USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 900 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 805 CYS SG : rot 78:sc= -2.01! USER MOD Set 1.2: A 814 THR OG1 : rot 174:sc= 1.98 USER MOD Set 1.3: A 833 THR OG1 : rot 165:sc= 0.945 USER MOD Set 1.4: A 838 CYS SG : rot -15:sc= -1.12! USER MOD Set 2.1: A 797 CYS SG : rot -107:sc= 0.284 USER MOD Set 2.2: A 818 CYS SG : rot -20:sc= 1.12 USER MOD Set 3.1: A 728 CYS SG : rot -83:sc= -4.45! USER MOD Set 3.2: A 758 THR OG1 : rot -130:sc= 1 USER MOD Set 3.3: A 762 SER OG : rot 52:sc= 0.908 USER MOD Set 4.1: A 721 CYS SG : rot 46:sc= -2.15 USER MOD Set 4.2: A 743 CYS SG : rot -80:sc= 0.668 USER MOD Set 5.1: A 702 CYS SG : rot -53:sc= 0.342 USER MOD Set 5.2: A 713 CYS SG : rot -162:sc= 1.28 USER MOD Single : A 701 LYS NZ :NH3+ -167:sc= -0.0331 (180deg=-0.256) USER MOD Single : A 703 GLN :FLIP amide:sc= -0.154 F(o=-0.72,f=-0.15) USER MOD Single : A 707 LYS NZ :NH3+ -150:sc= 1.14 (180deg=-0.577!) USER MOD Single : A 709 GLN : amide:sc= -0.558 K(o=-0.56,f=-2.3) USER MOD Single : A 710 ASN : amide:sc=-0.00208 X(o=-0.0021,f=-0.44) USER MOD Single : A 711 SER OG : rot 180:sc= 0 USER MOD Single : A 715 CYS SG : rot 180:sc= 0 USER MOD Single : A 716 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 717 MET CE :methyl -162:sc= -0.308 (180deg=-0.492) USER MOD Single : A 719 TYR OH : rot 180:sc= 0 USER MOD Single : A 724 SER OG : rot 44:sc= 0.859 USER MOD Single : A 730 GLN : amide:sc= 0.202 K(o=0.2,f=-0.41) USER MOD Single : A 734 SER OG : rot 120:sc= 0.364 USER MOD Single : A 735 LYS NZ :NH3+ -163:sc= 1.15 (180deg=0.935) USER MOD Single : A 741 THR OG1 : rot 180:sc= 0 USER MOD Single : A 744 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 745 MET CE :methyl 131:sc= -0.0397 (180deg=-2.31) USER MOD Single : A 746 HIS : no HD1:sc= 0.691 K(o=0.69,f=-2.7!) USER MOD Single : A 749 HIS : no HD1:sc= 0.394 K(o=0.39,f=-2.4!) USER MOD Single : A 750 CYS SG : rot -3:sc= -2 USER MOD Single : A 751 GLN : amide:sc= 0.379 K(o=0.38,f=-0.32) USER MOD Single : A 754 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 755 TYR OH : rot 180:sc= 0 USER MOD Single : A 756 THR OG1 : rot 140:sc= 0.477 USER MOD Single : A 763 CYS SG : rot -22:sc= -3.35! USER MOD Single : A 764 THR OG1 : rot 180:sc= 0 USER MOD Single : A 791 CYS SG : rot 35:sc= -0.757 USER MOD Single : A 795 SER OG : rot 180:sc= 0.0489 USER MOD Single : A 803 SER OG : rot 180:sc= 0 USER MOD Single : A 809 ASN : amide:sc= -0.0025 K(o=-0.0025,f=-0.72) USER MOD Single : A 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 813 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 815 MET CE :methyl 176:sc= -1.12 (180deg=-1.16) USER MOD Single : A 816 SER OG : rot 180:sc= 0 USER MOD Single : A 825 CYS SG : rot 139:sc= 1.36 USER MOD Single : A 828 GLN :FLIP amide:sc=-0.00969 F(o=-0.59,f=-0.0097) USER MOD Single : A 829 SER OG : rot 180:sc= 0 USER MOD Single : A 831 SER OG : rot 180:sc= 0 USER MOD Single : A 834 SER OG : rot 180:sc= 0.108 USER MOD ----------------------------------------------------------------- ATOM 174 N LYS A 701 57.132 -3.680 -14.219 1.00 0.00 N ATOM 175 CA LYS A 701 57.291 -5.107 -14.198 1.00 0.00 C ATOM 176 C LYS A 701 57.376 -5.638 -12.784 1.00 0.00 C ATOM 177 O LYS A 701 58.406 -6.160 -12.345 1.00 0.00 O ATOM 178 CB LYS A 701 58.470 -5.617 -15.058 1.00 0.00 C ATOM 179 CG LYS A 701 58.339 -5.357 -16.561 1.00 0.00 C ATOM 180 CD LYS A 701 58.669 -3.924 -16.945 1.00 0.00 C ATOM 181 CE LYS A 701 58.496 -3.692 -18.438 1.00 0.00 C ATOM 182 NZ LYS A 701 59.333 -4.605 -19.251 1.00 0.00 N ATOM 0 HA LYS A 701 56.389 -5.506 -14.662 1.00 0.00 H new ATOM 0 HB2 LYS A 701 59.388 -5.148 -14.703 1.00 0.00 H new ATOM 0 HB3 LYS A 701 58.578 -6.690 -14.899 1.00 0.00 H new ATOM 0 HG2 LYS A 701 59.001 -6.034 -17.101 1.00 0.00 H new ATOM 0 HG3 LYS A 701 57.322 -5.587 -16.877 1.00 0.00 H new ATOM 0 HD2 LYS A 701 58.024 -3.241 -16.393 1.00 0.00 H new ATOM 0 HD3 LYS A 701 59.695 -3.696 -16.657 1.00 0.00 H new ATOM 0 HE2 LYS A 701 57.448 -3.829 -18.705 1.00 0.00 H new ATOM 0 HE3 LYS A 701 58.753 -2.660 -18.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 701 59.354 -4.272 -20.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 701 60.301 -4.620 -18.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 701 58.933 -5.564 -19.218 1.00 0.00 H new ATOM 196 N CYS A 702 56.327 -5.442 -12.065 1.00 0.00 N ATOM 197 CA CYS A 702 56.211 -5.997 -10.759 1.00 0.00 C ATOM 198 C CYS A 702 55.268 -7.134 -10.920 1.00 0.00 C ATOM 199 O CYS A 702 54.340 -7.048 -11.754 1.00 0.00 O ATOM 200 CB CYS A 702 55.601 -4.993 -9.764 1.00 0.00 C ATOM 201 SG CYS A 702 56.208 -3.282 -9.933 1.00 0.00 S ATOM 0 H CYS A 702 55.522 -4.891 -12.365 1.00 0.00 H new ATOM 0 HA CYS A 702 57.188 -6.282 -10.369 1.00 0.00 H new ATOM 0 HB2 CYS A 702 54.518 -4.993 -9.888 1.00 0.00 H new ATOM 0 HB3 CYS A 702 55.806 -5.338 -8.750 1.00 0.00 H new ATOM 0 HG CYS A 702 57.508 -3.277 -9.898 1.00 0.00 H new ATOM 206 N GLN A 703 55.480 -8.200 -10.210 1.00 0.00 N ATOM 207 CA GLN A 703 54.556 -9.286 -10.271 1.00 0.00 C ATOM 208 C GLN A 703 53.297 -8.875 -9.534 1.00 0.00 C ATOM 209 O GLN A 703 53.271 -7.837 -8.871 1.00 0.00 O ATOM 210 CB GLN A 703 55.152 -10.559 -9.705 1.00 0.00 C ATOM 211 CG GLN A 703 56.443 -10.990 -10.398 1.00 0.00 C ATOM 212 CD GLN A 703 56.307 -11.195 -11.906 1.00 0.00 C ATOM 213 OE1 GLN A 703 55.161 -11.658 -12.366 1.00 0.00 O flip ATOM 214 NE2 GLN A 703 57.261 -10.972 -12.648 1.00 0.00 N flip ATOM 0 H GLN A 703 56.277 -8.339 -9.588 1.00 0.00 H new ATOM 0 HA GLN A 703 54.314 -9.507 -11.311 1.00 0.00 H new ATOM 0 HB2 GLN A 703 55.350 -10.417 -8.643 1.00 0.00 H new ATOM 0 HB3 GLN A 703 54.419 -11.362 -9.788 1.00 0.00 H new ATOM 0 HG2 GLN A 703 57.210 -10.238 -10.213 1.00 0.00 H new ATOM 0 HG3 GLN A 703 56.792 -11.919 -9.947 1.00 0.00 H new ATOM 0 HE21 GLN A 703 58.135 -10.614 -12.262 1.00 0.00 H new ATOM 0 HE22 GLN A 703 57.179 -11.145 -13.650 1.00 0.00 H new ATOM 223 N ARG A 704 52.287 -9.665 -9.588 1.00 0.00 N ATOM 224 CA ARG A 704 51.006 -9.217 -9.069 1.00 0.00 C ATOM 225 C ARG A 704 50.917 -9.293 -7.542 1.00 0.00 C ATOM 226 O ARG A 704 49.993 -8.763 -6.927 1.00 0.00 O ATOM 227 CB ARG A 704 49.881 -9.910 -9.801 1.00 0.00 C ATOM 228 CG ARG A 704 49.929 -9.604 -11.278 1.00 0.00 C ATOM 229 CD ARG A 704 48.947 -10.397 -12.079 1.00 0.00 C ATOM 230 NE ARG A 704 48.888 -9.917 -13.475 1.00 0.00 N ATOM 231 CZ ARG A 704 48.149 -10.461 -14.449 1.00 0.00 C ATOM 232 NH1 ARG A 704 47.678 -11.694 -14.327 1.00 0.00 N ATOM 233 NH2 ARG A 704 47.936 -9.795 -15.573 1.00 0.00 N ATOM 0 H ARG A 704 52.299 -10.609 -9.974 1.00 0.00 H new ATOM 0 HA ARG A 704 50.903 -8.151 -9.272 1.00 0.00 H new ATOM 0 HB2 ARG A 704 49.950 -10.987 -9.646 1.00 0.00 H new ATOM 0 HB3 ARG A 704 48.923 -9.590 -9.390 1.00 0.00 H new ATOM 0 HG2 ARG A 704 49.736 -8.542 -11.428 1.00 0.00 H new ATOM 0 HG3 ARG A 704 50.934 -9.801 -11.650 1.00 0.00 H new ATOM 0 HD2 ARG A 704 49.228 -11.450 -12.065 1.00 0.00 H new ATOM 0 HD3 ARG A 704 47.959 -10.324 -11.624 1.00 0.00 H new ATOM 0 HE ARG A 704 49.457 -9.105 -13.716 1.00 0.00 H new ATOM 0 HH11 ARG A 704 47.878 -12.235 -13.486 1.00 0.00 H new ATOM 0 HH12 ARG A 704 47.115 -12.101 -15.074 1.00 0.00 H new ATOM 0 HH21 ARG A 704 48.336 -8.865 -15.698 1.00 0.00 H new ATOM 0 HH22 ARG A 704 47.372 -10.212 -16.314 1.00 0.00 H new ATOM 247 N TRP A 705 51.892 -9.952 -6.946 1.00 0.00 N ATOM 248 CA TRP A 705 52.048 -9.990 -5.500 1.00 0.00 C ATOM 249 C TRP A 705 53.070 -8.916 -5.081 1.00 0.00 C ATOM 250 O TRP A 705 53.456 -8.802 -3.912 1.00 0.00 O ATOM 251 CB TRP A 705 52.493 -11.400 -5.043 1.00 0.00 C ATOM 252 CG TRP A 705 53.748 -11.909 -5.708 1.00 0.00 C ATOM 253 CD1 TRP A 705 55.031 -11.713 -5.301 1.00 0.00 C ATOM 254 CD2 TRP A 705 53.827 -12.705 -6.891 1.00 0.00 C ATOM 255 NE1 TRP A 705 55.898 -12.319 -6.169 1.00 0.00 N ATOM 256 CE2 TRP A 705 55.183 -12.934 -7.153 1.00 0.00 C ATOM 257 CE3 TRP A 705 52.885 -13.235 -7.758 1.00 0.00 C ATOM 258 CZ2 TRP A 705 55.610 -13.677 -8.249 1.00 0.00 C ATOM 259 CZ3 TRP A 705 53.306 -13.967 -8.835 1.00 0.00 C ATOM 260 CH2 TRP A 705 54.656 -14.181 -9.079 1.00 0.00 C ATOM 0 H TRP A 705 52.603 -10.480 -7.452 1.00 0.00 H new ATOM 0 HA TRP A 705 51.094 -9.778 -5.018 1.00 0.00 H new ATOM 0 HB2 TRP A 705 52.649 -11.385 -3.964 1.00 0.00 H new ATOM 0 HB3 TRP A 705 51.683 -12.103 -5.238 1.00 0.00 H new ATOM 0 HD1 TRP A 705 55.323 -11.160 -4.421 1.00 0.00 H new ATOM 0 HE1 TRP A 705 56.915 -12.312 -6.092 1.00 0.00 H new ATOM 0 HE3 TRP A 705 51.831 -13.072 -7.586 1.00 0.00 H new ATOM 0 HZ2 TRP A 705 56.660 -13.848 -8.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 705 52.573 -14.387 -9.509 1.00 0.00 H new ATOM 0 HH2 TRP A 705 54.954 -14.757 -9.942 1.00 0.00 H new ATOM 271 N GLU A 706 53.486 -8.124 -6.051 1.00 0.00 N ATOM 272 CA GLU A 706 54.456 -7.088 -5.843 1.00 0.00 C ATOM 273 C GLU A 706 53.850 -5.731 -6.077 1.00 0.00 C ATOM 274 O GLU A 706 52.761 -5.609 -6.634 1.00 0.00 O ATOM 275 CB GLU A 706 55.672 -7.266 -6.747 1.00 0.00 C ATOM 276 CG GLU A 706 56.442 -8.539 -6.522 1.00 0.00 C ATOM 277 CD GLU A 706 57.695 -8.581 -7.340 1.00 0.00 C ATOM 278 OE1 GLU A 706 57.637 -8.336 -8.557 1.00 0.00 O ATOM 279 OE2 GLU A 706 58.767 -8.903 -6.790 1.00 0.00 O ATOM 0 H GLU A 706 53.151 -8.190 -7.012 1.00 0.00 H new ATOM 0 HA GLU A 706 54.783 -7.161 -4.806 1.00 0.00 H new ATOM 0 HB2 GLU A 706 55.343 -7.235 -7.786 1.00 0.00 H new ATOM 0 HB3 GLU A 706 56.344 -6.420 -6.600 1.00 0.00 H new ATOM 0 HG2 GLU A 706 56.694 -8.630 -5.465 1.00 0.00 H new ATOM 0 HG3 GLU A 706 55.814 -9.393 -6.774 1.00 0.00 H new ATOM 286 N LYS A 707 54.551 -4.728 -5.646 1.00 0.00 N ATOM 287 CA LYS A 707 54.145 -3.364 -5.803 1.00 0.00 C ATOM 288 C LYS A 707 55.371 -2.516 -6.072 1.00 0.00 C ATOM 289 O LYS A 707 56.490 -2.876 -5.656 1.00 0.00 O ATOM 290 CB LYS A 707 53.392 -2.867 -4.553 1.00 0.00 C ATOM 291 CG LYS A 707 54.187 -2.955 -3.257 1.00 0.00 C ATOM 292 CD LYS A 707 53.364 -2.491 -2.072 1.00 0.00 C ATOM 293 CE LYS A 707 54.162 -2.553 -0.781 1.00 0.00 C ATOM 294 NZ LYS A 707 53.352 -2.148 0.373 1.00 0.00 N ATOM 0 H LYS A 707 55.443 -4.837 -5.164 1.00 0.00 H new ATOM 0 HA LYS A 707 53.459 -3.284 -6.646 1.00 0.00 H new ATOM 0 HB2 LYS A 707 53.095 -1.830 -4.712 1.00 0.00 H new ATOM 0 HB3 LYS A 707 52.476 -3.447 -4.442 1.00 0.00 H new ATOM 0 HG2 LYS A 707 54.512 -3.983 -3.096 1.00 0.00 H new ATOM 0 HG3 LYS A 707 55.087 -2.345 -3.338 1.00 0.00 H new ATOM 0 HD2 LYS A 707 53.024 -1.470 -2.242 1.00 0.00 H new ATOM 0 HD3 LYS A 707 52.473 -3.113 -1.981 1.00 0.00 H new ATOM 0 HE2 LYS A 707 54.532 -3.567 -0.629 1.00 0.00 H new ATOM 0 HE3 LYS A 707 55.034 -1.904 -0.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 707 53.966 -1.717 1.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 707 52.636 -1.457 0.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 707 52.879 -2.982 0.775 1.00 0.00 H new ATOM 308 N LEU A 708 55.177 -1.432 -6.764 1.00 0.00 N ATOM 309 CA LEU A 708 56.251 -0.541 -7.104 1.00 0.00 C ATOM 310 C LEU A 708 56.309 0.582 -6.089 1.00 0.00 C ATOM 311 O LEU A 708 55.339 1.323 -5.922 1.00 0.00 O ATOM 312 CB LEU A 708 56.023 0.055 -8.504 1.00 0.00 C ATOM 313 CG LEU A 708 57.137 0.958 -9.054 1.00 0.00 C ATOM 314 CD1 LEU A 708 58.391 0.158 -9.356 1.00 0.00 C ATOM 315 CD2 LEU A 708 56.667 1.714 -10.287 1.00 0.00 C ATOM 0 H LEU A 708 54.264 -1.138 -7.111 1.00 0.00 H new ATOM 0 HA LEU A 708 57.189 -1.097 -7.101 1.00 0.00 H new ATOM 0 HB2 LEU A 708 55.873 -0.767 -9.204 1.00 0.00 H new ATOM 0 HB3 LEU A 708 55.097 0.630 -8.484 1.00 0.00 H new ATOM 0 HG LEU A 708 57.383 1.689 -8.283 1.00 0.00 H new ATOM 0 HD11 LEU A 708 59.162 0.823 -9.744 1.00 0.00 H new ATOM 0 HD12 LEU A 708 58.748 -0.318 -8.443 1.00 0.00 H new ATOM 0 HD13 LEU A 708 58.165 -0.607 -10.099 1.00 0.00 H new ATOM 0 HD21 LEU A 708 57.475 2.346 -10.656 1.00 0.00 H new ATOM 0 HD22 LEU A 708 56.379 1.003 -11.062 1.00 0.00 H new ATOM 0 HD23 LEU A 708 55.810 2.335 -10.028 1.00 0.00 H new ATOM 327 N GLN A 709 57.399 0.669 -5.382 1.00 0.00 N ATOM 328 CA GLN A 709 57.638 1.763 -4.468 1.00 0.00 C ATOM 329 C GLN A 709 59.111 1.980 -4.461 1.00 0.00 C ATOM 330 O GLN A 709 59.855 1.022 -4.672 1.00 0.00 O ATOM 331 CB GLN A 709 57.121 1.472 -3.041 1.00 0.00 C ATOM 332 CG GLN A 709 57.972 0.512 -2.220 1.00 0.00 C ATOM 333 CD GLN A 709 57.328 0.176 -0.890 1.00 0.00 C ATOM 334 OE1 GLN A 709 56.100 0.160 -0.762 1.00 0.00 O ATOM 335 NE2 GLN A 709 58.127 -0.091 0.096 1.00 0.00 N ATOM 0 H GLN A 709 58.153 -0.016 -5.419 1.00 0.00 H new ATOM 0 HA GLN A 709 57.095 2.650 -4.796 1.00 0.00 H new ATOM 0 HB2 GLN A 709 57.045 2.416 -2.501 1.00 0.00 H new ATOM 0 HB3 GLN A 709 56.113 1.065 -3.114 1.00 0.00 H new ATOM 0 HG2 GLN A 709 58.133 -0.405 -2.787 1.00 0.00 H new ATOM 0 HG3 GLN A 709 58.953 0.955 -2.046 1.00 0.00 H new ATOM 0 HE21 GLN A 709 59.137 -0.068 -0.045 1.00 0.00 H new ATOM 0 HE22 GLN A 709 57.746 -0.324 1.013 1.00 0.00 H new ATOM 344 N ASN A 710 59.545 3.224 -4.328 1.00 0.00 N ATOM 345 CA ASN A 710 60.984 3.562 -4.285 1.00 0.00 C ATOM 346 C ASN A 710 61.617 3.206 -5.641 1.00 0.00 C ATOM 347 O ASN A 710 62.830 3.017 -5.764 1.00 0.00 O ATOM 348 CB ASN A 710 61.664 2.789 -3.120 1.00 0.00 C ATOM 349 CG ASN A 710 63.003 3.353 -2.695 1.00 0.00 C ATOM 350 OD1 ASN A 710 64.068 2.981 -3.206 1.00 0.00 O ATOM 351 ND2 ASN A 710 62.955 4.197 -1.714 1.00 0.00 N ATOM 0 H ASN A 710 58.926 4.031 -4.246 1.00 0.00 H new ATOM 0 HA ASN A 710 61.122 4.628 -4.105 1.00 0.00 H new ATOM 0 HB2 ASN A 710 60.994 2.788 -2.260 1.00 0.00 H new ATOM 0 HB3 ASN A 710 61.799 1.750 -3.419 1.00 0.00 H new ATOM 0 HD21 ASN A 710 63.818 4.584 -1.331 1.00 0.00 H new ATOM 0 HD22 ASN A 710 62.054 4.475 -1.324 1.00 0.00 H new ATOM 358 N SER A 711 60.742 3.121 -6.662 1.00 0.00 N ATOM 359 CA SER A 711 61.091 2.766 -8.030 1.00 0.00 C ATOM 360 C SER A 711 61.640 1.329 -8.148 1.00 0.00 C ATOM 361 O SER A 711 62.227 0.946 -9.166 1.00 0.00 O ATOM 362 CB SER A 711 62.035 3.810 -8.607 1.00 0.00 C ATOM 363 OG SER A 711 61.408 5.084 -8.558 1.00 0.00 O ATOM 0 H SER A 711 59.746 3.305 -6.542 1.00 0.00 H new ATOM 0 HA SER A 711 60.180 2.768 -8.628 1.00 0.00 H new ATOM 0 HB2 SER A 711 62.967 3.828 -8.041 1.00 0.00 H new ATOM 0 HB3 SER A 711 62.292 3.557 -9.636 1.00 0.00 H new ATOM 0 HG SER A 711 62.013 5.761 -8.927 1.00 0.00 H new ATOM 369 N ARG A 712 61.387 0.530 -7.134 1.00 0.00 N ATOM 370 CA ARG A 712 61.803 -0.849 -7.115 1.00 0.00 C ATOM 371 C ARG A 712 60.572 -1.714 -6.912 1.00 0.00 C ATOM 372 O ARG A 712 59.523 -1.221 -6.467 1.00 0.00 O ATOM 373 CB ARG A 712 62.823 -1.106 -5.995 1.00 0.00 C ATOM 374 CG ARG A 712 62.270 -0.911 -4.595 1.00 0.00 C ATOM 375 CD ARG A 712 63.296 -1.223 -3.531 1.00 0.00 C ATOM 376 NE ARG A 712 64.410 -0.267 -3.536 1.00 0.00 N ATOM 377 CZ ARG A 712 65.547 -0.411 -2.833 1.00 0.00 C ATOM 378 NH1 ARG A 712 65.725 -1.462 -2.036 1.00 0.00 N ATOM 379 NH2 ARG A 712 66.493 0.513 -2.912 1.00 0.00 N ATOM 0 H ARG A 712 60.884 0.824 -6.297 1.00 0.00 H new ATOM 0 HA ARG A 712 62.288 -1.094 -8.060 1.00 0.00 H new ATOM 0 HB2 ARG A 712 63.198 -2.125 -6.087 1.00 0.00 H new ATOM 0 HB3 ARG A 712 63.674 -0.439 -6.134 1.00 0.00 H new ATOM 0 HG2 ARG A 712 61.930 0.118 -4.480 1.00 0.00 H new ATOM 0 HG3 ARG A 712 61.399 -1.552 -4.457 1.00 0.00 H new ATOM 0 HD2 ARG A 712 62.816 -1.214 -2.552 1.00 0.00 H new ATOM 0 HD3 ARG A 712 63.683 -2.230 -3.686 1.00 0.00 H new ATOM 0 HE ARG A 712 64.315 0.567 -4.115 1.00 0.00 H new ATOM 0 HH11 ARG A 712 64.994 -2.169 -1.954 1.00 0.00 H new ATOM 0 HH12 ARG A 712 66.592 -1.560 -1.508 1.00 0.00 H new ATOM 0 HH21 ARG A 712 66.358 1.332 -3.505 1.00 0.00 H new ATOM 0 HH22 ARG A 712 67.356 0.406 -2.380 1.00 0.00 H new ATOM 393 N CYS A 713 60.684 -2.959 -7.221 1.00 0.00 N ATOM 394 CA CYS A 713 59.577 -3.855 -7.081 1.00 0.00 C ATOM 395 C CYS A 713 59.743 -4.642 -5.793 1.00 0.00 C ATOM 396 O CYS A 713 60.705 -5.401 -5.630 1.00 0.00 O ATOM 397 CB CYS A 713 59.534 -4.794 -8.283 1.00 0.00 C ATOM 398 SG CYS A 713 59.511 -3.936 -9.894 1.00 0.00 S ATOM 0 H CYS A 713 61.538 -3.388 -7.576 1.00 0.00 H new ATOM 0 HA CYS A 713 58.640 -3.299 -7.040 1.00 0.00 H new ATOM 0 HB2 CYS A 713 60.401 -5.454 -8.247 1.00 0.00 H new ATOM 0 HB3 CYS A 713 58.649 -5.425 -8.206 1.00 0.00 H new ATOM 0 HG CYS A 713 59.102 -4.756 -10.816 1.00 0.00 H new ATOM 403 N VAL A 714 58.838 -4.447 -4.877 1.00 0.00 N ATOM 404 CA VAL A 714 58.873 -5.138 -3.602 1.00 0.00 C ATOM 405 C VAL A 714 57.630 -5.969 -3.476 1.00 0.00 C ATOM 406 O VAL A 714 56.691 -5.773 -4.233 1.00 0.00 O ATOM 407 CB VAL A 714 58.965 -4.153 -2.389 1.00 0.00 C ATOM 408 CG1 VAL A 714 60.259 -3.364 -2.424 1.00 0.00 C ATOM 409 CG2 VAL A 714 57.772 -3.201 -2.354 1.00 0.00 C ATOM 0 H VAL A 714 58.052 -3.806 -4.985 1.00 0.00 H new ATOM 0 HA VAL A 714 59.768 -5.760 -3.579 1.00 0.00 H new ATOM 0 HB VAL A 714 58.949 -4.756 -1.481 1.00 0.00 H new ATOM 0 HG11 VAL A 714 60.296 -2.688 -1.570 1.00 0.00 H new ATOM 0 HG12 VAL A 714 61.105 -4.050 -2.381 1.00 0.00 H new ATOM 0 HG13 VAL A 714 60.308 -2.786 -3.347 1.00 0.00 H new ATOM 0 HG21 VAL A 714 57.867 -2.530 -1.500 1.00 0.00 H new ATOM 0 HG22 VAL A 714 57.746 -2.616 -3.273 1.00 0.00 H new ATOM 0 HG23 VAL A 714 56.850 -3.776 -2.264 1.00 0.00 H new ATOM 419 N CYS A 715 57.586 -6.841 -2.522 1.00 0.00 N ATOM 420 CA CYS A 715 56.431 -7.676 -2.338 1.00 0.00 C ATOM 421 C CYS A 715 55.493 -6.928 -1.438 1.00 0.00 C ATOM 422 O CYS A 715 55.942 -6.187 -0.547 1.00 0.00 O ATOM 423 CB CYS A 715 56.827 -9.019 -1.700 1.00 0.00 C ATOM 424 SG CYS A 715 58.109 -9.934 -2.628 1.00 0.00 S ATOM 0 H CYS A 715 58.338 -6.998 -1.851 1.00 0.00 H new ATOM 0 HA CYS A 715 55.961 -7.899 -3.296 1.00 0.00 H new ATOM 0 HB2 CYS A 715 57.187 -8.836 -0.687 1.00 0.00 H new ATOM 0 HB3 CYS A 715 55.939 -9.645 -1.615 1.00 0.00 H new ATOM 0 HG CYS A 715 58.377 -11.048 -2.014 1.00 0.00 H new ATOM 429 N LYS A 716 54.220 -7.044 -1.684 1.00 0.00 N ATOM 430 CA LYS A 716 53.270 -6.330 -0.886 1.00 0.00 C ATOM 431 C LYS A 716 53.025 -7.057 0.419 1.00 0.00 C ATOM 432 O LYS A 716 53.665 -8.071 0.714 1.00 0.00 O ATOM 433 CB LYS A 716 51.965 -6.070 -1.646 1.00 0.00 C ATOM 434 CG LYS A 716 51.215 -7.317 -2.061 1.00 0.00 C ATOM 435 CD LYS A 716 49.927 -6.996 -2.803 1.00 0.00 C ATOM 436 CE LYS A 716 50.206 -6.218 -4.070 1.00 0.00 C ATOM 437 NZ LYS A 716 48.971 -5.922 -4.817 1.00 0.00 N ATOM 0 H LYS A 716 53.820 -7.621 -2.424 1.00 0.00 H new ATOM 0 HA LYS A 716 53.693 -5.352 -0.655 1.00 0.00 H new ATOM 0 HB2 LYS A 716 51.312 -5.461 -1.021 1.00 0.00 H new ATOM 0 HB3 LYS A 716 52.190 -5.484 -2.537 1.00 0.00 H new ATOM 0 HG2 LYS A 716 51.855 -7.929 -2.697 1.00 0.00 H new ATOM 0 HG3 LYS A 716 50.984 -7.911 -1.176 1.00 0.00 H new ATOM 0 HD2 LYS A 716 49.405 -7.921 -3.048 1.00 0.00 H new ATOM 0 HD3 LYS A 716 49.266 -6.419 -2.157 1.00 0.00 H new ATOM 0 HE2 LYS A 716 50.711 -5.285 -3.819 1.00 0.00 H new ATOM 0 HE3 LYS A 716 50.886 -6.788 -4.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 716 49.206 -5.388 -5.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 716 48.502 -6.812 -5.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 716 48.333 -5.356 -4.222 1.00 0.00 H new ATOM 451 N MET A 717 52.147 -6.529 1.193 1.00 0.00 N ATOM 452 CA MET A 717 51.820 -7.092 2.468 1.00 0.00 C ATOM 453 C MET A 717 50.465 -7.784 2.381 1.00 0.00 C ATOM 454 O MET A 717 49.593 -7.331 1.642 1.00 0.00 O ATOM 455 CB MET A 717 51.805 -5.990 3.521 1.00 0.00 C ATOM 456 CG MET A 717 53.138 -5.262 3.688 1.00 0.00 C ATOM 457 SD MET A 717 54.478 -6.344 4.248 1.00 0.00 S ATOM 458 CE MET A 717 53.920 -6.780 5.899 1.00 0.00 C ATOM 0 H MET A 717 51.625 -5.684 0.963 1.00 0.00 H new ATOM 0 HA MET A 717 52.568 -7.831 2.755 1.00 0.00 H new ATOM 0 HB2 MET A 717 51.037 -5.262 3.258 1.00 0.00 H new ATOM 0 HB3 MET A 717 51.518 -6.423 4.479 1.00 0.00 H new ATOM 0 HG2 MET A 717 53.419 -4.809 2.737 1.00 0.00 H new ATOM 0 HG3 MET A 717 53.013 -4.449 4.403 1.00 0.00 H new ATOM 0 HE1 MET A 717 54.760 -7.164 6.477 1.00 0.00 H new ATOM 0 HE2 MET A 717 53.515 -5.896 6.391 1.00 0.00 H new ATOM 0 HE3 MET A 717 53.146 -7.545 5.831 1.00 0.00 H new ATOM 468 N PRO A 718 50.242 -8.873 3.157 1.00 0.00 N ATOM 469 CA PRO A 718 48.999 -9.678 3.081 1.00 0.00 C ATOM 470 C PRO A 718 47.727 -8.925 3.505 1.00 0.00 C ATOM 471 O PRO A 718 46.619 -9.426 3.346 1.00 0.00 O ATOM 472 CB PRO A 718 49.271 -10.858 4.024 1.00 0.00 C ATOM 473 CG PRO A 718 50.324 -10.365 4.954 1.00 0.00 C ATOM 474 CD PRO A 718 51.185 -9.434 4.149 1.00 0.00 C ATOM 0 HA PRO A 718 48.793 -9.967 2.050 1.00 0.00 H new ATOM 0 HB2 PRO A 718 48.370 -11.149 4.564 1.00 0.00 H new ATOM 0 HB3 PRO A 718 49.609 -11.735 3.473 1.00 0.00 H new ATOM 0 HG2 PRO A 718 49.881 -9.849 5.806 1.00 0.00 H new ATOM 0 HG3 PRO A 718 50.911 -11.192 5.353 1.00 0.00 H new ATOM 0 HD2 PRO A 718 51.626 -8.655 4.771 1.00 0.00 H new ATOM 0 HD3 PRO A 718 52.008 -9.962 3.668 1.00 0.00 H new ATOM 482 N TYR A 719 47.887 -7.726 4.017 1.00 0.00 N ATOM 483 CA TYR A 719 46.748 -6.935 4.433 1.00 0.00 C ATOM 484 C TYR A 719 46.437 -5.873 3.393 1.00 0.00 C ATOM 485 O TYR A 719 45.524 -5.070 3.553 1.00 0.00 O ATOM 486 CB TYR A 719 46.952 -6.328 5.830 1.00 0.00 C ATOM 487 CG TYR A 719 48.117 -5.372 5.964 1.00 0.00 C ATOM 488 CD1 TYR A 719 47.923 -3.998 5.892 1.00 0.00 C ATOM 489 CD2 TYR A 719 49.401 -5.838 6.185 1.00 0.00 C ATOM 490 CE1 TYR A 719 48.974 -3.122 6.039 1.00 0.00 C ATOM 491 CE2 TYR A 719 50.456 -4.965 6.330 1.00 0.00 C ATOM 492 CZ TYR A 719 50.240 -3.611 6.258 1.00 0.00 C ATOM 493 OH TYR A 719 51.301 -2.743 6.413 1.00 0.00 O ATOM 0 H TYR A 719 48.792 -7.277 4.156 1.00 0.00 H new ATOM 0 HA TYR A 719 45.885 -7.597 4.509 1.00 0.00 H new ATOM 0 HB2 TYR A 719 46.040 -5.803 6.115 1.00 0.00 H new ATOM 0 HB3 TYR A 719 47.088 -7.141 6.543 1.00 0.00 H new ATOM 0 HD1 TYR A 719 46.930 -3.611 5.718 1.00 0.00 H new ATOM 0 HD2 TYR A 719 49.578 -6.902 6.245 1.00 0.00 H new ATOM 0 HE1 TYR A 719 48.805 -2.057 5.983 1.00 0.00 H new ATOM 0 HE2 TYR A 719 51.452 -5.345 6.500 1.00 0.00 H new ATOM 0 HH TYR A 719 52.124 -3.255 6.561 1.00 0.00 H new ATOM 503 N GLU A 720 47.211 -5.877 2.327 1.00 0.00 N ATOM 504 CA GLU A 720 46.971 -5.000 1.198 1.00 0.00 C ATOM 505 C GLU A 720 46.128 -5.757 0.184 1.00 0.00 C ATOM 506 O GLU A 720 45.658 -5.206 -0.819 1.00 0.00 O ATOM 507 CB GLU A 720 48.291 -4.554 0.567 1.00 0.00 C ATOM 508 CG GLU A 720 49.145 -3.669 1.463 1.00 0.00 C ATOM 509 CD GLU A 720 50.429 -3.233 0.794 1.00 0.00 C ATOM 510 OE1 GLU A 720 50.473 -2.137 0.203 1.00 0.00 O ATOM 511 OE2 GLU A 720 51.422 -3.968 0.855 1.00 0.00 O ATOM 0 H GLU A 720 48.022 -6.486 2.218 1.00 0.00 H new ATOM 0 HA GLU A 720 46.447 -4.104 1.530 1.00 0.00 H new ATOM 0 HB2 GLU A 720 48.867 -5.438 0.294 1.00 0.00 H new ATOM 0 HB3 GLU A 720 48.076 -4.016 -0.356 1.00 0.00 H new ATOM 0 HG2 GLU A 720 48.572 -2.788 1.750 1.00 0.00 H new ATOM 0 HG3 GLU A 720 49.382 -4.208 2.380 1.00 0.00 H new ATOM 518 N CYS A 721 45.938 -7.023 0.477 1.00 0.00 N ATOM 519 CA CYS A 721 45.170 -7.918 -0.337 1.00 0.00 C ATOM 520 C CYS A 721 43.693 -7.613 -0.165 1.00 0.00 C ATOM 521 O CYS A 721 43.163 -7.648 0.951 1.00 0.00 O ATOM 522 CB CYS A 721 45.465 -9.357 0.077 1.00 0.00 C ATOM 523 SG CYS A 721 47.238 -9.787 0.023 1.00 0.00 S ATOM 0 H CYS A 721 46.326 -7.464 1.311 1.00 0.00 H new ATOM 0 HA CYS A 721 45.438 -7.789 -1.386 1.00 0.00 H new ATOM 0 HB2 CYS A 721 45.092 -9.519 1.088 1.00 0.00 H new ATOM 0 HB3 CYS A 721 44.916 -10.034 -0.578 1.00 0.00 H new ATOM 0 HG CYS A 721 47.931 -8.841 0.583 1.00 0.00 H new ATOM 528 N GLY A 722 43.056 -7.280 -1.248 1.00 0.00 N ATOM 529 CA GLY A 722 41.651 -6.959 -1.233 1.00 0.00 C ATOM 530 C GLY A 722 40.948 -7.567 -2.426 1.00 0.00 C ATOM 531 O GLY A 722 40.073 -8.415 -2.260 1.00 0.00 O ATOM 0 H GLY A 722 43.491 -7.222 -2.169 1.00 0.00 H new ATOM 0 HA2 GLY A 722 41.199 -7.328 -0.312 1.00 0.00 H new ATOM 0 HA3 GLY A 722 41.521 -5.877 -1.241 1.00 0.00 H new ATOM 535 N PRO A 723 41.298 -7.168 -3.654 1.00 0.00 N ATOM 536 CA PRO A 723 40.724 -7.762 -4.847 1.00 0.00 C ATOM 537 C PRO A 723 41.354 -9.136 -5.112 1.00 0.00 C ATOM 538 O PRO A 723 42.549 -9.214 -5.381 1.00 0.00 O ATOM 539 CB PRO A 723 41.092 -6.764 -5.969 1.00 0.00 C ATOM 540 CG PRO A 723 41.675 -5.576 -5.274 1.00 0.00 C ATOM 541 CD PRO A 723 42.246 -6.097 -4.001 1.00 0.00 C ATOM 0 HA PRO A 723 39.649 -7.926 -4.769 1.00 0.00 H new ATOM 0 HB2 PRO A 723 41.808 -7.202 -6.664 1.00 0.00 H new ATOM 0 HB3 PRO A 723 40.213 -6.486 -6.550 1.00 0.00 H new ATOM 0 HG2 PRO A 723 42.445 -5.103 -5.884 1.00 0.00 H new ATOM 0 HG3 PRO A 723 40.913 -4.821 -5.082 1.00 0.00 H new ATOM 0 HD2 PRO A 723 43.259 -6.477 -4.134 1.00 0.00 H new ATOM 0 HD3 PRO A 723 42.292 -5.328 -3.230 1.00 0.00 H new ATOM 549 N SER A 724 40.562 -10.215 -4.965 1.00 0.00 N ATOM 550 CA SER A 724 41.085 -11.554 -5.111 1.00 0.00 C ATOM 551 C SER A 724 39.964 -12.592 -5.095 1.00 0.00 C ATOM 552 O SER A 724 38.852 -12.306 -4.632 1.00 0.00 O ATOM 553 CB SER A 724 42.018 -11.800 -3.942 1.00 0.00 C ATOM 554 OG SER A 724 42.874 -12.846 -4.236 1.00 0.00 O ATOM 0 H SER A 724 39.567 -10.169 -4.747 1.00 0.00 H new ATOM 0 HA SER A 724 41.604 -11.646 -6.065 1.00 0.00 H new ATOM 0 HB2 SER A 724 42.592 -10.898 -3.727 1.00 0.00 H new ATOM 0 HB3 SER A 724 41.441 -12.031 -3.047 1.00 0.00 H new ATOM 0 HG SER A 724 43.212 -12.745 -5.150 1.00 0.00 H new ATOM 560 N LEU A 725 40.251 -13.774 -5.647 1.00 0.00 N ATOM 561 CA LEU A 725 39.360 -14.915 -5.563 1.00 0.00 C ATOM 562 C LEU A 725 39.504 -15.615 -4.245 1.00 0.00 C ATOM 563 O LEU A 725 40.633 -15.900 -3.804 1.00 0.00 O ATOM 564 CB LEU A 725 39.625 -15.958 -6.626 1.00 0.00 C ATOM 565 CG LEU A 725 38.908 -15.789 -7.941 1.00 0.00 C ATOM 566 CD1 LEU A 725 37.473 -15.437 -7.798 1.00 0.00 C ATOM 567 CD2 LEU A 725 39.619 -14.931 -8.903 1.00 0.00 C ATOM 0 H LEU A 725 41.111 -13.958 -6.164 1.00 0.00 H new ATOM 0 HA LEU A 725 38.362 -14.498 -5.696 1.00 0.00 H new ATOM 0 HB2 LEU A 725 40.697 -15.976 -6.824 1.00 0.00 H new ATOM 0 HB3 LEU A 725 39.360 -16.933 -6.218 1.00 0.00 H new ATOM 0 HG LEU A 725 38.919 -16.785 -8.384 1.00 0.00 H new ATOM 0 HD11 LEU A 725 37.024 -15.332 -8.786 1.00 0.00 H new ATOM 0 HD12 LEU A 725 36.958 -16.224 -7.247 1.00 0.00 H new ATOM 0 HD13 LEU A 725 37.382 -14.496 -7.256 1.00 0.00 H new ATOM 0 HD21 LEU A 725 39.040 -14.859 -9.823 1.00 0.00 H new ATOM 0 HD22 LEU A 725 39.749 -13.936 -8.477 1.00 0.00 H new ATOM 0 HD23 LEU A 725 40.596 -15.362 -9.122 1.00 0.00 H new ATOM 579 N ASP A 726 38.392 -15.893 -3.625 1.00 0.00 N ATOM 580 CA ASP A 726 38.350 -16.632 -2.370 1.00 0.00 C ATOM 581 C ASP A 726 38.635 -18.091 -2.675 1.00 0.00 C ATOM 582 O ASP A 726 37.968 -18.687 -3.537 1.00 0.00 O ATOM 583 CB ASP A 726 36.955 -16.534 -1.741 1.00 0.00 C ATOM 584 CG ASP A 726 36.419 -15.128 -1.659 1.00 0.00 C ATOM 585 OD1 ASP A 726 36.573 -14.478 -0.620 1.00 0.00 O ATOM 586 OD2 ASP A 726 35.812 -14.655 -2.659 1.00 0.00 O ATOM 0 H ASP A 726 37.473 -15.615 -3.971 1.00 0.00 H new ATOM 0 HA ASP A 726 39.084 -16.218 -1.679 1.00 0.00 H new ATOM 0 HB2 ASP A 726 36.262 -17.143 -2.321 1.00 0.00 H new ATOM 0 HB3 ASP A 726 36.989 -16.958 -0.738 1.00 0.00 H new ATOM 591 N VAL A 727 39.611 -18.666 -2.012 1.00 0.00 N ATOM 592 CA VAL A 727 40.008 -20.054 -2.249 1.00 0.00 C ATOM 593 C VAL A 727 40.233 -20.807 -0.935 1.00 0.00 C ATOM 594 O VAL A 727 40.237 -20.211 0.148 1.00 0.00 O ATOM 595 CB VAL A 727 41.296 -20.160 -3.124 1.00 0.00 C ATOM 596 CG1 VAL A 727 41.054 -19.611 -4.524 1.00 0.00 C ATOM 597 CG2 VAL A 727 42.472 -19.438 -2.460 1.00 0.00 C ATOM 0 H VAL A 727 40.158 -18.194 -1.292 1.00 0.00 H new ATOM 0 HA VAL A 727 39.181 -20.513 -2.791 1.00 0.00 H new ATOM 0 HB VAL A 727 41.550 -21.216 -3.212 1.00 0.00 H new ATOM 0 HG11 VAL A 727 41.968 -19.697 -5.112 1.00 0.00 H new ATOM 0 HG12 VAL A 727 40.258 -20.179 -5.005 1.00 0.00 H new ATOM 0 HG13 VAL A 727 40.763 -18.563 -4.458 1.00 0.00 H new ATOM 0 HG21 VAL A 727 43.357 -19.527 -3.090 1.00 0.00 H new ATOM 0 HG22 VAL A 727 42.225 -18.385 -2.329 1.00 0.00 H new ATOM 0 HG23 VAL A 727 42.673 -19.888 -1.488 1.00 0.00 H new ATOM 607 N CYS A 728 40.424 -22.103 -1.037 1.00 0.00 N ATOM 608 CA CYS A 728 40.667 -22.942 0.120 1.00 0.00 C ATOM 609 C CYS A 728 42.119 -23.334 0.144 1.00 0.00 C ATOM 610 O CYS A 728 42.681 -23.720 -0.897 1.00 0.00 O ATOM 611 CB CYS A 728 39.810 -24.204 0.062 1.00 0.00 C ATOM 612 SG CYS A 728 39.942 -25.236 1.504 1.00 0.00 S ATOM 0 H CYS A 728 40.416 -22.607 -1.924 1.00 0.00 H new ATOM 0 HA CYS A 728 40.408 -22.384 1.020 1.00 0.00 H new ATOM 0 HB2 CYS A 728 38.767 -23.917 -0.072 1.00 0.00 H new ATOM 0 HB3 CYS A 728 40.096 -24.785 -0.815 1.00 0.00 H new ATOM 0 HG CYS A 728 40.990 -25.998 1.398 1.00 0.00 H new ATOM 617 N ALA A 729 42.741 -23.228 1.285 1.00 0.00 N ATOM 618 CA ALA A 729 44.111 -23.598 1.396 1.00 0.00 C ATOM 619 C ALA A 729 44.370 -24.293 2.701 1.00 0.00 C ATOM 620 O ALA A 729 43.586 -24.188 3.648 1.00 0.00 O ATOM 621 CB ALA A 729 45.008 -22.387 1.246 1.00 0.00 C ATOM 0 H ALA A 729 42.315 -22.888 2.147 1.00 0.00 H new ATOM 0 HA ALA A 729 44.341 -24.293 0.589 1.00 0.00 H new ATOM 0 HB1 ALA A 729 46.050 -22.693 1.334 1.00 0.00 H new ATOM 0 HB2 ALA A 729 44.845 -21.932 0.269 1.00 0.00 H new ATOM 0 HB3 ALA A 729 44.775 -21.663 2.027 1.00 0.00 H new ATOM 627 N GLN A 730 45.446 -24.998 2.743 1.00 0.00 N ATOM 628 CA GLN A 730 45.871 -25.664 3.917 1.00 0.00 C ATOM 629 C GLN A 730 47.160 -25.036 4.399 1.00 0.00 C ATOM 630 O GLN A 730 48.099 -24.828 3.619 1.00 0.00 O ATOM 631 CB GLN A 730 46.082 -27.159 3.681 1.00 0.00 C ATOM 632 CG GLN A 730 46.504 -27.900 4.944 1.00 0.00 C ATOM 633 CD GLN A 730 46.638 -29.392 4.768 1.00 0.00 C ATOM 634 OE1 GLN A 730 46.960 -29.884 3.692 1.00 0.00 O ATOM 635 NE2 GLN A 730 46.401 -30.127 5.822 1.00 0.00 N ATOM 0 H GLN A 730 46.066 -25.128 1.944 1.00 0.00 H new ATOM 0 HA GLN A 730 45.090 -25.559 4.670 1.00 0.00 H new ATOM 0 HB2 GLN A 730 45.159 -27.596 3.299 1.00 0.00 H new ATOM 0 HB3 GLN A 730 46.842 -27.298 2.912 1.00 0.00 H new ATOM 0 HG2 GLN A 730 47.458 -27.498 5.286 1.00 0.00 H new ATOM 0 HG3 GLN A 730 45.775 -27.702 5.729 1.00 0.00 H new ATOM 0 HE21 GLN A 730 46.135 -29.686 6.702 1.00 0.00 H new ATOM 0 HE22 GLN A 730 46.482 -31.142 5.765 1.00 0.00 H new ATOM 644 N ASP A 731 47.188 -24.721 5.653 1.00 0.00 N ATOM 645 CA ASP A 731 48.357 -24.154 6.307 1.00 0.00 C ATOM 646 C ASP A 731 49.416 -25.270 6.439 1.00 0.00 C ATOM 647 O ASP A 731 49.062 -26.417 6.665 1.00 0.00 O ATOM 648 CB ASP A 731 47.922 -23.629 7.698 1.00 0.00 C ATOM 649 CG ASP A 731 48.999 -22.896 8.485 1.00 0.00 C ATOM 650 OD1 ASP A 731 50.077 -23.427 8.649 1.00 0.00 O ATOM 651 OD2 ASP A 731 48.721 -21.829 9.052 1.00 0.00 O ATOM 0 H ASP A 731 46.391 -24.847 6.277 1.00 0.00 H new ATOM 0 HA ASP A 731 48.783 -23.328 5.737 1.00 0.00 H new ATOM 0 HB2 ASP A 731 47.073 -22.958 7.565 1.00 0.00 H new ATOM 0 HB3 ASP A 731 47.572 -24.473 8.293 1.00 0.00 H new ATOM 656 N GLU A 732 50.683 -24.951 6.293 1.00 0.00 N ATOM 657 CA GLU A 732 51.731 -25.971 6.388 1.00 0.00 C ATOM 658 C GLU A 732 52.314 -26.114 7.774 1.00 0.00 C ATOM 659 O GLU A 732 53.038 -27.081 8.062 1.00 0.00 O ATOM 660 CB GLU A 732 52.834 -25.756 5.368 1.00 0.00 C ATOM 661 CG GLU A 732 52.431 -26.152 3.976 1.00 0.00 C ATOM 662 CD GLU A 732 52.029 -27.595 3.931 1.00 0.00 C ATOM 663 OE1 GLU A 732 50.825 -27.891 3.932 1.00 0.00 O ATOM 664 OE2 GLU A 732 52.906 -28.478 3.913 1.00 0.00 O ATOM 0 H GLU A 732 51.021 -24.006 6.110 1.00 0.00 H new ATOM 0 HA GLU A 732 51.228 -26.911 6.159 1.00 0.00 H new ATOM 0 HB2 GLU A 732 53.125 -24.705 5.371 1.00 0.00 H new ATOM 0 HB3 GLU A 732 53.712 -26.331 5.664 1.00 0.00 H new ATOM 0 HG2 GLU A 732 51.603 -25.528 3.641 1.00 0.00 H new ATOM 0 HG3 GLU A 732 53.259 -25.979 3.289 1.00 0.00 H new ATOM 671 N ARG A 733 52.011 -25.194 8.633 1.00 0.00 N ATOM 672 CA ARG A 733 52.522 -25.244 9.963 1.00 0.00 C ATOM 673 C ARG A 733 51.408 -25.681 10.901 1.00 0.00 C ATOM 674 O ARG A 733 51.611 -26.480 11.817 1.00 0.00 O ATOM 675 CB ARG A 733 53.064 -23.877 10.384 1.00 0.00 C ATOM 676 CG ARG A 733 53.937 -23.922 11.620 1.00 0.00 C ATOM 677 CD ARG A 733 55.225 -24.677 11.331 1.00 0.00 C ATOM 678 NE ARG A 733 56.080 -24.792 12.502 1.00 0.00 N ATOM 679 CZ ARG A 733 57.200 -25.524 12.554 1.00 0.00 C ATOM 680 NH1 ARG A 733 57.622 -26.201 11.479 1.00 0.00 N ATOM 681 NH2 ARG A 733 57.894 -25.583 13.679 1.00 0.00 N ATOM 0 H ARG A 733 51.409 -24.395 8.435 1.00 0.00 H new ATOM 0 HA ARG A 733 53.343 -25.959 10.008 1.00 0.00 H new ATOM 0 HB2 ARG A 733 53.638 -23.454 9.560 1.00 0.00 H new ATOM 0 HB3 ARG A 733 52.226 -23.204 10.566 1.00 0.00 H new ATOM 0 HG2 ARG A 733 54.168 -22.908 11.947 1.00 0.00 H new ATOM 0 HG3 ARG A 733 53.399 -24.406 12.436 1.00 0.00 H new ATOM 0 HD2 ARG A 733 54.983 -25.674 10.963 1.00 0.00 H new ATOM 0 HD3 ARG A 733 55.770 -24.168 10.536 1.00 0.00 H new ATOM 0 HE ARG A 733 55.808 -24.280 13.341 1.00 0.00 H new ATOM 0 HH11 ARG A 733 57.089 -26.162 10.610 1.00 0.00 H new ATOM 0 HH12 ARG A 733 58.476 -26.756 11.529 1.00 0.00 H new ATOM 0 HH21 ARG A 733 57.575 -25.072 14.502 1.00 0.00 H new ATOM 0 HH22 ARG A 733 58.748 -26.139 13.723 1.00 0.00 H new ATOM 695 N SER A 734 50.238 -25.156 10.663 1.00 0.00 N ATOM 696 CA SER A 734 49.076 -25.462 11.456 1.00 0.00 C ATOM 697 C SER A 734 48.338 -26.667 10.855 1.00 0.00 C ATOM 698 O SER A 734 47.606 -27.376 11.551 1.00 0.00 O ATOM 699 CB SER A 734 48.170 -24.239 11.473 1.00 0.00 C ATOM 700 OG SER A 734 48.938 -23.054 11.686 1.00 0.00 O ATOM 0 H SER A 734 50.061 -24.496 9.905 1.00 0.00 H new ATOM 0 HA SER A 734 49.370 -25.715 12.475 1.00 0.00 H new ATOM 0 HB2 SER A 734 47.630 -24.165 10.529 1.00 0.00 H new ATOM 0 HB3 SER A 734 47.423 -24.343 12.260 1.00 0.00 H new ATOM 0 HG SER A 734 48.828 -22.451 10.922 1.00 0.00 H new ATOM 706 N LYS A 735 48.552 -26.893 9.547 1.00 0.00 N ATOM 707 CA LYS A 735 47.942 -28.000 8.776 1.00 0.00 C ATOM 708 C LYS A 735 46.420 -27.949 8.738 1.00 0.00 C ATOM 709 O LYS A 735 45.769 -28.939 8.404 1.00 0.00 O ATOM 710 CB LYS A 735 48.457 -29.373 9.230 1.00 0.00 C ATOM 711 CG LYS A 735 49.969 -29.560 9.066 1.00 0.00 C ATOM 712 CD LYS A 735 50.445 -29.325 7.621 1.00 0.00 C ATOM 713 CE LYS A 735 49.808 -30.288 6.617 1.00 0.00 C ATOM 714 NZ LYS A 735 50.324 -30.101 5.244 1.00 0.00 N ATOM 0 H LYS A 735 49.164 -26.303 8.983 1.00 0.00 H new ATOM 0 HA LYS A 735 48.269 -27.853 7.747 1.00 0.00 H new ATOM 0 HB2 LYS A 735 48.195 -29.519 10.278 1.00 0.00 H new ATOM 0 HB3 LYS A 735 47.942 -30.148 8.662 1.00 0.00 H new ATOM 0 HG2 LYS A 735 50.490 -28.872 9.732 1.00 0.00 H new ATOM 0 HG3 LYS A 735 50.241 -30.570 9.374 1.00 0.00 H new ATOM 0 HD2 LYS A 735 50.213 -28.300 7.330 1.00 0.00 H new ATOM 0 HD3 LYS A 735 51.529 -29.431 7.580 1.00 0.00 H new ATOM 0 HE2 LYS A 735 49.994 -31.314 6.935 1.00 0.00 H new ATOM 0 HE3 LYS A 735 48.727 -30.145 6.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 735 49.679 -30.554 4.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 735 50.389 -29.085 5.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 735 51.267 -30.532 5.166 1.00 0.00 H new ATOM 728 N ARG A 736 45.866 -26.782 8.991 1.00 0.00 N ATOM 729 CA ARG A 736 44.431 -26.620 8.979 1.00 0.00 C ATOM 730 C ARG A 736 44.000 -26.126 7.631 1.00 0.00 C ATOM 731 O ARG A 736 44.803 -25.557 6.883 1.00 0.00 O ATOM 732 CB ARG A 736 43.944 -25.619 10.040 1.00 0.00 C ATOM 733 CG ARG A 736 44.277 -24.175 9.701 1.00 0.00 C ATOM 734 CD ARG A 736 43.461 -23.195 10.507 1.00 0.00 C ATOM 735 NE ARG A 736 43.895 -23.067 11.902 1.00 0.00 N ATOM 736 CZ ARG A 736 43.263 -22.324 12.827 1.00 0.00 C ATOM 737 NH1 ARG A 736 42.032 -21.872 12.599 1.00 0.00 N ATOM 738 NH2 ARG A 736 43.842 -22.086 14.002 1.00 0.00 N ATOM 0 H ARG A 736 46.389 -25.933 9.207 1.00 0.00 H new ATOM 0 HA ARG A 736 43.995 -27.593 9.204 1.00 0.00 H new ATOM 0 HB2 ARG A 736 42.865 -25.718 10.155 1.00 0.00 H new ATOM 0 HB3 ARG A 736 44.392 -25.872 11.001 1.00 0.00 H new ATOM 0 HG2 ARG A 736 45.337 -23.997 9.882 1.00 0.00 H new ATOM 0 HG3 ARG A 736 44.101 -24.004 8.639 1.00 0.00 H new ATOM 0 HD2 ARG A 736 43.511 -22.216 10.030 1.00 0.00 H new ATOM 0 HD3 ARG A 736 42.416 -23.505 10.489 1.00 0.00 H new ATOM 0 HE ARG A 736 44.731 -23.575 12.189 1.00 0.00 H new ATOM 0 HH11 ARG A 736 41.564 -22.089 11.719 1.00 0.00 H new ATOM 0 HH12 ARG A 736 41.557 -21.309 13.304 1.00 0.00 H new ATOM 0 HH21 ARG A 736 44.767 -22.468 14.202 1.00 0.00 H new ATOM 0 HH22 ARG A 736 43.361 -21.522 14.703 1.00 0.00 H new ATOM 752 N ILE A 737 42.761 -26.344 7.326 1.00 0.00 N ATOM 753 CA ILE A 737 42.175 -25.826 6.146 1.00 0.00 C ATOM 754 C ILE A 737 41.587 -24.469 6.475 1.00 0.00 C ATOM 755 O ILE A 737 40.755 -24.354 7.380 1.00 0.00 O ATOM 756 CB ILE A 737 41.048 -26.748 5.643 1.00 0.00 C ATOM 757 CG1 ILE A 737 41.578 -28.140 5.312 1.00 0.00 C ATOM 758 CG2 ILE A 737 40.412 -26.146 4.434 1.00 0.00 C ATOM 759 CD1 ILE A 737 42.581 -28.143 4.188 1.00 0.00 C ATOM 0 H ILE A 737 42.125 -26.895 7.902 1.00 0.00 H new ATOM 0 HA ILE A 737 42.934 -25.752 5.367 1.00 0.00 H new ATOM 0 HB ILE A 737 40.308 -26.849 6.437 1.00 0.00 H new ATOM 0 HG12 ILE A 737 42.039 -28.567 6.203 1.00 0.00 H new ATOM 0 HG13 ILE A 737 40.742 -28.786 5.045 1.00 0.00 H new ATOM 0 HG21 ILE A 737 39.615 -26.799 4.079 1.00 0.00 H new ATOM 0 HG22 ILE A 737 39.996 -25.171 4.689 1.00 0.00 H new ATOM 0 HG23 ILE A 737 41.160 -26.028 3.650 1.00 0.00 H new ATOM 0 HD11 ILE A 737 42.918 -29.163 4.003 1.00 0.00 H new ATOM 0 HD12 ILE A 737 42.117 -27.745 3.285 1.00 0.00 H new ATOM 0 HD13 ILE A 737 43.435 -27.523 4.461 1.00 0.00 H new ATOM 771 N LEU A 738 42.021 -23.462 5.797 1.00 0.00 N ATOM 772 CA LEU A 738 41.511 -22.142 6.025 1.00 0.00 C ATOM 773 C LEU A 738 41.167 -21.465 4.704 1.00 0.00 C ATOM 774 O LEU A 738 41.758 -21.775 3.656 1.00 0.00 O ATOM 775 CB LEU A 738 42.475 -21.247 6.879 1.00 0.00 C ATOM 776 CG LEU A 738 43.766 -20.712 6.225 1.00 0.00 C ATOM 777 CD1 LEU A 738 44.528 -19.838 7.206 1.00 0.00 C ATOM 778 CD2 LEU A 738 44.646 -21.833 5.747 1.00 0.00 C ATOM 0 H LEU A 738 42.735 -23.523 5.072 1.00 0.00 H new ATOM 0 HA LEU A 738 40.601 -22.257 6.614 1.00 0.00 H new ATOM 0 HB2 LEU A 738 41.903 -20.389 7.231 1.00 0.00 H new ATOM 0 HB3 LEU A 738 42.764 -21.820 7.760 1.00 0.00 H new ATOM 0 HG LEU A 738 43.478 -20.116 5.359 1.00 0.00 H new ATOM 0 HD11 LEU A 738 45.437 -19.467 6.733 1.00 0.00 H new ATOM 0 HD12 LEU A 738 43.904 -18.996 7.504 1.00 0.00 H new ATOM 0 HD13 LEU A 738 44.791 -20.424 8.087 1.00 0.00 H new ATOM 0 HD21 LEU A 738 45.546 -21.420 5.292 1.00 0.00 H new ATOM 0 HD22 LEU A 738 44.923 -22.464 6.592 1.00 0.00 H new ATOM 0 HD23 LEU A 738 44.108 -22.429 5.010 1.00 0.00 H new ATOM 790 N PRO A 739 40.182 -20.584 4.728 1.00 0.00 N ATOM 791 CA PRO A 739 39.827 -19.768 3.581 1.00 0.00 C ATOM 792 C PRO A 739 40.881 -18.682 3.367 1.00 0.00 C ATOM 793 O PRO A 739 41.287 -17.988 4.312 1.00 0.00 O ATOM 794 CB PRO A 739 38.493 -19.136 4.002 1.00 0.00 C ATOM 795 CG PRO A 739 38.545 -19.101 5.486 1.00 0.00 C ATOM 796 CD PRO A 739 39.330 -20.311 5.890 1.00 0.00 C ATOM 0 HA PRO A 739 39.761 -20.332 2.650 1.00 0.00 H new ATOM 0 HB2 PRO A 739 38.380 -18.135 3.586 1.00 0.00 H new ATOM 0 HB3 PRO A 739 37.647 -19.725 3.649 1.00 0.00 H new ATOM 0 HG2 PRO A 739 39.023 -18.188 5.840 1.00 0.00 H new ATOM 0 HG3 PRO A 739 37.543 -19.123 5.914 1.00 0.00 H new ATOM 0 HD2 PRO A 739 39.923 -20.122 6.785 1.00 0.00 H new ATOM 0 HD3 PRO A 739 38.677 -21.155 6.113 1.00 0.00 H new ATOM 804 N LEU A 740 41.347 -18.571 2.170 1.00 0.00 N ATOM 805 CA LEU A 740 42.301 -17.561 1.803 1.00 0.00 C ATOM 806 C LEU A 740 41.873 -16.951 0.521 1.00 0.00 C ATOM 807 O LEU A 740 40.864 -17.327 -0.049 1.00 0.00 O ATOM 808 CB LEU A 740 43.724 -18.125 1.608 1.00 0.00 C ATOM 809 CG LEU A 740 44.511 -18.568 2.838 1.00 0.00 C ATOM 810 CD1 LEU A 740 45.887 -19.029 2.397 1.00 0.00 C ATOM 811 CD2 LEU A 740 44.642 -17.426 3.840 1.00 0.00 C ATOM 0 H LEU A 740 41.077 -19.185 1.402 1.00 0.00 H new ATOM 0 HA LEU A 740 42.335 -16.835 2.616 1.00 0.00 H new ATOM 0 HB2 LEU A 740 43.651 -18.980 0.936 1.00 0.00 H new ATOM 0 HB3 LEU A 740 44.313 -17.365 1.094 1.00 0.00 H new ATOM 0 HG LEU A 740 43.980 -19.385 3.327 1.00 0.00 H new ATOM 0 HD11 LEU A 740 46.460 -19.348 3.267 1.00 0.00 H new ATOM 0 HD12 LEU A 740 45.786 -19.863 1.703 1.00 0.00 H new ATOM 0 HD13 LEU A 740 46.405 -18.207 1.903 1.00 0.00 H new ATOM 0 HD21 LEU A 740 45.207 -17.766 4.708 1.00 0.00 H new ATOM 0 HD22 LEU A 740 45.163 -16.590 3.373 1.00 0.00 H new ATOM 0 HD23 LEU A 740 43.650 -17.104 4.156 1.00 0.00 H new ATOM 823 N THR A 741 42.624 -16.031 0.076 1.00 0.00 N ATOM 824 CA THR A 741 42.414 -15.442 -1.177 1.00 0.00 C ATOM 825 C THR A 741 43.658 -15.608 -1.993 1.00 0.00 C ATOM 826 O THR A 741 44.757 -15.685 -1.425 1.00 0.00 O ATOM 827 CB THR A 741 42.060 -13.980 -1.012 1.00 0.00 C ATOM 828 OG1 THR A 741 42.279 -13.581 0.365 1.00 0.00 O ATOM 829 CG2 THR A 741 40.627 -13.764 -1.409 1.00 0.00 C ATOM 0 H THR A 741 43.424 -15.656 0.586 1.00 0.00 H new ATOM 0 HA THR A 741 41.582 -15.926 -1.688 1.00 0.00 H new ATOM 0 HB THR A 741 42.694 -13.370 -1.655 1.00 0.00 H new ATOM 0 HG1 THR A 741 42.051 -12.634 0.471 1.00 0.00 H new ATOM 0 HG21 THR A 741 40.371 -12.711 -1.290 1.00 0.00 H new ATOM 0 HG22 THR A 741 40.490 -14.056 -2.450 1.00 0.00 H new ATOM 0 HG23 THR A 741 39.979 -14.368 -0.775 1.00 0.00 H new ATOM 837 N VAL A 742 43.505 -15.688 -3.290 1.00 0.00 N ATOM 838 CA VAL A 742 44.621 -15.896 -4.193 1.00 0.00 C ATOM 839 C VAL A 742 45.738 -14.849 -4.063 1.00 0.00 C ATOM 840 O VAL A 742 46.932 -15.195 -4.092 1.00 0.00 O ATOM 841 CB VAL A 742 44.165 -16.151 -5.675 1.00 0.00 C ATOM 842 CG1 VAL A 742 43.135 -15.224 -6.140 1.00 0.00 C ATOM 843 CG2 VAL A 742 45.305 -16.152 -6.640 1.00 0.00 C ATOM 0 H VAL A 742 42.601 -15.611 -3.757 1.00 0.00 H new ATOM 0 HA VAL A 742 45.087 -16.824 -3.862 1.00 0.00 H new ATOM 0 HB VAL A 742 43.728 -17.149 -5.649 1.00 0.00 H new ATOM 0 HG11 VAL A 742 42.871 -15.461 -7.171 1.00 0.00 H new ATOM 0 HG12 VAL A 742 42.251 -15.315 -5.508 1.00 0.00 H new ATOM 0 HG13 VAL A 742 43.514 -14.203 -6.088 1.00 0.00 H new ATOM 0 HG21 VAL A 742 44.929 -16.333 -7.647 1.00 0.00 H new ATOM 0 HG22 VAL A 742 45.809 -15.186 -6.609 1.00 0.00 H new ATOM 0 HG23 VAL A 742 46.010 -16.938 -6.369 1.00 0.00 H new ATOM 853 N CYS A 743 45.358 -13.619 -3.864 1.00 0.00 N ATOM 854 CA CYS A 743 46.287 -12.537 -3.653 1.00 0.00 C ATOM 855 C CYS A 743 47.038 -12.764 -2.365 1.00 0.00 C ATOM 856 O CYS A 743 48.262 -12.771 -2.350 1.00 0.00 O ATOM 857 CB CYS A 743 45.548 -11.180 -3.613 1.00 0.00 C ATOM 858 SG CYS A 743 46.630 -9.715 -3.458 1.00 0.00 S ATOM 0 H CYS A 743 44.380 -13.332 -3.843 1.00 0.00 H new ATOM 0 HA CYS A 743 46.993 -12.511 -4.483 1.00 0.00 H new ATOM 0 HB2 CYS A 743 44.954 -11.080 -4.522 1.00 0.00 H new ATOM 0 HB3 CYS A 743 44.850 -11.188 -2.776 1.00 0.00 H new ATOM 0 HG CYS A 743 46.992 -9.572 -2.218 1.00 0.00 H new ATOM 863 N LYS A 744 46.288 -13.071 -1.316 1.00 0.00 N ATOM 864 CA LYS A 744 46.832 -13.243 0.014 1.00 0.00 C ATOM 865 C LYS A 744 47.804 -14.405 0.026 1.00 0.00 C ATOM 866 O LYS A 744 48.912 -14.273 0.499 1.00 0.00 O ATOM 867 CB LYS A 744 45.693 -13.462 0.996 1.00 0.00 C ATOM 868 CG LYS A 744 46.078 -13.333 2.460 1.00 0.00 C ATOM 869 CD LYS A 744 44.842 -13.352 3.344 1.00 0.00 C ATOM 870 CE LYS A 744 45.192 -13.139 4.808 1.00 0.00 C ATOM 871 NZ LYS A 744 43.981 -13.045 5.657 1.00 0.00 N ATOM 0 H LYS A 744 45.279 -13.208 -1.369 1.00 0.00 H new ATOM 0 HA LYS A 744 47.378 -12.348 0.313 1.00 0.00 H new ATOM 0 HB2 LYS A 744 44.902 -12.744 0.779 1.00 0.00 H new ATOM 0 HB3 LYS A 744 45.276 -14.456 0.831 1.00 0.00 H new ATOM 0 HG2 LYS A 744 46.744 -14.150 2.739 1.00 0.00 H new ATOM 0 HG3 LYS A 744 46.629 -12.405 2.616 1.00 0.00 H new ATOM 0 HD2 LYS A 744 44.150 -12.575 3.019 1.00 0.00 H new ATOM 0 HD3 LYS A 744 44.327 -14.306 3.228 1.00 0.00 H new ATOM 0 HE2 LYS A 744 45.816 -13.962 5.156 1.00 0.00 H new ATOM 0 HE3 LYS A 744 45.780 -12.227 4.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 744 44.262 -12.900 6.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 744 43.397 -12.244 5.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 744 43.433 -13.925 5.578 1.00 0.00 H new ATOM 885 N MET A 745 47.377 -15.516 -0.549 1.00 0.00 N ATOM 886 CA MET A 745 48.203 -16.714 -0.702 1.00 0.00 C ATOM 887 C MET A 745 49.481 -16.407 -1.499 1.00 0.00 C ATOM 888 O MET A 745 50.555 -16.850 -1.138 1.00 0.00 O ATOM 889 CB MET A 745 47.388 -17.806 -1.415 1.00 0.00 C ATOM 890 CG MET A 745 48.224 -18.820 -2.196 1.00 0.00 C ATOM 891 SD MET A 745 49.067 -20.048 -1.182 1.00 0.00 S ATOM 892 CE MET A 745 47.674 -21.000 -0.599 1.00 0.00 C ATOM 0 H MET A 745 46.436 -15.619 -0.929 1.00 0.00 H new ATOM 0 HA MET A 745 48.500 -17.062 0.288 1.00 0.00 H new ATOM 0 HB2 MET A 745 46.794 -18.340 -0.673 1.00 0.00 H new ATOM 0 HB3 MET A 745 46.688 -17.328 -2.100 1.00 0.00 H new ATOM 0 HG2 MET A 745 47.575 -19.337 -2.903 1.00 0.00 H new ATOM 0 HG3 MET A 745 48.968 -18.281 -2.782 1.00 0.00 H new ATOM 0 HE1 MET A 745 47.869 -22.061 -0.751 1.00 0.00 H new ATOM 0 HE2 MET A 745 47.521 -20.808 0.463 1.00 0.00 H new ATOM 0 HE3 MET A 745 46.780 -20.713 -1.152 1.00 0.00 H new ATOM 902 N HIS A 746 49.357 -15.638 -2.569 1.00 0.00 N ATOM 903 CA HIS A 746 50.530 -15.317 -3.399 1.00 0.00 C ATOM 904 C HIS A 746 51.515 -14.451 -2.637 1.00 0.00 C ATOM 905 O HIS A 746 52.735 -14.672 -2.698 1.00 0.00 O ATOM 906 CB HIS A 746 50.146 -14.635 -4.716 1.00 0.00 C ATOM 907 CG HIS A 746 49.963 -15.544 -5.902 1.00 0.00 C ATOM 908 ND1 HIS A 746 51.012 -16.021 -6.662 1.00 0.00 N ATOM 909 CD2 HIS A 746 48.845 -16.016 -6.487 1.00 0.00 C ATOM 910 CE1 HIS A 746 50.544 -16.744 -7.662 1.00 0.00 C ATOM 911 NE2 HIS A 746 49.228 -16.759 -7.578 1.00 0.00 N ATOM 0 H HIS A 746 48.479 -15.227 -2.887 1.00 0.00 H new ATOM 0 HA HIS A 746 51.004 -16.267 -3.645 1.00 0.00 H new ATOM 0 HB2 HIS A 746 49.219 -14.084 -4.560 1.00 0.00 H new ATOM 0 HB3 HIS A 746 50.915 -13.902 -4.960 1.00 0.00 H new ATOM 0 HD2 HIS A 746 47.831 -15.842 -6.158 1.00 0.00 H new ATOM 0 HE1 HIS A 746 51.136 -17.238 -8.418 1.00 0.00 H new ATOM 0 HE2 HIS A 746 48.598 -17.243 -8.218 1.00 0.00 H new ATOM 920 N VAL A 747 50.981 -13.499 -1.918 1.00 0.00 N ATOM 921 CA VAL A 747 51.756 -12.583 -1.117 1.00 0.00 C ATOM 922 C VAL A 747 52.399 -13.281 0.067 1.00 0.00 C ATOM 923 O VAL A 747 53.598 -13.162 0.281 1.00 0.00 O ATOM 924 CB VAL A 747 50.889 -11.396 -0.661 1.00 0.00 C ATOM 925 CG1 VAL A 747 51.632 -10.496 0.327 1.00 0.00 C ATOM 926 CG2 VAL A 747 50.472 -10.612 -1.885 1.00 0.00 C ATOM 0 H VAL A 747 49.976 -13.334 -1.871 1.00 0.00 H new ATOM 0 HA VAL A 747 52.563 -12.197 -1.739 1.00 0.00 H new ATOM 0 HB VAL A 747 50.011 -11.777 -0.139 1.00 0.00 H new ATOM 0 HG11 VAL A 747 50.985 -9.670 0.624 1.00 0.00 H new ATOM 0 HG12 VAL A 747 51.910 -11.074 1.208 1.00 0.00 H new ATOM 0 HG13 VAL A 747 52.531 -10.101 -0.146 1.00 0.00 H new ATOM 0 HG21 VAL A 747 49.856 -9.765 -1.582 1.00 0.00 H new ATOM 0 HG22 VAL A 747 51.359 -10.248 -2.404 1.00 0.00 H new ATOM 0 HG23 VAL A 747 49.900 -11.257 -2.553 1.00 0.00 H new ATOM 936 N LEU A 748 51.635 -14.045 0.815 1.00 0.00 N ATOM 937 CA LEU A 748 52.210 -14.747 1.937 1.00 0.00 C ATOM 938 C LEU A 748 53.248 -15.764 1.461 1.00 0.00 C ATOM 939 O LEU A 748 54.264 -15.973 2.116 1.00 0.00 O ATOM 940 CB LEU A 748 51.129 -15.336 2.907 1.00 0.00 C ATOM 941 CG LEU A 748 50.047 -16.284 2.349 1.00 0.00 C ATOM 942 CD1 LEU A 748 50.604 -17.626 1.933 1.00 0.00 C ATOM 943 CD2 LEU A 748 48.915 -16.455 3.354 1.00 0.00 C ATOM 0 H LEU A 748 50.636 -14.194 0.671 1.00 0.00 H new ATOM 0 HA LEU A 748 52.745 -14.023 2.551 1.00 0.00 H new ATOM 0 HB2 LEU A 748 51.655 -15.870 3.698 1.00 0.00 H new ATOM 0 HB3 LEU A 748 50.617 -14.495 3.376 1.00 0.00 H new ATOM 0 HG LEU A 748 49.652 -15.817 1.447 1.00 0.00 H new ATOM 0 HD11 LEU A 748 49.798 -18.251 1.549 1.00 0.00 H new ATOM 0 HD12 LEU A 748 51.355 -17.483 1.156 1.00 0.00 H new ATOM 0 HD13 LEU A 748 51.061 -18.113 2.794 1.00 0.00 H new ATOM 0 HD21 LEU A 748 48.162 -17.127 2.943 1.00 0.00 H new ATOM 0 HD22 LEU A 748 49.310 -16.875 4.279 1.00 0.00 H new ATOM 0 HD23 LEU A 748 48.462 -15.485 3.561 1.00 0.00 H new ATOM 955 N HIS A 749 53.021 -16.323 0.277 1.00 0.00 N ATOM 956 CA HIS A 749 53.948 -17.266 -0.314 1.00 0.00 C ATOM 957 C HIS A 749 55.262 -16.576 -0.644 1.00 0.00 C ATOM 958 O HIS A 749 56.320 -17.105 -0.328 1.00 0.00 O ATOM 959 CB HIS A 749 53.357 -17.931 -1.565 1.00 0.00 C ATOM 960 CG HIS A 749 53.184 -19.420 -1.471 1.00 0.00 C ATOM 961 ND1 HIS A 749 53.759 -20.295 -2.360 1.00 0.00 N ATOM 962 CD2 HIS A 749 52.443 -20.185 -0.626 1.00 0.00 C ATOM 963 CE1 HIS A 749 53.384 -21.525 -2.074 1.00 0.00 C ATOM 964 NE2 HIS A 749 52.588 -21.490 -1.031 1.00 0.00 N ATOM 0 H HIS A 749 52.195 -16.134 -0.291 1.00 0.00 H new ATOM 0 HA HIS A 749 54.136 -18.053 0.417 1.00 0.00 H new ATOM 0 HB2 HIS A 749 52.387 -17.480 -1.774 1.00 0.00 H new ATOM 0 HB3 HIS A 749 54.002 -17.708 -2.415 1.00 0.00 H new ATOM 0 HD2 HIS A 749 51.852 -19.833 0.207 1.00 0.00 H new ATOM 0 HE1 HIS A 749 53.682 -22.415 -2.609 1.00 0.00 H new ATOM 0 HE2 HIS A 749 52.149 -22.299 -0.593 1.00 0.00 H new ATOM 973 N CYS A 750 55.206 -15.368 -1.221 1.00 0.00 N ATOM 974 CA CYS A 750 56.432 -14.659 -1.560 1.00 0.00 C ATOM 975 C CYS A 750 57.117 -14.118 -0.306 1.00 0.00 C ATOM 976 O CYS A 750 58.345 -13.926 -0.292 1.00 0.00 O ATOM 977 CB CYS A 750 56.205 -13.546 -2.595 1.00 0.00 C ATOM 978 SG CYS A 750 55.127 -12.184 -2.053 1.00 0.00 S ATOM 0 H CYS A 750 54.344 -14.877 -1.456 1.00 0.00 H new ATOM 0 HA CYS A 750 57.097 -15.386 -2.027 1.00 0.00 H new ATOM 0 HB2 CYS A 750 57.173 -13.131 -2.875 1.00 0.00 H new ATOM 0 HB3 CYS A 750 55.777 -13.990 -3.493 1.00 0.00 H new ATOM 0 HG CYS A 750 54.673 -12.438 -0.861 1.00 0.00 H new ATOM 983 N GLN A 751 56.340 -13.879 0.764 1.00 0.00 N ATOM 984 CA GLN A 751 56.935 -13.456 2.020 1.00 0.00 C ATOM 985 C GLN A 751 57.651 -14.625 2.724 1.00 0.00 C ATOM 986 O GLN A 751 58.445 -14.421 3.648 1.00 0.00 O ATOM 987 CB GLN A 751 55.931 -12.798 2.962 1.00 0.00 C ATOM 988 CG GLN A 751 55.257 -11.576 2.374 1.00 0.00 C ATOM 989 CD GLN A 751 54.683 -10.657 3.425 1.00 0.00 C ATOM 990 OE1 GLN A 751 54.283 -11.088 4.511 1.00 0.00 O ATOM 991 NE2 GLN A 751 54.632 -9.396 3.114 1.00 0.00 N ATOM 0 H GLN A 751 55.324 -13.971 0.776 1.00 0.00 H new ATOM 0 HA GLN A 751 57.674 -12.697 1.763 1.00 0.00 H new ATOM 0 HB2 GLN A 751 55.168 -13.528 3.233 1.00 0.00 H new ATOM 0 HB3 GLN A 751 56.442 -12.513 3.882 1.00 0.00 H new ATOM 0 HG2 GLN A 751 55.979 -11.024 1.771 1.00 0.00 H new ATOM 0 HG3 GLN A 751 54.459 -11.895 1.703 1.00 0.00 H new ATOM 0 HE21 GLN A 751 54.973 -9.080 2.206 1.00 0.00 H new ATOM 0 HE22 GLN A 751 54.251 -8.722 3.778 1.00 0.00 H new ATOM 1000 N GLY A 752 57.365 -15.845 2.283 1.00 0.00 N ATOM 1001 CA GLY A 752 58.047 -17.005 2.822 1.00 0.00 C ATOM 1002 C GLY A 752 57.139 -17.976 3.552 1.00 0.00 C ATOM 1003 O GLY A 752 57.616 -18.911 4.188 1.00 0.00 O ATOM 0 H GLY A 752 56.673 -16.051 1.562 1.00 0.00 H new ATOM 0 HA2 GLY A 752 58.544 -17.532 2.007 1.00 0.00 H new ATOM 0 HA3 GLY A 752 58.826 -16.669 3.506 1.00 0.00 H new ATOM 1007 N ARG A 753 55.848 -17.779 3.468 1.00 0.00 N ATOM 1008 CA ARG A 753 54.908 -18.661 4.139 1.00 0.00 C ATOM 1009 C ARG A 753 54.534 -19.821 3.231 1.00 0.00 C ATOM 1010 O ARG A 753 54.187 -19.617 2.059 1.00 0.00 O ATOM 1011 CB ARG A 753 53.640 -17.908 4.537 1.00 0.00 C ATOM 1012 CG ARG A 753 53.863 -16.706 5.437 1.00 0.00 C ATOM 1013 CD ARG A 753 54.444 -17.107 6.781 1.00 0.00 C ATOM 1014 NE ARG A 753 54.606 -15.954 7.672 1.00 0.00 N ATOM 1015 CZ ARG A 753 54.945 -16.012 8.965 1.00 0.00 C ATOM 1016 NH1 ARG A 753 55.219 -17.186 9.535 1.00 0.00 N ATOM 1017 NH2 ARG A 753 55.017 -14.896 9.675 1.00 0.00 N ATOM 0 H ARG A 753 55.417 -17.018 2.943 1.00 0.00 H new ATOM 0 HA ARG A 753 55.392 -19.040 5.039 1.00 0.00 H new ATOM 0 HB2 ARG A 753 53.134 -17.575 3.631 1.00 0.00 H new ATOM 0 HB3 ARG A 753 52.967 -18.601 5.042 1.00 0.00 H new ATOM 0 HG2 ARG A 753 54.536 -16.004 4.945 1.00 0.00 H new ATOM 0 HG3 ARG A 753 52.917 -16.187 5.590 1.00 0.00 H new ATOM 0 HD2 ARG A 753 53.793 -17.842 7.253 1.00 0.00 H new ATOM 0 HD3 ARG A 753 55.410 -17.588 6.630 1.00 0.00 H new ATOM 0 HE ARG A 753 54.447 -15.029 7.272 1.00 0.00 H new ATOM 0 HH11 ARG A 753 55.171 -18.044 8.985 1.00 0.00 H new ATOM 0 HH12 ARG A 753 55.477 -17.226 10.521 1.00 0.00 H new ATOM 0 HH21 ARG A 753 54.814 -13.998 9.236 1.00 0.00 H new ATOM 0 HH22 ARG A 753 55.275 -14.935 10.661 1.00 0.00 H new ATOM 1031 N ASN A 754 54.606 -21.021 3.757 1.00 0.00 N ATOM 1032 CA ASN A 754 54.250 -22.213 3.001 1.00 0.00 C ATOM 1033 C ASN A 754 52.798 -22.561 3.235 1.00 0.00 C ATOM 1034 O ASN A 754 52.355 -22.674 4.388 1.00 0.00 O ATOM 1035 CB ASN A 754 55.113 -23.434 3.393 1.00 0.00 C ATOM 1036 CG ASN A 754 56.597 -23.266 3.143 1.00 0.00 C ATOM 1037 OD1 ASN A 754 57.026 -22.549 2.232 1.00 0.00 O ATOM 1038 ND2 ASN A 754 57.399 -23.932 3.935 1.00 0.00 N ATOM 0 H ASN A 754 54.910 -21.205 4.713 1.00 0.00 H new ATOM 0 HA ASN A 754 54.429 -21.985 1.950 1.00 0.00 H new ATOM 0 HB2 ASN A 754 54.958 -23.647 4.451 1.00 0.00 H new ATOM 0 HB3 ASN A 754 54.761 -24.304 2.838 1.00 0.00 H new ATOM 0 HD21 ASN A 754 58.409 -23.868 3.809 1.00 0.00 H new ATOM 0 HD22 ASN A 754 57.014 -24.515 4.678 1.00 0.00 H new ATOM 1045 N TYR A 755 52.065 -22.700 2.167 1.00 0.00 N ATOM 1046 CA TYR A 755 50.669 -23.108 2.203 1.00 0.00 C ATOM 1047 C TYR A 755 50.389 -23.990 1.025 1.00 0.00 C ATOM 1048 O TYR A 755 50.901 -23.737 -0.079 1.00 0.00 O ATOM 1049 CB TYR A 755 49.689 -21.933 2.153 1.00 0.00 C ATOM 1050 CG TYR A 755 49.497 -21.146 3.432 1.00 0.00 C ATOM 1051 CD1 TYR A 755 48.337 -21.284 4.175 1.00 0.00 C ATOM 1052 CD2 TYR A 755 50.446 -20.252 3.877 1.00 0.00 C ATOM 1053 CE1 TYR A 755 48.132 -20.548 5.321 1.00 0.00 C ATOM 1054 CE2 TYR A 755 50.254 -19.517 5.023 1.00 0.00 C ATOM 1055 CZ TYR A 755 49.095 -19.666 5.740 1.00 0.00 C ATOM 1056 OH TYR A 755 48.891 -18.916 6.881 1.00 0.00 O ATOM 0 H TYR A 755 52.417 -22.532 1.225 1.00 0.00 H new ATOM 0 HA TYR A 755 50.520 -23.624 3.151 1.00 0.00 H new ATOM 0 HB2 TYR A 755 50.025 -21.244 1.378 1.00 0.00 H new ATOM 0 HB3 TYR A 755 48.717 -22.315 1.841 1.00 0.00 H new ATOM 0 HD1 TYR A 755 47.579 -21.981 3.850 1.00 0.00 H new ATOM 0 HD2 TYR A 755 51.359 -20.126 3.314 1.00 0.00 H new ATOM 0 HE1 TYR A 755 47.219 -20.665 5.886 1.00 0.00 H new ATOM 0 HE2 TYR A 755 51.013 -18.825 5.357 1.00 0.00 H new ATOM 0 HH TYR A 755 49.670 -18.342 7.039 1.00 0.00 H new ATOM 1066 N THR A 756 49.572 -24.967 1.240 1.00 0.00 N ATOM 1067 CA THR A 756 49.187 -25.912 0.245 1.00 0.00 C ATOM 1068 C THR A 756 47.768 -25.579 -0.177 1.00 0.00 C ATOM 1069 O THR A 756 47.025 -25.009 0.599 1.00 0.00 O ATOM 1070 CB THR A 756 49.230 -27.328 0.876 1.00 0.00 C ATOM 1071 OG1 THR A 756 50.550 -27.600 1.325 1.00 0.00 O ATOM 1072 CG2 THR A 756 48.791 -28.412 -0.086 1.00 0.00 C ATOM 0 H THR A 756 49.138 -25.135 2.148 1.00 0.00 H new ATOM 0 HA THR A 756 49.852 -25.880 -0.618 1.00 0.00 H new ATOM 0 HB THR A 756 48.528 -27.335 1.710 1.00 0.00 H new ATOM 0 HG1 THR A 756 50.513 -28.070 2.184 1.00 0.00 H new ATOM 0 HG21 THR A 756 48.841 -29.381 0.410 1.00 0.00 H new ATOM 0 HG22 THR A 756 47.767 -28.221 -0.406 1.00 0.00 H new ATOM 0 HG23 THR A 756 49.448 -28.415 -0.955 1.00 0.00 H new ATOM 1080 N LEU A 757 47.404 -25.855 -1.395 1.00 0.00 N ATOM 1081 CA LEU A 757 46.042 -25.642 -1.776 1.00 0.00 C ATOM 1082 C LEU A 757 45.255 -26.890 -1.719 1.00 0.00 C ATOM 1083 O LEU A 757 45.756 -27.976 -2.016 1.00 0.00 O ATOM 1084 CB LEU A 757 45.864 -24.980 -3.114 1.00 0.00 C ATOM 1085 CG LEU A 757 46.235 -23.527 -3.167 1.00 0.00 C ATOM 1086 CD1 LEU A 757 47.692 -23.321 -3.569 1.00 0.00 C ATOM 1087 CD2 LEU A 757 45.267 -22.795 -4.046 1.00 0.00 C ATOM 0 H LEU A 757 48.016 -26.220 -2.125 1.00 0.00 H new ATOM 0 HA LEU A 757 45.661 -24.940 -1.034 1.00 0.00 H new ATOM 0 HB2 LEU A 757 46.463 -25.518 -3.849 1.00 0.00 H new ATOM 0 HB3 LEU A 757 44.822 -25.083 -3.416 1.00 0.00 H new ATOM 0 HG LEU A 757 46.159 -23.103 -2.166 1.00 0.00 H new ATOM 0 HD11 LEU A 757 47.915 -22.254 -3.594 1.00 0.00 H new ATOM 0 HD12 LEU A 757 48.342 -23.811 -2.844 1.00 0.00 H new ATOM 0 HD13 LEU A 757 47.861 -23.750 -4.556 1.00 0.00 H new ATOM 0 HD21 LEU A 757 45.537 -21.740 -4.084 1.00 0.00 H new ATOM 0 HD22 LEU A 757 45.299 -23.215 -5.051 1.00 0.00 H new ATOM 0 HD23 LEU A 757 44.260 -22.898 -3.642 1.00 0.00 H new ATOM 1099 N THR A 758 44.047 -26.733 -1.330 1.00 0.00 N ATOM 1100 CA THR A 758 43.125 -27.791 -1.202 1.00 0.00 C ATOM 1101 C THR A 758 41.890 -27.451 -2.038 1.00 0.00 C ATOM 1102 O THR A 758 41.964 -26.574 -2.926 1.00 0.00 O ATOM 1103 CB THR A 758 42.801 -27.973 0.297 1.00 0.00 C ATOM 1104 OG1 THR A 758 42.568 -26.684 0.883 1.00 0.00 O ATOM 1105 CG2 THR A 758 43.976 -28.646 1.004 1.00 0.00 C ATOM 0 H THR A 758 43.658 -25.823 -1.082 1.00 0.00 H new ATOM 0 HA THR A 758 43.526 -28.735 -1.570 1.00 0.00 H new ATOM 0 HB THR A 758 41.914 -28.598 0.405 1.00 0.00 H new ATOM 0 HG1 THR A 758 43.103 -26.594 1.699 1.00 0.00 H new ATOM 0 HG21 THR A 758 43.741 -28.771 2.061 1.00 0.00 H new ATOM 0 HG22 THR A 758 44.160 -29.622 0.555 1.00 0.00 H new ATOM 0 HG23 THR A 758 44.866 -28.025 0.901 1.00 0.00 H new ATOM 1113 N GLY A 759 40.796 -28.124 -1.813 1.00 0.00 N ATOM 1114 CA GLY A 759 39.622 -27.856 -2.582 1.00 0.00 C ATOM 1115 C GLY A 759 38.545 -27.225 -1.745 1.00 0.00 C ATOM 1116 O GLY A 759 38.528 -27.398 -0.522 1.00 0.00 O ATOM 0 H GLY A 759 40.697 -28.855 -1.109 1.00 0.00 H new ATOM 0 HA2 GLY A 759 39.873 -27.195 -3.412 1.00 0.00 H new ATOM 0 HA3 GLY A 759 39.250 -28.785 -3.015 1.00 0.00 H new ATOM 1120 N ARG A 760 37.627 -26.526 -2.404 1.00 0.00 N ATOM 1121 CA ARG A 760 36.524 -25.762 -1.765 1.00 0.00 C ATOM 1122 C ARG A 760 35.685 -26.599 -0.773 1.00 0.00 C ATOM 1123 O ARG A 760 35.031 -26.046 0.106 1.00 0.00 O ATOM 1124 CB ARG A 760 35.582 -25.135 -2.838 1.00 0.00 C ATOM 1125 CG ARG A 760 34.519 -26.079 -3.462 1.00 0.00 C ATOM 1126 CD ARG A 760 35.108 -27.279 -4.205 1.00 0.00 C ATOM 1127 NE ARG A 760 34.051 -28.131 -4.779 1.00 0.00 N ATOM 1128 CZ ARG A 760 34.242 -29.312 -5.413 1.00 0.00 C ATOM 1129 NH1 ARG A 760 35.464 -29.799 -5.594 1.00 0.00 N ATOM 1130 NH2 ARG A 760 33.202 -29.983 -5.890 1.00 0.00 N ATOM 0 H ARG A 760 37.616 -26.464 -3.422 1.00 0.00 H new ATOM 0 HA ARG A 760 37.012 -24.974 -1.191 1.00 0.00 H new ATOM 0 HB2 ARG A 760 35.064 -24.290 -2.385 1.00 0.00 H new ATOM 0 HB3 ARG A 760 36.199 -24.737 -3.643 1.00 0.00 H new ATOM 0 HG2 ARG A 760 33.862 -26.442 -2.671 1.00 0.00 H new ATOM 0 HG3 ARG A 760 33.900 -25.506 -4.153 1.00 0.00 H new ATOM 0 HD2 ARG A 760 35.766 -26.929 -5.000 1.00 0.00 H new ATOM 0 HD3 ARG A 760 35.720 -27.867 -3.521 1.00 0.00 H new ATOM 0 HE ARG A 760 33.090 -27.801 -4.691 1.00 0.00 H new ATOM 0 HH11 ARG A 760 36.275 -29.282 -5.254 1.00 0.00 H new ATOM 0 HH12 ARG A 760 35.592 -30.690 -6.073 1.00 0.00 H new ATOM 0 HH21 ARG A 760 32.259 -29.609 -5.779 1.00 0.00 H new ATOM 0 HH22 ARG A 760 33.345 -30.873 -6.368 1.00 0.00 H new ATOM 1144 N ASP A 761 35.729 -27.914 -0.920 1.00 0.00 N ATOM 1145 CA ASP A 761 34.929 -28.823 -0.100 1.00 0.00 C ATOM 1146 C ASP A 761 35.399 -28.829 1.350 1.00 0.00 C ATOM 1147 O ASP A 761 34.597 -29.010 2.271 1.00 0.00 O ATOM 1148 CB ASP A 761 34.994 -30.243 -0.670 1.00 0.00 C ATOM 1149 CG ASP A 761 34.185 -31.251 0.114 1.00 0.00 C ATOM 1150 OD1 ASP A 761 34.759 -31.993 0.918 1.00 0.00 O ATOM 1151 OD2 ASP A 761 32.949 -31.326 -0.089 1.00 0.00 O ATOM 0 H ASP A 761 36.317 -28.384 -1.608 1.00 0.00 H new ATOM 0 HA ASP A 761 33.899 -28.468 -0.121 1.00 0.00 H new ATOM 0 HB2 ASP A 761 34.639 -30.228 -1.700 1.00 0.00 H new ATOM 0 HB3 ASP A 761 36.034 -30.567 -0.696 1.00 0.00 H new ATOM 1156 N SER A 762 36.672 -28.570 1.552 1.00 0.00 N ATOM 1157 CA SER A 762 37.243 -28.657 2.877 1.00 0.00 C ATOM 1158 C SER A 762 37.037 -27.392 3.724 1.00 0.00 C ATOM 1159 O SER A 762 37.025 -27.463 4.959 1.00 0.00 O ATOM 1160 CB SER A 762 38.719 -29.098 2.817 1.00 0.00 C ATOM 1161 OG SER A 762 39.466 -28.340 1.871 1.00 0.00 O ATOM 0 H SER A 762 37.328 -28.299 0.820 1.00 0.00 H new ATOM 0 HA SER A 762 36.687 -29.433 3.402 1.00 0.00 H new ATOM 0 HB2 SER A 762 39.169 -28.991 3.804 1.00 0.00 H new ATOM 0 HB3 SER A 762 38.771 -30.155 2.556 1.00 0.00 H new ATOM 0 HG SER A 762 39.339 -27.384 2.045 1.00 0.00 H new ATOM 1167 N CYS A 763 36.855 -26.255 3.085 1.00 0.00 N ATOM 1168 CA CYS A 763 36.680 -25.013 3.834 1.00 0.00 C ATOM 1169 C CYS A 763 35.245 -24.520 3.766 1.00 0.00 C ATOM 1170 O CYS A 763 34.383 -25.131 3.111 1.00 0.00 O ATOM 1171 CB CYS A 763 37.576 -23.926 3.253 1.00 0.00 C ATOM 1172 SG CYS A 763 37.047 -23.355 1.596 1.00 0.00 S ATOM 0 H CYS A 763 36.824 -26.157 2.070 1.00 0.00 H new ATOM 0 HA CYS A 763 36.942 -25.221 4.872 1.00 0.00 H new ATOM 0 HB2 CYS A 763 37.591 -23.075 3.934 1.00 0.00 H new ATOM 0 HB3 CYS A 763 38.597 -24.302 3.190 1.00 0.00 H new ATOM 0 HG CYS A 763 36.312 -24.270 1.036 1.00 0.00 H new ATOM 1177 N THR A 764 34.993 -23.447 4.469 1.00 0.00 N ATOM 1178 CA THR A 764 33.776 -22.713 4.355 1.00 0.00 C ATOM 1179 C THR A 764 34.167 -21.396 3.717 1.00 0.00 C ATOM 1180 O THR A 764 34.873 -20.593 4.327 1.00 0.00 O ATOM 1181 CB THR A 764 33.162 -22.459 5.732 1.00 0.00 C ATOM 1182 OG1 THR A 764 33.058 -23.711 6.429 1.00 0.00 O ATOM 1183 CG2 THR A 764 31.781 -21.835 5.605 1.00 0.00 C ATOM 0 H THR A 764 35.646 -23.057 5.149 1.00 0.00 H new ATOM 0 HA THR A 764 33.034 -23.257 3.771 1.00 0.00 H new ATOM 0 HB THR A 764 33.800 -21.768 6.282 1.00 0.00 H new ATOM 0 HG1 THR A 764 32.667 -23.561 7.315 1.00 0.00 H new ATOM 0 HG21 THR A 764 31.366 -21.664 6.598 1.00 0.00 H new ATOM 0 HG22 THR A 764 31.858 -20.885 5.076 1.00 0.00 H new ATOM 0 HG23 THR A 764 31.128 -22.508 5.049 1.00 0.00 H new ATOM 1191 N LEU A 765 33.789 -21.206 2.490 1.00 0.00 N ATOM 1192 CA LEU A 765 34.232 -20.057 1.764 1.00 0.00 C ATOM 1193 C LEU A 765 33.228 -18.909 1.925 1.00 0.00 C ATOM 1194 O LEU A 765 32.018 -19.102 1.739 1.00 0.00 O ATOM 1195 CB LEU A 765 34.411 -20.428 0.305 1.00 0.00 C ATOM 1196 CG LEU A 765 35.511 -19.693 -0.456 1.00 0.00 C ATOM 1197 CD1 LEU A 765 36.868 -19.998 0.153 1.00 0.00 C ATOM 1198 CD2 LEU A 765 35.487 -20.085 -1.920 1.00 0.00 C ATOM 0 H LEU A 765 33.174 -21.833 1.971 1.00 0.00 H new ATOM 0 HA LEU A 765 35.189 -19.718 2.159 1.00 0.00 H new ATOM 0 HB2 LEU A 765 34.613 -21.498 0.248 1.00 0.00 H new ATOM 0 HB3 LEU A 765 33.466 -20.254 -0.209 1.00 0.00 H new ATOM 0 HG LEU A 765 35.332 -18.620 -0.381 1.00 0.00 H new ATOM 0 HD11 LEU A 765 37.643 -19.467 -0.400 1.00 0.00 H new ATOM 0 HD12 LEU A 765 36.880 -19.676 1.194 1.00 0.00 H new ATOM 0 HD13 LEU A 765 37.057 -21.070 0.103 1.00 0.00 H new ATOM 0 HD21 LEU A 765 36.276 -19.554 -2.452 1.00 0.00 H new ATOM 0 HD22 LEU A 765 35.647 -21.159 -2.012 1.00 0.00 H new ATOM 0 HD23 LEU A 765 34.520 -19.824 -2.351 1.00 0.00 H new ATOM 1210 N PRO A 766 33.715 -17.708 2.287 1.00 0.00 N ATOM 1211 CA PRO A 766 32.865 -16.531 2.520 1.00 0.00 C ATOM 1212 C PRO A 766 32.176 -16.037 1.246 1.00 0.00 C ATOM 1213 O PRO A 766 30.996 -15.644 1.259 1.00 0.00 O ATOM 1214 CB PRO A 766 33.832 -15.473 3.070 1.00 0.00 C ATOM 1215 CG PRO A 766 35.201 -15.932 2.692 1.00 0.00 C ATOM 1216 CD PRO A 766 35.141 -17.420 2.528 1.00 0.00 C ATOM 0 HA PRO A 766 32.047 -16.759 3.203 1.00 0.00 H new ATOM 0 HB2 PRO A 766 33.619 -14.492 2.647 1.00 0.00 H new ATOM 0 HB3 PRO A 766 33.736 -15.381 4.152 1.00 0.00 H new ATOM 0 HG2 PRO A 766 35.524 -15.456 1.766 1.00 0.00 H new ATOM 0 HG3 PRO A 766 35.924 -15.659 3.460 1.00 0.00 H new ATOM 0 HD2 PRO A 766 35.759 -17.753 1.694 1.00 0.00 H new ATOM 0 HD3 PRO A 766 35.504 -17.932 3.419 1.00 0.00 H new ATOM 1353 N LEU A 778 35.846 -6.329 -6.531 1.00 0.00 N ATOM 1354 CA LEU A 778 36.346 -5.653 -7.750 1.00 0.00 C ATOM 1355 C LEU A 778 35.425 -5.879 -8.968 1.00 0.00 C ATOM 1356 O LEU A 778 35.173 -4.957 -9.748 1.00 0.00 O ATOM 1357 CB LEU A 778 37.789 -6.103 -8.097 1.00 0.00 C ATOM 1358 CG LEU A 778 38.026 -7.620 -8.337 1.00 0.00 C ATOM 1359 CD1 LEU A 778 39.361 -7.871 -9.013 1.00 0.00 C ATOM 1360 CD2 LEU A 778 37.984 -8.401 -7.031 1.00 0.00 C ATOM 0 HA LEU A 778 36.351 -4.587 -7.524 1.00 0.00 H new ATOM 0 HB2 LEU A 778 38.103 -5.567 -8.993 1.00 0.00 H new ATOM 0 HB3 LEU A 778 38.445 -5.783 -7.288 1.00 0.00 H new ATOM 0 HG LEU A 778 37.222 -7.962 -8.988 1.00 0.00 H new ATOM 0 HD11 LEU A 778 39.496 -8.942 -9.166 1.00 0.00 H new ATOM 0 HD12 LEU A 778 39.383 -7.361 -9.976 1.00 0.00 H new ATOM 0 HD13 LEU A 778 40.165 -7.491 -8.383 1.00 0.00 H new ATOM 0 HD21 LEU A 778 38.153 -9.458 -7.234 1.00 0.00 H new ATOM 0 HD22 LEU A 778 38.760 -8.031 -6.361 1.00 0.00 H new ATOM 0 HD23 LEU A 778 37.008 -8.273 -6.562 1.00 0.00 H new ATOM 1372 N TRP A 779 34.906 -7.091 -9.084 1.00 0.00 N ATOM 1373 CA TRP A 779 34.040 -7.485 -10.193 1.00 0.00 C ATOM 1374 C TRP A 779 32.550 -7.248 -9.892 1.00 0.00 C ATOM 1375 O TRP A 779 31.677 -7.613 -10.682 1.00 0.00 O ATOM 1376 CB TRP A 779 34.299 -8.962 -10.567 1.00 0.00 C ATOM 1377 CG TRP A 779 34.377 -9.903 -9.380 1.00 0.00 C ATOM 1378 CD1 TRP A 779 33.365 -10.292 -8.563 1.00 0.00 C ATOM 1379 CD2 TRP A 779 35.548 -10.580 -8.909 1.00 0.00 C ATOM 1380 NE1 TRP A 779 33.838 -11.154 -7.597 1.00 0.00 N ATOM 1381 CE2 TRP A 779 35.180 -11.350 -7.794 1.00 0.00 C ATOM 1382 CE3 TRP A 779 36.870 -10.603 -9.319 1.00 0.00 C ATOM 1383 CZ2 TRP A 779 36.109 -12.136 -7.096 1.00 0.00 C ATOM 1384 CZ3 TRP A 779 37.775 -11.378 -8.620 1.00 0.00 C ATOM 1385 CH2 TRP A 779 37.388 -12.123 -7.536 1.00 0.00 C ATOM 0 H TRP A 779 35.073 -7.837 -8.409 1.00 0.00 H new ATOM 0 HA TRP A 779 34.289 -6.850 -11.043 1.00 0.00 H new ATOM 0 HB2 TRP A 779 33.505 -9.301 -11.232 1.00 0.00 H new ATOM 0 HB3 TRP A 779 35.232 -9.024 -11.127 1.00 0.00 H new ATOM 0 HD1 TRP A 779 32.338 -9.972 -8.656 1.00 0.00 H new ATOM 0 HE1 TRP A 779 33.280 -11.577 -6.856 1.00 0.00 H new ATOM 0 HE3 TRP A 779 37.189 -10.024 -10.173 1.00 0.00 H new ATOM 0 HZ2 TRP A 779 35.815 -12.728 -6.242 1.00 0.00 H new ATOM 0 HZ3 TRP A 779 38.808 -11.397 -8.934 1.00 0.00 H new ATOM 0 HH2 TRP A 779 38.126 -12.717 -7.018 1.00 0.00 H new ATOM 1396 N GLY A 780 32.267 -6.627 -8.777 1.00 0.00 N ATOM 1397 CA GLY A 780 30.898 -6.381 -8.416 1.00 0.00 C ATOM 1398 C GLY A 780 30.685 -4.937 -8.104 1.00 0.00 C ATOM 1399 O GLY A 780 31.607 -4.256 -7.659 1.00 0.00 O ATOM 0 H GLY A 780 32.959 -6.286 -8.110 1.00 0.00 H new ATOM 0 HA2 GLY A 780 30.242 -6.682 -9.233 1.00 0.00 H new ATOM 0 HA3 GLY A 780 30.630 -6.988 -7.551 1.00 0.00 H new ATOM 1526 N VAL A 790 25.628 -6.051 -8.468 1.00 0.00 N ATOM 1527 CA VAL A 790 25.600 -6.662 -9.764 1.00 0.00 C ATOM 1528 C VAL A 790 27.024 -6.962 -10.184 1.00 0.00 C ATOM 1529 O VAL A 790 27.962 -6.257 -9.793 1.00 0.00 O ATOM 1530 CB VAL A 790 24.845 -5.785 -10.835 1.00 0.00 C ATOM 1531 CG1 VAL A 790 25.570 -4.489 -11.151 1.00 0.00 C ATOM 1532 CG2 VAL A 790 24.548 -6.569 -12.112 1.00 0.00 C ATOM 0 HA VAL A 790 25.031 -7.590 -9.702 1.00 0.00 H new ATOM 0 HB VAL A 790 23.892 -5.515 -10.379 1.00 0.00 H new ATOM 0 HG11 VAL A 790 25.004 -3.927 -11.894 1.00 0.00 H new ATOM 0 HG12 VAL A 790 25.666 -3.895 -10.242 1.00 0.00 H new ATOM 0 HG13 VAL A 790 26.562 -4.713 -11.544 1.00 0.00 H new ATOM 0 HG21 VAL A 790 24.027 -5.926 -12.821 1.00 0.00 H new ATOM 0 HG22 VAL A 790 25.483 -6.913 -12.553 1.00 0.00 H new ATOM 0 HG23 VAL A 790 23.921 -7.428 -11.874 1.00 0.00 H new ATOM 1542 N CYS A 791 27.199 -7.996 -10.922 1.00 0.00 N ATOM 1543 CA CYS A 791 28.504 -8.375 -11.346 1.00 0.00 C ATOM 1544 C CYS A 791 28.779 -7.878 -12.731 1.00 0.00 C ATOM 1545 O CYS A 791 27.964 -8.036 -13.652 1.00 0.00 O ATOM 1546 CB CYS A 791 28.682 -9.876 -11.243 1.00 0.00 C ATOM 1547 SG CYS A 791 27.344 -10.845 -11.991 1.00 0.00 S ATOM 0 H CYS A 791 26.448 -8.604 -11.250 1.00 0.00 H new ATOM 0 HA CYS A 791 29.234 -7.910 -10.683 1.00 0.00 H new ATOM 0 HB2 CYS A 791 29.623 -10.151 -11.719 1.00 0.00 H new ATOM 0 HB3 CYS A 791 28.766 -10.148 -10.191 1.00 0.00 H new ATOM 0 HG CYS A 791 26.895 -10.225 -13.042 1.00 0.00 H new ATOM 1552 N ARG A 792 29.903 -7.253 -12.870 1.00 0.00 N ATOM 1553 CA ARG A 792 30.320 -6.697 -14.116 1.00 0.00 C ATOM 1554 C ARG A 792 31.147 -7.746 -14.816 1.00 0.00 C ATOM 1555 O ARG A 792 31.678 -8.640 -14.153 1.00 0.00 O ATOM 1556 CB ARG A 792 31.154 -5.436 -13.871 1.00 0.00 C ATOM 1557 CG ARG A 792 30.460 -4.370 -13.019 1.00 0.00 C ATOM 1558 CD ARG A 792 29.165 -3.864 -13.659 1.00 0.00 C ATOM 1559 NE ARG A 792 29.397 -3.287 -14.990 1.00 0.00 N ATOM 1560 CZ ARG A 792 29.231 -1.985 -15.311 1.00 0.00 C ATOM 1561 NH1 ARG A 792 28.757 -1.112 -14.415 1.00 0.00 N ATOM 1562 NH2 ARG A 792 29.501 -1.577 -16.545 1.00 0.00 N ATOM 0 H ARG A 792 30.568 -7.112 -12.109 1.00 0.00 H new ATOM 0 HA ARG A 792 29.462 -6.416 -14.726 1.00 0.00 H new ATOM 0 HB2 ARG A 792 32.086 -5.722 -13.384 1.00 0.00 H new ATOM 0 HB3 ARG A 792 31.418 -4.998 -14.834 1.00 0.00 H new ATOM 0 HG2 ARG A 792 30.239 -4.783 -12.035 1.00 0.00 H new ATOM 0 HG3 ARG A 792 31.139 -3.531 -12.867 1.00 0.00 H new ATOM 0 HD2 ARG A 792 28.455 -4.687 -13.740 1.00 0.00 H new ATOM 0 HD3 ARG A 792 28.711 -3.113 -13.013 1.00 0.00 H new ATOM 0 HE ARG A 792 29.707 -3.918 -15.729 1.00 0.00 H new ATOM 0 HH11 ARG A 792 28.516 -1.426 -13.475 1.00 0.00 H new ATOM 0 HH12 ARG A 792 28.637 -0.132 -14.672 1.00 0.00 H new ATOM 0 HH21 ARG A 792 29.831 -2.245 -17.242 1.00 0.00 H new ATOM 0 HH22 ARG A 792 29.379 -0.596 -16.796 1.00 0.00 H new ATOM 1576 N GLU A 793 31.259 -7.661 -16.118 1.00 0.00 N ATOM 1577 CA GLU A 793 32.015 -8.659 -16.848 1.00 0.00 C ATOM 1578 C GLU A 793 33.520 -8.416 -16.707 1.00 0.00 C ATOM 1579 O GLU A 793 33.952 -7.390 -16.146 1.00 0.00 O ATOM 1580 CB GLU A 793 31.604 -8.718 -18.319 1.00 0.00 C ATOM 1581 CG GLU A 793 30.145 -9.098 -18.551 1.00 0.00 C ATOM 1582 CD GLU A 793 29.745 -10.429 -17.925 1.00 0.00 C ATOM 1583 OE1 GLU A 793 30.322 -11.479 -18.293 1.00 0.00 O ATOM 1584 OE2 GLU A 793 28.793 -10.449 -17.118 1.00 0.00 O ATOM 0 H GLU A 793 30.845 -6.925 -16.691 1.00 0.00 H new ATOM 0 HA GLU A 793 31.784 -9.629 -16.408 1.00 0.00 H new ATOM 0 HB2 GLU A 793 31.790 -7.746 -18.775 1.00 0.00 H new ATOM 0 HB3 GLU A 793 32.241 -9.438 -18.833 1.00 0.00 H new ATOM 0 HG2 GLU A 793 29.507 -8.312 -18.148 1.00 0.00 H new ATOM 0 HG3 GLU A 793 29.958 -9.142 -19.624 1.00 0.00 H new ATOM 1591 N ALA A 794 34.309 -9.319 -17.272 1.00 0.00 N ATOM 1592 CA ALA A 794 35.754 -9.303 -17.138 1.00 0.00 C ATOM 1593 C ALA A 794 36.347 -8.050 -17.735 1.00 0.00 C ATOM 1594 O ALA A 794 37.269 -7.454 -17.176 1.00 0.00 O ATOM 1595 CB ALA A 794 36.346 -10.524 -17.804 1.00 0.00 C ATOM 0 H ALA A 794 33.958 -10.089 -17.841 1.00 0.00 H new ATOM 0 HA ALA A 794 35.996 -9.316 -16.075 1.00 0.00 H new ATOM 0 HB1 ALA A 794 37.431 -10.505 -17.700 1.00 0.00 H new ATOM 0 HB2 ALA A 794 35.951 -11.424 -17.332 1.00 0.00 H new ATOM 0 HB3 ALA A 794 36.083 -10.525 -18.862 1.00 0.00 H new ATOM 1601 N SER A 795 35.776 -7.627 -18.832 1.00 0.00 N ATOM 1602 CA SER A 795 36.225 -6.477 -19.554 1.00 0.00 C ATOM 1603 C SER A 795 35.908 -5.158 -18.819 1.00 0.00 C ATOM 1604 O SER A 795 36.475 -4.100 -19.135 1.00 0.00 O ATOM 1605 CB SER A 795 35.579 -6.507 -20.928 1.00 0.00 C ATOM 1606 OG SER A 795 34.190 -6.780 -20.797 1.00 0.00 O ATOM 0 H SER A 795 34.968 -8.086 -19.253 1.00 0.00 H new ATOM 0 HA SER A 795 37.311 -6.513 -19.642 1.00 0.00 H new ATOM 0 HB2 SER A 795 35.726 -5.551 -21.431 1.00 0.00 H new ATOM 0 HB3 SER A 795 36.053 -7.269 -21.547 1.00 0.00 H new ATOM 0 HG SER A 795 33.775 -6.797 -21.685 1.00 0.00 H new ATOM 1612 N GLU A 796 35.028 -5.226 -17.835 1.00 0.00 N ATOM 1613 CA GLU A 796 34.593 -4.044 -17.112 1.00 0.00 C ATOM 1614 C GLU A 796 35.336 -3.921 -15.785 1.00 0.00 C ATOM 1615 O GLU A 796 35.162 -2.953 -15.038 1.00 0.00 O ATOM 1616 CB GLU A 796 33.091 -4.109 -16.860 1.00 0.00 C ATOM 1617 CG GLU A 796 32.267 -4.366 -18.111 1.00 0.00 C ATOM 1618 CD GLU A 796 30.791 -4.309 -17.848 1.00 0.00 C ATOM 1619 OE1 GLU A 796 30.100 -3.447 -18.450 1.00 0.00 O ATOM 1620 OE2 GLU A 796 30.284 -5.079 -17.007 1.00 0.00 O ATOM 0 H GLU A 796 34.598 -6.094 -17.517 1.00 0.00 H new ATOM 0 HA GLU A 796 34.818 -3.167 -17.719 1.00 0.00 H new ATOM 0 HB2 GLU A 796 32.888 -4.897 -16.135 1.00 0.00 H new ATOM 0 HB3 GLU A 796 32.767 -3.171 -16.410 1.00 0.00 H new ATOM 0 HG2 GLU A 796 32.526 -3.629 -18.871 1.00 0.00 H new ATOM 0 HG3 GLU A 796 32.523 -5.345 -18.516 1.00 0.00 H new ATOM 1627 N CYS A 797 36.157 -4.893 -15.490 1.00 0.00 N ATOM 1628 CA CYS A 797 36.905 -4.875 -14.269 1.00 0.00 C ATOM 1629 C CYS A 797 38.329 -4.428 -14.548 1.00 0.00 C ATOM 1630 O CYS A 797 39.182 -5.210 -14.958 1.00 0.00 O ATOM 1631 CB CYS A 797 36.866 -6.230 -13.583 1.00 0.00 C ATOM 1632 SG CYS A 797 37.698 -6.273 -11.957 1.00 0.00 S ATOM 0 H CYS A 797 36.323 -5.707 -16.082 1.00 0.00 H new ATOM 0 HA CYS A 797 36.448 -4.161 -13.584 1.00 0.00 H new ATOM 0 HB2 CYS A 797 35.826 -6.529 -13.454 1.00 0.00 H new ATOM 0 HB3 CYS A 797 37.331 -6.968 -14.236 1.00 0.00 H new ATOM 0 HG CYS A 797 38.814 -6.932 -12.058 1.00 0.00 H new ATOM 1637 N GLU A 798 38.567 -3.161 -14.316 1.00 0.00 N ATOM 1638 CA GLU A 798 39.846 -2.509 -14.606 1.00 0.00 C ATOM 1639 C GLU A 798 40.806 -2.602 -13.416 1.00 0.00 C ATOM 1640 O GLU A 798 41.660 -1.734 -13.203 1.00 0.00 O ATOM 1641 CB GLU A 798 39.596 -1.046 -14.970 1.00 0.00 C ATOM 1642 CG GLU A 798 38.807 -0.271 -13.922 1.00 0.00 C ATOM 1643 CD GLU A 798 38.696 1.178 -14.263 1.00 0.00 C ATOM 1644 OE1 GLU A 798 37.843 1.543 -15.093 1.00 0.00 O ATOM 1645 OE2 GLU A 798 39.471 1.986 -13.724 1.00 0.00 O ATOM 0 H GLU A 798 37.873 -2.532 -13.913 1.00 0.00 H new ATOM 0 HA GLU A 798 40.313 -3.024 -15.446 1.00 0.00 H new ATOM 0 HB2 GLU A 798 40.555 -0.552 -15.126 1.00 0.00 H new ATOM 0 HB3 GLU A 798 39.059 -1.005 -15.918 1.00 0.00 H new ATOM 0 HG2 GLU A 798 37.809 -0.699 -13.830 1.00 0.00 H new ATOM 0 HG3 GLU A 798 39.291 -0.379 -12.951 1.00 0.00 H new ATOM 1652 N GLU A 799 40.670 -3.642 -12.655 1.00 0.00 N ATOM 1653 CA GLU A 799 41.532 -3.853 -11.526 1.00 0.00 C ATOM 1654 C GLU A 799 42.792 -4.560 -11.983 1.00 0.00 C ATOM 1655 O GLU A 799 43.910 -4.098 -11.728 1.00 0.00 O ATOM 1656 CB GLU A 799 40.815 -4.693 -10.471 1.00 0.00 C ATOM 1657 CG GLU A 799 41.635 -4.945 -9.220 1.00 0.00 C ATOM 1658 CD GLU A 799 42.053 -3.666 -8.547 1.00 0.00 C ATOM 1659 OE1 GLU A 799 41.179 -2.968 -8.002 1.00 0.00 O ATOM 1660 OE2 GLU A 799 43.269 -3.343 -8.550 1.00 0.00 O ATOM 0 H GLU A 799 39.965 -4.366 -12.794 1.00 0.00 H new ATOM 0 HA GLU A 799 41.796 -2.891 -11.087 1.00 0.00 H new ATOM 0 HB2 GLU A 799 39.889 -4.192 -10.191 1.00 0.00 H new ATOM 0 HB3 GLU A 799 40.539 -5.651 -10.911 1.00 0.00 H new ATOM 0 HG2 GLU A 799 41.054 -5.548 -8.522 1.00 0.00 H new ATOM 0 HG3 GLU A 799 42.522 -5.524 -9.479 1.00 0.00 H new ATOM 1667 N GLU A 800 42.579 -5.651 -12.703 1.00 0.00 N ATOM 1668 CA GLU A 800 43.624 -6.542 -13.164 1.00 0.00 C ATOM 1669 C GLU A 800 44.374 -7.177 -12.019 1.00 0.00 C ATOM 1670 O GLU A 800 45.373 -6.638 -11.505 1.00 0.00 O ATOM 1671 CB GLU A 800 44.557 -5.931 -14.194 1.00 0.00 C ATOM 1672 CG GLU A 800 43.889 -5.640 -15.514 1.00 0.00 C ATOM 1673 CD GLU A 800 44.868 -5.179 -16.534 1.00 0.00 C ATOM 1674 OE1 GLU A 800 45.563 -6.024 -17.128 1.00 0.00 O ATOM 1675 OE2 GLU A 800 44.976 -3.950 -16.768 1.00 0.00 O ATOM 0 H GLU A 800 41.646 -5.946 -12.989 1.00 0.00 H new ATOM 0 HA GLU A 800 43.103 -7.338 -13.696 1.00 0.00 H new ATOM 0 HB2 GLU A 800 44.971 -5.006 -13.794 1.00 0.00 H new ATOM 0 HB3 GLU A 800 45.394 -6.609 -14.361 1.00 0.00 H new ATOM 0 HG2 GLU A 800 43.385 -6.537 -15.873 1.00 0.00 H new ATOM 0 HG3 GLU A 800 43.122 -4.878 -15.374 1.00 0.00 H new ATOM 1682 N GLY A 801 43.843 -8.282 -11.592 1.00 0.00 N ATOM 1683 CA GLY A 801 44.426 -9.052 -10.549 1.00 0.00 C ATOM 1684 C GLY A 801 45.322 -10.127 -11.107 1.00 0.00 C ATOM 1685 O GLY A 801 45.956 -9.936 -12.143 1.00 0.00 O ATOM 0 H GLY A 801 42.980 -8.675 -11.967 1.00 0.00 H new ATOM 0 HA2 GLY A 801 45.000 -8.401 -9.889 1.00 0.00 H new ATOM 0 HA3 GLY A 801 43.641 -9.506 -9.945 1.00 0.00 H new ATOM 1689 N PHE A 802 45.329 -11.252 -10.465 1.00 0.00 N ATOM 1690 CA PHE A 802 46.163 -12.384 -10.835 1.00 0.00 C ATOM 1691 C PHE A 802 45.611 -13.180 -12.002 1.00 0.00 C ATOM 1692 O PHE A 802 44.582 -12.847 -12.588 1.00 0.00 O ATOM 1693 CB PHE A 802 46.352 -13.316 -9.643 1.00 0.00 C ATOM 1694 CG PHE A 802 47.114 -12.698 -8.537 1.00 0.00 C ATOM 1695 CD1 PHE A 802 46.472 -12.043 -7.518 1.00 0.00 C ATOM 1696 CD2 PHE A 802 48.482 -12.752 -8.522 1.00 0.00 C ATOM 1697 CE1 PHE A 802 47.178 -11.463 -6.515 1.00 0.00 C ATOM 1698 CE2 PHE A 802 49.183 -12.175 -7.516 1.00 0.00 C ATOM 1699 CZ PHE A 802 48.534 -11.529 -6.506 1.00 0.00 C ATOM 0 H PHE A 802 44.746 -11.427 -9.647 1.00 0.00 H new ATOM 0 HA PHE A 802 47.119 -11.964 -11.148 1.00 0.00 H new ATOM 0 HB2 PHE A 802 45.374 -13.626 -9.274 1.00 0.00 H new ATOM 0 HB3 PHE A 802 46.869 -14.217 -9.973 1.00 0.00 H new ATOM 0 HD1 PHE A 802 45.393 -11.988 -7.514 1.00 0.00 H new ATOM 0 HD2 PHE A 802 49.007 -13.259 -9.318 1.00 0.00 H new ATOM 0 HE1 PHE A 802 46.659 -10.947 -5.721 1.00 0.00 H new ATOM 0 HE2 PHE A 802 50.262 -12.227 -7.514 1.00 0.00 H new ATOM 0 HZ PHE A 802 49.095 -11.073 -5.704 1.00 0.00 H new ATOM 1709 N SER A 803 46.329 -14.202 -12.342 1.00 0.00 N ATOM 1710 CA SER A 803 45.944 -15.155 -13.328 1.00 0.00 C ATOM 1711 C SER A 803 45.946 -16.525 -12.660 1.00 0.00 C ATOM 1712 O SER A 803 46.909 -16.880 -11.974 1.00 0.00 O ATOM 1713 CB SER A 803 46.897 -15.067 -14.530 1.00 0.00 C ATOM 1714 OG SER A 803 48.246 -14.844 -14.103 1.00 0.00 O ATOM 0 H SER A 803 47.237 -14.402 -11.922 1.00 0.00 H new ATOM 0 HA SER A 803 44.945 -14.962 -13.718 1.00 0.00 H new ATOM 0 HB2 SER A 803 46.843 -15.989 -15.109 1.00 0.00 H new ATOM 0 HB3 SER A 803 46.582 -14.258 -15.189 1.00 0.00 H new ATOM 0 HG SER A 803 48.833 -14.794 -14.886 1.00 0.00 H new ATOM 1720 N ILE A 804 44.865 -17.258 -12.795 1.00 0.00 N ATOM 1721 CA ILE A 804 44.718 -18.526 -12.087 1.00 0.00 C ATOM 1722 C ILE A 804 44.264 -19.627 -13.020 1.00 0.00 C ATOM 1723 O ILE A 804 43.855 -19.358 -14.156 1.00 0.00 O ATOM 1724 CB ILE A 804 43.724 -18.454 -10.861 1.00 0.00 C ATOM 1725 CG1 ILE A 804 42.236 -18.215 -11.276 1.00 0.00 C ATOM 1726 CG2 ILE A 804 44.166 -17.392 -9.866 1.00 0.00 C ATOM 1727 CD1 ILE A 804 41.920 -16.843 -11.851 1.00 0.00 C ATOM 0 H ILE A 804 44.072 -17.006 -13.385 1.00 0.00 H new ATOM 0 HA ILE A 804 45.711 -18.749 -11.697 1.00 0.00 H new ATOM 0 HB ILE A 804 43.763 -19.436 -10.389 1.00 0.00 H new ATOM 0 HG12 ILE A 804 41.959 -18.969 -12.013 1.00 0.00 H new ATOM 0 HG13 ILE A 804 41.605 -18.376 -10.402 1.00 0.00 H new ATOM 0 HG21 ILE A 804 43.466 -17.362 -9.031 1.00 0.00 H new ATOM 0 HG22 ILE A 804 45.162 -17.633 -9.495 1.00 0.00 H new ATOM 0 HG23 ILE A 804 44.187 -16.419 -10.357 1.00 0.00 H new ATOM 0 HD11 ILE A 804 40.861 -16.789 -12.103 1.00 0.00 H new ATOM 0 HD12 ILE A 804 42.156 -16.076 -11.113 1.00 0.00 H new ATOM 0 HD13 ILE A 804 42.516 -16.679 -12.749 1.00 0.00 H new ATOM 1739 N CYS A 805 44.331 -20.843 -12.539 1.00 0.00 N ATOM 1740 CA CYS A 805 43.921 -22.000 -13.282 1.00 0.00 C ATOM 1741 C CYS A 805 42.568 -22.457 -12.769 1.00 0.00 C ATOM 1742 O CYS A 805 42.420 -22.840 -11.591 1.00 0.00 O ATOM 1743 CB CYS A 805 44.940 -23.125 -13.118 1.00 0.00 C ATOM 1744 SG CYS A 805 44.513 -24.662 -13.987 1.00 0.00 S ATOM 0 H CYS A 805 44.678 -21.056 -11.604 1.00 0.00 H new ATOM 0 HA CYS A 805 43.853 -21.746 -14.340 1.00 0.00 H new ATOM 0 HB2 CYS A 805 45.908 -22.776 -13.478 1.00 0.00 H new ATOM 0 HB3 CYS A 805 45.054 -23.343 -12.056 1.00 0.00 H new ATOM 0 HG CYS A 805 44.778 -24.532 -15.253 1.00 0.00 H new ATOM 1749 N VAL A 806 41.586 -22.373 -13.598 1.00 0.00 N ATOM 1750 CA VAL A 806 40.270 -22.778 -13.230 1.00 0.00 C ATOM 1751 C VAL A 806 39.756 -23.810 -14.239 1.00 0.00 C ATOM 1752 O VAL A 806 40.081 -23.735 -15.429 1.00 0.00 O ATOM 1753 CB VAL A 806 39.336 -21.538 -13.169 1.00 0.00 C ATOM 1754 CG1 VAL A 806 39.228 -20.904 -14.511 1.00 0.00 C ATOM 1755 CG2 VAL A 806 37.966 -21.872 -12.613 1.00 0.00 C ATOM 0 H VAL A 806 41.671 -22.021 -14.552 1.00 0.00 H new ATOM 0 HA VAL A 806 40.285 -23.238 -12.242 1.00 0.00 H new ATOM 0 HB VAL A 806 39.787 -20.826 -12.478 1.00 0.00 H new ATOM 0 HG11 VAL A 806 38.570 -20.037 -14.452 1.00 0.00 H new ATOM 0 HG12 VAL A 806 40.216 -20.588 -14.845 1.00 0.00 H new ATOM 0 HG13 VAL A 806 38.818 -21.622 -15.221 1.00 0.00 H new ATOM 0 HG21 VAL A 806 37.353 -20.971 -12.592 1.00 0.00 H new ATOM 0 HG22 VAL A 806 37.489 -22.621 -13.246 1.00 0.00 H new ATOM 0 HG23 VAL A 806 38.070 -22.264 -11.601 1.00 0.00 H new ATOM 1765 N GLU A 807 39.014 -24.777 -13.775 1.00 0.00 N ATOM 1766 CA GLU A 807 38.456 -25.757 -14.644 1.00 0.00 C ATOM 1767 C GLU A 807 37.079 -25.310 -15.106 1.00 0.00 C ATOM 1768 O GLU A 807 36.105 -25.296 -14.323 1.00 0.00 O ATOM 1769 CB GLU A 807 38.379 -27.139 -13.992 1.00 0.00 C ATOM 1770 CG GLU A 807 37.962 -28.221 -14.972 1.00 0.00 C ATOM 1771 CD GLU A 807 37.734 -29.552 -14.336 1.00 0.00 C ATOM 1772 OE1 GLU A 807 38.708 -30.300 -14.117 1.00 0.00 O ATOM 1773 OE2 GLU A 807 36.568 -29.890 -14.051 1.00 0.00 O ATOM 0 H GLU A 807 38.784 -24.902 -12.789 1.00 0.00 H new ATOM 0 HA GLU A 807 39.119 -25.850 -15.504 1.00 0.00 H new ATOM 0 HB2 GLU A 807 39.351 -27.392 -13.568 1.00 0.00 H new ATOM 0 HB3 GLU A 807 37.669 -27.108 -13.166 1.00 0.00 H new ATOM 0 HG2 GLU A 807 37.048 -27.908 -15.477 1.00 0.00 H new ATOM 0 HG3 GLU A 807 38.731 -28.321 -15.738 1.00 0.00 H new ATOM 1780 N VAL A 808 37.019 -24.884 -16.335 1.00 0.00 N ATOM 1781 CA VAL A 808 35.845 -24.510 -16.981 1.00 0.00 C ATOM 1782 C VAL A 808 35.732 -25.377 -18.207 1.00 0.00 C ATOM 1783 O VAL A 808 36.748 -25.805 -18.744 1.00 0.00 O ATOM 1784 CB VAL A 808 35.862 -23.036 -17.427 1.00 0.00 C ATOM 1785 CG1 VAL A 808 36.156 -22.098 -16.291 1.00 0.00 C ATOM 1786 CG2 VAL A 808 36.765 -22.778 -18.631 1.00 0.00 C ATOM 0 H VAL A 808 37.846 -24.792 -16.924 1.00 0.00 H new ATOM 0 HA VAL A 808 35.007 -24.631 -16.294 1.00 0.00 H new ATOM 0 HB VAL A 808 34.848 -22.822 -17.763 1.00 0.00 H new ATOM 0 HG11 VAL A 808 36.157 -21.072 -16.658 1.00 0.00 H new ATOM 0 HG12 VAL A 808 35.392 -22.208 -15.521 1.00 0.00 H new ATOM 0 HG13 VAL A 808 37.133 -22.333 -15.869 1.00 0.00 H new ATOM 0 HG21 VAL A 808 36.730 -21.720 -18.892 1.00 0.00 H new ATOM 0 HG22 VAL A 808 37.789 -23.057 -18.384 1.00 0.00 H new ATOM 0 HG23 VAL A 808 36.421 -23.372 -19.478 1.00 0.00 H new ATOM 1796 N ASN A 809 34.536 -25.707 -18.599 1.00 0.00 N ATOM 1797 CA ASN A 809 34.291 -26.478 -19.829 1.00 0.00 C ATOM 1798 C ASN A 809 34.782 -27.923 -19.750 1.00 0.00 C ATOM 1799 O ASN A 809 34.718 -28.659 -20.733 1.00 0.00 O ATOM 1800 CB ASN A 809 34.932 -25.804 -21.048 1.00 0.00 C ATOM 1801 CG ASN A 809 34.269 -24.507 -21.416 1.00 0.00 C ATOM 1802 OD1 ASN A 809 33.060 -24.321 -21.234 1.00 0.00 O ATOM 1803 ND2 ASN A 809 35.035 -23.592 -21.890 1.00 0.00 N ATOM 0 H ASN A 809 33.688 -25.459 -18.089 1.00 0.00 H new ATOM 0 HA ASN A 809 33.207 -26.499 -19.939 1.00 0.00 H new ATOM 0 HB2 ASN A 809 35.987 -25.621 -20.843 1.00 0.00 H new ATOM 0 HB3 ASN A 809 34.886 -26.484 -21.899 1.00 0.00 H new ATOM 0 HD21 ASN A 809 34.650 -22.678 -22.129 1.00 0.00 H new ATOM 0 HD22 ASN A 809 36.028 -23.779 -22.028 1.00 0.00 H new ATOM 1810 N GLY A 810 35.270 -28.327 -18.591 1.00 0.00 N ATOM 1811 CA GLY A 810 35.867 -29.641 -18.448 1.00 0.00 C ATOM 1812 C GLY A 810 37.356 -29.578 -18.742 1.00 0.00 C ATOM 1813 O GLY A 810 38.050 -30.600 -18.805 1.00 0.00 O ATOM 0 H GLY A 810 35.265 -27.766 -17.739 1.00 0.00 H new ATOM 0 HA2 GLY A 810 35.704 -30.014 -17.437 1.00 0.00 H new ATOM 0 HA3 GLY A 810 35.384 -30.343 -19.128 1.00 0.00 H new ATOM 1817 N LYS A 811 37.832 -28.378 -18.938 1.00 0.00 N ATOM 1818 CA LYS A 811 39.218 -28.102 -19.223 1.00 0.00 C ATOM 1819 C LYS A 811 39.752 -27.189 -18.149 1.00 0.00 C ATOM 1820 O LYS A 811 38.993 -26.551 -17.463 1.00 0.00 O ATOM 1821 CB LYS A 811 39.304 -27.340 -20.530 1.00 0.00 C ATOM 1822 CG LYS A 811 38.747 -28.060 -21.739 1.00 0.00 C ATOM 1823 CD LYS A 811 38.607 -27.104 -22.914 1.00 0.00 C ATOM 1824 CE LYS A 811 39.924 -26.425 -23.255 1.00 0.00 C ATOM 1825 NZ LYS A 811 39.780 -25.449 -24.348 1.00 0.00 N ATOM 0 H LYS A 811 37.251 -27.540 -18.903 1.00 0.00 H new ATOM 0 HA LYS A 811 39.778 -29.036 -19.272 1.00 0.00 H new ATOM 0 HB2 LYS A 811 38.774 -26.394 -20.415 1.00 0.00 H new ATOM 0 HB3 LYS A 811 40.349 -27.098 -20.722 1.00 0.00 H new ATOM 0 HG2 LYS A 811 39.404 -28.886 -22.012 1.00 0.00 H new ATOM 0 HG3 LYS A 811 37.776 -28.492 -21.497 1.00 0.00 H new ATOM 0 HD2 LYS A 811 38.244 -27.650 -23.785 1.00 0.00 H new ATOM 0 HD3 LYS A 811 37.859 -26.347 -22.678 1.00 0.00 H new ATOM 0 HE2 LYS A 811 40.311 -25.921 -22.369 1.00 0.00 H new ATOM 0 HE3 LYS A 811 40.657 -27.180 -23.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 40.702 -25.011 -24.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 39.436 -25.932 -25.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 39.100 -24.713 -24.069 1.00 0.00 H new ATOM 1839 N GLU A 812 41.024 -27.122 -18.009 1.00 0.00 N ATOM 1840 CA GLU A 812 41.602 -26.166 -17.104 1.00 0.00 C ATOM 1841 C GLU A 812 42.169 -25.058 -17.925 1.00 0.00 C ATOM 1842 O GLU A 812 42.835 -25.311 -18.920 1.00 0.00 O ATOM 1843 CB GLU A 812 42.619 -26.806 -16.163 1.00 0.00 C ATOM 1844 CG GLU A 812 41.972 -27.738 -15.148 1.00 0.00 C ATOM 1845 CD GLU A 812 42.960 -28.408 -14.239 1.00 0.00 C ATOM 1846 OE1 GLU A 812 43.211 -29.631 -14.411 1.00 0.00 O ATOM 1847 OE2 GLU A 812 43.508 -27.748 -13.337 1.00 0.00 O ATOM 0 H GLU A 812 41.695 -27.711 -18.503 1.00 0.00 H new ATOM 0 HA GLU A 812 40.840 -25.763 -16.438 1.00 0.00 H new ATOM 0 HB2 GLU A 812 43.350 -27.364 -16.749 1.00 0.00 H new ATOM 0 HB3 GLU A 812 43.164 -26.023 -15.636 1.00 0.00 H new ATOM 0 HG2 GLU A 812 41.262 -27.171 -14.546 1.00 0.00 H new ATOM 0 HG3 GLU A 812 41.402 -28.501 -15.678 1.00 0.00 H new ATOM 1854 N GLN A 813 41.841 -23.856 -17.561 1.00 0.00 N ATOM 1855 CA GLN A 813 42.183 -22.703 -18.327 1.00 0.00 C ATOM 1856 C GLN A 813 42.639 -21.575 -17.410 1.00 0.00 C ATOM 1857 O GLN A 813 42.166 -21.447 -16.271 1.00 0.00 O ATOM 1858 CB GLN A 813 40.946 -22.287 -19.126 1.00 0.00 C ATOM 1859 CG GLN A 813 41.089 -21.024 -19.944 1.00 0.00 C ATOM 1860 CD GLN A 813 39.812 -20.687 -20.701 1.00 0.00 C ATOM 1861 OE1 GLN A 813 39.051 -21.571 -21.093 1.00 0.00 O ATOM 1862 NE2 GLN A 813 39.560 -19.424 -20.909 1.00 0.00 N ATOM 0 H GLN A 813 41.320 -23.648 -16.709 1.00 0.00 H new ATOM 0 HA GLN A 813 43.006 -22.927 -19.005 1.00 0.00 H new ATOM 0 HB2 GLN A 813 40.677 -23.104 -19.796 1.00 0.00 H new ATOM 0 HB3 GLN A 813 40.115 -22.157 -18.433 1.00 0.00 H new ATOM 0 HG2 GLN A 813 41.351 -20.194 -19.287 1.00 0.00 H new ATOM 0 HG3 GLN A 813 41.910 -21.141 -20.652 1.00 0.00 H new ATOM 0 HE21 GLN A 813 40.209 -18.712 -20.573 1.00 0.00 H new ATOM 0 HE22 GLN A 813 38.714 -19.148 -21.408 1.00 0.00 H new ATOM 1871 N THR A 814 43.562 -20.786 -17.892 1.00 0.00 N ATOM 1872 CA THR A 814 44.062 -19.659 -17.165 1.00 0.00 C ATOM 1873 C THR A 814 43.295 -18.434 -17.551 1.00 0.00 C ATOM 1874 O THR A 814 43.262 -18.042 -18.722 1.00 0.00 O ATOM 1875 CB THR A 814 45.506 -19.393 -17.512 1.00 0.00 C ATOM 1876 OG1 THR A 814 46.260 -20.565 -17.318 1.00 0.00 O ATOM 1877 CG2 THR A 814 46.097 -18.257 -16.683 1.00 0.00 C ATOM 0 H THR A 814 43.989 -20.912 -18.809 1.00 0.00 H new ATOM 0 HA THR A 814 43.961 -19.881 -16.103 1.00 0.00 H new ATOM 0 HB THR A 814 45.545 -19.089 -18.558 1.00 0.00 H new ATOM 0 HG1 THR A 814 47.175 -20.422 -17.639 1.00 0.00 H new ATOM 0 HG21 THR A 814 47.138 -18.102 -16.968 1.00 0.00 H new ATOM 0 HG22 THR A 814 45.531 -17.343 -16.863 1.00 0.00 H new ATOM 0 HG23 THR A 814 46.045 -18.513 -15.625 1.00 0.00 H new ATOM 1885 N MET A 815 42.692 -17.854 -16.605 1.00 0.00 N ATOM 1886 CA MET A 815 41.991 -16.642 -16.806 1.00 0.00 C ATOM 1887 C MET A 815 42.389 -15.656 -15.755 1.00 0.00 C ATOM 1888 O MET A 815 43.102 -16.011 -14.801 1.00 0.00 O ATOM 1889 CB MET A 815 40.497 -16.886 -16.849 1.00 0.00 C ATOM 1890 CG MET A 815 39.991 -17.742 -15.738 1.00 0.00 C ATOM 1891 SD MET A 815 38.237 -18.099 -15.907 1.00 0.00 S ATOM 1892 CE MET A 815 38.269 -19.182 -17.336 1.00 0.00 C ATOM 0 H MET A 815 42.664 -18.204 -15.647 1.00 0.00 H new ATOM 0 HA MET A 815 42.257 -16.217 -17.774 1.00 0.00 H new ATOM 0 HB2 MET A 815 39.981 -15.926 -16.818 1.00 0.00 H new ATOM 0 HB3 MET A 815 40.243 -17.354 -17.800 1.00 0.00 H new ATOM 0 HG2 MET A 815 40.551 -18.677 -15.717 1.00 0.00 H new ATOM 0 HG3 MET A 815 40.169 -17.243 -14.786 1.00 0.00 H new ATOM 0 HE1 MET A 815 37.264 -19.554 -17.533 1.00 0.00 H new ATOM 0 HE2 MET A 815 38.628 -18.629 -18.204 1.00 0.00 H new ATOM 0 HE3 MET A 815 38.935 -20.023 -17.141 1.00 0.00 H new ATOM 1902 N SER A 816 41.960 -14.454 -15.908 1.00 0.00 N ATOM 1903 CA SER A 816 42.304 -13.423 -14.995 1.00 0.00 C ATOM 1904 C SER A 816 41.392 -13.486 -13.778 1.00 0.00 C ATOM 1905 O SER A 816 40.254 -13.971 -13.872 1.00 0.00 O ATOM 1906 CB SER A 816 42.216 -12.072 -15.705 1.00 0.00 C ATOM 1907 OG SER A 816 43.130 -12.021 -16.807 1.00 0.00 O ATOM 0 H SER A 816 41.357 -14.156 -16.675 1.00 0.00 H new ATOM 0 HA SER A 816 43.328 -13.555 -14.644 1.00 0.00 H new ATOM 0 HB2 SER A 816 41.199 -11.908 -16.061 1.00 0.00 H new ATOM 0 HB3 SER A 816 42.441 -11.270 -15.002 1.00 0.00 H new ATOM 0 HG SER A 816 43.059 -11.150 -17.251 1.00 0.00 H new ATOM 1913 N GLU A 817 41.910 -13.027 -12.655 1.00 0.00 N ATOM 1914 CA GLU A 817 41.223 -12.999 -11.371 1.00 0.00 C ATOM 1915 C GLU A 817 39.877 -12.293 -11.541 1.00 0.00 C ATOM 1916 O GLU A 817 38.833 -12.799 -11.133 1.00 0.00 O ATOM 1917 CB GLU A 817 42.104 -12.243 -10.375 1.00 0.00 C ATOM 1918 CG GLU A 817 41.911 -12.596 -8.909 1.00 0.00 C ATOM 1919 CD GLU A 817 42.940 -11.929 -8.022 1.00 0.00 C ATOM 1920 OE1 GLU A 817 43.156 -12.402 -6.887 1.00 0.00 O ATOM 1921 OE2 GLU A 817 43.571 -10.979 -8.470 1.00 0.00 O ATOM 0 H GLU A 817 42.856 -12.649 -12.606 1.00 0.00 H new ATOM 0 HA GLU A 817 41.042 -14.009 -11.003 1.00 0.00 H new ATOM 0 HB2 GLU A 817 43.147 -12.421 -10.636 1.00 0.00 H new ATOM 0 HB3 GLU A 817 41.922 -11.175 -10.498 1.00 0.00 H new ATOM 0 HG2 GLU A 817 40.912 -12.296 -8.593 1.00 0.00 H new ATOM 0 HG3 GLU A 817 41.973 -13.677 -8.786 1.00 0.00 H new ATOM 1928 N CYS A 818 39.923 -11.169 -12.242 1.00 0.00 N ATOM 1929 CA CYS A 818 38.752 -10.357 -12.539 1.00 0.00 C ATOM 1930 C CYS A 818 37.681 -11.171 -13.289 1.00 0.00 C ATOM 1931 O CYS A 818 36.491 -11.058 -13.012 1.00 0.00 O ATOM 1932 CB CYS A 818 39.179 -9.166 -13.392 1.00 0.00 C ATOM 1933 SG CYS A 818 40.591 -8.246 -12.699 1.00 0.00 S ATOM 0 H CYS A 818 40.789 -10.790 -12.626 1.00 0.00 H new ATOM 0 HA CYS A 818 38.318 -10.016 -11.599 1.00 0.00 H new ATOM 0 HB2 CYS A 818 39.440 -9.519 -14.390 1.00 0.00 H new ATOM 0 HB3 CYS A 818 38.333 -8.488 -13.504 1.00 0.00 H new ATOM 0 HG CYS A 818 40.698 -8.506 -11.430 1.00 0.00 H new ATOM 1938 N GLU A 819 38.137 -12.034 -14.177 1.00 0.00 N ATOM 1939 CA GLU A 819 37.269 -12.810 -15.026 1.00 0.00 C ATOM 1940 C GLU A 819 36.675 -13.969 -14.270 1.00 0.00 C ATOM 1941 O GLU A 819 35.459 -14.087 -14.184 1.00 0.00 O ATOM 1942 CB GLU A 819 38.043 -13.291 -16.242 1.00 0.00 C ATOM 1943 CG GLU A 819 37.248 -14.118 -17.215 1.00 0.00 C ATOM 1944 CD GLU A 819 37.960 -14.245 -18.521 1.00 0.00 C ATOM 1945 OE1 GLU A 819 39.075 -14.781 -18.555 1.00 0.00 O ATOM 1946 OE2 GLU A 819 37.422 -13.790 -19.538 1.00 0.00 O ATOM 0 H GLU A 819 39.130 -12.214 -14.327 1.00 0.00 H new ATOM 0 HA GLU A 819 36.444 -12.180 -15.361 1.00 0.00 H new ATOM 0 HB2 GLU A 819 38.442 -12.423 -16.767 1.00 0.00 H new ATOM 0 HB3 GLU A 819 38.896 -13.878 -15.902 1.00 0.00 H new ATOM 0 HG2 GLU A 819 37.072 -15.109 -16.796 1.00 0.00 H new ATOM 0 HG3 GLU A 819 36.271 -13.660 -17.373 1.00 0.00 H new ATOM 1953 N ALA A 820 37.540 -14.797 -13.692 1.00 0.00 N ATOM 1954 CA ALA A 820 37.113 -15.968 -12.929 1.00 0.00 C ATOM 1955 C ALA A 820 36.125 -15.572 -11.824 1.00 0.00 C ATOM 1956 O ALA A 820 35.136 -16.268 -11.567 1.00 0.00 O ATOM 1957 CB ALA A 820 38.313 -16.662 -12.316 1.00 0.00 C ATOM 0 H ALA A 820 38.552 -14.677 -13.738 1.00 0.00 H new ATOM 0 HA ALA A 820 36.613 -16.652 -13.614 1.00 0.00 H new ATOM 0 HB1 ALA A 820 37.980 -17.532 -11.751 1.00 0.00 H new ATOM 0 HB2 ALA A 820 38.992 -16.981 -13.107 1.00 0.00 H new ATOM 0 HB3 ALA A 820 38.831 -15.972 -11.649 1.00 0.00 H new ATOM 1963 N GLY A 821 36.391 -14.430 -11.199 1.00 0.00 N ATOM 1964 CA GLY A 821 35.534 -13.928 -10.160 1.00 0.00 C ATOM 1965 C GLY A 821 34.188 -13.507 -10.664 1.00 0.00 C ATOM 1966 O GLY A 821 33.160 -13.863 -10.065 1.00 0.00 O ATOM 0 H GLY A 821 37.199 -13.841 -11.403 1.00 0.00 H new ATOM 0 HA2 GLY A 821 35.406 -14.697 -9.399 1.00 0.00 H new ATOM 0 HA3 GLY A 821 36.017 -13.079 -9.677 1.00 0.00 H new ATOM 1970 N ALA A 822 34.176 -12.771 -11.763 1.00 0.00 N ATOM 1971 CA ALA A 822 32.933 -12.321 -12.355 1.00 0.00 C ATOM 1972 C ALA A 822 32.114 -13.506 -12.827 1.00 0.00 C ATOM 1973 O ALA A 822 30.880 -13.489 -12.762 1.00 0.00 O ATOM 1974 CB ALA A 822 33.189 -11.369 -13.493 1.00 0.00 C ATOM 0 H ALA A 822 35.015 -12.474 -12.261 1.00 0.00 H new ATOM 0 HA ALA A 822 32.367 -11.787 -11.591 1.00 0.00 H new ATOM 0 HB1 ALA A 822 32.239 -11.047 -13.919 1.00 0.00 H new ATOM 0 HB2 ALA A 822 33.734 -10.500 -13.125 1.00 0.00 H new ATOM 0 HB3 ALA A 822 33.779 -11.870 -14.260 1.00 0.00 H new ATOM 1980 N LEU A 823 32.803 -14.549 -13.270 1.00 0.00 N ATOM 1981 CA LEU A 823 32.157 -15.771 -13.680 1.00 0.00 C ATOM 1982 C LEU A 823 31.412 -16.402 -12.513 1.00 0.00 C ATOM 1983 O LEU A 823 30.234 -16.742 -12.656 1.00 0.00 O ATOM 1984 CB LEU A 823 33.151 -16.755 -14.314 1.00 0.00 C ATOM 1985 CG LEU A 823 33.826 -16.277 -15.611 1.00 0.00 C ATOM 1986 CD1 LEU A 823 34.778 -17.323 -16.145 1.00 0.00 C ATOM 1987 CD2 LEU A 823 32.793 -15.905 -16.669 1.00 0.00 C ATOM 0 H LEU A 823 33.820 -14.564 -13.352 1.00 0.00 H new ATOM 0 HA LEU A 823 31.427 -15.520 -14.450 1.00 0.00 H new ATOM 0 HB2 LEU A 823 33.928 -16.980 -13.583 1.00 0.00 H new ATOM 0 HB3 LEU A 823 32.628 -17.689 -14.521 1.00 0.00 H new ATOM 0 HG LEU A 823 34.400 -15.382 -15.370 1.00 0.00 H new ATOM 0 HD11 LEU A 823 35.241 -16.959 -17.062 1.00 0.00 H new ATOM 0 HD12 LEU A 823 35.551 -17.524 -15.403 1.00 0.00 H new ATOM 0 HD13 LEU A 823 34.229 -18.241 -16.355 1.00 0.00 H new ATOM 0 HD21 LEU A 823 33.302 -15.571 -17.573 1.00 0.00 H new ATOM 0 HD22 LEU A 823 32.178 -16.775 -16.899 1.00 0.00 H new ATOM 0 HD23 LEU A 823 32.159 -15.102 -16.292 1.00 0.00 H new ATOM 1999 N ARG A 824 32.077 -16.485 -11.332 1.00 0.00 N ATOM 2000 CA ARG A 824 31.440 -17.039 -10.104 1.00 0.00 C ATOM 2001 C ARG A 824 30.178 -16.264 -9.816 1.00 0.00 C ATOM 2002 O ARG A 824 29.127 -16.810 -9.489 1.00 0.00 O ATOM 2003 CB ARG A 824 32.318 -16.868 -8.844 1.00 0.00 C ATOM 2004 CG ARG A 824 33.745 -17.353 -8.912 1.00 0.00 C ATOM 2005 CD ARG A 824 34.370 -17.370 -7.525 1.00 0.00 C ATOM 2006 NE ARG A 824 34.338 -16.049 -6.853 1.00 0.00 N ATOM 2007 CZ ARG A 824 34.704 -15.841 -5.566 1.00 0.00 C ATOM 2008 NH1 ARG A 824 35.081 -16.860 -4.811 1.00 0.00 N ATOM 2009 NH2 ARG A 824 34.695 -14.623 -5.046 1.00 0.00 N ATOM 0 H ARG A 824 33.042 -16.180 -11.202 1.00 0.00 H new ATOM 0 HA ARG A 824 31.271 -18.098 -10.298 1.00 0.00 H new ATOM 0 HB2 ARG A 824 32.336 -15.808 -8.589 1.00 0.00 H new ATOM 0 HB3 ARG A 824 31.827 -17.386 -8.020 1.00 0.00 H new ATOM 0 HG2 ARG A 824 33.775 -18.354 -9.343 1.00 0.00 H new ATOM 0 HG3 ARG A 824 34.324 -16.705 -9.570 1.00 0.00 H new ATOM 0 HD2 ARG A 824 33.845 -18.098 -6.906 1.00 0.00 H new ATOM 0 HD3 ARG A 824 35.404 -17.705 -7.604 1.00 0.00 H new ATOM 0 HE ARG A 824 34.020 -15.245 -7.395 1.00 0.00 H new ATOM 0 HH11 ARG A 824 35.096 -17.803 -5.198 1.00 0.00 H new ATOM 0 HH12 ARG A 824 35.356 -16.702 -3.842 1.00 0.00 H new ATOM 0 HH21 ARG A 824 34.410 -13.827 -5.617 1.00 0.00 H new ATOM 0 HH22 ARG A 824 34.973 -14.481 -4.075 1.00 0.00 H new ATOM 2023 N CYS A 825 30.314 -14.983 -9.947 1.00 0.00 N ATOM 2024 CA CYS A 825 29.277 -14.057 -9.669 1.00 0.00 C ATOM 2025 C CYS A 825 28.091 -14.144 -10.623 1.00 0.00 C ATOM 2026 O CYS A 825 26.965 -14.237 -10.169 1.00 0.00 O ATOM 2027 CB CYS A 825 29.855 -12.669 -9.617 1.00 0.00 C ATOM 2028 SG CYS A 825 30.897 -12.377 -8.156 1.00 0.00 S ATOM 0 H CYS A 825 31.180 -14.544 -10.261 1.00 0.00 H new ATOM 0 HA CYS A 825 28.860 -14.319 -8.697 1.00 0.00 H new ATOM 0 HB2 CYS A 825 30.446 -12.495 -10.516 1.00 0.00 H new ATOM 0 HB3 CYS A 825 29.041 -11.944 -9.625 1.00 0.00 H new ATOM 0 HG CYS A 825 31.954 -11.706 -8.504 1.00 0.00 H new ATOM 2033 N ARG A 826 28.336 -14.173 -11.932 1.00 0.00 N ATOM 2034 CA ARG A 826 27.233 -14.133 -12.888 1.00 0.00 C ATOM 2035 C ARG A 826 26.444 -15.430 -12.941 1.00 0.00 C ATOM 2036 O ARG A 826 25.291 -15.449 -13.389 1.00 0.00 O ATOM 2037 CB ARG A 826 27.683 -13.737 -14.298 1.00 0.00 C ATOM 2038 CG ARG A 826 28.429 -14.789 -15.078 1.00 0.00 C ATOM 2039 CD ARG A 826 28.696 -14.295 -16.490 1.00 0.00 C ATOM 2040 NE ARG A 826 28.914 -15.393 -17.438 1.00 0.00 N ATOM 2041 CZ ARG A 826 29.616 -15.285 -18.586 1.00 0.00 C ATOM 2042 NH1 ARG A 826 30.259 -14.150 -18.888 1.00 0.00 N ATOM 2043 NH2 ARG A 826 29.629 -16.296 -19.452 1.00 0.00 N ATOM 0 H ARG A 826 29.266 -14.223 -12.347 1.00 0.00 H new ATOM 0 HA ARG A 826 26.570 -13.354 -12.512 1.00 0.00 H new ATOM 0 HB2 ARG A 826 26.802 -13.447 -14.870 1.00 0.00 H new ATOM 0 HB3 ARG A 826 28.317 -12.854 -14.220 1.00 0.00 H new ATOM 0 HG2 ARG A 826 29.371 -15.023 -14.581 1.00 0.00 H new ATOM 0 HG3 ARG A 826 27.848 -15.711 -15.110 1.00 0.00 H new ATOM 0 HD2 ARG A 826 27.853 -13.692 -16.826 1.00 0.00 H new ATOM 0 HD3 ARG A 826 29.571 -13.645 -16.485 1.00 0.00 H new ATOM 0 HE ARG A 826 28.507 -16.301 -17.214 1.00 0.00 H new ATOM 0 HH11 ARG A 826 30.221 -13.357 -18.248 1.00 0.00 H new ATOM 0 HH12 ARG A 826 30.787 -14.079 -19.758 1.00 0.00 H new ATOM 0 HH21 ARG A 826 29.109 -17.150 -19.247 1.00 0.00 H new ATOM 0 HH22 ARG A 826 30.159 -16.217 -20.320 1.00 0.00 H new ATOM 2057 N GLY A 827 27.042 -16.506 -12.499 1.00 0.00 N ATOM 2058 CA GLY A 827 26.344 -17.758 -12.547 1.00 0.00 C ATOM 2059 C GLY A 827 27.094 -18.793 -13.318 1.00 0.00 C ATOM 2060 O GLY A 827 26.687 -19.962 -13.363 1.00 0.00 O ATOM 0 H GLY A 827 27.985 -16.540 -12.112 1.00 0.00 H new ATOM 0 HA2 GLY A 827 26.174 -18.116 -11.532 1.00 0.00 H new ATOM 0 HA3 GLY A 827 25.364 -17.609 -13.001 1.00 0.00 H new ATOM 2064 N GLN A 828 28.170 -18.369 -13.954 1.00 0.00 N ATOM 2065 CA GLN A 828 29.026 -19.290 -14.677 1.00 0.00 C ATOM 2066 C GLN A 828 29.632 -20.284 -13.698 1.00 0.00 C ATOM 2067 O GLN A 828 30.234 -19.898 -12.694 1.00 0.00 O ATOM 2068 CB GLN A 828 30.125 -18.531 -15.436 1.00 0.00 C ATOM 2069 CG GLN A 828 31.117 -19.417 -16.203 1.00 0.00 C ATOM 2070 CD GLN A 828 30.489 -20.263 -17.307 1.00 0.00 C ATOM 2071 OE1 GLN A 828 29.430 -19.786 -17.906 1.00 0.00 O flip ATOM 2072 NE2 GLN A 828 30.971 -21.353 -17.614 1.00 0.00 N flip ATOM 0 H GLN A 828 28.471 -17.395 -13.985 1.00 0.00 H new ATOM 0 HA GLN A 828 28.431 -19.830 -15.413 1.00 0.00 H new ATOM 0 HB2 GLN A 828 29.652 -17.847 -16.141 1.00 0.00 H new ATOM 0 HB3 GLN A 828 30.681 -17.921 -14.724 1.00 0.00 H new ATOM 0 HG2 GLN A 828 31.886 -18.782 -16.643 1.00 0.00 H new ATOM 0 HG3 GLN A 828 31.616 -20.079 -15.495 1.00 0.00 H new ATOM 0 HE21 GLN A 828 31.798 -21.700 -17.129 1.00 0.00 H new ATOM 0 HE22 GLN A 828 30.543 -21.910 -18.354 1.00 0.00 H new ATOM 2081 N SER A 829 29.420 -21.537 -13.962 1.00 0.00 N ATOM 2082 CA SER A 829 29.931 -22.580 -13.132 1.00 0.00 C ATOM 2083 C SER A 829 31.386 -22.837 -13.486 1.00 0.00 C ATOM 2084 O SER A 829 31.716 -23.185 -14.628 1.00 0.00 O ATOM 2085 CB SER A 829 29.087 -23.835 -13.306 1.00 0.00 C ATOM 2086 OG SER A 829 27.702 -23.559 -13.044 1.00 0.00 O ATOM 0 H SER A 829 28.884 -21.865 -14.765 1.00 0.00 H new ATOM 0 HA SER A 829 29.880 -22.283 -12.084 1.00 0.00 H new ATOM 0 HB2 SER A 829 29.201 -24.217 -14.320 1.00 0.00 H new ATOM 0 HB3 SER A 829 29.441 -24.614 -12.630 1.00 0.00 H new ATOM 0 HG SER A 829 27.177 -24.378 -13.163 1.00 0.00 H new ATOM 2092 N ILE A 830 32.239 -22.630 -12.524 1.00 0.00 N ATOM 2093 CA ILE A 830 33.665 -22.764 -12.686 1.00 0.00 C ATOM 2094 C ILE A 830 34.209 -23.514 -11.487 1.00 0.00 C ATOM 2095 O ILE A 830 33.612 -23.480 -10.401 1.00 0.00 O ATOM 2096 CB ILE A 830 34.424 -21.376 -12.806 1.00 0.00 C ATOM 2097 CG1 ILE A 830 34.374 -20.552 -11.485 1.00 0.00 C ATOM 2098 CG2 ILE A 830 33.889 -20.543 -13.967 1.00 0.00 C ATOM 2099 CD1 ILE A 830 33.020 -19.966 -11.136 1.00 0.00 C ATOM 0 H ILE A 830 31.959 -22.357 -11.582 1.00 0.00 H new ATOM 0 HA ILE A 830 33.836 -23.298 -13.621 1.00 0.00 H new ATOM 0 HB ILE A 830 35.468 -21.619 -13.003 1.00 0.00 H new ATOM 0 HG12 ILE A 830 34.696 -21.193 -10.664 1.00 0.00 H new ATOM 0 HG13 ILE A 830 35.096 -19.738 -11.556 1.00 0.00 H new ATOM 0 HG21 ILE A 830 34.432 -19.599 -14.019 1.00 0.00 H new ATOM 0 HG22 ILE A 830 34.023 -21.090 -14.900 1.00 0.00 H new ATOM 0 HG23 ILE A 830 32.829 -20.343 -13.813 1.00 0.00 H new ATOM 0 HD11 ILE A 830 33.094 -19.412 -10.200 1.00 0.00 H new ATOM 0 HD12 ILE A 830 32.699 -19.293 -11.931 1.00 0.00 H new ATOM 0 HD13 ILE A 830 32.293 -20.771 -11.025 1.00 0.00 H new ATOM 2111 N SER A 831 35.292 -24.190 -11.673 1.00 0.00 N ATOM 2112 CA SER A 831 35.908 -24.927 -10.618 1.00 0.00 C ATOM 2113 C SER A 831 37.359 -24.490 -10.444 1.00 0.00 C ATOM 2114 O SER A 831 38.207 -24.856 -11.240 1.00 0.00 O ATOM 2115 CB SER A 831 35.858 -26.388 -10.981 1.00 0.00 C ATOM 2116 OG SER A 831 34.522 -26.845 -11.155 1.00 0.00 O ATOM 0 H SER A 831 35.780 -24.248 -12.567 1.00 0.00 H new ATOM 0 HA SER A 831 35.382 -24.746 -9.681 1.00 0.00 H new ATOM 0 HB2 SER A 831 36.421 -26.554 -11.900 1.00 0.00 H new ATOM 0 HB3 SER A 831 36.343 -26.973 -10.200 1.00 0.00 H new ATOM 0 HG SER A 831 34.530 -27.796 -11.391 1.00 0.00 H new ATOM 2122 N VAL A 832 37.638 -23.666 -9.454 1.00 0.00 N ATOM 2123 CA VAL A 832 39.011 -23.215 -9.233 1.00 0.00 C ATOM 2124 C VAL A 832 39.880 -24.357 -8.704 1.00 0.00 C ATOM 2125 O VAL A 832 39.687 -24.853 -7.583 1.00 0.00 O ATOM 2126 CB VAL A 832 39.101 -21.931 -8.336 1.00 0.00 C ATOM 2127 CG1 VAL A 832 38.407 -22.109 -6.986 1.00 0.00 C ATOM 2128 CG2 VAL A 832 40.555 -21.493 -8.147 1.00 0.00 C ATOM 0 H VAL A 832 36.951 -23.296 -8.797 1.00 0.00 H new ATOM 0 HA VAL A 832 39.408 -22.915 -10.203 1.00 0.00 H new ATOM 0 HB VAL A 832 38.567 -21.142 -8.865 1.00 0.00 H new ATOM 0 HG11 VAL A 832 38.499 -21.191 -6.406 1.00 0.00 H new ATOM 0 HG12 VAL A 832 37.352 -22.333 -7.146 1.00 0.00 H new ATOM 0 HG13 VAL A 832 38.874 -22.931 -6.442 1.00 0.00 H new ATOM 0 HG21 VAL A 832 40.588 -20.601 -7.521 1.00 0.00 H new ATOM 0 HG22 VAL A 832 41.117 -22.294 -7.667 1.00 0.00 H new ATOM 0 HG23 VAL A 832 40.997 -21.272 -9.118 1.00 0.00 H new ATOM 2138 N THR A 833 40.789 -24.804 -9.537 1.00 0.00 N ATOM 2139 CA THR A 833 41.647 -25.893 -9.210 1.00 0.00 C ATOM 2140 C THR A 833 42.937 -25.395 -8.551 1.00 0.00 C ATOM 2141 O THR A 833 43.463 -26.027 -7.616 1.00 0.00 O ATOM 2142 CB THR A 833 41.957 -26.728 -10.483 1.00 0.00 C ATOM 2143 OG1 THR A 833 42.417 -25.866 -11.536 1.00 0.00 O ATOM 2144 CG2 THR A 833 40.715 -27.473 -10.962 1.00 0.00 C ATOM 0 H THR A 833 40.947 -24.412 -10.465 1.00 0.00 H new ATOM 0 HA THR A 833 41.137 -26.534 -8.491 1.00 0.00 H new ATOM 0 HB THR A 833 42.731 -27.452 -10.229 1.00 0.00 H new ATOM 0 HG1 THR A 833 42.829 -26.405 -12.243 1.00 0.00 H new ATOM 0 HG21 THR A 833 40.958 -28.050 -11.854 1.00 0.00 H new ATOM 0 HG22 THR A 833 40.369 -28.146 -10.178 1.00 0.00 H new ATOM 0 HG23 THR A 833 39.929 -26.756 -11.197 1.00 0.00 H new ATOM 2152 N SER A 834 43.421 -24.245 -8.998 1.00 0.00 N ATOM 2153 CA SER A 834 44.641 -23.706 -8.469 1.00 0.00 C ATOM 2154 C SER A 834 44.690 -22.192 -8.637 1.00 0.00 C ATOM 2155 O SER A 834 44.024 -21.619 -9.497 1.00 0.00 O ATOM 2156 CB SER A 834 45.854 -24.361 -9.155 1.00 0.00 C ATOM 2157 OG SER A 834 47.082 -23.909 -8.590 1.00 0.00 O ATOM 0 H SER A 834 42.981 -23.678 -9.723 1.00 0.00 H new ATOM 0 HA SER A 834 44.676 -23.928 -7.402 1.00 0.00 H new ATOM 0 HB2 SER A 834 45.786 -25.445 -9.060 1.00 0.00 H new ATOM 0 HB3 SER A 834 45.837 -24.133 -10.221 1.00 0.00 H new ATOM 0 HG SER A 834 47.832 -24.345 -9.046 1.00 0.00 H new ATOM 2163 N ILE A 835 45.498 -21.563 -7.816 1.00 0.00 N ATOM 2164 CA ILE A 835 45.696 -20.129 -7.846 1.00 0.00 C ATOM 2165 C ILE A 835 46.944 -19.789 -8.654 1.00 0.00 C ATOM 2166 O ILE A 835 47.417 -18.633 -8.683 1.00 0.00 O ATOM 2167 CB ILE A 835 45.765 -19.554 -6.402 1.00 0.00 C ATOM 2168 CG1 ILE A 835 46.867 -20.176 -5.519 1.00 0.00 C ATOM 2169 CG2 ILE A 835 44.431 -19.715 -5.736 1.00 0.00 C ATOM 2170 CD1 ILE A 835 48.259 -19.639 -5.710 1.00 0.00 C ATOM 0 H ILE A 835 46.045 -22.038 -7.098 1.00 0.00 H new ATOM 0 HA ILE A 835 44.843 -19.662 -8.338 1.00 0.00 H new ATOM 0 HB ILE A 835 46.028 -18.501 -6.507 1.00 0.00 H new ATOM 0 HG12 ILE A 835 46.587 -20.037 -4.475 1.00 0.00 H new ATOM 0 HG13 ILE A 835 46.887 -21.250 -5.703 1.00 0.00 H new ATOM 0 HG21 ILE A 835 44.479 -19.312 -4.724 1.00 0.00 H new ATOM 0 HG22 ILE A 835 43.673 -19.177 -6.305 1.00 0.00 H new ATOM 0 HG23 ILE A 835 44.171 -20.773 -5.694 1.00 0.00 H new ATOM 0 HD11 ILE A 835 48.943 -20.153 -5.035 1.00 0.00 H new ATOM 0 HD12 ILE A 835 48.574 -19.803 -6.741 1.00 0.00 H new ATOM 0 HD13 ILE A 835 48.270 -18.571 -5.493 1.00 0.00 H new ATOM 2182 N ARG A 836 47.498 -20.809 -9.264 1.00 0.00 N ATOM 2183 CA ARG A 836 48.621 -20.667 -10.140 1.00 0.00 C ATOM 2184 C ARG A 836 48.083 -20.659 -11.553 1.00 0.00 C ATOM 2185 O ARG A 836 47.115 -21.360 -11.826 1.00 0.00 O ATOM 2186 CB ARG A 836 49.586 -21.856 -10.000 1.00 0.00 C ATOM 2187 CG ARG A 836 50.168 -22.090 -8.614 1.00 0.00 C ATOM 2188 CD ARG A 836 50.909 -20.872 -8.086 1.00 0.00 C ATOM 2189 NE ARG A 836 51.969 -20.396 -8.987 1.00 0.00 N ATOM 2190 CZ ARG A 836 53.000 -19.631 -8.608 1.00 0.00 C ATOM 2191 NH1 ARG A 836 53.281 -19.472 -7.314 1.00 0.00 N ATOM 2192 NH2 ARG A 836 53.791 -19.084 -9.519 1.00 0.00 N ATOM 0 H ARG A 836 47.173 -21.770 -9.160 1.00 0.00 H new ATOM 0 HA ARG A 836 49.162 -19.753 -9.896 1.00 0.00 H new ATOM 0 HB2 ARG A 836 49.062 -22.761 -10.309 1.00 0.00 H new ATOM 0 HB3 ARG A 836 50.411 -21.712 -10.698 1.00 0.00 H new ATOM 0 HG2 ARG A 836 49.365 -22.351 -7.925 1.00 0.00 H new ATOM 0 HG3 ARG A 836 50.849 -22.941 -8.647 1.00 0.00 H new ATOM 0 HD2 ARG A 836 50.195 -20.066 -7.920 1.00 0.00 H new ATOM 0 HD3 ARG A 836 51.347 -21.114 -7.118 1.00 0.00 H new ATOM 0 HE ARG A 836 51.915 -20.667 -9.969 1.00 0.00 H new ATOM 0 HH11 ARG A 836 52.709 -19.935 -6.607 1.00 0.00 H new ATOM 0 HH12 ARG A 836 54.068 -18.888 -7.031 1.00 0.00 H new ATOM 0 HH21 ARG A 836 53.615 -19.246 -10.511 1.00 0.00 H new ATOM 0 HH22 ARG A 836 54.576 -18.501 -9.229 1.00 0.00 H new ATOM 2206 N PRO A 837 48.652 -19.868 -12.458 1.00 0.00 N ATOM 2207 CA PRO A 837 48.235 -19.884 -13.853 1.00 0.00 C ATOM 2208 C PRO A 837 48.696 -21.181 -14.500 1.00 0.00 C ATOM 2209 O PRO A 837 49.778 -21.683 -14.171 1.00 0.00 O ATOM 2210 CB PRO A 837 48.985 -18.701 -14.492 1.00 0.00 C ATOM 2211 CG PRO A 837 49.628 -17.958 -13.371 1.00 0.00 C ATOM 2212 CD PRO A 837 49.734 -18.906 -12.216 1.00 0.00 C ATOM 0 HA PRO A 837 47.154 -19.810 -13.971 1.00 0.00 H new ATOM 0 HB2 PRO A 837 49.732 -19.053 -15.204 1.00 0.00 H new ATOM 0 HB3 PRO A 837 48.299 -18.057 -15.042 1.00 0.00 H new ATOM 0 HG2 PRO A 837 50.614 -17.597 -13.664 1.00 0.00 H new ATOM 0 HG3 PRO A 837 49.036 -17.084 -13.099 1.00 0.00 H new ATOM 0 HD2 PRO A 837 50.707 -19.396 -12.188 1.00 0.00 H new ATOM 0 HD3 PRO A 837 49.608 -18.392 -11.263 1.00 0.00 H new ATOM 2220 N CYS A 838 47.918 -21.735 -15.375 1.00 0.00 N ATOM 2221 CA CYS A 838 48.332 -22.942 -16.020 1.00 0.00 C ATOM 2222 C CYS A 838 48.935 -22.596 -17.380 1.00 0.00 C ATOM 2223 O CYS A 838 48.960 -21.427 -17.769 1.00 0.00 O ATOM 2224 CB CYS A 838 47.178 -23.963 -16.146 1.00 0.00 C ATOM 2225 SG CYS A 838 45.714 -23.396 -17.051 1.00 0.00 S ATOM 0 H CYS A 838 47.005 -21.378 -15.657 1.00 0.00 H new ATOM 0 HA CYS A 838 49.090 -23.427 -15.405 1.00 0.00 H new ATOM 0 HB2 CYS A 838 47.562 -24.857 -16.638 1.00 0.00 H new ATOM 0 HB3 CYS A 838 46.869 -24.259 -15.143 1.00 0.00 H new ATOM 0 HG CYS A 838 45.759 -22.104 -17.183 1.00 0.00 H new ATOM 2230 N ALA A 839 49.427 -23.578 -18.095 1.00 0.00 N ATOM 2231 CA ALA A 839 49.971 -23.340 -19.419 1.00 0.00 C ATOM 2232 C ALA A 839 48.839 -23.276 -20.436 1.00 0.00 C ATOM 2233 O ALA A 839 49.031 -22.931 -21.610 1.00 0.00 O ATOM 2234 CB ALA A 839 50.967 -24.425 -19.779 1.00 0.00 C ATOM 0 H ALA A 839 49.464 -24.550 -17.787 1.00 0.00 H new ATOM 0 HA ALA A 839 50.497 -22.385 -19.427 1.00 0.00 H new ATOM 0 HB1 ALA A 839 51.368 -24.235 -20.775 1.00 0.00 H new ATOM 0 HB2 ALA A 839 51.781 -24.427 -19.054 1.00 0.00 H new ATOM 0 HB3 ALA A 839 50.469 -25.394 -19.767 1.00 0.00 H new ATOM 2240 N ALA A 840 47.656 -23.601 -19.982 1.00 0.00 N ATOM 2241 CA ALA A 840 46.481 -23.563 -20.800 1.00 0.00 C ATOM 2242 C ALA A 840 45.968 -22.139 -20.925 1.00 0.00 C ATOM 2243 O ALA A 840 45.190 -21.647 -20.094 1.00 0.00 O ATOM 2244 CB ALA A 840 45.423 -24.474 -20.249 1.00 0.00 C ATOM 0 H ALA A 840 47.484 -23.902 -19.023 1.00 0.00 H new ATOM 0 HA ALA A 840 46.740 -23.917 -21.798 1.00 0.00 H new ATOM 0 HB1 ALA A 840 44.539 -24.431 -20.885 1.00 0.00 H new ATOM 0 HB2 ALA A 840 45.801 -25.496 -20.222 1.00 0.00 H new ATOM 0 HB3 ALA A 840 45.160 -24.158 -19.240 1.00 0.00 H new