719 46.701 -5.104 3.836 1.00 0.00 O ATOM 486 CB TYR A 719 47.966 -6.528 6.121 1.00 0.00 C ATOM 487 CG TYR A 719 49.340 -5.901 6.226 1.00 0.00 C ATOM 488 CD1 TYR A 719 50.453 -6.673 6.547 1.00 0.00 C ATOM 489 CD2 TYR A 719 49.527 -4.545 6.011 1.00 0.00 C ATOM 490 CE1 TYR A 719 51.699 -6.110 6.645 1.00 0.00 C ATOM 491 CE2 TYR A 719 50.775 -3.975 6.106 1.00 0.00 C ATOM 492 CZ TYR A 719 51.859 -4.763 6.423 1.00 0.00 C ATOM 493 OH TYR A 719 53.108 -4.208 6.502 1.00 0.00 O ATOM 0 H TYR A 719 49.643 -7.754 4.554 1.00 0.00 H new ATOM 0 HA TYR A 719 46.707 -7.671 4.823 1.00 0.00 H new ATOM 0 HB2 TYR A 719 47.216 -5.772 6.351 1.00 0.00 H new ATOM 0 HB3 TYR A 719 47.876 -7.307 6.878 1.00 0.00 H new ATOM 0 HD1 TYR A 719 50.333 -7.732 6.722 1.00 0.00 H new ATOM 0 HD2 TYR A 719 48.678 -3.925 5.765 1.00 0.00 H new ATOM 0 HE1 TYR A 719 52.552 -6.723 6.896 1.00 0.00 H new ATOM 0 HE2 TYR A 719 50.904 -2.917 5.933 1.00 0.00 H new ATOM 0 HH TYR A 719 53.051 -3.247 6.318 1.00 0.00 H new ATOM 503 N GLU A 720 48.205 -6.206 2.581 1.00 0.00 N ATOM 504 CA GLU A 720 48.130 -5.312 1.427 1.00 0.00 C ATOM 505 C GLU A 720 47.184 -5.969 0.415 1.00 0.00 C ATOM 506 O GLU A 720 46.842 -5.413 -0.632 1.00 0.00 O ATOM 507 CB GLU A 720 49.536 -5.191 0.813 1.00 0.00 C ATOM 508 CG GLU A 720 49.706 -4.161 -0.289 1.00 0.00 C ATOM 509 CD GLU A 720 49.575 -2.761 0.224 1.00 0.00 C ATOM 510 OE1 GLU A 720 48.609 -2.064 -0.131 1.00 0.00 O ATOM 511 OE2 GLU A 720 50.435 -2.328 1.004 1.00 0.00 O ATOM 0 H GLU A 720 48.875 -6.966 2.464 1.00 0.00 H new ATOM 0 HA GLU A 720 47.771 -4.321 1.705 1.00 0.00 H new ATOM 0 HB2 GLU A 720 50.238 -4.955 1.612 1.00 0.00 H new ATOM 0 HB3 GLU A 720 49.820 -6.166 0.416 1.00 0.00 H new ATOM 0 HG2 GLU A 720 50.684 -4.286 -0.754 1.00 0.00 H new ATOM 0 HG3 GLU A 720 48.960 -4.334 -1.064 1.00 0.00 H new ATOM 518 N CYS A 721 46.782 -7.166 0.757 1.00 0.00 N ATOM 519 CA CYS A 721 45.945 -7.986 -0.068 1.00 0.00 C ATOM 520 C CYS A 721 44.500 -7.558 0.064 1.00 0.00 C ATOM 521 O CYS A 721 43.994 -7.367 1.185 1.00 0.00 O ATOM 522 CB CYS A 721 46.113 -9.434 0.357 1.00 0.00 C ATOM 523 SG CYS A 721 47.856 -9.976 0.366 1.00 0.00 S ATOM 0 H CYS A 721 47.037 -7.605 1.642 1.00 0.00 H new ATOM 0 HA CYS A 721 46.234 -7.877 -1.113 1.00 0.00 H new ATOM 0 HB2 CYS A 721 45.692 -9.566 1.354 1.00 0.00 H new ATOM 0 HB3 CYS A 721 45.543 -10.073 -0.317 1.00 0.00 H new ATOM 0 HG CYS A 721 48.591 -9.066 0.933 1.00 0.00 H new ATOM 528 N GLY A 722 43.853 -7.382 -1.057 1.00 0.00 N ATOM 529 CA GLY A 722 42.480 -6.972 -1.067 1.00 0.00 C ATOM 530 C GLY A 722 41.731 -7.505 -2.274 1.00 0.00 C ATOM 531 O GLY A 722 40.868 -8.372 -2.123 1.00 0.00 O ATOM 0 H GLY A 722 44.262 -7.518 -1.981 1.00 0.00 H new ATOM 0 HA2 GLY A 722 41.992 -7.320 -0.156 1.00 0.00 H new ATOM 0 HA3 GLY A 722 42.428 -5.883 -1.061 1.00 0.00 H new ATOM 535 N PRO A 723 42.042 -7.025 -3.499 1.00 0.00 N ATOM 536 CA PRO A 723 41.339 -7.441 -4.700 1.00 0.00 C ATOM 537 C PRO A 723 41.821 -8.779 -5.252 1.00 0.00 C ATOM 538 O PRO A 723 42.741 -8.825 -6.063 1.00 0.00 O ATOM 539 CB PRO A 723 41.608 -6.310 -5.716 1.00 0.00 C ATOM 540 CG PRO A 723 42.502 -5.330 -5.017 1.00 0.00 C ATOM 541 CD PRO A 723 43.077 -6.039 -3.823 1.00 0.00 C ATOM 0 HA PRO A 723 40.281 -7.595 -4.490 1.00 0.00 H new ATOM 0 HB2 PRO A 723 42.084 -6.699 -6.616 1.00 0.00 H new ATOM 0 HB3 PRO A 723 40.677 -5.836 -6.027 1.00 0.00 H new ATOM 0 HG2 PRO A 723 43.295 -4.988 -5.682 1.00 0.00 H new ATOM 0 HG3 PRO A 723 41.942 -4.447 -4.709 1.00 0.00 H new ATOM 0 HD2 PRO A 723 44.030 -6.515 -4.056 1.00 0.00 H new ATOM 0 HD3 PRO A 723 43.257 -5.354 -2.994 1.00 0.00 H new ATOM 549 N SER A 724 41.238 -9.849 -4.745 1.00 0.00 N ATOM 550 CA SER A 724 41.503 -11.187 -5.195 1.00 0.00 C ATOM 551 C SER A 724 40.350 -12.110 -4.878 1.00 0.00 C ATOM 552 O SER A 724 39.490 -11.793 -4.037 1.00 0.00 O ATOM 553 CB SER A 724 42.783 -11.754 -4.591 1.00 0.00 C ATOM 554 OG SER A 724 43.936 -11.251 -5.228 1.00 0.00 O ATOM 0 H SER A 724 40.552 -9.802 -3.991 1.00 0.00 H new ATOM 0 HA SER A 724 41.630 -11.127 -6.276 1.00 0.00 H new ATOM 0 HB2 SER A 724 42.821 -11.512 -3.529 1.00 0.00 H new ATOM 0 HB3 SER A 724 42.770 -12.841 -4.670 1.00 0.00 H new ATOM 0 HG SER A 724 43.828 -11.318 -6.200 1.00 0.00 H new ATOM 560 N LEU A 725 40.333 -13.217 -5.569 1.00 0.00 N ATOM 561 CA LEU A 725 39.380 -14.277 -5.384 1.00 0.00 C ATOM 562 C LEU A 725 39.599 -14.982 -4.053 1.00 0.00 C ATOM 563 O LEU A 725 40.749 -15.157 -3.616 1.00 0.00 O ATOM 564 CB LEU A 725 39.520 -15.259 -6.546 1.00 0.00 C ATOM 565 CG LEU A 725 38.963 -14.796 -7.887 1.00 0.00 C ATOM 566 CD1 LEU A 725 39.439 -15.689 -9.011 1.00 0.00 C ATOM 567 CD2 LEU A 725 37.455 -14.805 -7.850 1.00 0.00 C ATOM 0 H LEU A 725 41.010 -13.413 -6.306 1.00 0.00 H new ATOM 0 HA LEU A 725 38.372 -13.863 -5.367 1.00 0.00 H new ATOM 0 HB2 LEU A 725 40.578 -15.489 -6.675 1.00 0.00 H new ATOM 0 HB3 LEU A 725 39.023 -16.189 -6.271 1.00 0.00 H new ATOM 0 HG LEU A 725 39.322 -13.783 -8.068 1.00 0.00 H new ATOM 0 HD11 LEU A 725 39.026 -15.336 -9.956 1.00 0.00 H new ATOM 0 HD12 LEU A 725 40.528 -15.665 -9.059 1.00 0.00 H new ATOM 0 HD13 LEU A 725 39.106 -16.711 -8.829 1.00 0.00 H new ATOM 0 HD21 LEU A 725 37.065 -14.473 -8.812 1.00 0.00 H new ATOM 0 HD22 LEU A 725 37.102 -15.816 -7.645 1.00 0.00 H new ATOM 0 HD23 LEU A 725 37.106 -14.133 -7.066 1.00 0.00 H new ATOM 579 N ASP A 726 38.502 -15.353 -3.401 1.00 0.00 N ATOM 580 CA ASP A 726 38.567 -16.064 -2.125 1.00 0.00 C ATOM 581 C ASP A 726 38.735 -17.528 -2.380 1.00 0.00 C ATOM 582 O ASP A 726 38.006 -18.114 -3.190 1.00 0.00 O ATOM 583 CB ASP A 726 37.312 -15.872 -1.253 1.00 0.00 C ATOM 584 CG ASP A 726 37.086 -14.472 -0.769 1.00 0.00 C ATOM 585 OD1 ASP A 726 37.950 -13.918 -0.098 1.00 0.00 O ATOM 586 OD2 ASP A 726 35.986 -13.915 -1.008 1.00 0.00 O ATOM 0 H ASP A 726 37.555 -15.174 -3.734 1.00 0.00 H new ATOM 0 HA ASP A 726 39.415 -15.646 -1.583 1.00 0.00 H new ATOM 0 HB2 ASP A 726 36.439 -16.188 -1.824 1.00 0.00 H new ATOM 0 HB3 ASP A 726 37.384 -16.532 -0.389 1.00 0.00 H new ATOM 591 N VAL A 727 39.680 -18.112 -1.711 1.00 0.00 N ATOM 592 CA VAL A 727 39.991 -19.515 -1.840 1.00 0.00 C ATOM 593 C VAL A 727 40.239 -20.128 -0.469 1.00 0.00 C ATOM 594 O VAL A 727 40.339 -19.417 0.534 1.00 0.00 O ATOM 595 CB VAL A 727 41.231 -19.761 -2.747 1.00 0.00 C ATOM 596 CG1 VAL A 727 40.935 -19.365 -4.187 1.00 0.00 C ATOM 597 CG2 VAL A 727 42.454 -19.005 -2.220 1.00 0.00 C ATOM 0 H VAL A 727 40.274 -17.621 -1.043 1.00 0.00 H new ATOM 0 HA VAL A 727 39.131 -19.991 -2.311 1.00 0.00 H new ATOM 0 HB VAL A 727 41.456 -20.827 -2.725 1.00 0.00 H new ATOM 0 HG11 VAL A 727 41.816 -19.546 -4.803 1.00 0.00 H new ATOM 0 HG12 VAL A 727 40.102 -19.958 -4.563 1.00 0.00 H new ATOM 0 HG13 VAL A 727 40.675 -18.307 -4.227 1.00 0.00 H new ATOM 0 HG21 VAL A 727 43.307 -19.194 -2.872 1.00 0.00 H new ATOM 0 HG22 VAL A 727 42.241 -17.936 -2.202 1.00 0.00 H new ATOM 0 HG23 VAL A 727 42.686 -19.346 -1.211 1.00 0.00 H new ATOM 607 N CYS A 728 40.356 -21.420 -0.425 1.00 0.00 N ATOM 608 CA CYS A 728 40.572 -22.113 0.806 1.00 0.00 C ATOM 609 C CYS A 728 41.897 -22.837 0.745 1.00 0.00 C ATOM 610 O CYS A 728 42.147 -23.639 -0.177 1.00 0.00 O ATOM 611 CB CYS A 728 39.435 -23.085 1.032 1.00 0.00 C ATOM 612 SG CYS A 728 37.796 -22.289 1.020 1.00 0.00 S ATOM 0 H CYS A 728 40.304 -22.024 -1.245 1.00 0.00 H new ATOM 0 HA CYS A 728 40.601 -21.409 1.638 1.00 0.00 H new ATOM 0 HB2 CYS A 728 39.464 -23.854 0.260 1.00 0.00 H new ATOM 0 HB3 CYS A 728 39.580 -23.588 1.988 1.00 0.00 H new ATOM 0 HG CYS A 728 37.551 -21.783 2.192 1.00 0.00 H new ATOM 617 N ALA A 729 42.748 -22.570 1.688 1.00 0.00 N ATOM 618 CA ALA A 729 44.058 -23.153 1.688 1.00 0.00 C ATOM 619 C ALA A 729 44.354 -23.801 3.010 1.00 0.00 C ATOM 620 O ALA A 729 43.789 -23.422 4.037 1.00 0.00 O ATOM 621 CB ALA A 729 45.096 -22.104 1.376 1.00 0.00 C ATOM 0 H ALA A 729 42.558 -21.948 2.474 1.00 0.00 H new ATOM 0 HA ALA A 729 44.090 -23.922 0.916 1.00 0.00 H new ATOM 0 HB1 ALA A 729 46.086 -22.560 1.379 1.00 0.00 H new ATOM 0 HB2 ALA A 729 44.897 -21.676 0.394 1.00 0.00 H new ATOM 0 HB3 ALA A 729 45.056 -21.317 2.129 1.00 0.00 H new ATOM 627 N GLN A 730 45.219 -24.764 2.987 1.00 0.00 N ATOM 628 CA GLN A 730 45.600 -25.456 4.167 1.00 0.00 C ATOM 629 C GLN A 730 46.889 -24.908 4.701 1.00 0.00 C ATOM 630 O GLN A 730 47.916 -24.875 4.003 1.00 0.00 O ATOM 631 CB GLN A 730 45.733 -26.949 3.926 1.00 0.00 C ATOM 632 CG GLN A 730 46.065 -27.727 5.188 1.00 0.00 C ATOM 633 CD GLN A 730 46.096 -29.219 4.978 1.00 0.00 C ATOM 634 OE1 GLN A 730 46.423 -29.711 3.896 1.00 0.00 O ATOM 635 NE2 GLN A 730 45.719 -29.954 5.986 1.00 0.00 N ATOM 0 H GLN A 730 45.682 -25.092 2.139 1.00 0.00 H new ATOM 0 HA GLN A 730 44.811 -25.304 4.903 1.00 0.00 H new ATOM 0 HB2 GLN A 730 44.801 -27.328 3.507 1.00 0.00 H new ATOM 0 HB3 GLN A 730 46.511 -27.124 3.183 1.00 0.00 H new ATOM 0 HG2 GLN A 730 47.034 -27.400 5.564 1.00 0.00 H new ATOM 0 HG3 GLN A 730 45.329 -27.490 5.956 1.00 0.00 H new ATOM 0 HE21 GLN A 730 45.455 -29.514 6.868 1.00 0.00 H new ATOM 0 HE22 GLN A 730 45.688 -30.969 5.893 1.00 0.00 H new ATOM 644 N ASP A 731 46.806 -24.463 5.908 1.00 0.00 N ATOM 645 CA ASP A 731 47.916 -23.964 6.672 1.00 0.00 C ATOM 646 C ASP A 731 48.801 -25.118 7.068 1.00 0.00 C ATOM 647 O ASP A 731 48.383 -25.969 7.836 1.00 0.00 O ATOM 648 CB ASP A 731 47.352 -23.278 7.915 1.00 0.00 C ATOM 649 CG ASP A 731 48.377 -22.818 8.919 1.00 0.00 C ATOM 650 OD1 ASP A 731 49.040 -21.794 8.689 1.00 0.00 O ATOM 651 OD2 ASP A 731 48.469 -23.452 10.002 1.00 0.00 O ATOM 0 H ASP A 731 45.924 -24.433 6.420 1.00 0.00 H new ATOM 0 HA ASP A 731 48.507 -23.256 6.091 1.00 0.00 H new ATOM 0 HB2 ASP A 731 46.765 -22.416 7.599 1.00 0.00 H new ATOM 0 HB3 ASP A 731 46.667 -23.966 8.410 1.00 0.00 H new ATOM 656 N GLU A 732 50.005 -25.169 6.528 1.00 0.00 N ATOM 657 CA GLU A 732 50.935 -26.266 6.810 1.00 0.00 C ATOM 658 C GLU A 732 51.325 -26.369 8.278 1.00 0.00 C ATOM 659 O GLU A 732 51.692 -27.452 8.753 1.00 0.00 O ATOM 660 CB GLU A 732 52.184 -26.183 5.931 1.00 0.00 C ATOM 661 CG GLU A 732 51.928 -26.528 4.482 1.00 0.00 C ATOM 662 CD GLU A 732 51.418 -27.930 4.316 1.00 0.00 C ATOM 663 OE1 GLU A 732 50.260 -28.112 3.913 1.00 0.00 O ATOM 664 OE2 GLU A 732 52.184 -28.884 4.573 1.00 0.00 O ATOM 0 H GLU A 732 50.370 -24.464 5.888 1.00 0.00 H new ATOM 0 HA GLU A 732 50.391 -27.178 6.565 1.00 0.00 H new ATOM 0 HB2 GLU A 732 52.592 -25.174 5.989 1.00 0.00 H new ATOM 0 HB3 GLU A 732 52.943 -26.857 6.328 1.00 0.00 H new ATOM 0 HG2 GLU A 732 51.204 -25.828 4.066 1.00 0.00 H new ATOM 0 HG3 GLU A 732 52.850 -26.409 3.913 1.00 0.00 H new ATOM 671 N ARG A 733 51.210 -25.270 8.991 1.00 0.00 N ATOM 672 CA ARG A 733 51.589 -25.212 10.383 1.00 0.00 C ATOM 673 C ARG A 733 50.633 -26.039 11.249 1.00 0.00 C ATOM 674 O ARG A 733 51.046 -26.984 11.905 1.00 0.00 O ATOM 675 CB ARG A 733 51.631 -23.752 10.853 1.00 0.00 C ATOM 676 CG ARG A 733 52.069 -23.538 12.301 1.00 0.00 C ATOM 677 CD ARG A 733 53.487 -24.042 12.562 1.00 0.00 C ATOM 678 NE ARG A 733 53.928 -23.683 13.916 1.00 0.00 N ATOM 679 CZ ARG A 733 55.059 -24.071 14.513 1.00 0.00 C ATOM 680 NH1 ARG A 733 55.859 -24.951 13.931 1.00 0.00 N ATOM 681 NH2 ARG A 733 55.364 -23.582 15.714 1.00 0.00 N ATOM 0 H ARG A 733 50.850 -24.391 8.620 1.00 0.00 H new ATOM 0 HA ARG A 733 52.585 -25.643 10.490 1.00 0.00 H new ATOM 0 HB2 ARG A 733 52.308 -23.199 10.202 1.00 0.00 H new ATOM 0 HB3 ARG A 733 50.639 -23.319 10.724 1.00 0.00 H new ATOM 0 HG2 ARG A 733 52.014 -22.476 12.541 1.00 0.00 H new ATOM 0 HG3 ARG A 733 51.376 -24.052 12.967 1.00 0.00 H new ATOM 0 HD2 ARG A 733 53.521 -25.124 12.439 1.00 0.00 H new ATOM 0 HD3 ARG A 733 54.170 -23.616 11.827 1.00 0.00 H new ATOM 0 HE ARG A 733 53.309 -23.077 14.455 1.00 0.00 H new ATOM 0 HH11 ARG A 733 55.614 -25.338 13.020 1.00 0.00 H new ATOM 0 HH12 ARG A 733 56.720 -25.241 14.394 1.00 0.00 H new ATOM 0 HH21 ARG A 733 54.737 -22.918 16.169 1.00 0.00 H new ATOM 0 HH22 ARG A 733 56.225 -23.871 16.179 1.00 0.00 H new ATOM 695 N SER A 734 49.366 -25.698 11.237 1.00 0.00 N ATOM 696 CA SER A 734 48.408 -26.395 12.080 1.00 0.00 C ATOM 697 C SER A 734 47.556 -27.402 11.286 1.00 0.00 C ATOM 698 O SER A 734 46.697 -28.075 11.851 1.00 0.00 O ATOM 699 CB SER A 734 47.523 -25.373 12.776 1.00 0.00 C ATOM 700 OG SER A 734 48.324 -24.385 13.412 1.00 0.00 O ATOM 0 H SER A 734 48.972 -24.953 10.663 1.00 0.00 H new ATOM 0 HA SER A 734 48.961 -26.973 12.821 1.00 0.00 H new ATOM 0 HB2 SER A 734 46.859 -24.902 12.051 1.00 0.00 H new ATOM 0 HB3 SER A 734 46.891 -25.869 13.513 1.00 0.00 H new ATOM 0 HG SER A 734 47.745 -23.731 13.856 1.00 0.00 H new ATOM 706 N LYS A 735 47.804 -27.488 9.975 1.00 0.00 N ATOM 707 CA LYS A 735 47.076 -28.379 9.047 1.00 0.00 C ATOM 708 C LYS A 735 45.595 -28.038 8.977 1.00 0.00 C ATOM 709 O LYS A 735 44.767 -28.868 8.623 1.00 0.00 O ATOM 710 CB LYS A 735 47.304 -29.864 9.368 1.00 0.00 C ATOM 711 CG LYS A 735 48.743 -30.326 9.162 1.00 0.00 C ATOM 712 CD LYS A 735 49.235 -29.971 7.764 1.00 0.00 C ATOM 713 CE LYS A 735 50.565 -30.630 7.448 1.00 0.00 C ATOM 714 NZ LYS A 735 51.628 -30.238 8.391 1.00 0.00 N ATOM 0 H LYS A 735 48.527 -26.934 9.515 1.00 0.00 H new ATOM 0 HA LYS A 735 47.493 -28.204 8.055 1.00 0.00 H new ATOM 0 HB2 LYS A 735 47.017 -30.050 10.403 1.00 0.00 H new ATOM 0 HB3 LYS A 735 46.646 -30.466 8.742 1.00 0.00 H new ATOM 0 HG2 LYS A 735 49.388 -29.861 9.908 1.00 0.00 H new ATOM 0 HG3 LYS A 735 48.808 -31.404 9.312 1.00 0.00 H new ATOM 0 HD2 LYS A 735 48.493 -30.281 7.028 1.00 0.00 H new ATOM 0 HD3 LYS A 735 49.337 -28.889 7.679 1.00 0.00 H new ATOM 0 HE2 LYS A 735 50.445 -31.713 7.471 1.00 0.00 H new ATOM 0 HE3 LYS A 735 50.867 -30.364 6.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 735 52.527 -30.674 8.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 735 51.729 -29.203 8.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 735 51.379 -30.560 9.348 1.00 0.00 H new ATOM 728 N ARG A 736 45.308 -26.790 9.201 1.00 0.00 N ATOM 729 CA ARG A 736 43.953 -26.272 9.248 1.00 0.00 C ATOM 730 C ARG A 736 43.614 -25.633 7.916 1.00 0.00 C ATOM 731 O ARG A 736 44.480 -25.024 7.286 1.00 0.00 O ATOM 732 CB ARG A 736 43.862 -25.227 10.377 1.00 0.00 C ATOM 733 CG ARG A 736 44.950 -24.167 10.266 1.00 0.00 C ATOM 734 CD ARG A 736 44.946 -23.168 11.391 1.00 0.00 C ATOM 735 NE ARG A 736 46.142 -22.309 11.321 1.00 0.00 N ATOM 736 CZ ARG A 736 46.236 -21.073 11.830 1.00 0.00 C ATOM 737 NH1 ARG A 736 45.195 -20.518 12.445 1.00 0.00 N ATOM 738 NH2 ARG A 736 47.377 -20.396 11.721 1.00 0.00 N ATOM 0 H ARG A 736 46.020 -26.078 9.361 1.00 0.00 H new ATOM 0 HA ARG A 736 43.246 -27.079 9.442 1.00 0.00 H new ATOM 0 HB2 ARG A 736 42.884 -24.746 10.348 1.00 0.00 H new ATOM 0 HB3 ARG A 736 43.942 -25.728 11.342 1.00 0.00 H new ATOM 0 HG2 ARG A 736 45.922 -24.660 10.235 1.00 0.00 H new ATOM 0 HG3 ARG A 736 44.831 -23.636 9.321 1.00 0.00 H new ATOM 0 HD2 ARG A 736 44.047 -22.555 11.338 1.00 0.00 H new ATOM 0 HD3 ARG A 736 44.920 -23.689 12.348 1.00 0.00 H new ATOM 0 HE ARG A 736 46.963 -22.685 10.847 1.00 0.00 H new ATOM 0 HH11 ARG A 736 44.319 -21.034 12.531 1.00 0.00 H new ATOM 0 HH12 ARG A 736 45.273 -19.577 12.830 1.00 0.00 H new ATOM 0 HH21 ARG A 736 48.178 -20.818 11.251 1.00 0.00 H new ATOM 0 HH22 ARG A 736 47.451 -19.455 12.108 1.00 0.00 H new ATOM 752 N ILE A 737 42.401 -25.789 7.472 1.00 0.00 N ATOM 753 CA ILE A 737 41.986 -25.152 6.246 1.00 0.00 C ATOM 754 C ILE A 737 41.457 -23.779 6.608 1.00 0.00 C ATOM 755 O ILE A 737 40.592 -23.661 7.485 1.00 0.00 O ATOM 756 CB ILE A 737 40.853 -25.924 5.543 1.00 0.00 C ATOM 757 CG1 ILE A 737 41.176 -27.420 5.414 1.00 0.00 C ATOM 758 CG2 ILE A 737 40.611 -25.320 4.160 1.00 0.00 C ATOM 759 CD1 ILE A 737 42.338 -27.744 4.522 1.00 0.00 C ATOM 0 H ILE A 737 41.682 -26.347 7.933 1.00 0.00 H new ATOM 0 HA ILE A 737 42.839 -25.113 5.569 1.00 0.00 H new ATOM 0 HB ILE A 737 39.953 -25.835 6.152 1.00 0.00 H new ATOM 0 HG12 ILE A 737 41.378 -27.820 6.408 1.00 0.00 H new ATOM 0 HG13 ILE A 737 40.293 -27.936 5.037 1.00 0.00 H new ATOM 0 HG21 ILE A 737 39.810 -25.864 3.660 1.00 0.00 H new ATOM 0 HG22 ILE A 737 40.328 -24.273 4.265 1.00 0.00 H new ATOM 0 HG23 ILE A 737 41.523 -25.392 3.567 1.00 0.00 H new ATOM 0 HD11 ILE A 737 42.487 -28.823 4.496 1.00 0.00 H new ATOM 0 HD12 ILE A 737 42.135 -27.381 3.514 1.00 0.00 H new ATOM 0 HD13 ILE A 737 43.237 -27.263 4.907 1.00 0.00 H new ATOM 771 N LEU A 738 41.974 -22.763 6.002 1.00 0.00 N ATOM 772 CA LEU A 738 41.528 -21.434 6.299 1.00 0.00 C ATOM 773 C LEU A 738 41.258 -20.636 5.013 1.00 0.00 C ATOM 774 O LEU A 738 41.842 -20.933 3.950 1.00 0.00 O ATOM 775 CB LEU A 738 42.517 -20.737 7.268 1.00 0.00 C ATOM 776 CG LEU A 738 43.946 -20.502 6.773 1.00 0.00 C ATOM 777 CD1 LEU A 738 44.031 -19.240 5.997 1.00 0.00 C ATOM 778 CD2 LEU A 738 44.928 -20.478 7.909 1.00 0.00 C ATOM 0 H LEU A 738 42.708 -22.823 5.296 1.00 0.00 H new ATOM 0 HA LEU A 738 40.570 -21.485 6.817 1.00 0.00 H new ATOM 0 HB2 LEU A 738 42.093 -19.771 7.543 1.00 0.00 H new ATOM 0 HB3 LEU A 738 42.571 -21.333 8.179 1.00 0.00 H new ATOM 0 HG LEU A 738 44.206 -21.336 6.121 1.00 0.00 H new ATOM 0 HD11 LEU A 738 45.055 -19.092 5.654 1.00 0.00 H new ATOM 0 HD12 LEU A 738 43.365 -19.297 5.136 1.00 0.00 H new ATOM 0 HD13 LEU A 738 43.735 -18.403 6.630 1.00 0.00 H new ATOM 0 HD21 LEU A 738 45.932 -20.309 7.519 1.00 0.00 H new ATOM 0 HD22 LEU A 738 44.667 -19.675 8.599 1.00 0.00 H new ATOM 0 HD23 LEU A 738 44.899 -21.432 8.435 1.00 0.00 H new ATOM 790 N PRO A 739 40.340 -19.661 5.082 1.00 0.00 N ATOM 791 CA PRO A 739 40.006 -18.799 3.947 1.00 0.00 C ATOM 792 C PRO A 739 41.110 -17.752 3.640 1.00 0.00 C ATOM 793 O PRO A 739 41.497 -16.942 4.505 1.00 0.00 O ATOM 794 CB PRO A 739 38.716 -18.109 4.414 1.00 0.00 C ATOM 795 CG PRO A 739 38.811 -18.083 5.896 1.00 0.00 C ATOM 796 CD PRO A 739 39.517 -19.345 6.276 1.00 0.00 C ATOM 0 HA PRO A 739 39.901 -19.362 3.019 1.00 0.00 H new ATOM 0 HB2 PRO A 739 38.637 -17.102 4.006 1.00 0.00 H new ATOM 0 HB3 PRO A 739 37.833 -18.657 4.084 1.00 0.00 H new ATOM 0 HG2 PRO A 739 39.362 -17.207 6.238 1.00 0.00 H new ATOM 0 HG3 PRO A 739 37.822 -18.035 6.351 1.00 0.00 H new ATOM 0 HD2 PRO A 739 40.135 -19.207 7.163 1.00 0.00 H new ATOM 0 HD3 PRO A 739 38.813 -20.146 6.500 1.00 0.00 H new ATOM 804 N LEU A 740 41.602 -17.779 2.423 1.00 0.00 N ATOM 805 CA LEU A 740 42.618 -16.855 1.950 1.00 0.00 C ATOM 806 C LEU A 740 42.200 -16.310 0.616 1.00 0.00 C ATOM 807 O LEU A 740 41.183 -16.706 0.072 1.00 0.00 O ATOM 808 CB LEU A 740 44.000 -17.540 1.786 1.00 0.00 C ATOM 809 CG LEU A 740 44.745 -17.931 3.060 1.00 0.00 C ATOM 810 CD1 LEU A 740 46.028 -18.659 2.727 1.00 0.00 C ATOM 811 CD2 LEU A 740 45.068 -16.702 3.887 1.00 0.00 C ATOM 0 H LEU A 740 41.305 -18.454 1.718 1.00 0.00 H new ATOM 0 HA LEU A 740 42.715 -16.063 2.692 1.00 0.00 H new ATOM 0 HB2 LEU A 740 43.861 -18.440 1.187 1.00 0.00 H new ATOM 0 HB3 LEU A 740 44.642 -16.871 1.212 1.00 0.00 H new ATOM 0 HG LEU A 740 44.097 -18.592 3.635 1.00 0.00 H new ATOM 0 HD11 LEU A 740 46.543 -18.928 3.649 1.00 0.00 H new ATOM 0 HD12 LEU A 740 45.798 -19.563 2.163 1.00 0.00 H new ATOM 0 HD13 LEU A 740 46.669 -18.011 2.129 1.00 0.00 H new ATOM 0 HD21 LEU A 740 45.599 -17.001 4.791 1.00 0.00 H new ATOM 0 HD22 LEU A 740 45.694 -16.026 3.305 1.00 0.00 H new ATOM 0 HD23 LEU A 740 44.143 -16.194 4.161 1.00 0.00 H new ATOM 823 N THR A 741 42.953 -15.401 0.103 1.00 0.00 N ATOM 824 CA THR A 741 42.732 -14.927 -1.215 1.00 0.00 C ATOM 825 C THR A 741 43.898 -15.275 -2.057 1.00 0.00 C ATOM 826 O THR A 741 44.952 -15.688 -1.532 1.00 0.00 O ATOM 827 CB THR A 741 42.528 -13.422 -1.272 1.00 0.00 C ATOM 828 OG1 THR A 741 43.486 -12.752 -0.442 1.00 0.00 O ATOM 829 CG2 THR A 741 41.124 -13.057 -0.906 1.00 0.00 C ATOM 0 H THR A 741 43.739 -14.966 0.586 1.00 0.00 H new ATOM 0 HA THR A 741 41.820 -15.401 -1.579 1.00 0.00 H new ATOM 0 HB THR A 741 42.690 -13.090 -2.297 1.00 0.00 H new ATOM 0 HG1 THR A 741 43.342 -11.784 -0.492 1.00 0.00 H new ATOM 0 HG21 THR A 741 41.005 -11.975 -0.955 1.00 0.00 H new ATOM 0 HG22 THR A 741 40.432 -13.530 -1.603 1.00 0.00 H new ATOM 0 HG23 THR A 741 40.911 -13.400 0.106 1.00 0.00 H new ATOM 837 N VAL A 742 43.731 -15.114 -3.336 1.00 0.00 N ATOM 838 CA VAL A 742 44.776 -15.353 -4.285 1.00 0.00 C ATOM 839 C VAL A 742 46.001 -14.492 -3.956 1.00 0.00 C ATOM 840 O VAL A 742 47.124 -15.008 -3.838 1.00 0.00 O ATOM 841 CB VAL A 742 44.298 -15.063 -5.712 1.00 0.00 C ATOM 842 CG1 VAL A 742 45.369 -15.323 -6.733 1.00 0.00 C ATOM 843 CG2 VAL A 742 43.082 -15.866 -6.029 1.00 0.00 C ATOM 0 H VAL A 742 42.852 -14.809 -3.755 1.00 0.00 H new ATOM 0 HA VAL A 742 45.054 -16.405 -4.224 1.00 0.00 H new ATOM 0 HB VAL A 742 44.051 -14.002 -5.758 1.00 0.00 H new ATOM 0 HG11 VAL A 742 44.984 -15.103 -7.729 1.00 0.00 H new ATOM 0 HG12 VAL A 742 46.229 -14.686 -6.528 1.00 0.00 H new ATOM 0 HG13 VAL A 742 45.672 -16.369 -6.684 1.00 0.00 H new ATOM 0 HG21 VAL A 742 42.757 -15.647 -7.046 1.00 0.00 H new ATOM 0 HG22 VAL A 742 43.314 -16.927 -5.943 1.00 0.00 H new ATOM 0 HG23 VAL A 742 42.285 -15.611 -5.330 1.00 0.00 H new ATOM 853 N CYS A 743 45.768 -13.200 -3.782 1.00 0.00 N ATOM 854 CA CYS A 743 46.809 -12.251 -3.433 1.00 0.00 C ATOM 855 C CYS A 743 47.504 -12.647 -2.143 1.00 0.00 C ATOM 856 O CYS A 743 48.728 -12.759 -2.108 1.00 0.00 O ATOM 857 CB CYS A 743 46.231 -10.824 -3.309 1.00 0.00 C ATOM 858 SG CYS A 743 47.466 -9.493 -3.063 1.00 0.00 S ATOM 0 H CYS A 743 44.844 -12.780 -3.880 1.00 0.00 H new ATOM 0 HA CYS A 743 47.546 -12.262 -4.236 1.00 0.00 H new ATOM 0 HB2 CYS A 743 45.658 -10.603 -4.210 1.00 0.00 H new ATOM 0 HB3 CYS A 743 45.531 -10.805 -2.474 1.00 0.00 H new ATOM 0 HG CYS A 743 47.791 -9.429 -1.806 1.00 0.00 H new ATOM 863 N LYS A 744 46.709 -12.945 -1.120 1.00 0.00 N ATOM 864 CA LYS A 744 47.222 -13.221 0.212 1.00 0.00 C ATOM 865 C LYS A 744 48.099 -14.454 0.200 1.00 0.00 C ATOM 866 O LYS A 744 49.221 -14.419 0.678 1.00 0.00 O ATOM 867 CB LYS A 744 46.065 -13.407 1.161 1.00 0.00 C ATOM 868 CG LYS A 744 46.346 -12.991 2.586 1.00 0.00 C ATOM 869 CD LYS A 744 45.112 -13.185 3.434 1.00 0.00 C ATOM 870 CE LYS A 744 45.270 -12.594 4.817 1.00 0.00 C ATOM 871 NZ LYS A 744 45.312 -11.120 4.784 1.00 0.00 N ATOM 0 H LYS A 744 45.693 -13.001 -1.194 1.00 0.00 H new ATOM 0 HA LYS A 744 47.830 -12.379 0.544 1.00 0.00 H new ATOM 0 HB2 LYS A 744 45.214 -12.836 0.791 1.00 0.00 H new ATOM 0 HB3 LYS A 744 45.772 -14.457 1.154 1.00 0.00 H new ATOM 0 HG2 LYS A 744 47.170 -13.579 2.989 1.00 0.00 H new ATOM 0 HG3 LYS A 744 46.656 -11.946 2.614 1.00 0.00 H new ATOM 0 HD2 LYS A 744 44.257 -12.724 2.939 1.00 0.00 H new ATOM 0 HD3 LYS A 744 44.895 -14.250 3.518 1.00 0.00 H new ATOM 0 HE2 LYS A 744 44.443 -12.920 5.448 1.00 0.00 H new ATOM 0 HE3 LYS A 744 46.185 -12.973 5.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 744 45.250 -10.749 5.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 744 46.204 -10.808 4.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 744 44.511 -10.762 4.225 1.00 0.00 H new ATOM 885 N MET A 745 47.580 -15.524 -0.378 1.00 0.00 N ATOM 886 CA MET A 745 48.304 -16.780 -0.520 1.00 0.00 C ATOM 887 C MET A 745 49.614 -16.578 -1.274 1.00 0.00 C ATOM 888 O MET A 745 50.639 -17.027 -0.825 1.00 0.00 O ATOM 889 CB MET A 745 47.414 -17.798 -1.247 1.00 0.00 C ATOM 890 CG MET A 745 48.146 -18.746 -2.211 1.00 0.00 C ATOM 891 SD MET A 745 49.113 -20.050 -1.425 1.00 0.00 S ATOM 892 CE MET A 745 47.801 -21.002 -0.685 1.00 0.00 C ATOM 0 H MET A 745 46.637 -15.548 -0.766 1.00 0.00 H new ATOM 0 HA MET A 745 48.552 -17.158 0.472 1.00 0.00 H new ATOM 0 HB2 MET A 745 46.893 -18.398 -0.501 1.00 0.00 H new ATOM 0 HB3 MET A 745 46.653 -17.255 -1.807 1.00 0.00 H new ATOM 0 HG2 MET A 745 47.410 -19.209 -2.868 1.00 0.00 H new ATOM 0 HG3 MET A 745 48.810 -18.155 -2.842 1.00 0.00 H new ATOM 0 HE1 MET A 745 48.075 -22.057 -0.680 1.00 0.00 H new ATOM 0 HE2 MET A 745 47.639 -20.665 0.339 1.00 0.00 H new ATOM 0 HE3 MET A 745 46.885 -20.868 -1.260 1.00 0.00 H new ATOM 902 N HIS A 746 49.574 -15.869 -2.402 1.00 0.00 N ATOM 903 CA HIS A 746 50.793 -15.687 -3.219 1.00 0.00 C ATOM 904 C HIS A 746 51.845 -14.902 -2.472 1.00 0.00 C ATOM 905 O HIS A 746 53.015 -15.289 -2.447 1.00 0.00 O ATOM 906 CB HIS A 746 50.519 -14.994 -4.545 1.00 0.00 C ATOM 907 CG HIS A 746 50.057 -15.848 -5.682 1.00 0.00 C ATOM 908 ND1 HIS A 746 50.917 -16.390 -6.613 1.00 0.00 N ATOM 909 CD2 HIS A 746 48.824 -16.167 -6.099 1.00 0.00 C ATOM 910 CE1 HIS A 746 50.228 -16.993 -7.547 1.00 0.00 C ATOM 911 NE2 HIS A 746 48.955 -16.872 -7.260 1.00 0.00 N ATOM 0 H HIS A 746 48.737 -15.418 -2.772 1.00 0.00 H new ATOM 0 HA HIS A 746 51.157 -16.693 -3.426 1.00 0.00 H new ATOM 0 HB2 HIS A 746 49.767 -14.224 -4.374 1.00 0.00 H new ATOM 0 HB3 HIS A 746 51.432 -14.485 -4.855 1.00 0.00 H new ATOM 0 HD2 HIS A 746 47.897 -15.913 -5.607 1.00 0.00 H new ATOM 0 HE1 HIS A 746 50.638 -17.503 -8.407 1.00 0.00 H new ATOM 0 HE2 HIS A 746 48.185 -17.245 -7.816 1.00 0.00 H new ATOM 920 N VAL A 747 51.422 -13.809 -1.866 1.00 0.00 N ATOM 921 CA VAL A 747 52.300 -12.959 -1.089 1.00 0.00 C ATOM 922 C VAL A 747 52.921 -13.740 0.038 1.00 0.00 C ATOM 923 O VAL A 747 54.141 -13.870 0.118 1.00 0.00 O ATOM 924 CB VAL A 747 51.531 -11.732 -0.542 1.00 0.00 C ATOM 925 CG1 VAL A 747 52.315 -11.020 0.550 1.00 0.00 C ATOM 926 CG2 VAL A 747 51.261 -10.780 -1.683 1.00 0.00 C ATOM 0 H VAL A 747 50.455 -13.485 -1.900 1.00 0.00 H new ATOM 0 HA VAL A 747 53.096 -12.598 -1.741 1.00 0.00 H new ATOM 0 HB VAL A 747 50.594 -12.076 -0.103 1.00 0.00 H new ATOM 0 HG11 VAL A 747 51.743 -10.164 0.909 1.00 0.00 H new ATOM 0 HG12 VAL A 747 52.496 -11.708 1.376 1.00 0.00 H new ATOM 0 HG13 VAL A 747 53.268 -10.677 0.148 1.00 0.00 H new ATOM 0 HG21 VAL A 747 50.719 -9.910 -1.311 1.00 0.00 H new ATOM 0 HG22 VAL A 747 52.206 -10.459 -2.120 1.00 0.00 H new ATOM 0 HG23 VAL A 747 50.662 -11.283 -2.442 1.00 0.00 H new ATOM 936 N LEU A 748 52.078 -14.310 0.842 1.00 0.00 N ATOM 937 CA LEU A 748 52.464 -15.086 1.981 1.00 0.00 C ATOM 938 C LEU A 748 53.348 -16.292 1.581 1.00 0.00 C ATOM 939 O LEU A 748 54.307 -16.628 2.276 1.00 0.00 O ATOM 940 CB LEU A 748 51.167 -15.411 2.788 1.00 0.00 C ATOM 941 CG LEU A 748 50.967 -16.764 3.455 1.00 0.00 C ATOM 942 CD1 LEU A 748 49.795 -16.659 4.417 1.00 0.00 C ATOM 943 CD2 LEU A 748 50.631 -17.820 2.410 1.00 0.00 C ATOM 0 H LEU A 748 51.067 -14.246 0.720 1.00 0.00 H new ATOM 0 HA LEU A 748 53.123 -14.532 2.650 1.00 0.00 H new ATOM 0 HB2 LEU A 748 51.082 -14.656 3.570 1.00 0.00 H new ATOM 0 HB3 LEU A 748 50.326 -15.264 2.110 1.00 0.00 H new ATOM 0 HG LEU A 748 51.881 -17.046 3.977 1.00 0.00 H new ATOM 0 HD11 LEU A 748 49.637 -17.621 4.905 1.00 0.00 H new ATOM 0 HD12 LEU A 748 50.010 -15.901 5.170 1.00 0.00 H new ATOM 0 HD13 LEU A 748 48.897 -16.379 3.867 1.00 0.00 H new ATOM 0 HD21 LEU A 748 50.490 -18.784 2.899 1.00 0.00 H new ATOM 0 HD22 LEU A 748 49.715 -17.539 1.891 1.00 0.00 H new ATOM 0 HD23 LEU A 748 51.447 -17.894 1.692 1.00 0.00 H new ATOM 955 N HIS A 749 53.065 -16.864 0.420 1.00 0.00 N ATOM 956 CA HIS A 749 53.825 -17.990 -0.119 1.00 0.00 C ATOM 957 C HIS A 749 55.243 -17.536 -0.434 1.00 0.00 C ATOM 958 O HIS A 749 56.216 -18.208 -0.102 1.00 0.00 O ATOM 959 CB HIS A 749 53.164 -18.499 -1.412 1.00 0.00 C ATOM 960 CG HIS A 749 53.623 -19.842 -1.871 1.00 0.00 C ATOM 961 ND1 HIS A 749 54.619 -20.048 -2.796 1.00 0.00 N ATOM 962 CD2 HIS A 749 53.180 -21.059 -1.529 1.00 0.00 C ATOM 963 CE1 HIS A 749 54.764 -21.339 -2.993 1.00 0.00 C ATOM 964 NE2 HIS A 749 53.905 -21.974 -2.238 1.00 0.00 N ATOM 0 H HIS A 749 52.298 -16.561 -0.180 1.00 0.00 H new ATOM 0 HA HIS A 749 53.844 -18.792 0.619 1.00 0.00 H new ATOM 0 HB2 HIS A 749 52.085 -18.533 -1.261 1.00 0.00 H new ATOM 0 HB3 HIS A 749 53.352 -17.777 -2.206 1.00 0.00 H new ATOM 0 HD2 HIS A 749 52.393 -21.277 -0.822 1.00 0.00 H new ATOM 0 HE1 HIS A 749 55.473 -21.799 -3.665 1.00 0.00 H new ATOM 0 HE2 HIS A 749 53.795 -22.987 -2.187 1.00 0.00 H new ATOM 973 N CYS A 750 55.348 -16.369 -1.026 1.00 0.00 N ATOM 974 CA CYS A 750 56.619 -15.834 -1.432 1.00 0.00 C ATOM 975 C CYS A 750 57.385 -15.239 -0.266 1.00 0.00 C ATOM 976 O CYS A 750 58.611 -15.117 -0.313 1.00 0.00 O ATOM 977 CB CYS A 750 56.433 -14.869 -2.579 1.00 0.00 C ATOM 978 SG CYS A 750 55.743 -15.710 -4.041 1.00 0.00 S ATOM 0 H CYS A 750 54.553 -15.767 -1.238 1.00 0.00 H new ATOM 0 HA CYS A 750 57.242 -16.652 -1.794 1.00 0.00 H new ATOM 0 HB2 CYS A 750 55.769 -14.061 -2.274 1.00 0.00 H new ATOM 0 HB3 CYS A 750 57.390 -14.415 -2.835 1.00 0.00 H new ATOM 0 HG CYS A 750 55.458 -14.829 -4.954 1.00 0.00 H new ATOM 983 N GLN A 751 56.670 -14.891 0.800 1.00 0.00 N ATOM 984 CA GLN A 751 57.309 -14.438 2.013 1.00 0.00 C ATOM 985 C GLN A 751 57.882 -15.611 2.834 1.00 0.00 C ATOM 986 O GLN A 751 58.506 -15.399 3.872 1.00 0.00 O ATOM 987 CB GLN A 751 56.350 -13.591 2.835 1.00 0.00 C ATOM 988 CG GLN A 751 55.902 -12.324 2.110 1.00 0.00 C ATOM 989 CD GLN A 751 57.011 -11.292 1.909 1.00 0.00 C ATOM 990 OE1 GLN A 751 58.195 -11.615 1.798 1.00 0.00 O ATOM 991 NE2 GLN A 751 56.628 -10.062 1.806 1.00 0.00 N ATOM 0 H GLN A 751 55.651 -14.917 0.840 1.00 0.00 H new ATOM 0 HA GLN A 751 58.157 -13.813 1.732 1.00 0.00 H new ATOM 0 HB2 GLN A 751 55.473 -14.187 3.089 1.00 0.00 H new ATOM 0 HB3 GLN A 751 56.831 -13.315 3.774 1.00 0.00 H new ATOM 0 HG2 GLN A 751 55.497 -12.600 1.136 1.00 0.00 H new ATOM 0 HG3 GLN A 751 55.091 -11.864 2.674 1.00 0.00 H new ATOM 0 HE21 GLN A 751 55.641 -9.826 1.903 1.00 0.00 H new ATOM 0 HE22 GLN A 751 57.313 -9.328 1.628 1.00 0.00 H new ATOM 1000 N GLY A 752 57.663 -16.839 2.362 1.00 0.00 N ATOM 1001 CA GLY A 752 58.272 -17.995 3.001 1.00 0.00 C ATOM 1002 C GLY A 752 57.284 -18.955 3.635 1.00 0.00 C ATOM 1003 O GLY A 752 57.685 -19.964 4.229 1.00 0.00 O ATOM 0 H GLY A 752 57.078 -17.052 1.554 1.00 0.00 H new ATOM 0 HA2 GLY A 752 58.861 -18.536 2.260 1.00 0.00 H new ATOM 0 HA3 GLY A 752 58.965 -17.648 3.767 1.00 0.00 H new ATOM 1007 N ARG A 753 56.005 -18.674 3.513 1.00 0.00 N ATOM 1008 CA ARG A 753 54.999 -19.526 4.126 1.00 0.00 C ATOM 1009 C ARG A 753 54.573 -20.642 3.182 1.00 0.00 C ATOM 1010 O ARG A 753 54.586 -20.476 1.954 1.00 0.00 O ATOM 1011 CB ARG A 753 53.778 -18.718 4.533 1.00 0.00 C ATOM 1012 CG ARG A 753 54.052 -17.584 5.512 1.00 0.00 C ATOM 1013 CD ARG A 753 54.645 -18.109 6.811 1.00 0.00 C ATOM 1014 NE ARG A 753 54.716 -17.081 7.854 1.00 0.00 N ATOM 1015 CZ ARG A 753 55.284 -17.249 9.062 1.00 0.00 C ATOM 1016 NH1 ARG A 753 55.943 -18.369 9.350 1.00 0.00 N ATOM 1017 NH2 ARG A 753 55.211 -16.290 9.968 1.00 0.00 N ATOM 0 H ARG A 753 55.636 -17.872 3.002 1.00 0.00 H new ATOM 0 HA ARG A 753 55.449 -19.968 5.015 1.00 0.00 H new ATOM 0 HB2 ARG A 753 53.322 -18.300 3.635 1.00 0.00 H new ATOM 0 HB3 ARG A 753 53.047 -19.393 4.978 1.00 0.00 H new ATOM 0 HG2 ARG A 753 54.738 -16.867 5.060 1.00 0.00 H new ATOM 0 HG3 ARG A 753 53.125 -17.050 5.722 1.00 0.00 H new ATOM 0 HD2 ARG A 753 54.043 -18.944 7.169 1.00 0.00 H new ATOM 0 HD3 ARG A 753 55.646 -18.496 6.619 1.00 0.00 H new ATOM 0 HE ARG A 753 54.304 -16.171 7.648 1.00 0.00 H new ATOM 0 HH11 ARG A 753 56.021 -19.109 8.652 1.00 0.00 H new ATOM 0 HH12 ARG A 753 56.370 -18.487 10.269 1.00 0.00 H new ATOM 0 HH21 ARG A 753 54.723 -15.421 9.752 1.00 0.00 H new ATOM 0 HH22 ARG A 753 55.642 -16.419 10.883 1.00 0.00 H new ATOM 1031 N ASN A 754 54.192 -21.767 3.744 1.00 0.00 N ATOM 1032 CA ASN A 754 53.742 -22.900 2.952 1.00 0.00 C ATOM 1033 C ASN A 754 52.293 -23.146 3.179 1.00 0.00 C ATOM 1034 O ASN A 754 51.848 -23.299 4.323 1.00 0.00 O ATOM 1035 CB ASN A 754 54.502 -24.202 3.250 1.00 0.00 C ATOM 1036 CG ASN A 754 55.943 -24.193 2.835 1.00 0.00 C ATOM 1037 OD1 ASN A 754 56.273 -24.505 1.684 1.00 0.00 O ATOM 1038 ND2 ASN A 754 56.811 -23.906 3.758 1.00 0.00 N ATOM 0 H ASN A 754 54.183 -21.926 4.751 1.00 0.00 H new ATOM 0 HA ASN A 754 53.940 -22.629 1.915 1.00 0.00 H new ATOM 0 HB2 ASN A 754 54.447 -24.403 4.320 1.00 0.00 H new ATOM 0 HB3 ASN A 754 53.997 -25.026 2.745 1.00 0.00 H new ATOM 0 HD21 ASN A 754 57.808 -23.933 3.546 1.00 0.00 H new ATOM 0 HD22 ASN A 754 56.495 -23.654 4.694 1.00 0.00 H new ATOM 1045 N TYR A 755 51.555 -23.166 2.110 1.00 0.00 N ATOM 1046 CA TYR A 755 50.151 -23.451 2.140 1.00 0.00 C ATOM 1047 C TYR A 755 49.800 -24.310 0.981 1.00 0.00 C ATOM 1048 O TYR A 755 50.298 -24.101 -0.139 1.00 0.00 O ATOM 1049 CB TYR A 755 49.286 -22.195 2.110 1.00 0.00 C ATOM 1050 CG TYR A 755 49.180 -21.459 3.419 1.00 0.00 C ATOM 1051 CD1 TYR A 755 50.233 -20.725 3.910 1.00 0.00 C ATOM 1052 CD2 TYR A 755 48.019 -21.506 4.160 1.00 0.00 C ATOM 1053 CE1 TYR A 755 50.147 -20.070 5.105 1.00 0.00 C ATOM 1054 CE2 TYR A 755 47.918 -20.842 5.356 1.00 0.00 C ATOM 1055 CZ TYR A 755 48.989 -20.126 5.827 1.00 0.00 C ATOM 1056 OH TYR A 755 48.916 -19.500 7.048 1.00 0.00 O ATOM 0 H TYR A 755 51.918 -22.981 1.175 1.00 0.00 H new ATOM 0 HA TYR A 755 49.949 -23.960 3.082 1.00 0.00 H new ATOM 0 HB2 TYR A 755 49.688 -21.514 1.360 1.00 0.00 H new ATOM 0 HB3 TYR A 755 48.283 -22.471 1.785 1.00 0.00 H new ATOM 0 HD1 TYR A 755 51.148 -20.665 3.339 1.00 0.00 H new ATOM 0 HD2 TYR A 755 47.176 -22.074 3.794 1.00 0.00 H new ATOM 0 HE1 TYR A 755 50.992 -19.510 5.478 1.00 0.00 H new ATOM 0 HE2 TYR A 755 47.000 -20.883 5.924 1.00 0.00 H new ATOM 0 HH TYR A 755 48.930 -20.172 7.761 1.00 0.00 H new ATOM 1066 N THR A 756 48.975 -25.251 1.238 1.00 0.00 N ATOM 1067 CA THR A 756 48.517 -26.174 0.258 1.00 0.00 C ATOM 1068 C THR A 756 47.116 -25.755 -0.203 1.00 0.00 C ATOM 1069 O THR A 756 46.298 -25.360 0.615 1.00 0.00 O ATOM 1070 CB THR A 756 48.488 -27.579 0.896 1.00 0.00 C ATOM 1071 OG1 THR A 756 49.823 -27.933 1.322 1.00 0.00 O ATOM 1072 CG2 THR A 756 47.965 -28.623 -0.066 1.00 0.00 C ATOM 0 H THR A 756 48.583 -25.411 2.166 1.00 0.00 H new ATOM 0 HA THR A 756 49.177 -26.187 -0.609 1.00 0.00 H new ATOM 0 HB THR A 756 47.812 -27.551 1.751 1.00 0.00 H new ATOM 0 HG1 THR A 756 49.786 -28.333 2.216 1.00 0.00 H new ATOM 0 HG21 THR A 756 47.961 -29.598 0.422 1.00 0.00 H new ATOM 0 HG22 THR A 756 46.950 -28.364 -0.368 1.00 0.00 H new ATOM 0 HG23 THR A 756 48.607 -28.661 -0.946 1.00 0.00 H new ATOM 1080 N LEU A 757 46.856 -25.792 -1.494 1.00 0.00 N ATOM 1081 CA LEU A 757 45.537 -25.433 -1.986 1.00 0.00 C ATOM 1082 C LEU A 757 44.571 -26.570 -1.801 1.00 0.00 C ATOM 1083 O LEU A 757 44.871 -27.719 -2.141 1.00 0.00 O ATOM 1084 CB LEU A 757 45.534 -24.952 -3.456 1.00 0.00 C ATOM 1085 CG LEU A 757 46.034 -23.525 -3.742 1.00 0.00 C ATOM 1086 CD1 LEU A 757 45.233 -22.502 -2.946 1.00 0.00 C ATOM 1087 CD2 LEU A 757 47.529 -23.379 -3.491 1.00 0.00 C ATOM 0 H LEU A 757 47.527 -26.062 -2.213 1.00 0.00 H new ATOM 0 HA LEU A 757 45.214 -24.583 -1.386 1.00 0.00 H new ATOM 0 HB2 LEU A 757 46.144 -25.644 -4.037 1.00 0.00 H new ATOM 0 HB3 LEU A 757 44.514 -25.032 -3.833 1.00 0.00 H new ATOM 0 HG LEU A 757 45.875 -23.331 -4.803 1.00 0.00 H new ATOM 0 HD11 LEU A 757 45.604 -21.500 -3.164 1.00 0.00 H new ATOM 0 HD12 LEU A 757 44.181 -22.568 -3.223 1.00 0.00 H new ATOM 0 HD13 LEU A 757 45.341 -22.705 -1.880 1.00 0.00 H new ATOM 0 HD21 LEU A 757 47.836 -22.355 -3.706 1.00 0.00 H new ATOM 0 HD22 LEU A 757 47.747 -23.612 -2.449 1.00 0.00 H new ATOM 0 HD23 LEU A 757 48.075 -24.065 -4.138 1.00 0.00 H new ATOM 1099 N THR A 758 43.442 -26.256 -1.247 1.00 0.00 N ATOM 1100 CA THR A 758 42.414 -27.217 -0.989 1.00 0.00 C ATOM 1101 C THR A 758 41.120 -26.753 -1.627 1.00 0.00 C ATOM 1102 O THR A 758 41.088 -25.669 -2.230 1.00 0.00 O ATOM 1103 CB THR A 758 42.247 -27.431 0.529 1.00 0.00 C ATOM 1104 OG1 THR A 758 42.256 -26.156 1.204 1.00 0.00 O ATOM 1105 CG2 THR A 758 43.367 -28.315 1.073 1.00 0.00 C ATOM 0 H THR A 758 43.204 -25.308 -0.956 1.00 0.00 H new ATOM 0 HA THR A 758 42.692 -28.176 -1.427 1.00 0.00 H new ATOM 0 HB THR A 758 41.294 -27.929 0.709 1.00 0.00 H new ATOM 0 HG1 THR A 758 42.054 -25.444 0.561 1.00 0.00 H new ATOM 0 HG21 THR A 758 43.232 -28.455 2.146 1.00 0.00 H new ATOM 0 HG22 THR A 758 43.340 -29.284 0.575 1.00 0.00 H new ATOM 0 HG23 THR A 758 44.329 -27.838 0.887 1.00 0.00 H new ATOM 1113 N GLY A 759 40.079 -27.541 -1.514 1.00 0.00 N ATOM 1114 CA GLY A 759 38.822 -27.182 -2.105 1.00 0.00 C ATOM 1115 C GLY A 759 38.157 -26.061 -1.347 1.00 0.00 C ATOM 1116 O GLY A 759 38.451 -25.853 -0.166 1.00 0.00 O ATOM 0 H GLY A 759 40.081 -28.433 -1.018 1.00 0.00 H new ATOM 0 HA2 GLY A 759 38.978 -26.880 -3.141 1.00 0.00 H new ATOM 0 HA3 GLY A 759 38.165 -28.051 -2.122 1.00 0.00 H new ATOM 1120 N ARG A 760 37.247 -25.350 -1.989 1.00 0.00 N ATOM 1121 CA ARG A 760 36.580 -24.218 -1.334 1.00 0.00 C ATOM 1122 C ARG A 760 35.594 -24.718 -0.282 1.00 0.00 C ATOM 1123 O ARG A 760 35.089 -23.963 0.534 1.00 0.00 O ATOM 1124 CB ARG A 760 35.866 -23.272 -2.339 1.00 0.00 C ATOM 1125 CG ARG A 760 34.478 -23.719 -2.830 1.00 0.00 C ATOM 1126 CD ARG A 760 34.513 -25.034 -3.570 1.00 0.00 C ATOM 1127 NE ARG A 760 33.202 -25.409 -4.090 1.00 0.00 N ATOM 1128 CZ ARG A 760 32.994 -26.304 -5.061 1.00 0.00 C ATOM 1129 NH1 ARG A 760 34.028 -26.944 -5.620 1.00 0.00 N ATOM 1130 NH2 ARG A 760 31.759 -26.556 -5.473 1.00 0.00 N ATOM 0 H ARG A 760 36.950 -25.525 -2.949 1.00 0.00 H new ATOM 0 HA ARG A 760 37.361 -23.631 -0.850 1.00 0.00 H new ATOM 0 HB2 ARG A 760 35.764 -22.292 -1.873 1.00 0.00 H new ATOM 0 HB3 ARG A 760 36.512 -23.146 -3.208 1.00 0.00 H new ATOM 0 HG2 ARG A 760 33.807 -23.806 -1.976 1.00 0.00 H new ATOM 0 HG3 ARG A 760 34.064 -22.951 -3.483 1.00 0.00 H new ATOM 0 HD2 ARG A 760 35.223 -24.966 -4.394 1.00 0.00 H new ATOM 0 HD3 ARG A 760 34.874 -25.816 -2.902 1.00 0.00 H new ATOM 0 HE ARG A 760 32.384 -24.955 -3.683 1.00 0.00 H new ATOM 0 HH11 ARG A 760 34.979 -26.750 -5.305 1.00 0.00 H new ATOM 0 HH12 ARG A 760 33.865 -27.626 -6.361 1.00 0.00 H new ATOM 0 HH21 ARG A 760 30.970 -26.067 -5.049 1.00 0.00 H new ATOM 0 HH22 ARG A 760 31.598 -27.238 -6.214 1.00 0.00 H new ATOM 1144 N ASP A 761 35.333 -26.004 -0.312 1.00 0.00 N ATOM 1145 CA ASP A 761 34.418 -26.590 0.626 1.00 0.00 C ATOM 1146 C ASP A 761 35.147 -27.013 1.898 1.00 0.00 C ATOM 1147 O ASP A 761 34.533 -27.267 2.923 1.00 0.00 O ATOM 1148 CB ASP A 761 33.686 -27.782 0.003 1.00 0.00 C ATOM 1149 CG ASP A 761 32.657 -28.389 0.934 1.00 0.00 C ATOM 1150 OD1 ASP A 761 32.840 -29.543 1.389 1.00 0.00 O ATOM 1151 OD2 ASP A 761 31.642 -27.727 1.225 1.00 0.00 O ATOM 0 H ASP A 761 35.743 -26.660 -0.977 1.00 0.00 H new ATOM 0 HA ASP A 761 33.676 -25.836 0.890 1.00 0.00 H new ATOM 0 HB2 ASP A 761 33.194 -27.461 -0.915 1.00 0.00 H new ATOM 0 HB3 ASP A 761 34.413 -28.545 -0.275 1.00 0.00 H new ATOM 1156 N SER A 762 36.463 -27.024 1.839 1.00 0.00 N ATOM 1157 CA SER A 762 37.283 -27.506 2.940 1.00 0.00 C ATOM 1158 C SER A 762 37.249 -26.585 4.200 1.00 0.00 C ATOM 1159 O SER A 762 37.639 -27.006 5.291 1.00 0.00 O ATOM 1160 CB SER A 762 38.700 -27.761 2.441 1.00 0.00 C ATOM 1161 OG SER A 762 38.678 -28.666 1.340 1.00 0.00 O ATOM 0 H SER A 762 36.996 -26.701 1.031 1.00 0.00 H new ATOM 0 HA SER A 762 36.853 -28.446 3.286 1.00 0.00 H new ATOM 0 HB2 SER A 762 39.162 -26.821 2.139 1.00 0.00 H new ATOM 0 HB3 SER A 762 39.309 -28.171 3.247 1.00 0.00 H new ATOM 0 HG SER A 762 38.601 -28.161 0.503 1.00 0.00 H new ATOM 1167 N CYS A 763 36.797 -25.355 4.049 1.00 0.00 N ATOM 1168 CA CYS A 763 36.611 -24.459 5.189 1.00 0.00 C ATOM 1169 C CYS A 763 35.438 -23.561 4.905 1.00 0.00 C ATOM 1170 O CYS A 763 34.706 -23.790 3.929 1.00 0.00 O ATOM 1171 CB CYS A 763 37.873 -23.638 5.505 1.00 0.00 C ATOM 1172 SG CYS A 763 38.389 -22.480 4.218 1.00 0.00 S ATOM 0 H CYS A 763 36.549 -24.946 3.148 1.00 0.00 H new ATOM 0 HA CYS A 763 36.416 -25.061 6.076 1.00 0.00 H new ATOM 0 HB2 CYS A 763 37.701 -23.079 6.425 1.00 0.00 H new ATOM 0 HB3 CYS A 763 38.695 -24.327 5.700 1.00 0.00 H new ATOM 0 HG CYS A 763 38.176 -23.007 3.049 1.00 0.00 H new ATOM 1177 N THR A 764 35.224 -22.577 5.729 1.00 0.00 N ATOM 1178 CA THR A 764 34.110 -21.719 5.548 1.00 0.00 C ATOM 1179 C THR A 764 34.541 -20.434 4.864 1.00 0.00 C ATOM 1180 O THR A 764 35.271 -19.616 5.432 1.00 0.00 O ATOM 1181 CB THR A 764 33.453 -21.406 6.888 1.00 0.00 C ATOM 1182 OG1 THR A 764 33.401 -22.620 7.674 1.00 0.00 O ATOM 1183 CG2 THR A 764 32.036 -20.892 6.667 1.00 0.00 C ATOM 0 H THR A 764 35.813 -22.356 6.532 1.00 0.00 H new ATOM 0 HA THR A 764 33.383 -22.227 4.915 1.00 0.00 H new ATOM 0 HB THR A 764 34.031 -20.642 7.408 1.00 0.00 H new ATOM 0 HG1 THR A 764 32.982 -22.432 8.540 1.00 0.00 H new ATOM 0 HG21 THR A 764 31.575 -20.671 7.630 1.00 0.00 H new ATOM 0 HG22 THR A 764 32.068 -19.985 6.063 1.00 0.00 H new ATOM 0 HG23 THR A 764 31.450 -21.652 6.150 1.00 0.00 H new ATOM 1191 N LEU A 765 34.115 -20.287 3.653 1.00 0.00 N ATOM 1192 CA LEU A 765 34.410 -19.132 2.877 1.00 0.00 C ATOM 1193 C LEU A 765 33.217 -18.185 3.055 1.00 0.00 C ATOM 1194 O LEU A 765 32.095 -18.663 3.291 1.00 0.00 O ATOM 1195 CB LEU A 765 34.554 -19.574 1.414 1.00 0.00 C ATOM 1196 CG LEU A 765 35.496 -18.765 0.534 1.00 0.00 C ATOM 1197 CD1 LEU A 765 36.906 -18.824 1.098 1.00 0.00 C ATOM 1198 CD2 LEU A 765 35.474 -19.304 -0.882 1.00 0.00 C ATOM 0 H LEU A 765 33.543 -20.979 3.169 1.00 0.00 H new ATOM 0 HA LEU A 765 35.331 -18.633 3.178 1.00 0.00 H new ATOM 0 HB2 LEU A 765 34.890 -20.611 1.406 1.00 0.00 H new ATOM 0 HB3 LEU A 765 33.565 -19.556 0.956 1.00 0.00 H new ATOM 0 HG LEU A 765 35.166 -17.726 0.517 1.00 0.00 H new ATOM 0 HD11 LEU A 765 37.576 -18.243 0.464 1.00 0.00 H new ATOM 0 HD12 LEU A 765 36.912 -18.411 2.107 1.00 0.00 H new ATOM 0 HD13 LEU A 765 37.243 -19.860 1.128 1.00 0.00 H new ATOM 0 HD21 LEU A 765 36.151 -18.719 -1.505 1.00 0.00 H new ATOM 0 HD22 LEU A 765 35.793 -20.346 -0.880 1.00 0.00 H new ATOM 0 HD23 LEU A 765 34.462 -19.235 -1.282 1.00 0.00 H new ATOM 1210 N PRO A 766 33.418 -16.851 3.011 1.00 0.00 N ATOM 1211 CA PRO A 766 32.325 -15.897 3.183 1.00 0.00 C ATOM 1212 C PRO A 766 31.293 -15.958 2.049 1.00 0.00 C ATOM 1213 O PRO A 766 31.427 -16.756 1.095 1.00 0.00 O ATOM 1214 CB PRO A 766 33.024 -14.536 3.224 1.00 0.00 C ATOM 1215 CG PRO A 766 34.277 -14.762 2.481 1.00 0.00 C ATOM 1216 CD PRO A 766 34.704 -16.164 2.823 1.00 0.00 C ATOM 0 HA PRO A 766 31.748 -16.110 4.083 1.00 0.00 H new ATOM 0 HB2 PRO A 766 32.417 -13.760 2.758 1.00 0.00 H new ATOM 0 HB3 PRO A 766 33.218 -14.217 4.248 1.00 0.00 H new ATOM 0 HG2 PRO A 766 34.122 -14.650 1.408 1.00 0.00 H new ATOM 0 HG3 PRO A 766 35.040 -14.039 2.770 1.00 0.00 H new ATOM 0 HD2 PRO A 766 35.292 -16.615 2.024 1.00 0.00 H new ATOM 0 HD3 PRO A 766 35.316 -16.193 3.725 1.00 0.00 H new ATOM 1353 N LEU A 778 35.099 -6.435 -6.202 1.00 0.00 N ATOM 1354 CA LEU A 778 35.405 -5.587 -7.370 1.00 0.00 C ATOM 1355 C LEU A 778 34.869 -6.017 -8.758 1.00 0.00 C ATOM 1356 O LEU A 778 34.598 -5.159 -9.588 1.00 0.00 O ATOM 1357 CB LEU A 778 36.935 -5.209 -7.416 1.00 0.00 C ATOM 1358 CG LEU A 778 38.068 -6.314 -7.408 1.00 0.00 C ATOM 1359 CD1 LEU A 778 38.032 -7.239 -6.200 1.00 0.00 C ATOM 1360 CD2 LEU A 778 38.143 -7.105 -8.698 1.00 0.00 C ATOM 0 HA LEU A 778 34.801 -4.700 -7.176 1.00 0.00 H new ATOM 0 HB2 LEU A 778 37.085 -4.610 -8.314 1.00 0.00 H new ATOM 0 HB3 LEU A 778 37.124 -4.557 -6.563 1.00 0.00 H new ATOM 0 HG LEU A 778 38.989 -5.738 -7.324 1.00 0.00 H new ATOM 0 HD11 LEU A 778 38.841 -7.965 -6.274 1.00 0.00 H new ATOM 0 HD12 LEU A 778 38.152 -6.653 -5.289 1.00 0.00 H new ATOM 0 HD13 LEU A 778 37.076 -7.762 -6.171 1.00 0.00 H new ATOM 0 HD21 LEU A 778 38.940 -7.845 -8.625 1.00 0.00 H new ATOM 0 HD22 LEU A 778 37.193 -7.611 -8.870 1.00 0.00 H new ATOM 0 HD23 LEU A 778 38.350 -6.429 -9.528 1.00 0.00 H new ATOM 1372 N TRP A 779 34.705 -7.299 -9.003 1.00 0.00 N ATOM 1373 CA TRP A 779 34.249 -7.773 -10.329 1.00 0.00 C ATOM 1374 C TRP A 779 32.733 -7.818 -10.425 1.00 0.00 C ATOM 1375 O TRP A 779 32.171 -8.226 -11.447 1.00 0.00 O ATOM 1376 CB TRP A 779 34.841 -9.164 -10.654 1.00 0.00 C ATOM 1377 CG TRP A 779 34.649 -10.173 -9.559 1.00 0.00 C ATOM 1378 CD1 TRP A 779 33.534 -10.902 -9.282 1.00 0.00 C ATOM 1379 CD2 TRP A 779 35.615 -10.547 -8.590 1.00 0.00 C ATOM 1380 NE1 TRP A 779 33.746 -11.670 -8.174 1.00 0.00 N ATOM 1381 CE2 TRP A 779 35.019 -11.467 -7.731 1.00 0.00 C ATOM 1382 CE3 TRP A 779 36.920 -10.172 -8.368 1.00 0.00 C ATOM 1383 CZ2 TRP A 779 35.698 -12.013 -6.653 1.00 0.00 C ATOM 1384 CZ3 TRP A 779 37.602 -10.706 -7.307 1.00 0.00 C ATOM 1385 CH2 TRP A 779 36.988 -11.615 -6.453 1.00 0.00 C ATOM 0 H TRP A 779 34.874 -8.039 -8.322 1.00 0.00 H new ATOM 0 HA TRP A 779 34.611 -7.054 -11.064 1.00 0.00 H new ATOM 0 HB2 TRP A 779 34.381 -9.540 -11.568 1.00 0.00 H new ATOM 0 HB3 TRP A 779 35.907 -9.057 -10.855 1.00 0.00 H new ATOM 0 HD1 TRP A 779 32.618 -10.877 -9.854 1.00 0.00 H new ATOM 0 HE1 TRP A 779 33.062 -12.295 -7.747 1.00 0.00 H new ATOM 0 HE3 TRP A 779 37.402 -9.463 -9.024 1.00 0.00 H new ATOM 0 HZ2 TRP A 779 35.224 -12.727 -5.996 1.00 0.00 H new ATOM 0 HZ3 TRP A 779 38.628 -10.418 -7.132 1.00 0.00 H new ATOM 0 HH2 TRP A 779 37.542 -12.014 -5.616 1.00 0.00 H new ATOM 1396 N GLY A 780 32.076 -7.375 -9.391 1.00 0.00 N ATOM 1397 CA GLY A 780 30.651 -7.493 -9.349 1.00 0.00 C ATOM 1398 C GLY A 780 30.314 -8.831 -8.756 1.00 0.00 C ATOM 1399 O GLY A 780 30.682 -9.868 -9.299 1.00 0.00 O ATOM 0 H GLY A 780 32.501 -6.934 -8.575 1.00 0.00 H new ATOM 0 HA2 GLY A 780 30.220 -6.691 -8.750 1.00 0.00 H new ATOM 0 HA3 GLY A 780 30.231 -7.404 -10.351 1.00 0.00 H new ATOM 1526 N VAL A 790 24.737 -7.900 -8.081 1.00 0.00 N ATOM 1527 CA VAL A 790 25.017 -7.573 -9.455 1.00 0.00 C ATOM 1528 C VAL A 790 26.457 -7.903 -9.774 1.00 0.00 C ATOM 1529 O VAL A 790 27.346 -7.692 -8.953 1.00 0.00 O ATOM 1530 CB VAL A 790 24.680 -6.079 -9.813 1.00 0.00 C ATOM 1531 CG1 VAL A 790 25.510 -5.086 -9.020 1.00 0.00 C ATOM 1532 CG2 VAL A 790 24.808 -5.819 -11.304 1.00 0.00 C ATOM 0 HA VAL A 790 24.361 -8.182 -10.077 1.00 0.00 H new ATOM 0 HB VAL A 790 23.639 -5.926 -9.528 1.00 0.00 H new ATOM 0 HG11 VAL A 790 25.236 -4.071 -9.308 1.00 0.00 H new ATOM 0 HG12 VAL A 790 25.323 -5.224 -7.955 1.00 0.00 H new ATOM 0 HG13 VAL A 790 26.568 -5.249 -9.227 1.00 0.00 H new ATOM 0 HG21 VAL A 790 24.568 -4.777 -11.514 1.00 0.00 H new ATOM 0 HG22 VAL A 790 25.829 -6.027 -11.623 1.00 0.00 H new ATOM 0 HG23 VAL A 790 24.119 -6.466 -11.847 1.00 0.00 H new ATOM 1542 N CYS A 791 26.673 -8.453 -10.921 1.00 0.00 N ATOM 1543 CA CYS A 791 27.982 -8.835 -11.344 1.00 0.00 C ATOM 1544 C CYS A 791 28.306 -8.171 -12.659 1.00 0.00 C ATOM 1545 O CYS A 791 27.396 -7.723 -13.372 1.00 0.00 O ATOM 1546 CB CYS A 791 28.065 -10.356 -11.469 1.00 0.00 C ATOM 1547 SG CYS A 791 26.811 -11.095 -12.565 1.00 0.00 S ATOM 0 H CYS A 791 25.939 -8.653 -11.600 1.00 0.00 H new ATOM 0 HA CYS A 791 28.712 -8.511 -10.603 1.00 0.00 H new ATOM 0 HB2 CYS A 791 29.055 -10.624 -11.838 1.00 0.00 H new ATOM 0 HB3 CYS A 791 27.966 -10.795 -10.476 1.00 0.00 H new ATOM 0 HG CYS A 791 26.399 -10.203 -13.416 1.00 0.00 H new ATOM 1552 N ARG A 792 29.571 -8.038 -12.963 1.00 0.00 N ATOM 1553 CA ARG A 792 29.977 -7.516 -14.249 1.00 0.00 C ATOM 1554 C ARG A 792 30.198 -8.690 -15.169 1.00 0.00 C ATOM 1555 O ARG A 792 30.094 -9.854 -14.747 1.00 0.00 O ATOM 1556 CB ARG A 792 31.308 -6.763 -14.163 1.00 0.00 C ATOM 1557 CG ARG A 792 31.356 -5.561 -13.250 1.00 0.00 C ATOM 1558 CD ARG A 792 32.761 -4.988 -13.267 1.00 0.00 C ATOM 1559 NE ARG A 792 32.928 -3.840 -12.386 1.00 0.00 N ATOM 1560 CZ ARG A 792 34.100 -3.232 -12.144 1.00 0.00 C ATOM 1561 NH1 ARG A 792 35.208 -3.588 -12.817 1.00 0.00 N ATOM 1562 NH2 ARG A 792 34.150 -2.247 -11.262 1.00 0.00 N ATOM 0 H ARG A 792 30.340 -8.283 -12.340 1.00 0.00 H new ATOM 0 HA ARG A 792 29.204 -6.834 -14.602 1.00 0.00 H new ATOM 0 HB2 ARG A 792 32.075 -7.466 -13.838 1.00 0.00 H new ATOM 0 HB3 ARG A 792 31.579 -6.437 -15.167 1.00 0.00 H new ATOM 0 HG2 ARG A 792 30.638 -4.809 -13.578 1.00 0.00 H new ATOM 0 HG3 ARG A 792 31.077 -5.846 -12.236 1.00 0.00 H new ATOM 0 HD2 ARG A 792 33.466 -5.766 -12.975 1.00 0.00 H new ATOM 0 HD3 ARG A 792 33.013 -4.695 -14.286 1.00 0.00 H new ATOM 0 HE ARG A 792 32.098 -3.473 -11.921 1.00 0.00 H new ATOM 0 HH11 ARG A 792 35.163 -4.326 -13.519 1.00 0.00 H new ATOM 0 HH12 ARG A 792 36.094 -3.120 -12.625 1.00 0.00 H new ATOM 0 HH21 ARG A 792 33.303 -1.956 -10.773 1.00 0.00 H new ATOM 0 HH22 ARG A 792 35.035 -1.778 -11.071 1.00 0.00 H new ATOM 1576 N GLU A 793 30.456 -8.413 -16.406 1.00 0.00 N ATOM 1577 CA GLU A 793 30.902 -9.425 -17.304 1.00 0.00 C ATOM 1578 C GLU A 793 32.409 -9.341 -17.343 1.00 0.00 C ATOM 1579 O GLU A 793 32.983 -8.313 -16.943 1.00 0.00 O ATOM 1580 CB GLU A 793 30.302 -9.274 -18.704 1.00 0.00 C ATOM 1581 CG GLU A 793 28.797 -9.454 -18.750 1.00 0.00 C ATOM 1582 CD GLU A 793 28.268 -9.543 -20.153 1.00 0.00 C ATOM 1583 OE1 GLU A 793 28.294 -10.646 -20.737 1.00 0.00 O ATOM 1584 OE2 GLU A 793 27.798 -8.528 -20.700 1.00 0.00 O ATOM 0 H GLU A 793 30.364 -7.485 -16.819 1.00 0.00 H new ATOM 0 HA GLU A 793 30.571 -10.402 -16.953 1.00 0.00 H new ATOM 0 HB2 GLU A 793 30.552 -8.286 -19.091 1.00 0.00 H new ATOM 0 HB3 GLU A 793 30.766 -10.003 -19.368 1.00 0.00 H new ATOM 0 HG2 GLU A 793 28.526 -10.359 -18.206 1.00 0.00 H new ATOM 0 HG3 GLU A 793 28.319 -8.619 -18.238 1.00 0.00 H new ATOM 1591 N ALA A 794 33.054 -10.369 -17.841 1.00 0.00 N ATOM 1592 CA ALA A 794 34.509 -10.431 -17.857 1.00 0.00 C ATOM 1593 C ALA A 794 35.110 -9.359 -18.746 1.00 0.00 C ATOM 1594 O ALA A 794 36.285 -9.024 -18.619 1.00 0.00 O ATOM 1595 CB ALA A 794 34.976 -11.789 -18.305 1.00 0.00 C ATOM 0 H ALA A 794 32.595 -11.185 -18.246 1.00 0.00 H new ATOM 0 HA ALA A 794 34.850 -10.252 -16.837 1.00 0.00 H new ATOM 0 HB1 ALA A 794 36.066 -11.816 -18.310 1.00 0.00 H new ATOM 0 HB2 ALA A 794 34.598 -12.548 -17.620 1.00 0.00 H new ATOM 0 HB3 ALA A 794 34.603 -11.989 -19.310 1.00 0.00 H new ATOM 1601 N SER A 795 34.298 -8.806 -19.611 1.00 0.00 N ATOM 1602 CA SER A 795 34.709 -7.783 -20.517 1.00 0.00 C ATOM 1603 C SER A 795 34.920 -6.425 -19.794 1.00 0.00 C ATOM 1604 O SER A 795 35.541 -5.497 -20.340 1.00 0.00 O ATOM 1605 CB SER A 795 33.666 -7.699 -21.620 1.00 0.00 C ATOM 1606 OG SER A 795 32.349 -7.735 -21.059 1.00 0.00 O ATOM 0 H SER A 795 33.315 -9.065 -19.701 1.00 0.00 H new ATOM 0 HA SER A 795 35.678 -8.029 -20.951 1.00 0.00 H new ATOM 0 HB2 SER A 795 33.802 -6.780 -22.189 1.00 0.00 H new ATOM 0 HB3 SER A 795 33.795 -8.527 -22.317 1.00 0.00 H new ATOM 0 HG SER A 795 31.686 -7.679 -21.778 1.00 0.00 H new ATOM 1612 N GLU A 796 34.425 -6.330 -18.564 1.00 0.00 N ATOM 1613 CA GLU A 796 34.572 -5.142 -17.754 1.00 0.00 C ATOM 1614 C GLU A 796 35.415 -5.511 -16.515 1.00 0.00 C ATOM 1615 O GLU A 796 35.133 -5.112 -15.378 1.00 0.00 O ATOM 1616 CB GLU A 796 33.183 -4.590 -17.376 1.00 0.00 C ATOM 1617 CG GLU A 796 33.208 -3.203 -16.734 1.00 0.00 C ATOM 1618 CD GLU A 796 31.833 -2.669 -16.444 1.00 0.00 C ATOM 1619 OE1 GLU A 796 31.238 -3.030 -15.428 1.00 0.00 O ATOM 1620 OE2 GLU A 796 31.321 -1.846 -17.234 1.00 0.00 O ATOM 0 H GLU A 796 33.910 -7.082 -18.106 1.00 0.00 H new ATOM 0 HA GLU A 796 35.085 -4.352 -18.302 1.00 0.00 H new ATOM 0 HB2 GLU A 796 32.565 -4.551 -18.273 1.00 0.00 H new ATOM 0 HB3 GLU A 796 32.703 -5.287 -16.688 1.00 0.00 H new ATOM 0 HG2 GLU A 796 33.778 -3.248 -15.806 1.00 0.00 H new ATOM 0 HG3 GLU A 796 33.729 -2.511 -17.396 1.00 0.00 H new ATOM 1627 N CYS A 797 36.454 -6.296 -16.772 1.00 0.00 N ATOM 1628 CA CYS A 797 37.417 -6.715 -15.759 1.00 0.00 C ATOM 1629 C CYS A 797 38.042 -5.463 -15.119 1.00 0.00 C ATOM 1630 O CYS A 797 37.853 -5.210 -13.921 1.00 0.00 O ATOM 1631 CB CYS A 797 38.470 -7.653 -16.423 1.00 0.00 C ATOM 1632 SG CYS A 797 39.824 -8.261 -15.370 1.00 0.00 S ATOM 0 H CYS A 797 36.655 -6.665 -17.702 1.00 0.00 H new ATOM 0 HA CYS A 797 36.938 -7.281 -14.960 1.00 0.00 H new ATOM 0 HB2 CYS A 797 37.944 -8.517 -16.829 1.00 0.00 H new ATOM 0 HB3 CYS A 797 38.911 -7.122 -17.267 1.00 0.00 H new ATOM 0 HG CYS A 797 40.412 -7.254 -14.795 1.00 0.00 H new ATOM 1637 N GLU A 798 38.727 -4.675 -15.951 1.00 0.00 N ATOM 1638 CA GLU A 798 39.300 -3.346 -15.649 1.00 0.00 C ATOM 1639 C GLU A 798 40.438 -3.365 -14.629 1.00 0.00 C ATOM 1640 O GLU A 798 41.474 -2.711 -14.815 1.00 0.00 O ATOM 1641 CB GLU A 798 38.207 -2.345 -15.264 1.00 0.00 C ATOM 1642 CG GLU A 798 37.102 -2.213 -16.312 1.00 0.00 C ATOM 1643 CD GLU A 798 37.619 -1.817 -17.676 1.00 0.00 C ATOM 1644 OE1 GLU A 798 38.181 -2.678 -18.401 1.00 0.00 O ATOM 1645 OE2 GLU A 798 37.449 -0.651 -18.077 1.00 0.00 O ATOM 0 H GLU A 798 38.912 -4.958 -16.913 1.00 0.00 H new ATOM 0 HA GLU A 798 39.763 -3.011 -16.577 1.00 0.00 H new ATOM 0 HB2 GLU A 798 37.763 -2.651 -14.317 1.00 0.00 H new ATOM 0 HB3 GLU A 798 38.662 -1.368 -15.102 1.00 0.00 H new ATOM 0 HG2 GLU A 798 36.572 -3.162 -16.393 1.00 0.00 H new ATOM 0 HG3 GLU A 798 36.378 -1.471 -15.976 1.00 0.00 H new ATOM 1652 N GLU A 799 40.253 -4.087 -13.586 1.00 0.00 N ATOM 1653 CA GLU A 799 41.244 -4.231 -12.574 1.00 0.00 C ATOM 1654 C GLU A 799 42.114 -5.415 -12.956 1.00 0.00 C ATOM 1655 O GLU A 799 41.668 -6.305 -13.672 1.00 0.00 O ATOM 1656 CB GLU A 799 40.582 -4.413 -11.190 1.00 0.00 C ATOM 1657 CG GLU A 799 41.561 -4.475 -10.021 1.00 0.00 C ATOM 1658 CD GLU A 799 42.530 -3.312 -10.017 1.00 0.00 C ATOM 1659 OE1 GLU A 799 43.614 -3.435 -10.619 1.00 0.00 O ATOM 1660 OE2 GLU A 799 42.236 -2.255 -9.421 1.00 0.00 O ATOM 0 H GLU A 799 39.394 -4.606 -13.404 1.00 0.00 H new ATOM 0 HA GLU A 799 41.863 -3.337 -12.499 1.00 0.00 H new ATOM 0 HB2 GLU A 799 39.888 -3.589 -11.023 1.00 0.00 H new ATOM 0 HB3 GLU A 799 39.992 -5.329 -11.202 1.00 0.00 H new ATOM 0 HG2 GLU A 799 41.004 -4.483 -9.084 1.00 0.00 H new ATOM 0 HG3 GLU A 799 42.120 -5.410 -10.068 1.00 0.00 H new ATOM 1667 N GLU A 800 43.345 -5.405 -12.530 1.00 0.00 N ATOM 1668 CA GLU A 800 44.240 -6.456 -12.889 1.00 0.00 C ATOM 1669 C GLU A 800 44.028 -7.676 -12.019 1.00 0.00 C ATOM 1670 O GLU A 800 43.931 -8.800 -12.543 1.00 0.00 O ATOM 1671 CB GLU A 800 45.702 -6.006 -12.822 1.00 0.00 C ATOM 1672 CG GLU A 800 46.060 -4.872 -13.770 1.00 0.00 C ATOM 1673 CD GLU A 800 47.539 -4.556 -13.753 1.00 0.00 C ATOM 1674 OE1 GLU A 800 48.281 -5.060 -14.628 1.00 0.00 O ATOM 1675 OE2 GLU A 800 47.989 -3.806 -12.863 1.00 0.00 O ATOM 0 H GLU A 800 43.747 -4.680 -11.935 1.00 0.00 H new ATOM 0 HA GLU A 800 44.018 -6.723 -13.922 1.00 0.00 H new ATOM 0 HB2 GLU A 800 45.926 -5.694 -11.802 1.00 0.00 H new ATOM 0 HB3 GLU A 800 46.342 -6.861 -13.041 1.00 0.00 H new ATOM 0 HG2 GLU A 800 45.759 -5.139 -14.783 1.00 0.00 H new ATOM 0 HG3 GLU A 800 45.497 -3.980 -13.495 1.00 0.00 H new ATOM 1682 N GLY A 801 43.915 -7.450 -10.697 1.00 0.00 N ATOM 1683 CA GLY A 801 43.873 -8.542 -9.750 1.00 0.00 C ATOM 1684 C GLY A 801 45.057 -9.451 -9.973 1.00 0.00 C ATOM 1685 O GLY A 801 46.161 -8.982 -10.305 1.00 0.00 O ATOM 0 H GLY A 801 43.853 -6.522 -10.278 1.00 0.00 H new ATOM 0 HA2 GLY A 801 43.886 -8.154 -8.731 1.00 0.00 H new ATOM 0 HA3 GLY A 801 42.945 -9.102 -9.866 1.00 0.00 H new ATOM 1689 N PHE A 802 44.868 -10.699 -9.796 1.00 0.00 N ATOM 1690 CA PHE A 802 45.855 -11.676 -10.142 1.00 0.00 C ATOM 1691 C PHE A 802 45.459 -12.408 -11.392 1.00 0.00 C ATOM 1692 O PHE A 802 44.415 -12.152 -11.975 1.00 0.00 O ATOM 1693 CB PHE A 802 46.062 -12.669 -9.006 1.00 0.00 C ATOM 1694 CG PHE A 802 46.945 -12.173 -7.911 1.00 0.00 C ATOM 1695 CD1 PHE A 802 47.896 -12.999 -7.378 1.00 0.00 C ATOM 1696 CD2 PHE A 802 46.851 -10.880 -7.438 1.00 0.00 C ATOM 1697 CE1 PHE A 802 48.732 -12.564 -6.402 1.00 0.00 C ATOM 1698 CE2 PHE A 802 47.682 -10.433 -6.461 1.00 0.00 C ATOM 1699 CZ PHE A 802 48.635 -11.279 -5.934 1.00 0.00 C ATOM 0 H PHE A 802 44.013 -11.091 -9.401 1.00 0.00 H new ATOM 0 HA PHE A 802 46.794 -11.151 -10.320 1.00 0.00 H new ATOM 0 HB2 PHE A 802 45.091 -12.929 -8.584 1.00 0.00 H new ATOM 0 HB3 PHE A 802 46.488 -13.586 -9.413 1.00 0.00 H new ATOM 0 HD1 PHE A 802 47.983 -14.013 -7.740 1.00 0.00 H new ATOM 0 HD2 PHE A 802 46.107 -10.215 -7.850 1.00 0.00 H new ATOM 0 HE1 PHE A 802 49.476 -13.232 -5.993 1.00 0.00 H new ATOM 0 HE2 PHE A 802 47.597 -9.419 -6.098 1.00 0.00 H new ATOM 0 HZ PHE A 802 49.301 -10.932 -5.158 1.00 0.00 H new ATOM 1709 N SER A 803 46.329 -13.234 -11.851 1.00 0.00 N ATOM 1710 CA SER A 803 46.023 -14.131 -12.913 1.00 0.00 C ATOM 1711 C SER A 803 45.985 -15.541 -12.316 1.00 0.00 C ATOM 1712 O SER A 803 46.879 -15.913 -11.547 1.00 0.00 O ATOM 1713 CB SER A 803 47.072 -13.992 -14.006 1.00 0.00 C ATOM 1714 OG SER A 803 47.171 -12.632 -14.417 1.00 0.00 O ATOM 0 H SER A 803 47.283 -13.309 -11.499 1.00 0.00 H new ATOM 0 HA SER A 803 45.058 -13.913 -13.371 1.00 0.00 H new ATOM 0 HB2 SER A 803 48.038 -14.341 -13.641 1.00 0.00 H new ATOM 0 HB3 SER A 803 46.807 -14.619 -14.857 1.00 0.00 H new ATOM 0 HG SER A 803 47.850 -12.551 -15.119 1.00 0.00 H new ATOM 1720 N ILE A 804 44.951 -16.293 -12.623 1.00 0.00 N ATOM 1721 CA ILE A 804 44.737 -17.608 -12.022 1.00 0.00 C ATOM 1722 C ILE A 804 44.401 -18.641 -13.098 1.00 0.00 C ATOM 1723 O ILE A 804 43.923 -18.282 -14.180 1.00 0.00 O ATOM 1724 CB ILE A 804 43.585 -17.613 -10.918 1.00 0.00 C ATOM 1725 CG1 ILE A 804 42.156 -17.359 -11.496 1.00 0.00 C ATOM 1726 CG2 ILE A 804 43.874 -16.609 -9.802 1.00 0.00 C ATOM 1727 CD1 ILE A 804 41.913 -15.981 -12.089 1.00 0.00 C ATOM 0 H ILE A 804 44.232 -16.019 -13.293 1.00 0.00 H new ATOM 0 HA ILE A 804 45.672 -17.868 -11.525 1.00 0.00 H new ATOM 0 HB ILE A 804 43.590 -18.624 -10.510 1.00 0.00 H new ATOM 0 HG12 ILE A 804 41.960 -18.104 -12.267 1.00 0.00 H new ATOM 0 HG13 ILE A 804 41.429 -17.524 -10.701 1.00 0.00 H new ATOM 0 HG21 ILE A 804 43.069 -16.639 -9.068 1.00 0.00 H new ATOM 0 HG22 ILE A 804 44.817 -16.865 -9.318 1.00 0.00 H new ATOM 0 HG23 ILE A 804 43.943 -15.606 -10.224 1.00 0.00 H new ATOM 0 HD11 ILE A 804 40.889 -15.919 -12.459 1.00 0.00 H new ATOM 0 HD12 ILE A 804 42.068 -15.222 -11.322 1.00 0.00 H new ATOM 0 HD13 ILE A 804 42.607 -15.812 -12.912 1.00 0.00 H new ATOM 1739 N CYS A 805 44.670 -19.896 -12.823 1.00 0.00 N ATOM 1740 CA CYS A 805 44.349 -20.961 -13.742 1.00 0.00 C ATOM 1741 C CYS A 805 43.038 -21.620 -13.294 1.00 0.00 C ATOM 1742 O CYS A 805 42.910 -22.079 -12.143 1.00 0.00 O ATOM 1743 CB CYS A 805 45.444 -22.006 -13.758 1.00 0.00 C ATOM 1744 SG CYS A 805 45.168 -23.300 -14.998 1.00 0.00 S ATOM 0 H CYS A 805 45.116 -20.206 -11.959 1.00 0.00 H new ATOM 0 HA CYS A 805 44.249 -20.544 -14.744 1.00 0.00 H new ATOM 0 HB2 CYS A 805 46.400 -21.520 -13.954 1.00 0.00 H new ATOM 0 HB3 CYS A 805 45.516 -22.465 -12.772 1.00 0.00 H new ATOM 0 HG CYS A 805 46.298 -23.608 -15.562 1.00 0.00 H new ATOM 1749 N VAL A 806 42.086 -21.668 -14.167 1.00 0.00 N ATOM 1750 CA VAL A 806 40.780 -22.184 -13.849 1.00 0.00 C ATOM 1751 C VAL A 806 40.347 -23.251 -14.877 1.00 0.00 C ATOM 1752 O VAL A 806 40.497 -23.062 -16.087 1.00 0.00 O ATOM 1753 CB VAL A 806 39.758 -20.994 -13.748 1.00 0.00 C ATOM 1754 CG1 VAL A 806 39.843 -20.106 -14.957 1.00 0.00 C ATOM 1755 CG2 VAL A 806 38.342 -21.468 -13.573 1.00 0.00 C ATOM 0 H VAL A 806 42.186 -21.350 -15.131 1.00 0.00 H new ATOM 0 HA VAL A 806 40.808 -22.683 -12.881 1.00 0.00 H new ATOM 0 HB VAL A 806 40.035 -20.426 -12.860 1.00 0.00 H new ATOM 0 HG11 VAL A 806 39.125 -19.291 -14.861 1.00 0.00 H new ATOM 0 HG12 VAL A 806 40.850 -19.696 -15.037 1.00 0.00 H new ATOM 0 HG13 VAL A 806 39.616 -20.686 -15.851 1.00 0.00 H new ATOM 0 HG21 VAL A 806 37.676 -20.608 -13.509 1.00 0.00 H new ATOM 0 HG22 VAL A 806 38.057 -22.085 -14.425 1.00 0.00 H new ATOM 0 HG23 VAL A 806 38.265 -22.056 -12.658 1.00 0.00 H new ATOM 1765 N GLU A 807 39.837 -24.362 -14.383 1.00 0.00 N ATOM 1766 CA GLU A 807 39.418 -25.459 -15.214 1.00 0.00 C ATOM 1767 C GLU A 807 38.018 -25.208 -15.703 1.00 0.00 C ATOM 1768 O GLU A 807 37.080 -25.120 -14.923 1.00 0.00 O ATOM 1769 CB GLU A 807 39.477 -26.769 -14.440 1.00 0.00 C ATOM 1770 CG GLU A 807 39.159 -27.993 -15.266 1.00 0.00 C ATOM 1771 CD GLU A 807 39.251 -29.251 -14.467 1.00 0.00 C ATOM 1772 OE1 GLU A 807 38.247 -29.658 -13.860 1.00 0.00 O ATOM 1773 OE2 GLU A 807 40.336 -29.863 -14.424 1.00 0.00 O ATOM 0 H GLU A 807 39.703 -24.524 -13.385 1.00 0.00 H new ATOM 0 HA GLU A 807 40.092 -25.537 -16.067 1.00 0.00 H new ATOM 0 HB2 GLU A 807 40.474 -26.881 -14.014 1.00 0.00 H new ATOM 0 HB3 GLU A 807 38.778 -26.716 -13.605 1.00 0.00 H new ATOM 0 HG2 GLU A 807 38.155 -27.900 -15.679 1.00 0.00 H new ATOM 0 HG3 GLU A 807 39.847 -28.049 -16.110 1.00 0.00 H new ATOM 1780 N VAL A 808 37.893 -25.040 -16.966 1.00 0.00 N ATOM 1781 CA VAL A 808 36.642 -24.782 -17.593 1.00 0.00 C ATOM 1782 C VAL A 808 36.563 -25.677 -18.801 1.00 0.00 C ATOM 1783 O VAL A 808 37.504 -25.712 -19.605 1.00 0.00 O ATOM 1784 CB VAL A 808 36.542 -23.332 -18.071 1.00 0.00 C ATOM 1785 CG1 VAL A 808 35.172 -23.016 -18.617 1.00 0.00 C ATOM 1786 CG2 VAL A 808 36.981 -22.348 -17.018 1.00 0.00 C ATOM 0 H VAL A 808 38.678 -25.078 -17.616 1.00 0.00 H new ATOM 0 HA VAL A 808 35.837 -24.964 -16.881 1.00 0.00 H new ATOM 0 HB VAL A 808 37.244 -23.224 -18.898 1.00 0.00 H new ATOM 0 HG11 VAL A 808 35.142 -21.977 -18.946 1.00 0.00 H new ATOM 0 HG12 VAL A 808 34.957 -23.670 -19.462 1.00 0.00 H new ATOM 0 HG13 VAL A 808 34.425 -23.172 -17.838 1.00 0.00 H new ATOM 0 HG21 VAL A 808 36.891 -21.334 -17.407 1.00 0.00 H new ATOM 0 HG22 VAL A 808 36.351 -22.455 -16.135 1.00 0.00 H new ATOM 0 HG23 VAL A 808 38.019 -22.542 -16.749 1.00 0.00 H new ATOM 1796 N ASN A 809 35.480 -26.428 -18.911 1.00 0.00 N ATOM 1797 CA ASN A 809 35.251 -27.369 -20.019 1.00 0.00 C ATOM 1798 C ASN A 809 36.208 -28.539 -19.940 1.00 0.00 C ATOM 1799 O ASN A 809 36.382 -29.288 -20.903 1.00 0.00 O ATOM 1800 CB ASN A 809 35.371 -26.696 -21.400 1.00 0.00 C ATOM 1801 CG ASN A 809 34.269 -25.716 -21.706 1.00 0.00 C ATOM 1802 OD1 ASN A 809 34.542 -24.463 -21.517 1.00 0.00 O flip ATOM 1803 ND2 ASN A 809 33.189 -26.096 -22.170 1.00 0.00 N flip ATOM 0 H ASN A 809 34.720 -26.409 -18.231 1.00 0.00 H new ATOM 0 HA ASN A 809 34.227 -27.728 -19.911 1.00 0.00 H new ATOM 0 HB2 ASN A 809 36.329 -26.179 -21.458 1.00 0.00 H new ATOM 0 HB3 ASN A 809 35.379 -27.469 -22.169 1.00 0.00 H new ATOM 0 HD21 ASN A 809 33.013 -27.092 -22.303 1.00 0.00 H new ATOM 0 HD22 ASN A 809 32.473 -25.414 -22.420 1.00 0.00 H new ATOM 1810 N GLY A 810 36.810 -28.706 -18.789 1.00 0.00 N ATOM 1811 CA GLY A 810 37.771 -29.751 -18.595 1.00 0.00 C ATOM 1812 C GLY A 810 39.185 -29.258 -18.780 1.00 0.00 C ATOM 1813 O GLY A 810 40.135 -29.886 -18.314 1.00 0.00 O ATOM 0 H GLY A 810 36.646 -28.123 -17.968 1.00 0.00 H new ATOM 0 HA2 GLY A 810 37.659 -30.165 -17.593 1.00 0.00 H new ATOM 0 HA3 GLY A 810 37.574 -30.560 -19.298 1.00 0.00 H new ATOM 1817 N LYS A 811 39.327 -28.125 -19.441 1.00 0.00 N ATOM 1818 CA LYS A 811 40.633 -27.557 -19.733 1.00 0.00 C ATOM 1819 C LYS A 811 40.959 -26.445 -18.762 1.00 0.00 C ATOM 1820 O LYS A 811 40.080 -25.726 -18.328 1.00 0.00 O ATOM 1821 CB LYS A 811 40.669 -27.037 -21.164 1.00 0.00 C ATOM 1822 CG LYS A 811 40.456 -28.125 -22.198 1.00 0.00 C ATOM 1823 CD LYS A 811 40.391 -27.583 -23.614 1.00 0.00 C ATOM 1824 CE LYS A 811 41.674 -26.882 -24.029 1.00 0.00 C ATOM 1825 NZ LYS A 811 41.637 -26.480 -25.452 1.00 0.00 N ATOM 0 H LYS A 811 38.544 -27.572 -19.791 1.00 0.00 H new ATOM 0 HA LYS A 811 41.384 -28.339 -19.623 1.00 0.00 H new ATOM 0 HB2 LYS A 811 39.901 -26.273 -21.286 1.00 0.00 H new ATOM 0 HB3 LYS A 811 41.630 -26.555 -21.345 1.00 0.00 H new ATOM 0 HG2 LYS A 811 41.266 -28.851 -22.128 1.00 0.00 H new ATOM 0 HG3 LYS A 811 39.531 -28.657 -21.974 1.00 0.00 H new ATOM 0 HD2 LYS A 811 40.189 -28.402 -24.304 1.00 0.00 H new ATOM 0 HD3 LYS A 811 39.557 -26.885 -23.695 1.00 0.00 H new ATOM 0 HE2 LYS A 811 41.827 -26.001 -23.405 1.00 0.00 H new ATOM 0 HE3 LYS A 811 42.523 -27.544 -23.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 42.528 -26.005 -25.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 41.516 -27.324 -26.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 40.841 -25.829 -25.608 1.00 0.00 H new ATOM 1839 N GLU A 812 42.205 -26.295 -18.433 1.00 0.00 N ATOM 1840 CA GLU A 812 42.598 -25.285 -17.476 1.00 0.00 C ATOM 1841 C GLU A 812 43.133 -24.053 -18.159 1.00 0.00 C ATOM 1842 O GLU A 812 44.273 -24.022 -18.597 1.00 0.00 O ATOM 1843 CB GLU A 812 43.584 -25.831 -16.443 1.00 0.00 C ATOM 1844 CG GLU A 812 42.970 -26.811 -15.462 1.00 0.00 C ATOM 1845 CD GLU A 812 43.944 -27.284 -14.417 1.00 0.00 C ATOM 1846 OE1 GLU A 812 44.530 -28.372 -14.585 1.00 0.00 O ATOM 1847 OE2 GLU A 812 44.147 -26.582 -13.400 1.00 0.00 O ATOM 0 H GLU A 812 42.972 -26.853 -18.807 1.00 0.00 H new ATOM 0 HA GLU A 812 41.699 -24.991 -16.934 1.00 0.00 H new ATOM 0 HB2 GLU A 812 44.406 -26.321 -16.964 1.00 0.00 H new ATOM 0 HB3 GLU A 812 44.012 -24.996 -15.887 1.00 0.00 H new ATOM 0 HG2 GLU A 812 42.119 -26.340 -14.971 1.00 0.00 H new ATOM 0 HG3 GLU A 812 42.586 -27.672 -16.009 1.00 0.00 H new ATOM 1854 N GLN A 813 42.298 -23.048 -18.263 1.00 0.00 N ATOM 1855 CA GLN A 813 42.659 -21.814 -18.908 1.00 0.00 C ATOM 1856 C GLN A 813 43.011 -20.770 -17.852 1.00 0.00 C ATOM 1857 O GLN A 813 42.513 -20.813 -16.740 1.00 0.00 O ATOM 1858 CB GLN A 813 41.503 -21.332 -19.796 1.00 0.00 C ATOM 1859 CG GLN A 813 41.773 -20.013 -20.502 1.00 0.00 C ATOM 1860 CD GLN A 813 40.630 -19.539 -21.379 1.00 0.00 C ATOM 1861 OE1 GLN A 813 39.422 -19.882 -21.025 1.00 0.00 O flip ATOM 1862 NE2 GLN A 813 40.850 -18.862 -22.382 1.00 0.00 N flip ATOM 0 H GLN A 813 41.345 -23.065 -17.900 1.00 0.00 H new ATOM 0 HA GLN A 813 43.531 -21.972 -19.542 1.00 0.00 H new ATOM 0 HB2 GLN A 813 41.291 -22.096 -20.544 1.00 0.00 H new ATOM 0 HB3 GLN A 813 40.607 -21.228 -19.184 1.00 0.00 H new ATOM 0 HG2 GLN A 813 41.985 -19.249 -19.754 1.00 0.00 H new ATOM 0 HG3 GLN A 813 42.669 -20.117 -21.114 1.00 0.00 H new ATOM 0 HE21 GLN A 813 41.808 -18.612 -22.629 1.00 0.00 H new ATOM 0 HE22 GLN A 813 40.075 -18.550 -22.967 1.00 0.00 H new ATOM 1871 N THR A 814 43.879 -19.866 -18.187 1.00 0.00 N ATOM 1872 CA THR A 814 44.297 -18.843 -17.281 1.00 0.00 C ATOM 1873 C THR A 814 43.577 -17.534 -17.564 1.00 0.00 C ATOM 1874 O THR A 814 43.565 -17.044 -18.696 1.00 0.00 O ATOM 1875 CB THR A 814 45.781 -18.683 -17.412 1.00 0.00 C ATOM 1876 OG1 THR A 814 46.344 -19.980 -17.168 1.00 0.00 O ATOM 1877 CG2 THR A 814 46.335 -17.670 -16.417 1.00 0.00 C ATOM 0 H THR A 814 44.321 -19.818 -19.105 1.00 0.00 H new ATOM 0 HA THR A 814 44.044 -19.126 -16.259 1.00 0.00 H new ATOM 0 HB THR A 814 46.036 -18.306 -18.403 1.00 0.00 H new ATOM 0 HG1 THR A 814 46.706 -20.342 -18.004 1.00 0.00 H new ATOM 0 HG21 THR A 814 47.414 -17.585 -16.547 1.00 0.00 H new ATOM 0 HG22 THR A 814 45.871 -16.699 -16.590 1.00 0.00 H new ATOM 0 HG23 THR A 814 46.117 -18.000 -15.402 1.00 0.00 H new ATOM 1885 N MET A 815 42.980 -16.984 -16.539 1.00 0.00 N ATOM 1886 CA MET A 815 42.205 -15.779 -16.677 1.00 0.00 C ATOM 1887 C MET A 815 42.682 -14.760 -15.683 1.00 0.00 C ATOM 1888 O MET A 815 43.479 -15.078 -14.787 1.00 0.00 O ATOM 1889 CB MET A 815 40.718 -16.058 -16.406 1.00 0.00 C ATOM 1890 CG MET A 815 40.182 -17.258 -17.132 1.00 0.00 C ATOM 1891 SD MET A 815 38.395 -17.423 -17.058 1.00 0.00 S ATOM 1892 CE MET A 815 38.229 -18.994 -17.892 1.00 0.00 C ATOM 0 H MET A 815 43.017 -17.356 -15.590 1.00 0.00 H new ATOM 0 HA MET A 815 42.326 -15.409 -17.695 1.00 0.00 H new ATOM 0 HB2 MET A 815 40.574 -16.200 -15.335 1.00 0.00 H new ATOM 0 HB3 MET A 815 40.136 -15.182 -16.693 1.00 0.00 H new ATOM 0 HG2 MET A 815 40.488 -17.204 -18.177 1.00 0.00 H new ATOM 0 HG3 MET A 815 40.637 -18.156 -16.713 1.00 0.00 H new ATOM 0 HE1 MET A 815 37.322 -18.991 -18.496 1.00 0.00 H new ATOM 0 HE2 MET A 815 39.093 -19.157 -18.536 1.00 0.00 H new ATOM 0 HE3 MET A 815 38.170 -19.794 -17.154 1.00 0.00 H new ATOM 1902 N SER A 816 42.220 -13.557 -15.837 1.00 0.00 N ATOM 1903 CA SER A 816 42.469 -12.522 -14.881 1.00 0.00 C ATOM 1904 C SER A 816 41.429 -12.653 -13.760 1.00 0.00 C ATOM 1905 O SER A 816 40.345 -13.217 -13.989 1.00 0.00 O ATOM 1906 CB SER A 816 42.392 -11.160 -15.569 1.00 0.00 C ATOM 1907 OG SER A 816 43.342 -11.092 -16.634 1.00 0.00 O ATOM 0 H SER A 816 41.656 -13.264 -16.635 1.00 0.00 H new ATOM 0 HA SER A 816 43.467 -12.613 -14.452 1.00 0.00 H new ATOM 0 HB2 SER A 816 41.387 -10.997 -15.957 1.00 0.00 H new ATOM 0 HB3 SER A 816 42.587 -10.368 -14.846 1.00 0.00 H new ATOM 0 HG SER A 816 43.283 -10.216 -17.069 1.00 0.00 H new ATOM 1913 N GLU A 817 41.772 -12.167 -12.575 1.00 0.00 N ATOM 1914 CA GLU A 817 40.959 -12.275 -11.349 1.00 0.00 C ATOM 1915 C GLU A 817 39.495 -11.910 -11.595 1.00 0.00 C ATOM 1916 O GLU A 817 38.586 -12.724 -11.382 1.00 0.00 O ATOM 1917 CB GLU A 817 41.501 -11.315 -10.310 1.00 0.00 C ATOM 1918 CG GLU A 817 41.091 -11.638 -8.900 1.00 0.00 C ATOM 1919 CD GLU A 817 42.191 -12.281 -8.130 1.00 0.00 C ATOM 1920 OE1 GLU A 817 42.029 -13.423 -7.715 1.00 0.00 O ATOM 1921 OE2 GLU A 817 43.212 -11.621 -7.888 1.00 0.00 O ATOM 0 H GLU A 817 42.650 -11.669 -12.425 1.00 0.00 H new ATOM 0 HA GLU A 817 41.012 -13.311 -11.014 1.00 0.00 H new ATOM 0 HB2 GLU A 817 42.589 -11.311 -10.368 1.00 0.00 H new ATOM 0 HB3 GLU A 817 41.165 -10.307 -10.552 1.00 0.00 H new ATOM 0 HG2 GLU A 817 40.782 -10.723 -8.394 1.00 0.00 H new ATOM 0 HG3 GLU A 817 40.226 -12.301 -8.917 1.00 0.00 H new ATOM 1928 N CYS A 818 39.284 -10.689 -12.070 1.00 0.00 N ATOM 1929 CA CYS A 818 37.952 -10.159 -12.289 1.00 0.00 C ATOM 1930 C CYS A 818 37.198 -10.976 -13.329 1.00 0.00 C ATOM 1931 O CYS A 818 36.002 -11.128 -13.238 1.00 0.00 O ATOM 1932 CB CYS A 818 38.039 -8.709 -12.718 1.00 0.00 C ATOM 1933 SG CYS A 818 39.222 -7.733 -11.746 1.00 0.00 S ATOM 0 H CYS A 818 40.034 -10.042 -12.313 1.00 0.00 H new ATOM 0 HA CYS A 818 37.399 -10.222 -11.352 1.00 0.00 H new ATOM 0 HB2 CYS A 818 38.323 -8.666 -13.770 1.00 0.00 H new ATOM 0 HB3 CYS A 818 37.052 -8.255 -12.636 1.00 0.00 H new ATOM 0 HG CYS A 818 40.107 -7.207 -12.540 1.00 0.00 H new ATOM 1938 N GLU A 819 37.924 -11.522 -14.289 1.00 0.00 N ATOM 1939 CA GLU A 819 37.342 -12.355 -15.320 1.00 0.00 C ATOM 1940 C GLU A 819 36.796 -13.641 -14.718 1.00 0.00 C ATOM 1941 O GLU A 819 35.583 -13.818 -14.661 1.00 0.00 O ATOM 1942 CB GLU A 819 38.370 -12.631 -16.435 1.00 0.00 C ATOM 1943 CG GLU A 819 37.929 -13.618 -17.504 1.00 0.00 C ATOM 1944 CD GLU A 819 38.834 -13.603 -18.705 1.00 0.00 C ATOM 1945 OE1 GLU A 819 38.420 -13.092 -19.777 1.00 0.00 O ATOM 1946 OE2 GLU A 819 39.981 -14.059 -18.616 1.00 0.00 O ATOM 0 H GLU A 819 38.933 -11.399 -14.373 1.00 0.00 H new ATOM 0 HA GLU A 819 36.504 -11.825 -15.774 1.00 0.00 H new ATOM 0 HB2 GLU A 819 38.618 -11.686 -16.918 1.00 0.00 H new ATOM 0 HB3 GLU A 819 39.286 -13.004 -15.976 1.00 0.00 H new ATOM 0 HG2 GLU A 819 37.907 -14.622 -17.081 1.00 0.00 H new ATOM 0 HG3 GLU A 819 36.912 -13.382 -17.816 1.00 0.00 H new ATOM 1953 N ALA A 820 37.690 -14.480 -14.189 1.00 0.00 N ATOM 1954 CA ALA A 820 37.309 -15.775 -13.620 1.00 0.00 C ATOM 1955 C ALA A 820 36.241 -15.605 -12.533 1.00 0.00 C ATOM 1956 O ALA A 820 35.292 -16.396 -12.430 1.00 0.00 O ATOM 1957 CB ALA A 820 38.520 -16.461 -13.022 1.00 0.00 C ATOM 0 H ALA A 820 38.690 -14.283 -14.143 1.00 0.00 H new ATOM 0 HA ALA A 820 36.900 -16.385 -14.425 1.00 0.00 H new ATOM 0 HB1 ALA A 820 38.223 -17.422 -12.602 1.00 0.00 H new ATOM 0 HB2 ALA A 820 39.269 -16.619 -13.798 1.00 0.00 H new ATOM 0 HB3 ALA A 820 38.940 -15.836 -12.234 1.00 0.00 H new ATOM 1963 N GLY A 821 36.402 -14.546 -11.743 1.00 0.00 N ATOM 1964 CA GLY A 821 35.484 -14.240 -10.679 1.00 0.00 C ATOM 1965 C GLY A 821 34.108 -13.883 -11.177 1.00 0.00 C ATOM 1966 O GLY A 821 33.105 -14.400 -10.661 1.00 0.00 O ATOM 0 H GLY A 821 37.174 -13.885 -11.832 1.00 0.00 H new ATOM 0 HA2 GLY A 821 35.412 -15.098 -10.010 1.00 0.00 H new ATOM 0 HA3 GLY A 821 35.879 -13.411 -10.092 1.00 0.00 H new ATOM 1970 N ALA A 822 34.046 -13.034 -12.188 1.00 0.00 N ATOM 1971 CA ALA A 822 32.779 -12.590 -12.735 1.00 0.00 C ATOM 1972 C ALA A 822 32.063 -13.729 -13.434 1.00 0.00 C ATOM 1973 O ALA A 822 30.828 -13.785 -13.436 1.00 0.00 O ATOM 1974 CB ALA A 822 32.959 -11.397 -13.650 1.00 0.00 C ATOM 0 H ALA A 822 34.865 -12.637 -12.648 1.00 0.00 H new ATOM 0 HA ALA A 822 32.151 -12.265 -11.905 1.00 0.00 H new ATOM 0 HB1 ALA A 822 31.990 -11.090 -14.043 1.00 0.00 H new ATOM 0 HB2 ALA A 822 33.401 -10.573 -13.090 1.00 0.00 H new ATOM 0 HB3 ALA A 822 33.616 -11.668 -14.477 1.00 0.00 H new ATOM 1980 N LEU A 823 32.832 -14.662 -14.011 1.00 0.00 N ATOM 1981 CA LEU A 823 32.233 -15.857 -14.584 1.00 0.00 C ATOM 1982 C LEU A 823 31.489 -16.654 -13.510 1.00 0.00 C ATOM 1983 O LEU A 823 30.370 -17.107 -13.741 1.00 0.00 O ATOM 1984 CB LEU A 823 33.228 -16.768 -15.358 1.00 0.00 C ATOM 1985 CG LEU A 823 33.530 -16.437 -16.850 1.00 0.00 C ATOM 1986 CD1 LEU A 823 32.255 -16.292 -17.665 1.00 0.00 C ATOM 1987 CD2 LEU A 823 34.397 -15.215 -17.012 1.00 0.00 C ATOM 0 H LEU A 823 33.848 -14.609 -14.089 1.00 0.00 H new ATOM 0 HA LEU A 823 31.525 -15.501 -15.333 1.00 0.00 H new ATOM 0 HB2 LEU A 823 34.175 -16.759 -14.818 1.00 0.00 H new ATOM 0 HB3 LEU A 823 32.846 -17.788 -15.315 1.00 0.00 H new ATOM 0 HG LEU A 823 34.091 -17.288 -17.235 1.00 0.00 H new ATOM 0 HD11 LEU A 823 32.509 -16.061 -18.700 1.00 0.00 H new ATOM 0 HD12 LEU A 823 31.692 -17.225 -17.629 1.00 0.00 H new ATOM 0 HD13 LEU A 823 31.649 -15.486 -17.252 1.00 0.00 H new ATOM 0 HD21 LEU A 823 34.574 -15.033 -18.072 1.00 0.00 H new ATOM 0 HD22 LEU A 823 33.895 -14.352 -16.574 1.00 0.00 H new ATOM 0 HD23 LEU A 823 35.350 -15.375 -16.507 1.00 0.00 H new ATOM 1999 N ARG A 824 32.080 -16.766 -12.313 1.00 0.00 N ATOM 2000 CA ARG A 824 31.427 -17.499 -11.206 1.00 0.00 C ATOM 2001 C ARG A 824 30.171 -16.767 -10.775 1.00 0.00 C ATOM 2002 O ARG A 824 29.132 -17.373 -10.513 1.00 0.00 O ATOM 2003 CB ARG A 824 32.351 -17.683 -9.976 1.00 0.00 C ATOM 2004 CG ARG A 824 33.662 -18.405 -10.247 1.00 0.00 C ATOM 2005 CD ARG A 824 34.386 -18.797 -8.977 1.00 0.00 C ATOM 2006 NE ARG A 824 34.634 -17.666 -8.087 1.00 0.00 N ATOM 2007 CZ ARG A 824 35.065 -17.766 -6.822 1.00 0.00 C ATOM 2008 NH1 ARG A 824 35.275 -18.957 -6.266 1.00 0.00 N ATOM 2009 NH2 ARG A 824 35.245 -16.669 -6.115 1.00 0.00 N ATOM 0 H ARG A 824 32.991 -16.369 -12.083 1.00 0.00 H new ATOM 0 HA ARG A 824 31.185 -18.491 -11.587 1.00 0.00 H new ATOM 0 HB2 ARG A 824 32.576 -16.700 -9.562 1.00 0.00 H new ATOM 0 HB3 ARG A 824 31.804 -18.234 -9.211 1.00 0.00 H new ATOM 0 HG2 ARG A 824 33.464 -19.299 -10.838 1.00 0.00 H new ATOM 0 HG3 ARG A 824 34.308 -17.763 -10.846 1.00 0.00 H new ATOM 0 HD2 ARG A 824 33.798 -19.547 -8.447 1.00 0.00 H new ATOM 0 HD3 ARG A 824 35.337 -19.263 -9.237 1.00 0.00 H new ATOM 0 HE ARG A 824 34.467 -16.730 -8.456 1.00 0.00 H new ATOM 0 HH11 ARG A 824 35.108 -19.807 -6.804 1.00 0.00 H new ATOM 0 HH12 ARG A 824 35.603 -19.019 -5.302 1.00 0.00 H new ATOM 0 HH21 ARG A 824 35.057 -15.757 -6.532 1.00 0.00 H new ATOM 0 HH22 ARG A 824 35.573 -16.732 -5.151 1.00 0.00 H new ATOM 2023 N CYS A 825 30.273 -15.464 -10.742 1.00 0.00 N ATOM 2024 CA CYS A 825 29.186 -14.599 -10.336 1.00 0.00 C ATOM 2025 C CYS A 825 28.003 -14.632 -11.297 1.00 0.00 C ATOM 2026 O CYS A 825 26.851 -14.532 -10.877 1.00 0.00 O ATOM 2027 CB CYS A 825 29.701 -13.188 -10.165 1.00 0.00 C ATOM 2028 SG CYS A 825 30.905 -13.041 -8.825 1.00 0.00 S ATOM 0 H CYS A 825 31.123 -14.963 -10.999 1.00 0.00 H new ATOM 0 HA CYS A 825 28.809 -14.974 -9.384 1.00 0.00 H new ATOM 0 HB2 CYS A 825 30.159 -12.858 -11.097 1.00 0.00 H new ATOM 0 HB3 CYS A 825 28.862 -12.521 -9.968 1.00 0.00 H new ATOM 0 HG CYS A 825 31.926 -12.347 -9.233 1.00 0.00 H new ATOM 2033 N ARG A 826 28.276 -14.803 -12.578 1.00 0.00 N ATOM 2034 CA ARG A 826 27.209 -14.815 -13.564 1.00 0.00 C ATOM 2035 C ARG A 826 26.583 -16.191 -13.723 1.00 0.00 C ATOM 2036 O ARG A 826 25.607 -16.354 -14.463 1.00 0.00 O ATOM 2037 CB ARG A 826 27.674 -14.308 -14.915 1.00 0.00 C ATOM 2038 CG ARG A 826 28.738 -15.138 -15.584 1.00 0.00 C ATOM 2039 CD ARG A 826 29.039 -14.597 -16.959 1.00 0.00 C ATOM 2040 NE ARG A 826 27.827 -14.538 -17.763 1.00 0.00 N ATOM 2041 CZ ARG A 826 27.604 -13.681 -18.767 1.00 0.00 C ATOM 2042 NH1 ARG A 826 28.585 -12.886 -19.210 1.00 0.00 N ATOM 2043 NH2 ARG A 826 26.406 -13.643 -19.344 1.00 0.00 N ATOM 0 H ARG A 826 29.214 -14.934 -12.957 1.00 0.00 H new ATOM 0 HA ARG A 826 26.448 -14.135 -13.181 1.00 0.00 H new ATOM 0 HB2 ARG A 826 26.812 -14.249 -15.579 1.00 0.00 H new ATOM 0 HB3 ARG A 826 28.052 -13.293 -14.793 1.00 0.00 H new ATOM 0 HG2 ARG A 826 29.644 -15.135 -14.979 1.00 0.00 H new ATOM 0 HG3 ARG A 826 28.407 -16.174 -15.658 1.00 0.00 H new ATOM 0 HD2 ARG A 826 29.476 -13.602 -16.876 1.00 0.00 H new ATOM 0 HD3 ARG A 826 29.778 -15.230 -17.451 1.00 0.00 H new ATOM 0 HE ARG A 826 27.087 -15.204 -17.543 1.00 0.00 H new ATOM 0 HH11 ARG A 826 29.510 -12.931 -18.782 1.00 0.00 H new ATOM 0 HH12 ARG A 826 28.408 -12.235 -19.975 1.00 0.00 H new ATOM 0 HH21 ARG A 826 25.664 -14.264 -19.021 1.00 0.00 H new ATOM 0 HH22 ARG A 826 26.229 -12.993 -20.109 1.00 0.00 H new ATOM 2057 N GLY A 827 27.142 -17.180 -13.073 1.00 0.00 N ATOM 2058 CA GLY A 827 26.557 -18.488 -13.162 1.00 0.00 C ATOM 2059 C GLY A 827 27.300 -19.422 -14.084 1.00 0.00 C ATOM 2060 O GLY A 827 26.944 -20.591 -14.190 1.00 0.00 O ATOM 0 H GLY A 827 27.978 -17.107 -12.493 1.00 0.00 H new ATOM 0 HA2 GLY A 827 26.520 -18.928 -12.166 1.00 0.00 H new ATOM 0 HA3 GLY A 827 25.527 -18.393 -13.507 1.00 0.00 H new ATOM 2064 N GLN A 828 28.323 -18.911 -14.756 1.00 0.00 N ATOM 2065 CA GLN A 828 29.133 -19.736 -15.654 1.00 0.00 C ATOM 2066 C GLN A 828 29.848 -20.822 -14.848 1.00 0.00 C ATOM 2067 O GLN A 828 30.232 -20.595 -13.704 1.00 0.00 O ATOM 2068 CB GLN A 828 30.179 -18.878 -16.388 1.00 0.00 C ATOM 2069 CG GLN A 828 31.107 -19.665 -17.330 1.00 0.00 C ATOM 2070 CD GLN A 828 30.532 -19.957 -18.714 1.00 0.00 C ATOM 2071 OE1 GLN A 828 29.247 -19.940 -18.858 1.00 0.00 O flip ATOM 2072 NE2 GLN A 828 31.277 -20.107 -19.669 1.00 0.00 N flip ATOM 0 H GLN A 828 28.614 -17.935 -14.700 1.00 0.00 H new ATOM 0 HA GLN A 828 28.473 -20.193 -16.391 1.00 0.00 H new ATOM 0 HB2 GLN A 828 29.661 -18.113 -16.966 1.00 0.00 H new ATOM 0 HB3 GLN A 828 30.789 -18.360 -15.648 1.00 0.00 H new ATOM 0 HG2 GLN A 828 32.035 -19.106 -17.450 1.00 0.00 H new ATOM 0 HG3 GLN A 828 31.364 -20.611 -16.854 1.00 0.00 H new ATOM 0 HE21 GLN A 828 32.288 -20.117 -19.531 1.00 0.00 H new ATOM 0 HE22 GLN A 828 30.889 -20.222 -20.605 1.00 0.00 H new ATOM 2081 N SER A 829 29.995 -21.983 -15.418 1.00 0.00 N ATOM 2082 CA SER A 829 30.683 -23.041 -14.758 1.00 0.00 C ATOM 2083 C SER A 829 32.163 -23.059 -15.145 1.00 0.00 C ATOM 2084 O SER A 829 32.541 -23.369 -16.280 1.00 0.00 O ATOM 2085 CB SER A 829 29.995 -24.360 -15.048 1.00 0.00 C ATOM 2086 OG SER A 829 28.623 -24.281 -14.654 1.00 0.00 O ATOM 0 H SER A 829 29.642 -22.217 -16.346 1.00 0.00 H new ATOM 0 HA SER A 829 30.647 -22.876 -13.681 1.00 0.00 H new ATOM 0 HB2 SER A 829 30.066 -24.593 -16.110 1.00 0.00 H new ATOM 0 HB3 SER A 829 30.492 -25.167 -14.511 1.00 0.00 H new ATOM 0 HG SER A 829 28.179 -25.134 -14.843 1.00 0.00 H new ATOM 2092 N ILE A 830 32.962 -22.674 -14.195 1.00 0.00 N ATOM 2093 CA ILE A 830 34.402 -22.616 -14.268 1.00 0.00 C ATOM 2094 C ILE A 830 34.877 -23.114 -12.906 1.00 0.00 C ATOM 2095 O ILE A 830 34.246 -22.813 -11.870 1.00 0.00 O ATOM 2096 CB ILE A 830 34.948 -21.129 -14.491 1.00 0.00 C ATOM 2097 CG1 ILE A 830 34.633 -20.165 -13.318 1.00 0.00 C ATOM 2098 CG2 ILE A 830 34.404 -20.535 -15.791 1.00 0.00 C ATOM 2099 CD1 ILE A 830 33.179 -19.789 -13.212 1.00 0.00 C ATOM 0 H ILE A 830 32.608 -22.371 -13.288 1.00 0.00 H new ATOM 0 HA ILE A 830 34.764 -23.206 -15.110 1.00 0.00 H new ATOM 0 HB ILE A 830 36.032 -21.226 -14.546 1.00 0.00 H new ATOM 0 HG12 ILE A 830 34.947 -20.630 -12.384 1.00 0.00 H new ATOM 0 HG13 ILE A 830 35.225 -19.258 -13.437 1.00 0.00 H new ATOM 0 HG21 ILE A 830 34.790 -19.524 -15.919 1.00 0.00 H new ATOM 0 HG22 ILE A 830 34.718 -21.152 -16.633 1.00 0.00 H new ATOM 0 HG23 ILE A 830 33.315 -20.505 -15.750 1.00 0.00 H new ATOM 0 HD11 ILE A 830 33.039 -19.113 -12.368 1.00 0.00 H new ATOM 0 HD12 ILE A 830 32.863 -19.294 -14.130 1.00 0.00 H new ATOM 0 HD13 ILE A 830 32.581 -20.688 -13.060 1.00 0.00 H new ATOM 2111 N SER A 831 35.883 -23.883 -12.884 1.00 0.00 N ATOM 2112 CA SER A 831 36.373 -24.427 -11.664 1.00 0.00 C ATOM 2113 C SER A 831 37.773 -23.939 -11.372 1.00 0.00 C ATOM 2114 O SER A 831 38.717 -24.387 -11.988 1.00 0.00 O ATOM 2115 CB SER A 831 36.348 -25.935 -11.763 1.00 0.00 C ATOM 2116 OG SER A 831 35.014 -26.425 -11.908 1.00 0.00 O ATOM 0 H SER A 831 36.406 -24.165 -13.713 1.00 0.00 H new ATOM 0 HA SER A 831 35.736 -24.098 -10.843 1.00 0.00 H new ATOM 0 HB2 SER A 831 36.950 -26.255 -12.614 1.00 0.00 H new ATOM 0 HB3 SER A 831 36.801 -26.367 -10.871 1.00 0.00 H new ATOM 0 HG SER A 831 35.030 -27.403 -11.971 1.00 0.00 H new ATOM 2122 N VAL A 832 37.904 -22.986 -10.471 1.00 0.00 N ATOM 2123 CA VAL A 832 39.215 -22.471 -10.107 1.00 0.00 C ATOM 2124 C VAL A 832 39.993 -23.580 -9.415 1.00 0.00 C ATOM 2125 O VAL A 832 39.651 -23.998 -8.307 1.00 0.00 O ATOM 2126 CB VAL A 832 39.114 -21.221 -9.195 1.00 0.00 C ATOM 2127 CG1 VAL A 832 40.501 -20.701 -8.818 1.00 0.00 C ATOM 2128 CG2 VAL A 832 38.307 -20.122 -9.881 1.00 0.00 C ATOM 0 H VAL A 832 37.124 -22.552 -9.977 1.00 0.00 H new ATOM 0 HA VAL A 832 39.734 -22.155 -11.012 1.00 0.00 H new ATOM 0 HB VAL A 832 38.600 -21.515 -8.280 1.00 0.00 H new ATOM 0 HG11 VAL A 832 40.399 -19.824 -8.178 1.00 0.00 H new ATOM 0 HG12 VAL A 832 41.048 -21.478 -8.284 1.00 0.00 H new ATOM 0 HG13 VAL A 832 41.046 -20.429 -9.722 1.00 0.00 H new ATOM 0 HG21 VAL A 832 38.246 -19.253 -9.226 1.00 0.00 H new ATOM 0 HG22 VAL A 832 38.795 -19.841 -10.814 1.00 0.00 H new ATOM 0 HG23 VAL A 832 37.302 -20.487 -10.093 1.00 0.00 H new ATOM 2138 N THR A 833 40.974 -24.095 -10.101 1.00 0.00 N ATOM 2139 CA THR A 833 41.722 -25.210 -9.630 1.00 0.00 C ATOM 2140 C THR A 833 43.045 -24.787 -9.037 1.00 0.00 C ATOM 2141 O THR A 833 43.584 -25.451 -8.132 1.00 0.00 O ATOM 2142 CB THR A 833 41.963 -26.150 -10.804 1.00 0.00 C ATOM 2143 OG1 THR A 833 42.331 -25.353 -11.952 1.00 0.00 O ATOM 2144 CG2 THR A 833 40.715 -26.943 -11.121 1.00 0.00 C ATOM 0 H THR A 833 41.274 -23.744 -11.011 1.00 0.00 H new ATOM 0 HA THR A 833 41.157 -25.707 -8.841 1.00 0.00 H new ATOM 0 HB THR A 833 42.757 -26.852 -10.550 1.00 0.00 H new ATOM 0 HG1 THR A 833 42.672 -25.938 -12.661 1.00 0.00 H new ATOM 0 HG21 THR A 833 40.910 -27.608 -11.963 1.00 0.00 H new ATOM 0 HG22 THR A 833 40.429 -27.534 -10.251 1.00 0.00 H new ATOM 0 HG23 THR A 833 39.905 -26.260 -11.378 1.00 0.00 H new ATOM 2152 N SER A 834 43.568 -23.699 -9.537 1.00 0.00 N ATOM 2153 CA SER A 834 44.851 -23.229 -9.122 1.00 0.00 C ATOM 2154 C SER A 834 44.818 -21.725 -8.990 1.00 0.00 C ATOM 2155 O SER A 834 44.241 -21.033 -9.824 1.00 0.00 O ATOM 2156 CB SER A 834 45.889 -23.622 -10.167 1.00 0.00 C ATOM 2157 OG SER A 834 45.783 -24.998 -10.500 1.00 0.00 O ATOM 0 H SER A 834 43.113 -23.119 -10.242 1.00 0.00 H new ATOM 0 HA SER A 834 45.110 -23.672 -8.160 1.00 0.00 H new ATOM 0 HB2 SER A 834 45.755 -23.016 -11.063 1.00 0.00 H new ATOM 0 HB3 SER A 834 46.889 -23.412 -9.788 1.00 0.00 H new ATOM 0 HG SER A 834 46.458 -25.225 -11.173 1.00 0.00 H new ATOM 2163 N ILE A 835 45.438 -21.214 -7.965 1.00 0.00 N ATOM 2164 CA ILE A 835 45.489 -19.782 -7.778 1.00 0.00 C ATOM 2165 C ILE A 835 46.690 -19.198 -8.487 1.00 0.00 C ATOM 2166 O ILE A 835 46.896 -17.989 -8.527 1.00 0.00 O ATOM 2167 CB ILE A 835 45.422 -19.369 -6.277 1.00 0.00 C ATOM 2168 CG1 ILE A 835 46.470 -20.067 -5.394 1.00 0.00 C ATOM 2169 CG2 ILE A 835 44.055 -19.636 -5.737 1.00 0.00 C ATOM 2170 CD1 ILE A 835 47.871 -19.560 -5.545 1.00 0.00 C ATOM 0 H ILE A 835 45.914 -21.759 -7.247 1.00 0.00 H new ATOM 0 HA ILE A 835 44.594 -19.358 -8.234 1.00 0.00 H new ATOM 0 HB ILE A 835 45.648 -18.303 -6.244 1.00 0.00 H new ATOM 0 HG12 ILE A 835 46.172 -19.960 -4.351 1.00 0.00 H new ATOM 0 HG13 ILE A 835 46.460 -21.133 -5.620 1.00 0.00 H new ATOM 0 HG21 ILE A 835 44.015 -19.345 -4.687 1.00 0.00 H new ATOM 0 HG22 ILE A 835 43.322 -19.060 -6.301 1.00 0.00 H new ATOM 0 HG23 ILE A 835 43.829 -20.698 -5.828 1.00 0.00 H new ATOM 0 HD11 ILE A 835 48.533 -20.116 -4.881 1.00 0.00 H new ATOM 0 HD12 ILE A 835 48.197 -19.693 -6.577 1.00 0.00 H new ATOM 0 HD13 ILE A 835 47.905 -18.501 -5.288 1.00 0.00 H new ATOM 2182 N ARG A 836 47.499 -20.076 -9.010 1.00 0.00 N ATOM 2183 CA ARG A 836 48.642 -19.699 -9.783 1.00 0.00 C ATOM 2184 C ARG A 836 48.213 -19.633 -11.232 1.00 0.00 C ATOM 2185 O ARG A 836 47.378 -20.441 -11.657 1.00 0.00 O ATOM 2186 CB ARG A 836 49.757 -20.726 -9.630 1.00 0.00 C ATOM 2187 CG ARG A 836 50.220 -20.952 -8.207 1.00 0.00 C ATOM 2188 CD ARG A 836 51.334 -21.965 -8.180 1.00 0.00 C ATOM 2189 NE ARG A 836 51.700 -22.369 -6.813 1.00 0.00 N ATOM 2190 CZ ARG A 836 52.802 -23.064 -6.493 1.00 0.00 C ATOM 2191 NH1 ARG A 836 53.702 -23.351 -7.426 1.00 0.00 N ATOM 2192 NH2 ARG A 836 53.000 -23.461 -5.237 1.00 0.00 N ATOM 0 H ARG A 836 47.379 -21.084 -8.909 1.00 0.00 H new ATOM 0 HA ARG A 836 49.020 -18.736 -9.441 1.00 0.00 H new ATOM 0 HB2 ARG A 836 49.416 -21.676 -10.042 1.00 0.00 H new ATOM 0 HB3 ARG A 836 50.610 -20.407 -10.229 1.00 0.00 H new ATOM 0 HG2 ARG A 836 50.562 -20.012 -7.774 1.00 0.00 H new ATOM 0 HG3 ARG A 836 49.387 -21.300 -7.596 1.00 0.00 H new ATOM 0 HD2 ARG A 836 51.032 -22.846 -8.747 1.00 0.00 H new ATOM 0 HD3 ARG A 836 52.210 -21.550 -8.679 1.00 0.00 H new ATOM 0 HE ARG A 836 51.071 -22.102 -6.055 1.00 0.00 H new ATOM 0 HH11 ARG A 836 53.556 -23.043 -8.387 1.00 0.00 H new ATOM 0 HH12 ARG A 836 54.539 -23.879 -7.181 1.00 0.00 H new ATOM 0 HH21 ARG A 836 52.313 -23.237 -4.517 1.00 0.00 H new ATOM 0 HH22 ARG A 836 53.838 -23.989 -4.995 1.00 0.00 H new ATOM 2206 N PRO A 837 48.712 -18.674 -11.999 1.00 0.00 N ATOM 2207 CA PRO A 837 48.370 -18.564 -13.402 1.00 0.00 C ATOM 2208 C PRO A 837 49.072 -19.635 -14.215 1.00 0.00 C ATOM 2209 O PRO A 837 50.219 -19.999 -13.918 1.00 0.00 O ATOM 2210 CB PRO A 837 48.894 -17.179 -13.799 1.00 0.00 C ATOM 2211 CG PRO A 837 49.989 -16.880 -12.833 1.00 0.00 C ATOM 2212 CD PRO A 837 49.648 -17.612 -11.563 1.00 0.00 C ATOM 0 HA PRO A 837 47.302 -18.689 -13.580 1.00 0.00 H new ATOM 0 HB2 PRO A 837 49.263 -17.177 -14.825 1.00 0.00 H new ATOM 0 HB3 PRO A 837 48.105 -16.429 -13.743 1.00 0.00 H new ATOM 0 HG2 PRO A 837 50.952 -17.209 -13.224 1.00 0.00 H new ATOM 0 HG3 PRO A 837 50.067 -15.808 -12.654 1.00 0.00 H new ATOM 0 HD2 PRO A 837 50.538 -18.032 -11.094 1.00 0.00 H new ATOM 0 HD3 PRO A 837 49.186 -16.948 -10.832 1.00 0.00 H new ATOM 2220 N CYS A 838 48.416 -20.161 -15.205 1.00 0.00 N ATOM 2221 CA CYS A 838 49.063 -21.098 -16.043 1.00 0.00 C ATOM 2222 C CYS A 838 49.434 -20.456 -17.379 1.00 0.00 C ATOM 2223 O CYS A 838 49.239 -19.249 -17.557 1.00 0.00 O ATOM 2224 CB CYS A 838 48.304 -22.414 -16.176 1.00 0.00 C ATOM 2225 SG CYS A 838 48.409 -23.438 -14.666 1.00 0.00 S ATOM 0 H CYS A 838 47.446 -19.955 -15.443 1.00 0.00 H new ATOM 0 HA CYS A 838 49.997 -21.386 -15.560 1.00 0.00 H new ATOM 0 HB2 CYS A 838 47.257 -22.205 -16.398 1.00 0.00 H new ATOM 0 HB3 CYS A 838 48.703 -22.976 -17.021 1.00 0.00 H new ATOM 0 HG CYS A 838 47.211 -23.741 -14.263 1.00 0.00 H new ATOM 2230 N ALA A 839 49.976 -21.213 -18.301 1.00 0.00 N ATOM 2231 CA ALA A 839 50.378 -20.662 -19.588 1.00 0.00 C ATOM 2232 C ALA A 839 49.322 -20.920 -20.645 1.00 0.00 C ATOM 2233 O ALA A 839 49.527 -20.673 -21.844 1.00 0.00 O ATOM 2234 CB ALA A 839 51.700 -21.242 -20.013 1.00 0.00 C ATOM 0 H ALA A 839 50.152 -22.212 -18.192 1.00 0.00 H new ATOM 0 HA ALA A 839 50.487 -19.583 -19.477 1.00 0.00 H new ATOM 0 HB1 ALA A 839 51.989 -20.822 -20.976 1.00 0.00 H new ATOM 0 HB2 ALA A 839 52.459 -21.000 -19.269 1.00 0.00 H new ATOM 0 HB3 ALA A 839 51.611 -22.325 -20.102 1.00 0.00 H new ATOM 2240 N ALA A 840 48.192 -21.404 -20.212 1.00 0.00 N ATOM 2241 CA ALA A 840 47.111 -21.662 -21.109 1.00 0.00 C ATOM 2242 C ALA A 840 46.321 -20.399 -21.349 1.00 0.00 C ATOM 2243 O ALA A 840 45.364 -20.082 -20.627 1.00 0.00 O ATOM 2244 CB ALA A 840 46.229 -22.768 -20.608 1.00 0.00 C ATOM 0 H ALA A 840 47.999 -21.628 -19.236 1.00 0.00 H new ATOM 0 HA ALA A 840 47.530 -21.994 -22.059 1.00 0.00 H new ATOM 0 HB1 ALA A 840 45.418 -22.936 -21.317 1.00 0.00 H new ATOM 0 HB2 ALA A 840 46.815 -23.681 -20.504 1.00 0.00 H new ATOM 0 HB3 ALA A 840 45.813 -22.491 -19.639 1.00 0.00 H new