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 -115:sc= -6.73! USER MOD Set 1.2: A 833 THR OG1 : rot 175:sc= 1.33 USER MOD Set 1.3: A 834 SER OG : rot 133:sc= -1.05 USER MOD Set 2.1: A 813 GLN :FLIP amide:sc= -0.0057 F(o=-3.8,f=-1.8) USER MOD Set 2.2: A 815 MET CE :methyl -162:sc= -1.78 (180deg=-2.22!) USER MOD Set 3.1: A 797 CYS SG : rot 85:sc= -0.538 USER MOD Set 3.2: A 818 CYS SG : rot -137:sc= 1.9 USER MOD Set 4.1: A 721 CYS SG : rot 48:sc= -0.907! USER MOD Set 4.2: A 743 CYS SG : rot -67:sc= 0.0272 USER MOD Set 5.1: A 728 CYS SG : rot 180:sc= -1.31 USER MOD Set 5.2: A 763 CYS SG : rot -11:sc= -0.435 USER MOD Single : A 701 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 702 CYS SG : rot 180:sc= 0.0448 USER MOD Single : A 703 GLN : amide:sc= -0.0212 X(o=-0.021,f=-0.021) USER MOD Single : A 707 LYS NZ :NH3+ -177:sc= 0.254 (180deg=0.233) USER MOD Single : A 709 GLN : amide:sc= -8.27! C(o=-8.3!,f=-13!) USER MOD Single : A 710 ASN : amide:sc=-0.00369 X(o=-0.0037,f=-0.081) USER MOD Single : A 711 SER OG : rot 180:sc= 0 USER MOD Single : A 713 CYS SG : rot -173:sc= 0.469 USER MOD Single : A 715 CYS SG : rot 170:sc= -0.15 USER MOD Single : A 716 LYS NZ :NH3+ 163:sc= 0.141 (180deg=0.0633) USER MOD Single : A 717 MET CE :methyl -129:sc=-0.00984 (180deg=-0.781) USER MOD Single : A 719 TYR OH : rot 180:sc= 0 USER MOD Single : A 724 SER OG : rot -57:sc= 0.0073 USER MOD Single : A 730 GLN : amide:sc=-0.000561 K(o=-0.00056,f=-1.1) USER MOD Single : A 734 SER OG : rot 180:sc= 0 USER MOD Single : A 735 LYS NZ :NH3+ -165:sc= 1.32 (180deg=1.14) USER MOD Single : A 741 THR OG1 : rot -170:sc= -0.0728 USER MOD Single : A 744 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0191) USER MOD Single : A 745 MET CE :methyl 153:sc= -0.091 (180deg=-2.35) USER MOD Single : A 746 HIS : no HD1:sc= 0.73 K(o=0.73,f=-4.4!) USER MOD Single : A 749 HIS : no HD1:sc= 0 X(o=0,f=-0.0044) USER MOD Single : A 750 CYS SG : rot -2:sc= -4.31! USER MOD Single : A 751 GLN : amide:sc= 0.282 K(o=0.28,f=-0.71) USER MOD Single : A 754 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 755 TYR OH : rot 53:sc= 1.23 USER MOD Single : A 756 THR OG1 : rot 180:sc= 0 USER MOD Single : A 758 THR OG1 : rot 150:sc= 0 USER MOD Single : A 762 SER OG : rot 180:sc= 0 USER MOD Single : A 764 THR OG1 : rot 180:sc= 0 USER MOD Single : A 791 CYS SG : rot 160:sc= -2.75! USER MOD Single : A 795 SER OG : rot 180:sc= 0.0883 USER MOD Single : A 803 SER OG : rot -148:sc= -0.557 USER MOD Single : A 809 ASN : amide:sc= -0.0204 K(o=-0.02,f=-0.78) USER MOD Single : A 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 814 THR OG1 : rot 82:sc= 0.314 USER MOD Single : A 816 SER OG : rot 180:sc= 0 USER MOD Single : A 825 CYS SG : rot 159:sc= 0.967 USER MOD Single : A 828 GLN : amide:sc= 0.464 K(o=0.46,f=-5!) 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 838 CYS SG : rot -162:sc= -0.234 USER MOD ----------------------------------------------------------------- ATOM 174 N LYS A 701 60.343 -4.311 -12.328 1.00 0.00 N ATOM 175 CA LYS A 701 60.484 -5.738 -12.570 1.00 0.00 C ATOM 176 C LYS A 701 59.828 -6.517 -11.430 1.00 0.00 C ATOM 177 O LYS A 701 60.385 -7.482 -10.914 1.00 0.00 O ATOM 178 CB LYS A 701 61.969 -6.090 -12.660 1.00 0.00 C ATOM 179 CG LYS A 701 62.707 -5.421 -13.804 1.00 0.00 C ATOM 180 CD LYS A 701 62.257 -5.945 -15.160 1.00 0.00 C ATOM 181 CE LYS A 701 63.076 -5.328 -16.282 1.00 0.00 C ATOM 182 NZ LYS A 701 62.721 -5.884 -17.604 1.00 0.00 N ATOM 0 HA LYS A 701 59.995 -6.003 -13.507 1.00 0.00 H new ATOM 0 HB2 LYS A 701 62.452 -5.814 -11.723 1.00 0.00 H new ATOM 0 HB3 LYS A 701 62.067 -7.171 -12.764 1.00 0.00 H new ATOM 0 HG2 LYS A 701 62.544 -4.344 -13.760 1.00 0.00 H new ATOM 0 HG3 LYS A 701 63.778 -5.586 -13.689 1.00 0.00 H new ATOM 0 HD2 LYS A 701 62.357 -7.030 -15.186 1.00 0.00 H new ATOM 0 HD3 LYS A 701 61.201 -5.719 -15.309 1.00 0.00 H new ATOM 0 HE2 LYS A 701 62.922 -4.249 -16.291 1.00 0.00 H new ATOM 0 HE3 LYS A 701 64.136 -5.497 -16.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 701 63.304 -5.434 -18.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 701 62.892 -6.910 -17.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 701 61.716 -5.700 -17.800 1.00 0.00 H new ATOM 196 N CYS A 702 58.643 -6.117 -11.075 1.00 0.00 N ATOM 197 CA CYS A 702 57.917 -6.757 -9.996 1.00 0.00 C ATOM 198 C CYS A 702 56.842 -7.642 -10.525 1.00 0.00 C ATOM 199 O CYS A 702 56.211 -7.343 -11.546 1.00 0.00 O ATOM 200 CB CYS A 702 57.284 -5.732 -9.043 1.00 0.00 C ATOM 201 SG CYS A 702 56.432 -4.347 -9.851 1.00 0.00 S ATOM 0 H CYS A 702 58.147 -5.343 -11.517 1.00 0.00 H new ATOM 0 HA CYS A 702 58.646 -7.350 -9.444 1.00 0.00 H new ATOM 0 HB2 CYS A 702 56.573 -6.249 -8.399 1.00 0.00 H new ATOM 0 HB3 CYS A 702 58.065 -5.330 -8.397 1.00 0.00 H new ATOM 0 HG CYS A 702 55.939 -3.554 -8.947 1.00 0.00 H new ATOM 206 N GLN A 703 56.656 -8.744 -9.864 1.00 0.00 N ATOM 207 CA GLN A 703 55.582 -9.642 -10.163 1.00 0.00 C ATOM 208 C GLN A 703 54.309 -9.057 -9.545 1.00 0.00 C ATOM 209 O GLN A 703 54.366 -8.024 -8.873 1.00 0.00 O ATOM 210 CB GLN A 703 55.886 -11.019 -9.592 1.00 0.00 C ATOM 211 CG GLN A 703 57.261 -11.585 -9.981 1.00 0.00 C ATOM 212 CD GLN A 703 57.516 -11.611 -11.477 1.00 0.00 C ATOM 213 OE1 GLN A 703 57.191 -12.577 -12.156 1.00 0.00 O ATOM 214 NE2 GLN A 703 58.146 -10.585 -11.986 1.00 0.00 N ATOM 0 H GLN A 703 57.252 -9.048 -9.094 1.00 0.00 H new ATOM 0 HA GLN A 703 55.453 -9.756 -11.239 1.00 0.00 H new ATOM 0 HB2 GLN A 703 55.823 -10.969 -8.505 1.00 0.00 H new ATOM 0 HB3 GLN A 703 55.115 -11.714 -9.924 1.00 0.00 H new ATOM 0 HG2 GLN A 703 58.037 -10.989 -9.501 1.00 0.00 H new ATOM 0 HG3 GLN A 703 57.349 -12.599 -9.590 1.00 0.00 H new ATOM 0 HE21 GLN A 703 58.402 -9.797 -11.391 1.00 0.00 H new ATOM 0 HE22 GLN A 703 58.382 -10.572 -12.978 1.00 0.00 H new ATOM 223 N ARG A 704 53.193 -9.711 -9.714 1.00 0.00 N ATOM 224 CA ARG A 704 51.911 -9.142 -9.273 1.00 0.00 C ATOM 225 C ARG A 704 51.735 -9.142 -7.749 1.00 0.00 C ATOM 226 O ARG A 704 50.881 -8.433 -7.209 1.00 0.00 O ATOM 227 CB ARG A 704 50.758 -9.800 -10.025 1.00 0.00 C ATOM 228 CG ARG A 704 50.846 -9.499 -11.500 1.00 0.00 C ATOM 229 CD ARG A 704 49.926 -10.311 -12.361 1.00 0.00 C ATOM 230 NE ARG A 704 50.205 -10.025 -13.775 1.00 0.00 N ATOM 231 CZ ARG A 704 49.717 -10.677 -14.822 1.00 0.00 C ATOM 232 NH1 ARG A 704 48.906 -11.681 -14.649 1.00 0.00 N ATOM 233 NH2 ARG A 704 50.068 -10.325 -16.044 1.00 0.00 N ATOM 0 H ARG A 704 53.125 -10.632 -10.148 1.00 0.00 H new ATOM 0 HA ARG A 704 51.909 -8.083 -9.533 1.00 0.00 H new ATOM 0 HB2 ARG A 704 50.781 -10.878 -9.866 1.00 0.00 H new ATOM 0 HB3 ARG A 704 49.807 -9.440 -9.631 1.00 0.00 H new ATOM 0 HG2 ARG A 704 50.628 -8.442 -11.655 1.00 0.00 H new ATOM 0 HG3 ARG A 704 51.871 -9.665 -11.830 1.00 0.00 H new ATOM 0 HD2 ARG A 704 50.063 -11.373 -12.159 1.00 0.00 H new ATOM 0 HD3 ARG A 704 48.888 -10.074 -12.128 1.00 0.00 H new ATOM 0 HE ARG A 704 50.836 -9.248 -13.971 1.00 0.00 H new ATOM 0 HH11 ARG A 704 48.644 -11.968 -13.706 1.00 0.00 H new ATOM 0 HH12 ARG A 704 48.533 -12.180 -15.456 1.00 0.00 H new ATOM 0 HH21 ARG A 704 50.716 -9.550 -16.185 1.00 0.00 H new ATOM 0 HH22 ARG A 704 49.691 -10.828 -16.848 1.00 0.00 H new ATOM 247 N TRP A 705 52.558 -9.909 -7.071 1.00 0.00 N ATOM 248 CA TRP A 705 52.587 -9.953 -5.621 1.00 0.00 C ATOM 249 C TRP A 705 53.733 -9.078 -5.097 1.00 0.00 C ATOM 250 O TRP A 705 53.995 -9.010 -3.893 1.00 0.00 O ATOM 251 CB TRP A 705 52.738 -11.410 -5.142 1.00 0.00 C ATOM 252 CG TRP A 705 53.909 -12.145 -5.736 1.00 0.00 C ATOM 253 CD1 TRP A 705 55.170 -12.215 -5.239 1.00 0.00 C ATOM 254 CD2 TRP A 705 53.915 -12.910 -6.944 1.00 0.00 C ATOM 255 NE1 TRP A 705 55.959 -12.975 -6.054 1.00 0.00 N ATOM 256 CE2 TRP A 705 55.212 -13.418 -7.108 1.00 0.00 C ATOM 257 CE3 TRP A 705 52.947 -13.217 -7.896 1.00 0.00 C ATOM 258 CZ2 TRP A 705 55.567 -14.212 -8.193 1.00 0.00 C ATOM 259 CZ3 TRP A 705 53.301 -14.000 -8.969 1.00 0.00 C ATOM 260 CH2 TRP A 705 54.597 -14.491 -9.110 1.00 0.00 C ATOM 0 H TRP A 705 53.236 -10.529 -7.514 1.00 0.00 H new ATOM 0 HA TRP A 705 51.649 -9.561 -5.227 1.00 0.00 H new ATOM 0 HB2 TRP A 705 52.836 -11.414 -4.056 1.00 0.00 H new ATOM 0 HB3 TRP A 705 51.824 -11.954 -5.382 1.00 0.00 H new ATOM 0 HD1 TRP A 705 55.502 -11.738 -4.329 1.00 0.00 H new ATOM 0 HE1 TRP A 705 56.947 -13.179 -5.900 1.00 0.00 H new ATOM 0 HE3 TRP A 705 51.937 -12.847 -7.794 1.00 0.00 H new ATOM 0 HZ2 TRP A 705 56.571 -14.593 -8.305 1.00 0.00 H new ATOM 0 HZ3 TRP A 705 52.560 -14.239 -9.717 1.00 0.00 H new ATOM 0 HH2 TRP A 705 54.839 -15.106 -9.964 1.00 0.00 H new ATOM 271 N GLU A 706 54.416 -8.405 -6.006 1.00 0.00 N ATOM 272 CA GLU A 706 55.478 -7.548 -5.645 1.00 0.00 C ATOM 273 C GLU A 706 55.079 -6.134 -5.972 1.00 0.00 C ATOM 274 O GLU A 706 54.034 -5.907 -6.586 1.00 0.00 O ATOM 275 CB GLU A 706 56.753 -7.928 -6.374 1.00 0.00 C ATOM 276 CG GLU A 706 57.258 -9.321 -6.097 1.00 0.00 C ATOM 277 CD GLU A 706 58.530 -9.584 -6.834 1.00 0.00 C ATOM 278 OE1 GLU A 706 58.556 -9.401 -8.065 1.00 0.00 O ATOM 279 OE2 GLU A 706 59.523 -9.993 -6.205 1.00 0.00 O ATOM 0 H GLU A 706 54.233 -8.452 -7.008 1.00 0.00 H new ATOM 0 HA GLU A 706 55.676 -7.640 -4.577 1.00 0.00 H new ATOM 0 HB2 GLU A 706 56.584 -7.826 -7.446 1.00 0.00 H new ATOM 0 HB3 GLU A 706 57.533 -7.216 -6.105 1.00 0.00 H new ATOM 0 HG2 GLU A 706 57.421 -9.447 -5.027 1.00 0.00 H new ATOM 0 HG3 GLU A 706 56.504 -10.051 -6.393 1.00 0.00 H new ATOM 286 N LYS A 707 55.879 -5.203 -5.580 1.00 0.00 N ATOM 287 CA LYS A 707 55.582 -3.826 -5.799 1.00 0.00 C ATOM 288 C LYS A 707 56.873 -3.061 -5.999 1.00 0.00 C ATOM 289 O LYS A 707 57.967 -3.610 -5.809 1.00 0.00 O ATOM 290 CB LYS A 707 54.830 -3.260 -4.591 1.00 0.00 C ATOM 291 CG LYS A 707 55.670 -3.174 -3.312 1.00 0.00 C ATOM 292 CD LYS A 707 54.876 -2.615 -2.141 1.00 0.00 C ATOM 293 CE LYS A 707 54.257 -1.253 -2.457 1.00 0.00 C ATOM 294 NZ LYS A 707 55.257 -0.218 -2.797 1.00 0.00 N ATOM 0 H LYS A 707 56.761 -5.374 -5.097 1.00 0.00 H new ATOM 0 HA LYS A 707 54.957 -3.726 -6.687 1.00 0.00 H new ATOM 0 HB2 LYS A 707 54.464 -2.264 -4.839 1.00 0.00 H new ATOM 0 HB3 LYS A 707 53.956 -3.882 -4.397 1.00 0.00 H new ATOM 0 HG2 LYS A 707 56.042 -4.166 -3.056 1.00 0.00 H new ATOM 0 HG3 LYS A 707 56.541 -2.544 -3.493 1.00 0.00 H new ATOM 0 HD2 LYS A 707 54.087 -3.317 -1.872 1.00 0.00 H new ATOM 0 HD3 LYS A 707 55.529 -2.522 -1.273 1.00 0.00 H new ATOM 0 HE2 LYS A 707 53.561 -1.363 -3.289 1.00 0.00 H new ATOM 0 HE3 LYS A 707 53.676 -0.918 -1.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 707 54.777 0.692 -2.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 707 55.938 -0.123 -2.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 707 55.761 -0.494 -3.664 1.00 0.00 H new ATOM 308 N LEU A 708 56.744 -1.818 -6.350 1.00 0.00 N ATOM 309 CA LEU A 708 57.870 -0.947 -6.520 1.00 0.00 C ATOM 310 C LEU A 708 57.891 0.020 -5.359 1.00 0.00 C ATOM 311 O LEU A 708 56.870 0.655 -5.054 1.00 0.00 O ATOM 312 CB LEU A 708 57.739 -0.168 -7.844 1.00 0.00 C ATOM 313 CG LEU A 708 58.841 0.867 -8.153 1.00 0.00 C ATOM 314 CD1 LEU A 708 60.199 0.205 -8.321 1.00 0.00 C ATOM 315 CD2 LEU A 708 58.483 1.683 -9.387 1.00 0.00 C ATOM 0 H LEU A 708 55.844 -1.373 -6.529 1.00 0.00 H new ATOM 0 HA LEU A 708 58.793 -1.526 -6.550 1.00 0.00 H new ATOM 0 HB2 LEU A 708 57.711 -0.889 -8.661 1.00 0.00 H new ATOM 0 HB3 LEU A 708 56.779 0.348 -7.841 1.00 0.00 H new ATOM 0 HG LEU A 708 58.907 1.542 -7.300 1.00 0.00 H new ATOM 0 HD11 LEU A 708 60.950 0.965 -8.538 1.00 0.00 H new ATOM 0 HD12 LEU A 708 60.466 -0.317 -7.402 1.00 0.00 H new ATOM 0 HD13 LEU A 708 60.157 -0.508 -9.144 1.00 0.00 H new ATOM 0 HD21 LEU A 708 59.273 2.406 -9.587 1.00 0.00 H new ATOM 0 HD22 LEU A 708 58.375 1.018 -10.244 1.00 0.00 H new ATOM 0 HD23 LEU A 708 57.544 2.210 -9.215 1.00 0.00 H new ATOM 327 N GLN A 709 58.977 0.074 -4.661 1.00 0.00 N ATOM 328 CA GLN A 709 59.137 1.048 -3.636 1.00 0.00 C ATOM 329 C GLN A 709 60.580 1.448 -3.609 1.00 0.00 C ATOM 330 O GLN A 709 61.410 0.628 -3.915 1.00 0.00 O ATOM 331 CB GLN A 709 58.729 0.502 -2.254 1.00 0.00 C ATOM 332 CG GLN A 709 59.885 0.019 -1.416 1.00 0.00 C ATOM 333 CD GLN A 709 60.368 -1.284 -1.539 1.00 0.00 C ATOM 334 OE1 GLN A 709 60.341 -1.859 -2.625 1.00 0.00 O ATOM 335 NE2 GLN A 709 60.864 -1.790 -0.450 1.00 0.00 N ATOM 0 H GLN A 709 59.773 -0.552 -4.785 1.00 0.00 H new ATOM 0 HA GLN A 709 58.491 1.899 -3.851 1.00 0.00 H new ATOM 0 HB2 GLN A 709 58.201 1.284 -1.708 1.00 0.00 H new ATOM 0 HB3 GLN A 709 58.027 -0.320 -2.393 1.00 0.00 H new ATOM 0 HG2 GLN A 709 60.722 0.689 -1.611 1.00 0.00 H new ATOM 0 HG3 GLN A 709 59.602 0.157 -0.372 1.00 0.00 H new ATOM 0 HE21 GLN A 709 60.850 -1.250 0.415 1.00 0.00 H new ATOM 0 HE22 GLN A 709 61.267 -2.727 -0.461 1.00 0.00 H new ATOM 344 N ASN A 710 60.878 2.697 -3.304 1.00 0.00 N ATOM 345 CA ASN A 710 62.271 3.148 -3.046 1.00 0.00 C ATOM 346 C ASN A 710 63.195 2.816 -4.239 1.00 0.00 C ATOM 347 O ASN A 710 64.406 2.655 -4.090 1.00 0.00 O ATOM 348 CB ASN A 710 62.760 2.444 -1.751 1.00 0.00 C ATOM 349 CG ASN A 710 63.931 3.132 -1.083 1.00 0.00 C ATOM 350 OD1 ASN A 710 65.098 2.816 -1.330 1.00 0.00 O ATOM 351 ND2 ASN A 710 63.631 4.060 -0.217 1.00 0.00 N ATOM 0 H ASN A 710 60.181 3.438 -3.224 1.00 0.00 H new ATOM 0 HA ASN A 710 62.298 4.231 -2.921 1.00 0.00 H new ATOM 0 HB2 ASN A 710 61.932 2.389 -1.044 1.00 0.00 H new ATOM 0 HB3 ASN A 710 63.042 1.419 -1.991 1.00 0.00 H new ATOM 0 HD21 ASN A 710 64.373 4.551 0.282 1.00 0.00 H new ATOM 0 HD22 ASN A 710 62.655 4.295 -0.039 1.00 0.00 H new ATOM 358 N SER A 711 62.581 2.739 -5.426 1.00 0.00 N ATOM 359 CA SER A 711 63.235 2.375 -6.673 1.00 0.00 C ATOM 360 C SER A 711 63.677 0.887 -6.717 1.00 0.00 C ATOM 361 O SER A 711 64.381 0.471 -7.636 1.00 0.00 O ATOM 362 CB SER A 711 64.387 3.333 -6.973 1.00 0.00 C ATOM 363 OG SER A 711 63.890 4.669 -7.070 1.00 0.00 O ATOM 0 H SER A 711 61.587 2.935 -5.541 1.00 0.00 H new ATOM 0 HA SER A 711 62.496 2.477 -7.467 1.00 0.00 H new ATOM 0 HB2 SER A 711 65.139 3.271 -6.186 1.00 0.00 H new ATOM 0 HB3 SER A 711 64.876 3.048 -7.904 1.00 0.00 H new ATOM 0 HG SER A 711 64.631 5.281 -7.261 1.00 0.00 H new ATOM 369 N ARG A 712 63.222 0.088 -5.762 1.00 0.00 N ATOM 370 CA ARG A 712 63.516 -1.330 -5.742 1.00 0.00 C ATOM 371 C ARG A 712 62.210 -2.104 -5.871 1.00 0.00 C ATOM 372 O ARG A 712 61.127 -1.535 -5.705 1.00 0.00 O ATOM 373 CB ARG A 712 64.281 -1.751 -4.456 1.00 0.00 C ATOM 374 CG ARG A 712 63.562 -1.431 -3.149 1.00 0.00 C ATOM 375 CD ARG A 712 64.235 -2.064 -1.934 1.00 0.00 C ATOM 376 NE ARG A 712 65.656 -1.699 -1.775 1.00 0.00 N ATOM 377 CZ ARG A 712 66.283 -1.539 -0.588 1.00 0.00 C ATOM 378 NH1 ARG A 712 65.598 -1.564 0.549 1.00 0.00 N ATOM 379 NH2 ARG A 712 67.590 -1.352 -0.552 1.00 0.00 N ATOM 0 H ARG A 712 62.642 0.406 -4.985 1.00 0.00 H new ATOM 0 HA ARG A 712 64.171 -1.561 -6.582 1.00 0.00 H new ATOM 0 HB2 ARG A 712 64.469 -2.824 -4.497 1.00 0.00 H new ATOM 0 HB3 ARG A 712 65.253 -1.257 -4.450 1.00 0.00 H new ATOM 0 HG2 ARG A 712 63.524 -0.350 -3.016 1.00 0.00 H new ATOM 0 HG3 ARG A 712 62.532 -1.781 -3.211 1.00 0.00 H new ATOM 0 HD2 ARG A 712 63.692 -1.768 -1.036 1.00 0.00 H new ATOM 0 HD3 ARG A 712 64.156 -3.148 -2.012 1.00 0.00 H new ATOM 0 HE ARG A 712 66.205 -1.557 -2.623 1.00 0.00 H new ATOM 0 HH11 ARG A 712 64.588 -1.705 0.533 1.00 0.00 H new ATOM 0 HH12 ARG A 712 66.082 -1.442 1.439 1.00 0.00 H new ATOM 0 HH21 ARG A 712 68.126 -1.328 -1.420 1.00 0.00 H new ATOM 0 HH22 ARG A 712 68.063 -1.231 0.343 1.00 0.00 H new ATOM 393 N CYS A 713 62.290 -3.358 -6.190 1.00 0.00 N ATOM 394 CA CYS A 713 61.099 -4.156 -6.291 1.00 0.00 C ATOM 395 C CYS A 713 61.100 -5.196 -5.198 1.00 0.00 C ATOM 396 O CYS A 713 61.960 -6.088 -5.162 1.00 0.00 O ATOM 397 CB CYS A 713 60.987 -4.809 -7.673 1.00 0.00 C ATOM 398 SG CYS A 713 60.883 -3.619 -9.061 1.00 0.00 S ATOM 0 H CYS A 713 63.160 -3.853 -6.385 1.00 0.00 H new ATOM 0 HA CYS A 713 60.229 -3.511 -6.168 1.00 0.00 H new ATOM 0 HB2 CYS A 713 61.851 -5.456 -7.828 1.00 0.00 H new ATOM 0 HB3 CYS A 713 60.104 -5.448 -7.690 1.00 0.00 H new ATOM 0 HG CYS A 713 60.646 -4.261 -10.166 1.00 0.00 H new ATOM 403 N VAL A 714 60.151 -5.087 -4.316 1.00 0.00 N ATOM 404 CA VAL A 714 60.033 -5.978 -3.186 1.00 0.00 C ATOM 405 C VAL A 714 58.676 -6.614 -3.203 1.00 0.00 C ATOM 406 O VAL A 714 57.852 -6.255 -4.030 1.00 0.00 O ATOM 407 CB VAL A 714 60.232 -5.252 -1.825 1.00 0.00 C ATOM 408 CG1 VAL A 714 61.608 -4.591 -1.780 1.00 0.00 C ATOM 409 CG2 VAL A 714 59.119 -4.203 -1.575 1.00 0.00 C ATOM 0 H VAL A 714 59.426 -4.371 -4.356 1.00 0.00 H new ATOM 0 HA VAL A 714 60.821 -6.725 -3.278 1.00 0.00 H new ATOM 0 HB VAL A 714 60.168 -5.997 -1.032 1.00 0.00 H new ATOM 0 HG11 VAL A 714 61.738 -4.085 -0.823 1.00 0.00 H new ATOM 0 HG12 VAL A 714 62.381 -5.351 -1.896 1.00 0.00 H new ATOM 0 HG13 VAL A 714 61.689 -3.864 -2.588 1.00 0.00 H new ATOM 0 HG21 VAL A 714 59.288 -3.714 -0.615 1.00 0.00 H new ATOM 0 HG22 VAL A 714 59.136 -3.457 -2.370 1.00 0.00 H new ATOM 0 HG23 VAL A 714 58.148 -4.698 -1.563 1.00 0.00 H new ATOM 419 N CYS A 715 58.422 -7.498 -2.288 1.00 0.00 N ATOM 420 CA CYS A 715 57.144 -8.149 -2.218 1.00 0.00 C ATOM 421 C CYS A 715 56.240 -7.284 -1.364 1.00 0.00 C ATOM 422 O CYS A 715 56.705 -6.677 -0.383 1.00 0.00 O ATOM 423 CB CYS A 715 57.302 -9.531 -1.588 1.00 0.00 C ATOM 424 SG CYS A 715 58.518 -10.603 -2.439 1.00 0.00 S ATOM 0 H CYS A 715 59.087 -7.789 -1.572 1.00 0.00 H new ATOM 0 HA CYS A 715 56.718 -8.277 -3.213 1.00 0.00 H new ATOM 0 HB2 CYS A 715 57.603 -9.412 -0.547 1.00 0.00 H new ATOM 0 HB3 CYS A 715 56.333 -10.030 -1.584 1.00 0.00 H new ATOM 0 HG CYS A 715 58.742 -11.662 -1.719 1.00 0.00 H new ATOM 429 N LYS A 716 54.977 -7.179 -1.735 1.00 0.00 N ATOM 430 CA LYS A 716 54.059 -6.322 -1.007 1.00 0.00 C ATOM 431 C LYS A 716 53.677 -6.962 0.327 1.00 0.00 C ATOM 432 O LYS A 716 54.101 -8.081 0.628 1.00 0.00 O ATOM 433 CB LYS A 716 52.831 -5.935 -1.865 1.00 0.00 C ATOM 434 CG LYS A 716 52.009 -7.104 -2.361 1.00 0.00 C ATOM 435 CD LYS A 716 50.894 -6.688 -3.331 1.00 0.00 C ATOM 436 CE LYS A 716 49.845 -5.801 -2.673 1.00 0.00 C ATOM 437 NZ LYS A 716 48.754 -5.440 -3.608 1.00 0.00 N ATOM 0 H LYS A 716 54.566 -7.671 -2.528 1.00 0.00 H new ATOM 0 HA LYS A 716 54.567 -5.384 -0.781 1.00 0.00 H new ATOM 0 HB2 LYS A 716 52.187 -5.280 -1.278 1.00 0.00 H new ATOM 0 HB3 LYS A 716 53.173 -5.359 -2.725 1.00 0.00 H new ATOM 0 HG2 LYS A 716 52.666 -7.818 -2.857 1.00 0.00 H new ATOM 0 HG3 LYS A 716 51.567 -7.618 -1.507 1.00 0.00 H new ATOM 0 HD2 LYS A 716 51.332 -6.159 -4.177 1.00 0.00 H new ATOM 0 HD3 LYS A 716 50.412 -7.581 -3.729 1.00 0.00 H new ATOM 0 HE2 LYS A 716 49.426 -6.316 -1.809 1.00 0.00 H new ATOM 0 HE3 LYS A 716 50.320 -4.892 -2.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 716 47.936 -5.092 -3.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 716 49.084 -4.696 -4.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 716 48.476 -6.278 -4.157 1.00 0.00 H new ATOM 451 N MET A 717 52.915 -6.265 1.125 1.00 0.00 N ATOM 452 CA MET A 717 52.585 -6.753 2.451 1.00 0.00 C ATOM 453 C MET A 717 51.177 -7.358 2.471 1.00 0.00 C ATOM 454 O MET A 717 50.310 -6.894 1.743 1.00 0.00 O ATOM 455 CB MET A 717 52.720 -5.621 3.471 1.00 0.00 C ATOM 456 CG MET A 717 54.124 -5.020 3.557 1.00 0.00 C ATOM 457 SD MET A 717 55.398 -6.234 3.995 1.00 0.00 S ATOM 458 CE MET A 717 54.941 -6.653 5.681 1.00 0.00 C ATOM 0 H MET A 717 52.509 -5.360 0.889 1.00 0.00 H new ATOM 0 HA MET A 717 53.284 -7.544 2.722 1.00 0.00 H new ATOM 0 HB2 MET A 717 52.014 -4.831 3.216 1.00 0.00 H new ATOM 0 HB3 MET A 717 52.437 -5.997 4.454 1.00 0.00 H new ATOM 0 HG2 MET A 717 54.377 -4.568 2.598 1.00 0.00 H new ATOM 0 HG3 MET A 717 54.125 -4.220 4.297 1.00 0.00 H new ATOM 0 HE1 MET A 717 55.813 -6.561 6.328 1.00 0.00 H new ATOM 0 HE2 MET A 717 54.160 -5.975 6.026 1.00 0.00 H new ATOM 0 HE3 MET A 717 54.572 -7.678 5.714 1.00 0.00 H new ATOM 468 N PRO A 718 50.927 -8.394 3.327 1.00 0.00 N ATOM 469 CA PRO A 718 49.626 -9.123 3.400 1.00 0.00 C ATOM 470 C PRO A 718 48.393 -8.226 3.652 1.00 0.00 C ATOM 471 O PRO A 718 47.266 -8.602 3.344 1.00 0.00 O ATOM 472 CB PRO A 718 49.820 -10.111 4.565 1.00 0.00 C ATOM 473 CG PRO A 718 51.031 -9.625 5.295 1.00 0.00 C ATOM 474 CD PRO A 718 51.906 -8.984 4.263 1.00 0.00 C ATOM 0 HA PRO A 718 49.406 -9.593 2.441 1.00 0.00 H new ATOM 0 HB2 PRO A 718 48.947 -10.126 5.217 1.00 0.00 H new ATOM 0 HB3 PRO A 718 49.963 -11.128 4.199 1.00 0.00 H new ATOM 0 HG2 PRO A 718 50.758 -8.911 6.072 1.00 0.00 H new ATOM 0 HG3 PRO A 718 51.547 -10.450 5.786 1.00 0.00 H new ATOM 0 HD2 PRO A 718 52.557 -8.226 4.699 1.00 0.00 H new ATOM 0 HD3 PRO A 718 52.550 -9.712 3.770 1.00 0.00 H new ATOM 482 N TYR A 719 48.606 -7.055 4.190 1.00 0.00 N ATOM 483 CA TYR A 719 47.509 -6.133 4.460 1.00 0.00 C ATOM 484 C TYR A 719 47.310 -5.153 3.311 1.00 0.00 C ATOM 485 O TYR A 719 46.357 -4.382 3.290 1.00 0.00 O ATOM 486 CB TYR A 719 47.723 -5.403 5.782 1.00 0.00 C ATOM 487 CG TYR A 719 49.005 -4.604 5.878 1.00 0.00 C ATOM 488 CD1 TYR A 719 50.218 -5.226 6.154 1.00 0.00 C ATOM 489 CD2 TYR A 719 48.994 -3.225 5.740 1.00 0.00 C ATOM 490 CE1 TYR A 719 51.373 -4.494 6.284 1.00 0.00 C ATOM 491 CE2 TYR A 719 50.151 -2.487 5.858 1.00 0.00 C ATOM 492 CZ TYR A 719 51.338 -3.126 6.135 1.00 0.00 C ATOM 493 OH TYR A 719 52.500 -2.396 6.261 1.00 0.00 O ATOM 0 H TYR A 719 49.527 -6.706 4.454 1.00 0.00 H new ATOM 0 HA TYR A 719 46.595 -6.720 4.547 1.00 0.00 H new ATOM 0 HB2 TYR A 719 46.881 -4.730 5.947 1.00 0.00 H new ATOM 0 HB3 TYR A 719 47.709 -6.135 6.589 1.00 0.00 H new ATOM 0 HD1 TYR A 719 50.252 -6.299 6.268 1.00 0.00 H new ATOM 0 HD2 TYR A 719 48.061 -2.720 5.536 1.00 0.00 H new ATOM 0 HE1 TYR A 719 52.307 -4.991 6.503 1.00 0.00 H new ATOM 0 HE2 TYR A 719 50.127 -1.414 5.734 1.00 0.00 H new ATOM 0 HH TYR A 719 52.305 -1.445 6.127 1.00 0.00 H new ATOM 503 N GLU A 720 48.207 -5.207 2.349 1.00 0.00 N ATOM 504 CA GLU A 720 48.121 -4.367 1.175 1.00 0.00 C ATOM 505 C GLU A 720 47.406 -5.171 0.083 1.00 0.00 C ATOM 506 O GLU A 720 47.185 -4.712 -1.042 1.00 0.00 O ATOM 507 CB GLU A 720 49.530 -3.928 0.743 1.00 0.00 C ATOM 508 CG GLU A 720 49.553 -2.868 -0.342 1.00 0.00 C ATOM 509 CD GLU A 720 50.939 -2.385 -0.664 1.00 0.00 C ATOM 510 OE1 GLU A 720 51.537 -2.876 -1.629 1.00 0.00 O ATOM 511 OE2 GLU A 720 51.437 -1.472 0.044 1.00 0.00 O ATOM 0 H GLU A 720 49.013 -5.832 2.359 1.00 0.00 H new ATOM 0 HA GLU A 720 47.556 -3.457 1.376 1.00 0.00 H new ATOM 0 HB2 GLU A 720 50.062 -3.549 1.615 1.00 0.00 H new ATOM 0 HB3 GLU A 720 50.077 -4.802 0.391 1.00 0.00 H new ATOM 0 HG2 GLU A 720 49.096 -3.271 -1.246 1.00 0.00 H new ATOM 0 HG3 GLU A 720 48.943 -2.021 -0.027 1.00 0.00 H new ATOM 518 N CYS A 721 47.054 -6.379 0.452 1.00 0.00 N ATOM 519 CA CYS A 721 46.316 -7.282 -0.383 1.00 0.00 C ATOM 520 C CYS A 721 44.850 -6.946 -0.252 1.00 0.00 C ATOM 521 O CYS A 721 44.351 -6.785 0.869 1.00 0.00 O ATOM 522 CB CYS A 721 46.546 -8.713 0.097 1.00 0.00 C ATOM 523 SG CYS A 721 48.296 -9.189 0.196 1.00 0.00 S ATOM 0 H CYS A 721 47.282 -6.767 1.367 1.00 0.00 H new ATOM 0 HA CYS A 721 46.639 -7.192 -1.420 1.00 0.00 H new ATOM 0 HB2 CYS A 721 46.092 -8.832 1.081 1.00 0.00 H new ATOM 0 HB3 CYS A 721 46.032 -9.398 -0.577 1.00 0.00 H new ATOM 0 HG CYS A 721 48.964 -8.261 0.815 1.00 0.00 H new ATOM 528 N GLY A 722 44.174 -6.805 -1.348 1.00 0.00 N ATOM 529 CA GLY A 722 42.775 -6.499 -1.284 1.00 0.00 C ATOM 530 C GLY A 722 41.963 -7.330 -2.245 1.00 0.00 C ATOM 531 O GLY A 722 41.715 -8.517 -1.982 1.00 0.00 O ATOM 0 H GLY A 722 44.559 -6.895 -2.288 1.00 0.00 H new ATOM 0 HA2 GLY A 722 42.415 -6.666 -0.269 1.00 0.00 H new ATOM 0 HA3 GLY A 722 42.626 -5.442 -1.505 1.00 0.00 H new ATOM 535 N PRO A 723 41.564 -6.746 -3.382 1.00 0.00 N ATOM 536 CA PRO A 723 40.726 -7.413 -4.380 1.00 0.00 C ATOM 537 C PRO A 723 41.389 -8.667 -4.956 1.00 0.00 C ATOM 538 O PRO A 723 42.416 -8.579 -5.628 1.00 0.00 O ATOM 539 CB PRO A 723 40.535 -6.344 -5.474 1.00 0.00 C ATOM 540 CG PRO A 723 41.637 -5.370 -5.266 1.00 0.00 C ATOM 541 CD PRO A 723 41.912 -5.373 -3.796 1.00 0.00 C ATOM 0 HA PRO A 723 39.788 -7.764 -3.950 1.00 0.00 H new ATOM 0 HB2 PRO A 723 40.583 -6.786 -6.469 1.00 0.00 H new ATOM 0 HB3 PRO A 723 39.562 -5.861 -5.387 1.00 0.00 H new ATOM 0 HG2 PRO A 723 42.524 -5.657 -5.830 1.00 0.00 H new ATOM 0 HG3 PRO A 723 41.350 -4.376 -5.608 1.00 0.00 H new ATOM 0 HD2 PRO A 723 42.956 -5.142 -3.583 1.00 0.00 H new ATOM 0 HD3 PRO A 723 41.308 -4.631 -3.273 1.00 0.00 H new ATOM 549 N SER A 724 40.812 -9.826 -4.642 1.00 0.00 N ATOM 550 CA SER A 724 41.302 -11.090 -5.085 1.00 0.00 C ATOM 551 C SER A 724 40.250 -12.188 -4.863 1.00 0.00 C ATOM 552 O SER A 724 39.221 -11.950 -4.196 1.00 0.00 O ATOM 553 CB SER A 724 42.632 -11.393 -4.385 1.00 0.00 C ATOM 554 OG SER A 724 42.599 -10.998 -3.017 1.00 0.00 O ATOM 0 H SER A 724 39.976 -9.893 -4.061 1.00 0.00 H new ATOM 0 HA SER A 724 41.491 -11.060 -6.158 1.00 0.00 H new ATOM 0 HB2 SER A 724 42.846 -12.460 -4.453 1.00 0.00 H new ATOM 0 HB3 SER A 724 43.441 -10.872 -4.897 1.00 0.00 H new ATOM 0 HG SER A 724 42.386 -10.043 -2.957 1.00 0.00 H new ATOM 560 N LEU A 725 40.481 -13.346 -5.440 1.00 0.00 N ATOM 561 CA LEU A 725 39.573 -14.483 -5.326 1.00 0.00 C ATOM 562 C LEU A 725 39.711 -15.225 -4.012 1.00 0.00 C ATOM 563 O LEU A 725 40.815 -15.515 -3.551 1.00 0.00 O ATOM 564 CB LEU A 725 39.761 -15.455 -6.491 1.00 0.00 C ATOM 565 CG LEU A 725 39.068 -15.122 -7.799 1.00 0.00 C ATOM 566 CD1 LEU A 725 39.618 -15.996 -8.907 1.00 0.00 C ATOM 567 CD2 LEU A 725 37.588 -15.380 -7.670 1.00 0.00 C ATOM 0 H LEU A 725 41.308 -13.534 -6.007 1.00 0.00 H new ATOM 0 HA LEU A 725 38.566 -14.066 -5.359 1.00 0.00 H new ATOM 0 HB2 LEU A 725 40.830 -15.541 -6.689 1.00 0.00 H new ATOM 0 HB3 LEU A 725 39.417 -16.438 -6.168 1.00 0.00 H new ATOM 0 HG LEU A 725 39.243 -14.072 -8.033 1.00 0.00 H new ATOM 0 HD11 LEU A 725 39.117 -15.753 -9.844 1.00 0.00 H new ATOM 0 HD12 LEU A 725 40.689 -15.820 -9.011 1.00 0.00 H new ATOM 0 HD13 LEU A 725 39.444 -17.044 -8.664 1.00 0.00 H new ATOM 0 HD21 LEU A 725 37.093 -15.140 -8.611 1.00 0.00 H new ATOM 0 HD22 LEU A 725 37.421 -16.430 -7.430 1.00 0.00 H new ATOM 0 HD23 LEU A 725 37.178 -14.757 -6.875 1.00 0.00 H new ATOM 579 N ASP A 726 38.589 -15.492 -3.416 1.00 0.00 N ATOM 580 CA ASP A 726 38.478 -16.290 -2.207 1.00 0.00 C ATOM 581 C ASP A 726 38.703 -17.740 -2.518 1.00 0.00 C ATOM 582 O ASP A 726 38.048 -18.311 -3.396 1.00 0.00 O ATOM 583 CB ASP A 726 37.104 -16.079 -1.566 1.00 0.00 C ATOM 584 CG ASP A 726 35.974 -16.097 -2.572 1.00 0.00 C ATOM 585 OD1 ASP A 726 35.340 -17.137 -2.778 1.00 0.00 O ATOM 586 OD2 ASP A 726 35.717 -15.040 -3.220 1.00 0.00 O ATOM 0 H ASP A 726 37.690 -15.155 -3.759 1.00 0.00 H new ATOM 0 HA ASP A 726 39.243 -15.971 -1.499 1.00 0.00 H new ATOM 0 HB2 ASP A 726 36.933 -16.857 -0.822 1.00 0.00 H new ATOM 0 HB3 ASP A 726 37.098 -15.125 -1.038 1.00 0.00 H new ATOM 591 N VAL A 727 39.658 -18.331 -1.830 1.00 0.00 N ATOM 592 CA VAL A 727 40.009 -19.717 -2.055 1.00 0.00 C ATOM 593 C VAL A 727 40.298 -20.445 -0.736 1.00 0.00 C ATOM 594 O VAL A 727 40.617 -19.818 0.281 1.00 0.00 O ATOM 595 CB VAL A 727 41.231 -19.887 -3.015 1.00 0.00 C ATOM 596 CG1 VAL A 727 40.888 -19.452 -4.437 1.00 0.00 C ATOM 597 CG2 VAL A 727 42.441 -19.104 -2.497 1.00 0.00 C ATOM 0 H VAL A 727 40.208 -17.869 -1.106 1.00 0.00 H new ATOM 0 HA VAL A 727 39.139 -20.165 -2.535 1.00 0.00 H new ATOM 0 HB VAL A 727 41.484 -20.947 -3.039 1.00 0.00 H new ATOM 0 HG11 VAL A 727 41.760 -19.583 -5.078 1.00 0.00 H new ATOM 0 HG12 VAL A 727 40.065 -20.059 -4.815 1.00 0.00 H new ATOM 0 HG13 VAL A 727 40.594 -18.402 -4.435 1.00 0.00 H new ATOM 0 HG21 VAL A 727 43.280 -19.237 -3.180 1.00 0.00 H new ATOM 0 HG22 VAL A 727 42.189 -18.045 -2.433 1.00 0.00 H new ATOM 0 HG23 VAL A 727 42.717 -19.472 -1.509 1.00 0.00 H new ATOM 607 N CYS A 728 40.227 -21.746 -0.767 1.00 0.00 N ATOM 608 CA CYS A 728 40.466 -22.545 0.412 1.00 0.00 C ATOM 609 C CYS A 728 41.896 -23.042 0.365 1.00 0.00 C ATOM 610 O CYS A 728 42.359 -23.523 -0.689 1.00 0.00 O ATOM 611 CB CYS A 728 39.540 -23.755 0.420 1.00 0.00 C ATOM 612 SG CYS A 728 37.784 -23.406 0.092 1.00 0.00 S ATOM 0 H CYS A 728 40.003 -22.285 -1.604 1.00 0.00 H new ATOM 0 HA CYS A 728 40.285 -21.943 1.303 1.00 0.00 H new ATOM 0 HB2 CYS A 728 39.896 -24.467 -0.325 1.00 0.00 H new ATOM 0 HB3 CYS A 728 39.619 -24.244 1.391 1.00 0.00 H new ATOM 0 HG CYS A 728 37.107 -24.516 0.125 1.00 0.00 H new ATOM 617 N ALA A 729 42.601 -22.931 1.459 1.00 0.00 N ATOM 618 CA ALA A 729 43.968 -23.351 1.489 1.00 0.00 C ATOM 619 C ALA A 729 44.282 -24.086 2.767 1.00 0.00 C ATOM 620 O ALA A 729 43.715 -23.802 3.809 1.00 0.00 O ATOM 621 CB ALA A 729 44.879 -22.157 1.338 1.00 0.00 C ATOM 0 H ALA A 729 42.248 -22.553 2.338 1.00 0.00 H new ATOM 0 HA ALA A 729 44.133 -24.035 0.656 1.00 0.00 H new ATOM 0 HB1 ALA A 729 45.918 -22.487 1.362 1.00 0.00 H new ATOM 0 HB2 ALA A 729 44.677 -21.663 0.388 1.00 0.00 H new ATOM 0 HB3 ALA A 729 44.701 -21.458 2.155 1.00 0.00 H new ATOM 627 N GLN A 730 45.162 -25.027 2.678 1.00 0.00 N ATOM 628 CA GLN A 730 45.593 -25.761 3.822 1.00 0.00 C ATOM 629 C GLN A 730 46.920 -25.235 4.263 1.00 0.00 C ATOM 630 O GLN A 730 47.856 -25.101 3.450 1.00 0.00 O ATOM 631 CB GLN A 730 45.692 -27.249 3.522 1.00 0.00 C ATOM 632 CG GLN A 730 45.973 -28.105 4.744 1.00 0.00 C ATOM 633 CD GLN A 730 45.819 -29.592 4.466 1.00 0.00 C ATOM 634 OE1 GLN A 730 45.043 -30.005 3.601 1.00 0.00 O ATOM 635 NE2 GLN A 730 46.536 -30.399 5.198 1.00 0.00 N ATOM 0 H GLN A 730 45.605 -25.311 1.804 1.00 0.00 H new ATOM 0 HA GLN A 730 44.858 -25.635 4.617 1.00 0.00 H new ATOM 0 HB2 GLN A 730 44.760 -27.580 3.065 1.00 0.00 H new ATOM 0 HB3 GLN A 730 46.482 -27.410 2.788 1.00 0.00 H new ATOM 0 HG2 GLN A 730 46.986 -27.908 5.095 1.00 0.00 H new ATOM 0 HG3 GLN A 730 45.295 -27.818 5.548 1.00 0.00 H new ATOM 0 HE21 GLN A 730 47.168 -30.021 5.904 1.00 0.00 H new ATOM 0 HE22 GLN A 730 46.465 -31.408 5.064 1.00 0.00 H new ATOM 644 N ASP A 731 46.996 -24.895 5.515 1.00 0.00 N ATOM 645 CA ASP A 731 48.217 -24.413 6.103 1.00 0.00 C ATOM 646 C ASP A 731 49.173 -25.580 6.239 1.00 0.00 C ATOM 647 O ASP A 731 48.864 -26.545 6.928 1.00 0.00 O ATOM 648 CB ASP A 731 47.932 -23.760 7.476 1.00 0.00 C ATOM 649 CG ASP A 731 49.169 -23.195 8.150 1.00 0.00 C ATOM 650 OD1 ASP A 731 49.993 -23.963 8.636 1.00 0.00 O ATOM 651 OD2 ASP A 731 49.327 -21.959 8.211 1.00 0.00 O ATOM 0 H ASP A 731 46.210 -24.943 6.164 1.00 0.00 H new ATOM 0 HA ASP A 731 48.666 -23.650 5.468 1.00 0.00 H new ATOM 0 HB2 ASP A 731 47.203 -22.960 7.344 1.00 0.00 H new ATOM 0 HB3 ASP A 731 47.477 -24.501 8.133 1.00 0.00 H new ATOM 656 N GLU A 732 50.312 -25.513 5.563 1.00 0.00 N ATOM 657 CA GLU A 732 51.270 -26.618 5.574 1.00 0.00 C ATOM 658 C GLU A 732 51.871 -26.907 6.937 1.00 0.00 C ATOM 659 O GLU A 732 52.325 -28.014 7.179 1.00 0.00 O ATOM 660 CB GLU A 732 52.395 -26.450 4.549 1.00 0.00 C ATOM 661 CG GLU A 732 51.994 -26.692 3.106 1.00 0.00 C ATOM 662 CD GLU A 732 53.202 -26.816 2.195 1.00 0.00 C ATOM 663 OE1 GLU A 732 53.317 -26.046 1.214 1.00 0.00 O ATOM 664 OE2 GLU A 732 54.072 -27.697 2.454 1.00 0.00 O ATOM 0 H GLU A 732 50.597 -24.711 5.002 1.00 0.00 H new ATOM 0 HA GLU A 732 50.663 -27.478 5.292 1.00 0.00 H new ATOM 0 HB2 GLU A 732 52.795 -25.439 4.634 1.00 0.00 H new ATOM 0 HB3 GLU A 732 53.203 -27.135 4.805 1.00 0.00 H new ATOM 0 HG2 GLU A 732 51.397 -27.602 3.043 1.00 0.00 H new ATOM 0 HG3 GLU A 732 51.363 -25.872 2.762 1.00 0.00 H new ATOM 671 N ARG A 733 51.857 -25.958 7.829 1.00 0.00 N ATOM 672 CA ARG A 733 52.507 -26.168 9.098 1.00 0.00 C ATOM 673 C ARG A 733 51.511 -26.703 10.128 1.00 0.00 C ATOM 674 O ARG A 733 51.759 -27.712 10.791 1.00 0.00 O ATOM 675 CB ARG A 733 53.150 -24.864 9.592 1.00 0.00 C ATOM 676 CG ARG A 733 54.056 -25.039 10.798 1.00 0.00 C ATOM 677 CD ARG A 733 55.244 -25.913 10.447 1.00 0.00 C ATOM 678 NE ARG A 733 56.124 -26.164 11.584 1.00 0.00 N ATOM 679 CZ ARG A 733 57.204 -26.941 11.537 1.00 0.00 C ATOM 680 NH1 ARG A 733 57.590 -27.471 10.388 1.00 0.00 N ATOM 681 NH2 ARG A 733 57.903 -27.167 12.634 1.00 0.00 N ATOM 0 H ARG A 733 51.413 -25.047 7.709 1.00 0.00 H new ATOM 0 HA ARG A 733 53.294 -26.911 8.966 1.00 0.00 H new ATOM 0 HB2 ARG A 733 53.727 -24.425 8.778 1.00 0.00 H new ATOM 0 HB3 ARG A 733 52.361 -24.155 9.843 1.00 0.00 H new ATOM 0 HG2 ARG A 733 54.403 -24.065 11.144 1.00 0.00 H new ATOM 0 HG3 ARG A 733 53.496 -25.488 11.619 1.00 0.00 H new ATOM 0 HD2 ARG A 733 54.885 -26.865 10.056 1.00 0.00 H new ATOM 0 HD3 ARG A 733 55.816 -25.437 9.651 1.00 0.00 H new ATOM 0 HE ARG A 733 55.897 -25.715 12.471 1.00 0.00 H new ATOM 0 HH11 ARG A 733 57.060 -27.284 9.537 1.00 0.00 H new ATOM 0 HH12 ARG A 733 58.418 -28.066 10.353 1.00 0.00 H new ATOM 0 HH21 ARG A 733 57.616 -26.746 13.518 1.00 0.00 H new ATOM 0 HH22 ARG A 733 58.730 -27.762 12.598 1.00 0.00 H new ATOM 695 N SER A 734 50.380 -26.047 10.211 1.00 0.00 N ATOM 696 CA SER A 734 49.364 -26.360 11.191 1.00 0.00 C ATOM 697 C SER A 734 48.417 -27.463 10.699 1.00 0.00 C ATOM 698 O SER A 734 47.675 -28.050 11.488 1.00 0.00 O ATOM 699 CB SER A 734 48.591 -25.092 11.501 1.00 0.00 C ATOM 700 OG SER A 734 49.485 -24.041 11.846 1.00 0.00 O ATOM 0 H SER A 734 50.134 -25.272 9.595 1.00 0.00 H new ATOM 0 HA SER A 734 49.845 -26.739 12.093 1.00 0.00 H new ATOM 0 HB2 SER A 734 47.994 -24.802 10.637 1.00 0.00 H new ATOM 0 HB3 SER A 734 47.897 -25.273 12.322 1.00 0.00 H new ATOM 0 HG SER A 734 48.974 -23.228 12.042 1.00 0.00 H new ATOM 706 N LYS A 735 48.439 -27.713 9.385 1.00 0.00 N ATOM 707 CA LYS A 735 47.638 -28.756 8.722 1.00 0.00 C ATOM 708 C LYS A 735 46.126 -28.498 8.789 1.00 0.00 C ATOM 709 O LYS A 735 45.324 -29.412 8.640 1.00 0.00 O ATOM 710 CB LYS A 735 47.993 -30.163 9.233 1.00 0.00 C ATOM 711 CG LYS A 735 49.438 -30.586 8.963 1.00 0.00 C ATOM 712 CD LYS A 735 49.800 -30.442 7.491 1.00 0.00 C ATOM 713 CE LYS A 735 51.122 -31.124 7.156 1.00 0.00 C ATOM 714 NZ LYS A 735 52.274 -30.607 7.934 1.00 0.00 N ATOM 0 H LYS A 735 49.025 -27.187 8.737 1.00 0.00 H new ATOM 0 HA LYS A 735 47.907 -28.707 7.667 1.00 0.00 H new ATOM 0 HB2 LYS A 735 47.810 -30.204 10.307 1.00 0.00 H new ATOM 0 HB3 LYS A 735 47.322 -30.885 8.768 1.00 0.00 H new ATOM 0 HG2 LYS A 735 50.114 -29.979 9.565 1.00 0.00 H new ATOM 0 HG3 LYS A 735 49.578 -31.622 9.273 1.00 0.00 H new ATOM 0 HD2 LYS A 735 49.006 -30.871 6.879 1.00 0.00 H new ATOM 0 HD3 LYS A 735 49.863 -29.384 7.235 1.00 0.00 H new ATOM 0 HE2 LYS A 735 51.024 -32.195 7.336 1.00 0.00 H new ATOM 0 HE3 LYS A 735 51.327 -30.997 6.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 735 53.161 -30.920 7.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 735 52.243 -29.568 7.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 735 52.227 -30.970 8.907 1.00 0.00 H new ATOM 728 N ARG A 736 45.745 -27.259 8.964 1.00 0.00 N ATOM 729 CA ARG A 736 44.339 -26.897 8.977 1.00 0.00 C ATOM 730 C ARG A 736 43.946 -26.236 7.678 1.00 0.00 C ATOM 731 O ARG A 736 44.780 -25.589 7.029 1.00 0.00 O ATOM 732 CB ARG A 736 43.996 -25.958 10.119 1.00 0.00 C ATOM 733 CG ARG A 736 44.885 -24.749 10.203 1.00 0.00 C ATOM 734 CD ARG A 736 44.171 -23.581 10.826 1.00 0.00 C ATOM 735 NE ARG A 736 43.484 -23.905 12.080 1.00 0.00 N ATOM 736 CZ ARG A 736 43.201 -23.022 13.047 1.00 0.00 C ATOM 737 NH1 ARG A 736 43.757 -21.811 13.039 1.00 0.00 N ATOM 738 NH2 ARG A 736 42.395 -23.372 14.045 1.00 0.00 N ATOM 0 H ARG A 736 46.386 -26.477 9.100 1.00 0.00 H new ATOM 0 HA ARG A 736 43.784 -27.826 9.112 1.00 0.00 H new ATOM 0 HB2 ARG A 736 42.963 -25.630 10.008 1.00 0.00 H new ATOM 0 HB3 ARG A 736 44.057 -26.507 11.059 1.00 0.00 H new ATOM 0 HG2 ARG A 736 45.772 -24.989 10.789 1.00 0.00 H new ATOM 0 HG3 ARG A 736 45.226 -24.477 9.204 1.00 0.00 H new ATOM 0 HD2 ARG A 736 44.892 -22.785 11.013 1.00 0.00 H new ATOM 0 HD3 ARG A 736 43.443 -23.191 10.115 1.00 0.00 H new ATOM 0 HE ARG A 736 43.201 -24.874 12.227 1.00 0.00 H new ATOM 0 HH11 ARG A 736 44.403 -21.551 12.293 1.00 0.00 H new ATOM 0 HH12 ARG A 736 43.537 -21.144 13.778 1.00 0.00 H new ATOM 0 HH21 ARG A 736 41.995 -24.310 14.072 1.00 0.00 H new ATOM 0 HH22 ARG A 736 42.177 -22.703 14.783 1.00 0.00 H new ATOM 752 N ILE A 737 42.702 -26.388 7.300 1.00 0.00 N ATOM 753 CA ILE A 737 42.180 -25.729 6.136 1.00 0.00 C ATOM 754 C ILE A 737 41.709 -24.364 6.589 1.00 0.00 C ATOM 755 O ILE A 737 40.922 -24.264 7.551 1.00 0.00 O ATOM 756 CB ILE A 737 40.938 -26.451 5.555 1.00 0.00 C ATOM 757 CG1 ILE A 737 41.170 -27.964 5.388 1.00 0.00 C ATOM 758 CG2 ILE A 737 40.567 -25.819 4.215 1.00 0.00 C ATOM 759 CD1 ILE A 737 42.199 -28.337 4.359 1.00 0.00 C ATOM 0 H ILE A 737 42.025 -26.972 7.792 1.00 0.00 H new ATOM 0 HA ILE A 737 42.958 -25.705 5.373 1.00 0.00 H new ATOM 0 HB ILE A 737 40.117 -26.332 6.262 1.00 0.00 H new ATOM 0 HG12 ILE A 737 41.472 -28.379 6.350 1.00 0.00 H new ATOM 0 HG13 ILE A 737 40.224 -28.435 5.121 1.00 0.00 H new ATOM 0 HG21 ILE A 737 39.693 -26.325 3.804 1.00 0.00 H new ATOM 0 HG22 ILE A 737 40.340 -24.763 4.361 1.00 0.00 H new ATOM 0 HG23 ILE A 737 41.403 -25.917 3.522 1.00 0.00 H new ATOM 0 HD11 ILE A 737 42.292 -29.422 4.314 1.00 0.00 H new ATOM 0 HD12 ILE A 737 41.892 -27.958 3.384 1.00 0.00 H new ATOM 0 HD13 ILE A 737 43.160 -27.902 4.631 1.00 0.00 H new ATOM 771 N LEU A 738 42.178 -23.344 5.968 1.00 0.00 N ATOM 772 CA LEU A 738 41.763 -22.034 6.313 1.00 0.00 C ATOM 773 C LEU A 738 41.399 -21.252 5.064 1.00 0.00 C ATOM 774 O LEU A 738 41.941 -21.507 3.978 1.00 0.00 O ATOM 775 CB LEU A 738 42.811 -21.318 7.203 1.00 0.00 C ATOM 776 CG LEU A 738 44.213 -21.039 6.621 1.00 0.00 C ATOM 777 CD1 LEU A 738 44.221 -19.789 5.829 1.00 0.00 C ATOM 778 CD2 LEU A 738 45.238 -20.955 7.712 1.00 0.00 C ATOM 0 H LEU A 738 42.858 -23.393 5.209 1.00 0.00 H new ATOM 0 HA LEU A 738 40.861 -22.099 6.922 1.00 0.00 H new ATOM 0 HB2 LEU A 738 42.385 -20.363 7.511 1.00 0.00 H new ATOM 0 HB3 LEU A 738 42.941 -21.915 8.106 1.00 0.00 H new ATOM 0 HG LEU A 738 44.466 -21.870 5.963 1.00 0.00 H new ATOM 0 HD11 LEU A 738 45.221 -19.617 5.431 1.00 0.00 H new ATOM 0 HD12 LEU A 738 43.512 -19.876 5.005 1.00 0.00 H new ATOM 0 HD13 LEU A 738 43.935 -18.952 6.467 1.00 0.00 H new ATOM 0 HD21 LEU A 738 46.218 -20.758 7.277 1.00 0.00 H new ATOM 0 HD22 LEU A 738 44.976 -20.148 8.396 1.00 0.00 H new ATOM 0 HD23 LEU A 738 45.267 -21.898 8.258 1.00 0.00 H new ATOM 790 N PRO A 739 40.449 -20.349 5.176 1.00 0.00 N ATOM 791 CA PRO A 739 40.028 -19.532 4.060 1.00 0.00 C ATOM 792 C PRO A 739 41.033 -18.416 3.738 1.00 0.00 C ATOM 793 O PRO A 739 41.349 -17.550 4.591 1.00 0.00 O ATOM 794 CB PRO A 739 38.710 -18.939 4.540 1.00 0.00 C ATOM 795 CG PRO A 739 38.813 -18.905 6.019 1.00 0.00 C ATOM 796 CD PRO A 739 39.673 -20.065 6.404 1.00 0.00 C ATOM 0 HA PRO A 739 39.944 -20.110 3.140 1.00 0.00 H new ATOM 0 HB2 PRO A 739 38.557 -17.939 4.133 1.00 0.00 H new ATOM 0 HB3 PRO A 739 37.865 -19.547 4.218 1.00 0.00 H new ATOM 0 HG2 PRO A 739 39.252 -17.966 6.357 1.00 0.00 H new ATOM 0 HG3 PRO A 739 37.828 -18.981 6.480 1.00 0.00 H new ATOM 0 HD2 PRO A 739 40.325 -19.819 7.242 1.00 0.00 H new ATOM 0 HD3 PRO A 739 39.074 -20.924 6.707 1.00 0.00 H new ATOM 804 N LEU A 740 41.530 -18.434 2.535 1.00 0.00 N ATOM 805 CA LEU A 740 42.446 -17.438 2.067 1.00 0.00 C ATOM 806 C LEU A 740 41.893 -16.741 0.859 1.00 0.00 C ATOM 807 O LEU A 740 40.737 -16.920 0.478 1.00 0.00 O ATOM 808 CB LEU A 740 43.847 -18.014 1.764 1.00 0.00 C ATOM 809 CG LEU A 740 44.745 -18.276 2.968 1.00 0.00 C ATOM 810 CD1 LEU A 740 46.047 -18.918 2.544 1.00 0.00 C ATOM 811 CD2 LEU A 740 45.029 -16.980 3.726 1.00 0.00 C ATOM 0 H LEU A 740 41.307 -19.150 1.844 1.00 0.00 H new ATOM 0 HA LEU A 740 42.567 -16.715 2.874 1.00 0.00 H new ATOM 0 HB2 LEU A 740 43.722 -18.951 1.221 1.00 0.00 H new ATOM 0 HB3 LEU A 740 44.363 -17.325 1.096 1.00 0.00 H new ATOM 0 HG LEU A 740 44.217 -18.963 3.630 1.00 0.00 H new ATOM 0 HD11 LEU A 740 46.669 -19.094 3.422 1.00 0.00 H new ATOM 0 HD12 LEU A 740 45.841 -19.867 2.049 1.00 0.00 H new ATOM 0 HD13 LEU A 740 46.571 -18.256 1.855 1.00 0.00 H new ATOM 0 HD21 LEU A 740 45.671 -17.192 4.581 1.00 0.00 H new ATOM 0 HD22 LEU A 740 45.528 -16.273 3.063 1.00 0.00 H new ATOM 0 HD23 LEU A 740 44.090 -16.550 4.075 1.00 0.00 H new ATOM 823 N THR A 741 42.686 -15.915 0.298 1.00 0.00 N ATOM 824 CA THR A 741 42.334 -15.180 -0.853 1.00 0.00 C ATOM 825 C THR A 741 43.609 -15.150 -1.701 1.00 0.00 C ATOM 826 O THR A 741 44.704 -15.205 -1.129 1.00 0.00 O ATOM 827 CB THR A 741 41.895 -13.759 -0.419 1.00 0.00 C ATOM 828 OG1 THR A 741 41.115 -13.874 0.785 1.00 0.00 O ATOM 829 CG2 THR A 741 41.013 -13.124 -1.456 1.00 0.00 C ATOM 0 H THR A 741 43.629 -15.724 0.637 1.00 0.00 H new ATOM 0 HA THR A 741 41.506 -15.611 -1.416 1.00 0.00 H new ATOM 0 HB THR A 741 42.789 -13.152 -0.277 1.00 0.00 H new ATOM 0 HG1 THR A 741 40.697 -13.011 0.988 1.00 0.00 H new ATOM 0 HG21 THR A 741 40.721 -12.128 -1.124 1.00 0.00 H new ATOM 0 HG22 THR A 741 41.556 -13.048 -2.398 1.00 0.00 H new ATOM 0 HG23 THR A 741 40.122 -13.735 -1.599 1.00 0.00 H new ATOM 837 N VAL A 742 43.474 -15.130 -3.014 1.00 0.00 N ATOM 838 CA VAL A 742 44.611 -15.224 -3.956 1.00 0.00 C ATOM 839 C VAL A 742 45.740 -14.246 -3.652 1.00 0.00 C ATOM 840 O VAL A 742 46.916 -14.653 -3.618 1.00 0.00 O ATOM 841 CB VAL A 742 44.159 -15.039 -5.417 1.00 0.00 C ATOM 842 CG1 VAL A 742 45.297 -15.167 -6.406 1.00 0.00 C ATOM 843 CG2 VAL A 742 43.056 -15.986 -5.761 1.00 0.00 C ATOM 0 H VAL A 742 42.569 -15.048 -3.477 1.00 0.00 H new ATOM 0 HA VAL A 742 45.003 -16.232 -3.819 1.00 0.00 H new ATOM 0 HB VAL A 742 43.785 -14.018 -5.496 1.00 0.00 H new ATOM 0 HG11 VAL A 742 44.917 -15.027 -7.418 1.00 0.00 H new ATOM 0 HG12 VAL A 742 46.051 -14.409 -6.193 1.00 0.00 H new ATOM 0 HG13 VAL A 742 45.744 -16.157 -6.320 1.00 0.00 H new ATOM 0 HG21 VAL A 742 42.756 -15.834 -6.798 1.00 0.00 H new ATOM 0 HG22 VAL A 742 43.403 -17.011 -5.630 1.00 0.00 H new ATOM 0 HG23 VAL A 742 42.203 -15.805 -5.106 1.00 0.00 H new ATOM 853 N CYS A 743 45.409 -12.986 -3.418 1.00 0.00 N ATOM 854 CA CYS A 743 46.433 -11.994 -3.153 1.00 0.00 C ATOM 855 C CYS A 743 47.139 -12.311 -1.846 1.00 0.00 C ATOM 856 O CYS A 743 48.370 -12.326 -1.808 1.00 0.00 O ATOM 857 CB CYS A 743 45.881 -10.561 -3.183 1.00 0.00 C ATOM 858 SG CYS A 743 47.160 -9.257 -3.207 1.00 0.00 S ATOM 0 H CYS A 743 44.453 -12.632 -3.406 1.00 0.00 H new ATOM 0 HA CYS A 743 47.167 -12.043 -3.957 1.00 0.00 H new ATOM 0 HB2 CYS A 743 45.248 -10.447 -4.063 1.00 0.00 H new ATOM 0 HB3 CYS A 743 45.244 -10.412 -2.311 1.00 0.00 H new ATOM 0 HG CYS A 743 47.809 -9.265 -2.081 1.00 0.00 H new ATOM 863 N LYS A 744 46.351 -12.639 -0.791 1.00 0.00 N ATOM 864 CA LYS A 744 46.915 -13.070 0.498 1.00 0.00 C ATOM 865 C LYS A 744 47.888 -14.211 0.272 1.00 0.00 C ATOM 866 O LYS A 744 49.033 -14.107 0.591 1.00 0.00 O ATOM 867 CB LYS A 744 45.834 -13.586 1.460 1.00 0.00 C ATOM 868 CG LYS A 744 44.789 -12.590 1.912 1.00 0.00 C ATOM 869 CD LYS A 744 43.806 -13.260 2.867 1.00 0.00 C ATOM 870 CE LYS A 744 42.676 -12.334 3.292 1.00 0.00 C ATOM 871 NZ LYS A 744 43.151 -11.134 4.006 1.00 0.00 N ATOM 0 H LYS A 744 45.332 -12.611 -0.814 1.00 0.00 H new ATOM 0 HA LYS A 744 47.403 -12.199 0.935 1.00 0.00 H new ATOM 0 HB2 LYS A 744 45.322 -14.420 0.980 1.00 0.00 H new ATOM 0 HB3 LYS A 744 46.330 -13.983 2.346 1.00 0.00 H new ATOM 0 HG2 LYS A 744 45.270 -11.745 2.406 1.00 0.00 H new ATOM 0 HG3 LYS A 744 44.256 -12.193 1.048 1.00 0.00 H new ATOM 0 HD2 LYS A 744 43.385 -14.144 2.387 1.00 0.00 H new ATOM 0 HD3 LYS A 744 44.342 -13.602 3.752 1.00 0.00 H new ATOM 0 HE2 LYS A 744 42.115 -12.026 2.410 1.00 0.00 H new ATOM 0 HE3 LYS A 744 41.986 -12.882 3.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 744 42.335 -10.576 4.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 744 43.721 -11.421 4.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 744 43.733 -10.557 3.366 1.00 0.00 H new ATOM 885 N MET A 745 47.391 -15.267 -0.347 1.00 0.00 N ATOM 886 CA MET A 745 48.151 -16.484 -0.624 1.00 0.00 C ATOM 887 C MET A 745 49.450 -16.218 -1.386 1.00 0.00 C ATOM 888 O MET A 745 50.486 -16.707 -0.997 1.00 0.00 O ATOM 889 CB MET A 745 47.256 -17.477 -1.372 1.00 0.00 C ATOM 890 CG MET A 745 47.982 -18.446 -2.304 1.00 0.00 C ATOM 891 SD MET A 745 48.796 -19.820 -1.466 1.00 0.00 S ATOM 892 CE MET A 745 47.373 -20.722 -0.872 1.00 0.00 C ATOM 0 H MET A 745 46.428 -15.308 -0.680 1.00 0.00 H new ATOM 0 HA MET A 745 48.456 -16.913 0.330 1.00 0.00 H new ATOM 0 HB2 MET A 745 46.695 -18.057 -0.639 1.00 0.00 H new ATOM 0 HB3 MET A 745 46.529 -16.914 -1.957 1.00 0.00 H new ATOM 0 HG2 MET A 745 47.265 -18.847 -3.021 1.00 0.00 H new ATOM 0 HG3 MET A 745 48.727 -17.892 -2.875 1.00 0.00 H new ATOM 0 HE1 MET A 745 47.628 -21.777 -0.770 1.00 0.00 H new ATOM 0 HE2 MET A 745 47.070 -20.326 0.097 1.00 0.00 H new ATOM 0 HE3 MET A 745 46.552 -20.614 -1.581 1.00 0.00 H new ATOM 902 N HIS A 746 49.392 -15.427 -2.442 1.00 0.00 N ATOM 903 CA HIS A 746 50.601 -15.152 -3.243 1.00 0.00 C ATOM 904 C HIS A 746 51.608 -14.310 -2.468 1.00 0.00 C ATOM 905 O HIS A 746 52.797 -14.633 -2.420 1.00 0.00 O ATOM 906 CB HIS A 746 50.275 -14.467 -4.576 1.00 0.00 C ATOM 907 CG HIS A 746 49.894 -15.373 -5.710 1.00 0.00 C ATOM 908 ND1 HIS A 746 50.805 -15.876 -6.609 1.00 0.00 N ATOM 909 CD2 HIS A 746 48.690 -15.805 -6.130 1.00 0.00 C ATOM 910 CE1 HIS A 746 50.177 -16.568 -7.534 1.00 0.00 C ATOM 911 NE2 HIS A 746 48.893 -16.541 -7.269 1.00 0.00 N ATOM 0 H HIS A 746 48.544 -14.965 -2.771 1.00 0.00 H new ATOM 0 HA HIS A 746 51.045 -16.124 -3.461 1.00 0.00 H new ATOM 0 HB2 HIS A 746 49.459 -13.764 -4.410 1.00 0.00 H new ATOM 0 HB3 HIS A 746 51.142 -13.882 -4.882 1.00 0.00 H new ATOM 0 HD2 HIS A 746 47.739 -15.608 -5.657 1.00 0.00 H new ATOM 0 HE1 HIS A 746 50.640 -17.072 -8.369 1.00 0.00 H new ATOM 0 HE2 HIS A 746 48.164 -16.994 -7.820 1.00 0.00 H new ATOM 920 N VAL A 747 51.123 -13.263 -1.848 1.00 0.00 N ATOM 921 CA VAL A 747 51.956 -12.354 -1.080 1.00 0.00 C ATOM 922 C VAL A 747 52.517 -13.040 0.154 1.00 0.00 C ATOM 923 O VAL A 747 53.706 -12.990 0.425 1.00 0.00 O ATOM 924 CB VAL A 747 51.160 -11.081 -0.727 1.00 0.00 C ATOM 925 CG1 VAL A 747 51.866 -10.211 0.317 1.00 0.00 C ATOM 926 CG2 VAL A 747 50.934 -10.299 -2.003 1.00 0.00 C ATOM 0 H VAL A 747 50.135 -13.011 -1.858 1.00 0.00 H new ATOM 0 HA VAL A 747 52.810 -12.055 -1.688 1.00 0.00 H new ATOM 0 HB VAL A 747 50.211 -11.378 -0.280 1.00 0.00 H new ATOM 0 HG11 VAL A 747 51.260 -9.330 0.526 1.00 0.00 H new ATOM 0 HG12 VAL A 747 52.003 -10.783 1.235 1.00 0.00 H new ATOM 0 HG13 VAL A 747 52.838 -9.900 -0.066 1.00 0.00 H new ATOM 0 HG21 VAL A 747 50.372 -9.392 -1.779 1.00 0.00 H new ATOM 0 HG22 VAL A 747 51.896 -10.031 -2.441 1.00 0.00 H new ATOM 0 HG23 VAL A 747 50.371 -10.910 -2.709 1.00 0.00 H new ATOM 936 N LEU A 748 51.682 -13.735 0.850 1.00 0.00 N ATOM 937 CA LEU A 748 52.084 -14.482 2.008 1.00 0.00 C ATOM 938 C LEU A 748 53.054 -15.616 1.616 1.00 0.00 C ATOM 939 O LEU A 748 53.942 -15.995 2.383 1.00 0.00 O ATOM 940 CB LEU A 748 50.810 -14.909 2.805 1.00 0.00 C ATOM 941 CG LEU A 748 50.697 -16.302 3.423 1.00 0.00 C ATOM 942 CD1 LEU A 748 49.518 -16.320 4.385 1.00 0.00 C ATOM 943 CD2 LEU A 748 50.437 -17.341 2.341 1.00 0.00 C ATOM 0 H LEU A 748 50.688 -13.805 0.634 1.00 0.00 H new ATOM 0 HA LEU A 748 52.668 -13.872 2.697 1.00 0.00 H new ATOM 0 HB2 LEU A 748 50.684 -14.190 3.614 1.00 0.00 H new ATOM 0 HB3 LEU A 748 49.959 -14.787 2.135 1.00 0.00 H new ATOM 0 HG LEU A 748 51.629 -16.534 3.939 1.00 0.00 H new ATOM 0 HD11 LEU A 748 49.428 -17.310 4.832 1.00 0.00 H new ATOM 0 HD12 LEU A 748 49.678 -15.581 5.170 1.00 0.00 H new ATOM 0 HD13 LEU A 748 48.603 -16.082 3.843 1.00 0.00 H new ATOM 0 HD21 LEU A 748 50.359 -18.328 2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 748 49.506 -17.104 1.825 1.00 0.00 H new ATOM 0 HD23 LEU A 748 51.260 -17.335 1.626 1.00 0.00 H new ATOM 955 N HIS A 749 52.926 -16.092 0.389 1.00 0.00 N ATOM 956 CA HIS A 749 53.808 -17.125 -0.131 1.00 0.00 C ATOM 957 C HIS A 749 55.190 -16.541 -0.393 1.00 0.00 C ATOM 958 O HIS A 749 56.189 -17.181 -0.111 1.00 0.00 O ATOM 959 CB HIS A 749 53.263 -17.737 -1.430 1.00 0.00 C ATOM 960 CG HIS A 749 53.939 -19.011 -1.834 1.00 0.00 C ATOM 961 ND1 HIS A 749 55.077 -19.073 -2.604 1.00 0.00 N ATOM 962 CD2 HIS A 749 53.619 -20.283 -1.551 1.00 0.00 C ATOM 963 CE1 HIS A 749 55.423 -20.327 -2.768 1.00 0.00 C ATOM 964 NE2 HIS A 749 54.558 -21.081 -2.139 1.00 0.00 N ATOM 0 H HIS A 749 52.214 -15.777 -0.270 1.00 0.00 H new ATOM 0 HA HIS A 749 53.869 -17.914 0.618 1.00 0.00 H new ATOM 0 HB2 HIS A 749 52.196 -17.926 -1.311 1.00 0.00 H new ATOM 0 HB3 HIS A 749 53.370 -17.010 -2.235 1.00 0.00 H new ATOM 0 HD2 HIS A 749 52.774 -20.615 -0.966 1.00 0.00 H new ATOM 0 HE1 HIS A 749 56.277 -20.678 -3.328 1.00 0.00 H new ATOM 0 HE2 HIS A 749 54.581 -22.100 -2.095 1.00 0.00 H new ATOM 973 N CYS A 750 55.247 -15.314 -0.899 1.00 0.00 N ATOM 974 CA CYS A 750 56.530 -14.695 -1.200 1.00 0.00 C ATOM 975 C CYS A 750 57.158 -14.145 0.069 1.00 0.00 C ATOM 976 O CYS A 750 58.375 -13.905 0.136 1.00 0.00 O ATOM 977 CB CYS A 750 56.420 -13.631 -2.297 1.00 0.00 C ATOM 978 SG CYS A 750 55.307 -12.245 -1.923 1.00 0.00 S ATOM 0 H CYS A 750 54.432 -14.736 -1.106 1.00 0.00 H new ATOM 0 HA CYS A 750 57.189 -15.466 -1.598 1.00 0.00 H new ATOM 0 HB2 CYS A 750 57.415 -13.233 -2.496 1.00 0.00 H new ATOM 0 HB3 CYS A 750 56.080 -14.112 -3.214 1.00 0.00 H new ATOM 0 HG CYS A 750 54.751 -12.436 -0.764 1.00 0.00 H new ATOM 983 N GLN A 751 56.321 -13.945 1.083 1.00 0.00 N ATOM 984 CA GLN A 751 56.798 -13.613 2.414 1.00 0.00 C ATOM 985 C GLN A 751 57.502 -14.831 3.028 1.00 0.00 C ATOM 986 O GLN A 751 58.333 -14.698 3.926 1.00 0.00 O ATOM 987 CB GLN A 751 55.648 -13.151 3.310 1.00 0.00 C ATOM 988 CG GLN A 751 55.032 -11.817 2.902 1.00 0.00 C ATOM 989 CD GLN A 751 55.996 -10.651 3.031 1.00 0.00 C ATOM 990 OE1 GLN A 751 56.899 -10.662 3.859 1.00 0.00 O ATOM 991 NE2 GLN A 751 55.803 -9.629 2.240 1.00 0.00 N ATOM 0 H GLN A 751 55.306 -14.008 1.004 1.00 0.00 H new ATOM 0 HA GLN A 751 57.509 -12.790 2.335 1.00 0.00 H new ATOM 0 HB2 GLN A 751 54.870 -13.914 3.305 1.00 0.00 H new ATOM 0 HB3 GLN A 751 56.010 -13.072 4.335 1.00 0.00 H new ATOM 0 HG2 GLN A 751 54.688 -11.883 1.870 1.00 0.00 H new ATOM 0 HG3 GLN A 751 54.154 -11.625 3.519 1.00 0.00 H new ATOM 0 HE21 GLN A 751 55.043 -9.647 1.560 1.00 0.00 H new ATOM 0 HE22 GLN A 751 56.412 -8.813 2.303 1.00 0.00 H new ATOM 1000 N GLY A 752 57.171 -16.016 2.524 1.00 0.00 N ATOM 1001 CA GLY A 752 57.843 -17.219 2.961 1.00 0.00 C ATOM 1002 C GLY A 752 56.919 -18.278 3.530 1.00 0.00 C ATOM 1003 O GLY A 752 57.386 -19.295 4.044 1.00 0.00 O ATOM 0 H GLY A 752 56.448 -16.161 1.820 1.00 0.00 H new ATOM 0 HA2 GLY A 752 58.388 -17.644 2.118 1.00 0.00 H new ATOM 0 HA3 GLY A 752 58.582 -16.954 3.717 1.00 0.00 H new ATOM 1007 N ARG A 753 55.620 -18.072 3.447 1.00 0.00 N ATOM 1008 CA ARG A 753 54.685 -19.040 4.019 1.00 0.00 C ATOM 1009 C ARG A 753 54.309 -20.082 2.969 1.00 0.00 C ATOM 1010 O ARG A 753 54.330 -19.796 1.764 1.00 0.00 O ATOM 1011 CB ARG A 753 53.426 -18.349 4.541 1.00 0.00 C ATOM 1012 CG ARG A 753 53.690 -17.111 5.398 1.00 0.00 C ATOM 1013 CD ARG A 753 54.542 -17.417 6.612 1.00 0.00 C ATOM 1014 NE ARG A 753 54.900 -16.189 7.322 1.00 0.00 N ATOM 1015 CZ ARG A 753 55.600 -16.118 8.455 1.00 0.00 C ATOM 1016 NH1 ARG A 753 55.974 -17.222 9.086 1.00 0.00 N ATOM 1017 NH2 ARG A 753 55.914 -14.931 8.953 1.00 0.00 N ATOM 0 H ARG A 753 55.187 -17.263 3.001 1.00 0.00 H new ATOM 0 HA ARG A 753 55.176 -19.531 4.859 1.00 0.00 H new ATOM 0 HB2 ARG A 753 52.806 -18.062 3.692 1.00 0.00 H new ATOM 0 HB3 ARG A 753 52.851 -19.065 5.128 1.00 0.00 H new ATOM 0 HG2 ARG A 753 54.186 -16.353 4.792 1.00 0.00 H new ATOM 0 HG3 ARG A 753 52.739 -16.688 5.723 1.00 0.00 H new ATOM 0 HD2 ARG A 753 54.001 -18.085 7.282 1.00 0.00 H new ATOM 0 HD3 ARG A 753 55.447 -17.940 6.303 1.00 0.00 H new ATOM 0 HE ARG A 753 54.586 -15.308 6.914 1.00 0.00 H new ATOM 0 HH11 ARG A 753 55.727 -18.136 8.706 1.00 0.00 H new ATOM 0 HH12 ARG A 753 56.509 -17.158 9.952 1.00 0.00 H new ATOM 0 HH21 ARG A 753 55.621 -14.082 8.470 1.00 0.00 H new ATOM 0 HH22 ARG A 753 56.449 -14.867 9.819 1.00 0.00 H new ATOM 1031 N ASN A 754 53.991 -21.275 3.411 1.00 0.00 N ATOM 1032 CA ASN A 754 53.658 -22.378 2.511 1.00 0.00 C ATOM 1033 C ASN A 754 52.223 -22.815 2.724 1.00 0.00 C ATOM 1034 O ASN A 754 51.796 -23.068 3.871 1.00 0.00 O ATOM 1035 CB ASN A 754 54.597 -23.573 2.738 1.00 0.00 C ATOM 1036 CG ASN A 754 56.059 -23.231 2.563 1.00 0.00 C ATOM 1037 OD1 ASN A 754 56.593 -23.282 1.471 1.00 0.00 O ATOM 1038 ND2 ASN A 754 56.724 -22.903 3.645 1.00 0.00 N ATOM 0 H ASN A 754 53.953 -21.519 4.401 1.00 0.00 H new ATOM 0 HA ASN A 754 53.781 -22.025 1.487 1.00 0.00 H new ATOM 0 HB2 ASN A 754 54.441 -23.962 3.744 1.00 0.00 H new ATOM 0 HB3 ASN A 754 54.333 -24.370 2.043 1.00 0.00 H new ATOM 0 HD21 ASN A 754 57.718 -22.682 3.585 1.00 0.00 H new ATOM 0 HD22 ASN A 754 56.247 -22.869 4.546 1.00 0.00 H new ATOM 1045 N TYR A 755 51.470 -22.892 1.642 1.00 0.00 N ATOM 1046 CA TYR A 755 50.060 -23.251 1.686 1.00 0.00 C ATOM 1047 C TYR A 755 49.663 -24.080 0.496 1.00 0.00 C ATOM 1048 O TYR A 755 50.148 -23.864 -0.623 1.00 0.00 O ATOM 1049 CB TYR A 755 49.155 -22.022 1.755 1.00 0.00 C ATOM 1050 CG TYR A 755 49.074 -21.377 3.103 1.00 0.00 C ATOM 1051 CD1 TYR A 755 48.038 -21.679 3.953 1.00 0.00 C ATOM 1052 CD2 TYR A 755 50.036 -20.490 3.533 1.00 0.00 C ATOM 1053 CE1 TYR A 755 47.963 -21.119 5.198 1.00 0.00 C ATOM 1054 CE2 TYR A 755 49.968 -19.917 4.777 1.00 0.00 C ATOM 1055 CZ TYR A 755 48.928 -20.238 5.609 1.00 0.00 C ATOM 1056 OH TYR A 755 48.869 -19.699 6.875 1.00 0.00 O ATOM 0 H TYR A 755 51.819 -22.707 0.702 1.00 0.00 H new ATOM 0 HA TYR A 755 49.928 -23.837 2.596 1.00 0.00 H new ATOM 0 HB2 TYR A 755 49.512 -21.285 1.036 1.00 0.00 H new ATOM 0 HB3 TYR A 755 48.151 -22.310 1.445 1.00 0.00 H new ATOM 0 HD1 TYR A 755 47.271 -22.369 3.633 1.00 0.00 H new ATOM 0 HD2 TYR A 755 50.859 -20.241 2.879 1.00 0.00 H new ATOM 0 HE1 TYR A 755 47.145 -21.371 5.856 1.00 0.00 H new ATOM 0 HE2 TYR A 755 50.727 -19.219 5.098 1.00 0.00 H new ATOM 0 HH TYR A 755 48.794 -20.420 7.534 1.00 0.00 H new ATOM 1066 N THR A 756 48.771 -24.985 0.733 1.00 0.00 N ATOM 1067 CA THR A 756 48.286 -25.882 -0.276 1.00 0.00 C ATOM 1068 C THR A 756 46.866 -25.481 -0.680 1.00 0.00 C ATOM 1069 O THR A 756 46.062 -25.172 0.168 1.00 0.00 O ATOM 1070 CB THR A 756 48.257 -27.304 0.309 1.00 0.00 C ATOM 1071 OG1 THR A 756 49.551 -27.634 0.841 1.00 0.00 O ATOM 1072 CG2 THR A 756 47.865 -28.318 -0.735 1.00 0.00 C ATOM 0 H THR A 756 48.348 -25.128 1.650 1.00 0.00 H new ATOM 0 HA THR A 756 48.936 -25.842 -1.150 1.00 0.00 H new ATOM 0 HB THR A 756 47.512 -27.329 1.104 1.00 0.00 H new ATOM 0 HG1 THR A 756 49.530 -28.540 1.215 1.00 0.00 H new ATOM 0 HG21 THR A 756 47.854 -29.313 -0.290 1.00 0.00 H new ATOM 0 HG22 THR A 756 46.873 -28.081 -1.118 1.00 0.00 H new ATOM 0 HG23 THR A 756 48.585 -28.295 -1.553 1.00 0.00 H new ATOM 1080 N LEU A 757 46.580 -25.465 -1.961 1.00 0.00 N ATOM 1081 CA LEU A 757 45.234 -25.170 -2.430 1.00 0.00 C ATOM 1082 C LEU A 757 44.387 -26.408 -2.318 1.00 0.00 C ATOM 1083 O LEU A 757 44.760 -27.471 -2.828 1.00 0.00 O ATOM 1084 CB LEU A 757 45.221 -24.627 -3.874 1.00 0.00 C ATOM 1085 CG LEU A 757 45.700 -23.177 -4.088 1.00 0.00 C ATOM 1086 CD1 LEU A 757 44.843 -22.204 -3.289 1.00 0.00 C ATOM 1087 CD2 LEU A 757 47.181 -23.005 -3.755 1.00 0.00 C ATOM 0 H LEU A 757 47.256 -25.652 -2.701 1.00 0.00 H new ATOM 0 HA LEU A 757 44.821 -24.382 -1.800 1.00 0.00 H new ATOM 0 HB2 LEU A 757 45.842 -25.281 -4.486 1.00 0.00 H new ATOM 0 HB3 LEU A 757 44.203 -24.706 -4.255 1.00 0.00 H new ATOM 0 HG LEU A 757 45.584 -22.950 -5.148 1.00 0.00 H new ATOM 0 HD11 LEU A 757 45.198 -21.187 -3.454 1.00 0.00 H new ATOM 0 HD12 LEU A 757 43.805 -22.283 -3.612 1.00 0.00 H new ATOM 0 HD13 LEU A 757 44.912 -22.445 -2.228 1.00 0.00 H new ATOM 0 HD21 LEU A 757 47.473 -21.968 -3.921 1.00 0.00 H new ATOM 0 HD22 LEU A 757 47.352 -23.268 -2.711 1.00 0.00 H new ATOM 0 HD23 LEU A 757 47.776 -23.656 -4.395 1.00 0.00 H new ATOM 1099 N THR A 758 43.290 -26.290 -1.632 1.00 0.00 N ATOM 1100 CA THR A 758 42.444 -27.412 -1.378 1.00 0.00 C ATOM 1101 C THR A 758 41.125 -27.291 -2.128 1.00 0.00 C ATOM 1102 O THR A 758 40.954 -26.398 -2.985 1.00 0.00 O ATOM 1103 CB THR A 758 42.183 -27.531 0.133 1.00 0.00 C ATOM 1104 OG1 THR A 758 41.620 -26.306 0.631 1.00 0.00 O ATOM 1105 CG2 THR A 758 43.468 -27.828 0.866 1.00 0.00 C ATOM 0 H THR A 758 42.958 -25.412 -1.233 1.00 0.00 H new ATOM 0 HA THR A 758 42.950 -28.310 -1.733 1.00 0.00 H new ATOM 0 HB THR A 758 41.481 -28.348 0.300 1.00 0.00 H new ATOM 0 HG1 THR A 758 41.035 -26.501 1.393 1.00 0.00 H new ATOM 0 HG21 THR A 758 43.267 -27.909 1.934 1.00 0.00 H new ATOM 0 HG22 THR A 758 43.885 -28.767 0.503 1.00 0.00 H new ATOM 0 HG23 THR A 758 44.181 -27.022 0.691 1.00 0.00 H new ATOM 1113 N GLY A 759 40.200 -28.176 -1.813 1.00 0.00 N ATOM 1114 CA GLY A 759 38.915 -28.156 -2.432 1.00 0.00 C ATOM 1115 C GLY A 759 38.027 -27.076 -1.856 1.00 0.00 C ATOM 1116 O GLY A 759 38.228 -26.634 -0.711 1.00 0.00 O ATOM 0 H GLY A 759 40.328 -28.918 -1.125 1.00 0.00 H new ATOM 0 HA2 GLY A 759 39.031 -27.997 -3.504 1.00 0.00 H new ATOM 0 HA3 GLY A 759 38.436 -29.126 -2.304 1.00 0.00 H new ATOM 1120 N ARG A 760 37.030 -26.685 -2.624 1.00 0.00 N ATOM 1121 CA ARG A 760 36.095 -25.614 -2.268 1.00 0.00 C ATOM 1122 C ARG A 760 35.207 -26.012 -1.085 1.00 0.00 C ATOM 1123 O ARG A 760 34.574 -25.177 -0.464 1.00 0.00 O ATOM 1124 CB ARG A 760 35.233 -25.230 -3.519 1.00 0.00 C ATOM 1125 CG ARG A 760 34.303 -26.346 -4.048 1.00 0.00 C ATOM 1126 CD ARG A 760 32.979 -26.410 -3.282 1.00 0.00 C ATOM 1127 NE ARG A 760 32.288 -27.704 -3.420 1.00 0.00 N ATOM 1128 CZ ARG A 760 31.222 -28.071 -2.684 1.00 0.00 C ATOM 1129 NH1 ARG A 760 30.558 -27.161 -1.976 1.00 0.00 N ATOM 1130 NH2 ARG A 760 30.794 -29.329 -2.706 1.00 0.00 N ATOM 0 H ARG A 760 36.835 -27.105 -3.533 1.00 0.00 H new ATOM 0 HA ARG A 760 36.670 -24.743 -1.954 1.00 0.00 H new ATOM 0 HB2 ARG A 760 34.624 -24.361 -3.268 1.00 0.00 H new ATOM 0 HB3 ARG A 760 35.904 -24.927 -4.323 1.00 0.00 H new ATOM 0 HG2 ARG A 760 34.101 -26.176 -5.106 1.00 0.00 H new ATOM 0 HG3 ARG A 760 34.812 -27.307 -3.971 1.00 0.00 H new ATOM 0 HD2 ARG A 760 33.169 -26.218 -2.226 1.00 0.00 H new ATOM 0 HD3 ARG A 760 32.323 -25.616 -3.638 1.00 0.00 H new ATOM 0 HE ARG A 760 32.639 -28.362 -4.116 1.00 0.00 H new ATOM 0 HH11 ARG A 760 30.857 -26.186 -1.991 1.00 0.00 H new ATOM 0 HH12 ARG A 760 29.750 -27.439 -1.418 1.00 0.00 H new ATOM 0 HH21 ARG A 760 31.274 -30.021 -3.282 1.00 0.00 H new ATOM 0 HH22 ARG A 760 29.986 -29.603 -2.147 1.00 0.00 H new ATOM 1144 N ASP A 761 35.151 -27.293 -0.807 1.00 0.00 N ATOM 1145 CA ASP A 761 34.291 -27.821 0.248 1.00 0.00 C ATOM 1146 C ASP A 761 35.007 -27.840 1.601 1.00 0.00 C ATOM 1147 O ASP A 761 34.377 -27.964 2.649 1.00 0.00 O ATOM 1148 CB ASP A 761 33.819 -29.235 -0.144 1.00 0.00 C ATOM 1149 CG ASP A 761 32.991 -29.927 0.918 1.00 0.00 C ATOM 1150 OD1 ASP A 761 31.812 -29.555 1.112 1.00 0.00 O ATOM 1151 OD2 ASP A 761 33.499 -30.878 1.554 1.00 0.00 O ATOM 0 H ASP A 761 35.694 -28.003 -1.298 1.00 0.00 H new ATOM 0 HA ASP A 761 33.426 -27.166 0.355 1.00 0.00 H new ATOM 0 HB2 ASP A 761 33.233 -29.170 -1.061 1.00 0.00 H new ATOM 0 HB3 ASP A 761 34.692 -29.849 -0.366 1.00 0.00 H new ATOM 1156 N SER A 762 36.309 -27.661 1.573 1.00 0.00 N ATOM 1157 CA SER A 762 37.114 -27.787 2.768 1.00 0.00 C ATOM 1158 C SER A 762 36.913 -26.637 3.788 1.00 0.00 C ATOM 1159 O SER A 762 36.957 -26.873 4.999 1.00 0.00 O ATOM 1160 CB SER A 762 38.571 -27.973 2.381 1.00 0.00 C ATOM 1161 OG SER A 762 38.691 -29.077 1.491 1.00 0.00 O ATOM 0 H SER A 762 36.835 -27.427 0.731 1.00 0.00 H new ATOM 0 HA SER A 762 36.771 -28.675 3.300 1.00 0.00 H new ATOM 0 HB2 SER A 762 38.950 -27.068 1.907 1.00 0.00 H new ATOM 0 HB3 SER A 762 39.176 -28.144 3.272 1.00 0.00 H new ATOM 0 HG SER A 762 39.631 -29.195 1.241 1.00 0.00 H new ATOM 1167 N CYS A 763 36.685 -25.422 3.330 1.00 0.00 N ATOM 1168 CA CYS A 763 36.441 -24.335 4.266 1.00 0.00 C ATOM 1169 C CYS A 763 35.437 -23.357 3.704 1.00 0.00 C ATOM 1170 O CYS A 763 35.125 -23.388 2.508 1.00 0.00 O ATOM 1171 CB CYS A 763 37.737 -23.611 4.667 1.00 0.00 C ATOM 1172 SG CYS A 763 38.564 -22.707 3.337 1.00 0.00 S ATOM 0 H CYS A 763 36.663 -25.163 2.344 1.00 0.00 H new ATOM 0 HA CYS A 763 36.027 -24.780 5.171 1.00 0.00 H new ATOM 0 HB2 CYS A 763 37.508 -22.912 5.471 1.00 0.00 H new ATOM 0 HB3 CYS A 763 38.433 -24.346 5.072 1.00 0.00 H new ATOM 0 HG CYS A 763 38.021 -23.019 2.198 1.00 0.00 H new ATOM 1177 N THR A 764 34.924 -22.522 4.550 1.00 0.00 N ATOM 1178 CA THR A 764 33.962 -21.533 4.175 1.00 0.00 C ATOM 1179 C THR A 764 34.675 -20.209 3.882 1.00 0.00 C ATOM 1180 O THR A 764 35.514 -19.756 4.668 1.00 0.00 O ATOM 1181 CB THR A 764 32.939 -21.372 5.318 1.00 0.00 C ATOM 1182 OG1 THR A 764 32.314 -22.657 5.578 1.00 0.00 O ATOM 1183 CG2 THR A 764 31.867 -20.344 4.973 1.00 0.00 C ATOM 0 H THR A 764 35.166 -22.507 5.541 1.00 0.00 H new ATOM 0 HA THR A 764 33.434 -21.841 3.272 1.00 0.00 H new ATOM 0 HB THR A 764 33.467 -21.018 6.203 1.00 0.00 H new ATOM 0 HG1 THR A 764 31.663 -22.563 6.305 1.00 0.00 H new ATOM 0 HG21 THR A 764 31.165 -20.258 5.802 1.00 0.00 H new ATOM 0 HG22 THR A 764 32.335 -19.376 4.793 1.00 0.00 H new ATOM 0 HG23 THR A 764 31.333 -20.661 4.077 1.00 0.00 H new ATOM 1191 N LEU A 765 34.361 -19.617 2.761 1.00 0.00 N ATOM 1192 CA LEU A 765 34.968 -18.383 2.359 1.00 0.00 C ATOM 1193 C LEU A 765 34.148 -17.194 2.773 1.00 0.00 C ATOM 1194 O LEU A 765 32.929 -17.298 3.014 1.00 0.00 O ATOM 1195 CB LEU A 765 35.208 -18.295 0.833 1.00 0.00 C ATOM 1196 CG LEU A 765 36.372 -19.069 0.242 1.00 0.00 C ATOM 1197 CD1 LEU A 765 37.659 -18.840 0.999 1.00 0.00 C ATOM 1198 CD2 LEU A 765 36.060 -20.483 0.160 1.00 0.00 C ATOM 0 H LEU A 765 33.674 -19.981 2.101 1.00 0.00 H new ATOM 0 HA LEU A 765 35.932 -18.368 2.868 1.00 0.00 H new ATOM 0 HB2 LEU A 765 34.299 -18.629 0.334 1.00 0.00 H new ATOM 0 HB3 LEU A 765 35.344 -17.244 0.578 1.00 0.00 H new ATOM 0 HG LEU A 765 36.530 -18.690 -0.768 1.00 0.00 H new ATOM 0 HD11 LEU A 765 38.461 -19.416 0.536 1.00 0.00 H new ATOM 0 HD12 LEU A 765 37.912 -17.780 0.974 1.00 0.00 H new ATOM 0 HD13 LEU A 765 37.534 -19.159 2.034 1.00 0.00 H new ATOM 0 HD21 LEU A 765 36.908 -21.019 -0.266 1.00 0.00 H new ATOM 0 HD22 LEU A 765 35.852 -20.868 1.158 1.00 0.00 H new ATOM 0 HD23 LEU A 765 35.185 -20.626 -0.474 1.00 0.00 H new ATOM 1210 N PRO A 766 34.821 -16.054 2.904 1.00 0.00 N ATOM 1211 CA PRO A 766 34.185 -14.759 3.092 1.00 0.00 C ATOM 1212 C PRO A 766 33.474 -14.325 1.798 1.00 0.00 C ATOM 1213 O PRO A 766 33.469 -15.058 0.798 1.00 0.00 O ATOM 1214 CB PRO A 766 35.385 -13.839 3.346 1.00 0.00 C ATOM 1215 CG PRO A 766 36.472 -14.514 2.606 1.00 0.00 C ATOM 1216 CD PRO A 766 36.287 -15.936 2.921 1.00 0.00 C ATOM 0 HA PRO A 766 33.438 -14.751 3.885 1.00 0.00 H new ATOM 0 HB2 PRO A 766 35.208 -12.830 2.974 1.00 0.00 H new ATOM 0 HB3 PRO A 766 35.611 -13.752 4.409 1.00 0.00 H new ATOM 0 HG2 PRO A 766 36.399 -14.330 1.534 1.00 0.00 H new ATOM 0 HG3 PRO A 766 37.452 -14.159 2.925 1.00 0.00 H new ATOM 0 HD2 PRO A 766 36.759 -16.584 2.183 1.00 0.00 H new ATOM 0 HD3 PRO A 766 36.708 -16.199 3.891 1.00 0.00 H new ATOM 1353 N LEU A 778 35.188 -7.556 -6.896 1.00 0.00 N ATOM 1354 CA LEU A 778 35.765 -7.230 -8.217 1.00 0.00 C ATOM 1355 C LEU A 778 34.730 -7.455 -9.317 1.00 0.00 C ATOM 1356 O LEU A 778 34.643 -6.718 -10.287 1.00 0.00 O ATOM 1357 CB LEU A 778 36.994 -8.121 -8.541 1.00 0.00 C ATOM 1358 CG LEU A 778 38.211 -8.112 -7.589 1.00 0.00 C ATOM 1359 CD1 LEU A 778 37.893 -8.759 -6.245 1.00 0.00 C ATOM 1360 CD2 LEU A 778 39.388 -8.818 -8.246 1.00 0.00 C ATOM 0 HA LEU A 778 36.072 -6.185 -8.178 1.00 0.00 H new ATOM 0 HB2 LEU A 778 36.642 -9.150 -8.612 1.00 0.00 H new ATOM 0 HB3 LEU A 778 37.351 -7.838 -9.531 1.00 0.00 H new ATOM 0 HG LEU A 778 38.470 -7.071 -7.395 1.00 0.00 H new ATOM 0 HD11 LEU A 778 38.778 -8.730 -5.609 1.00 0.00 H new ATOM 0 HD12 LEU A 778 37.081 -8.215 -5.762 1.00 0.00 H new ATOM 0 HD13 LEU A 778 37.593 -9.795 -6.402 1.00 0.00 H new ATOM 0 HD21 LEU A 778 40.242 -8.808 -7.569 1.00 0.00 H new ATOM 0 HD22 LEU A 778 39.115 -9.849 -8.470 1.00 0.00 H new ATOM 0 HD23 LEU A 778 39.651 -8.303 -9.170 1.00 0.00 H new ATOM 1372 N TRP A 779 33.986 -8.500 -9.137 1.00 0.00 N ATOM 1373 CA TRP A 779 32.992 -8.979 -10.086 1.00 0.00 C ATOM 1374 C TRP A 779 31.597 -8.450 -9.774 1.00 0.00 C ATOM 1375 O TRP A 779 30.745 -8.342 -10.652 1.00 0.00 O ATOM 1376 CB TRP A 779 33.019 -10.512 -10.063 1.00 0.00 C ATOM 1377 CG TRP A 779 33.252 -11.065 -8.677 1.00 0.00 C ATOM 1378 CD1 TRP A 779 32.332 -11.270 -7.705 1.00 0.00 C ATOM 1379 CD2 TRP A 779 34.515 -11.443 -8.115 1.00 0.00 C ATOM 1380 NE1 TRP A 779 32.938 -11.762 -6.575 1.00 0.00 N ATOM 1381 CE2 TRP A 779 34.281 -11.873 -6.802 1.00 0.00 C ATOM 1382 CE3 TRP A 779 35.817 -11.455 -8.604 1.00 0.00 C ATOM 1383 CZ2 TRP A 779 35.304 -12.311 -5.971 1.00 0.00 C ATOM 1384 CZ3 TRP A 779 36.830 -11.885 -7.781 1.00 0.00 C ATOM 1385 CH2 TRP A 779 36.567 -12.307 -6.477 1.00 0.00 C ATOM 0 H TRP A 779 34.045 -9.076 -8.297 1.00 0.00 H new ATOM 0 HA TRP A 779 33.237 -8.609 -11.082 1.00 0.00 H new ATOM 0 HB2 TRP A 779 32.074 -10.895 -10.449 1.00 0.00 H new ATOM 0 HB3 TRP A 779 33.804 -10.869 -10.730 1.00 0.00 H new ATOM 0 HD1 TRP A 779 31.274 -11.075 -7.804 1.00 0.00 H new ATOM 0 HE1 TRP A 779 32.462 -12.005 -5.706 1.00 0.00 H new ATOM 0 HE3 TRP A 779 36.028 -11.132 -9.613 1.00 0.00 H new ATOM 0 HZ2 TRP A 779 35.105 -12.642 -4.962 1.00 0.00 H new ATOM 0 HZ3 TRP A 779 37.845 -11.897 -8.149 1.00 0.00 H new ATOM 0 HH2 TRP A 779 37.385 -12.638 -5.855 1.00 0.00 H new ATOM 1396 N GLY A 780 31.381 -8.109 -8.536 1.00 0.00 N ATOM 1397 CA GLY A 780 30.104 -7.613 -8.120 1.00 0.00 C ATOM 1398 C GLY A 780 30.150 -6.130 -8.070 1.00 0.00 C ATOM 1399 O GLY A 780 30.975 -5.560 -7.363 1.00 0.00 O ATOM 0 H GLY A 780 32.079 -8.167 -7.794 1.00 0.00 H new ATOM 0 HA2 GLY A 780 29.329 -7.942 -8.813 1.00 0.00 H new ATOM 0 HA3 GLY A 780 29.846 -8.014 -7.140 1.00 0.00 H new ATOM 1526 N VAL A 790 25.007 -6.321 -8.785 1.00 0.00 N ATOM 1527 CA VAL A 790 24.960 -7.235 -9.899 1.00 0.00 C ATOM 1528 C VAL A 790 26.338 -7.716 -10.240 1.00 0.00 C ATOM 1529 O VAL A 790 27.335 -7.126 -9.823 1.00 0.00 O ATOM 1530 CB VAL A 790 24.283 -6.633 -11.169 1.00 0.00 C ATOM 1531 CG1 VAL A 790 22.823 -6.333 -10.909 1.00 0.00 C ATOM 1532 CG2 VAL A 790 25.012 -5.379 -11.655 1.00 0.00 C ATOM 0 HA VAL A 790 24.340 -8.072 -9.577 1.00 0.00 H new ATOM 0 HB VAL A 790 24.347 -7.381 -11.959 1.00 0.00 H new ATOM 0 HG11 VAL A 790 22.372 -5.914 -11.808 1.00 0.00 H new ATOM 0 HG12 VAL A 790 22.305 -7.253 -10.638 1.00 0.00 H new ATOM 0 HG13 VAL A 790 22.739 -5.615 -10.093 1.00 0.00 H new ATOM 0 HG21 VAL A 790 24.512 -4.988 -12.541 1.00 0.00 H new ATOM 0 HG22 VAL A 790 25.001 -4.624 -10.869 1.00 0.00 H new ATOM 0 HG23 VAL A 790 26.043 -5.630 -11.902 1.00 0.00 H new ATOM 1542 N CYS A 791 26.399 -8.760 -10.982 1.00 0.00 N ATOM 1543 CA CYS A 791 27.645 -9.322 -11.368 1.00 0.00 C ATOM 1544 C CYS A 791 27.965 -8.832 -12.750 1.00 0.00 C ATOM 1545 O CYS A 791 27.164 -8.995 -13.670 1.00 0.00 O ATOM 1546 CB CYS A 791 27.557 -10.846 -11.354 1.00 0.00 C ATOM 1547 SG CYS A 791 26.961 -11.537 -9.774 1.00 0.00 S ATOM 0 H CYS A 791 25.582 -9.254 -11.342 1.00 0.00 H new ATOM 0 HA CYS A 791 28.429 -9.022 -10.673 1.00 0.00 H new ATOM 0 HB2 CYS A 791 26.892 -11.169 -12.155 1.00 0.00 H new ATOM 0 HB3 CYS A 791 28.542 -11.259 -11.572 1.00 0.00 H new ATOM 0 HG CYS A 791 26.516 -12.743 -9.968 1.00 0.00 H new ATOM 1552 N ARG A 792 29.081 -8.183 -12.877 1.00 0.00 N ATOM 1553 CA ARG A 792 29.551 -7.700 -14.149 1.00 0.00 C ATOM 1554 C ARG A 792 30.073 -8.857 -14.966 1.00 0.00 C ATOM 1555 O ARG A 792 30.421 -9.902 -14.403 1.00 0.00 O ATOM 1556 CB ARG A 792 30.664 -6.659 -13.941 1.00 0.00 C ATOM 1557 CG ARG A 792 30.182 -5.248 -13.625 1.00 0.00 C ATOM 1558 CD ARG A 792 29.492 -4.647 -14.837 1.00 0.00 C ATOM 1559 NE ARG A 792 29.155 -3.227 -14.682 1.00 0.00 N ATOM 1560 CZ ARG A 792 29.637 -2.253 -15.483 1.00 0.00 C ATOM 1561 NH1 ARG A 792 30.706 -2.487 -16.249 1.00 0.00 N ATOM 1562 NH2 ARG A 792 29.081 -1.051 -15.485 1.00 0.00 N ATOM 0 H ARG A 792 29.701 -7.969 -12.096 1.00 0.00 H new ATOM 0 HA ARG A 792 28.725 -7.227 -14.680 1.00 0.00 H new ATOM 0 HB2 ARG A 792 31.308 -6.996 -13.129 1.00 0.00 H new ATOM 0 HB3 ARG A 792 31.278 -6.623 -14.841 1.00 0.00 H new ATOM 0 HG2 ARG A 792 29.494 -5.271 -12.780 1.00 0.00 H new ATOM 0 HG3 ARG A 792 31.026 -4.624 -13.331 1.00 0.00 H new ATOM 0 HD2 ARG A 792 30.138 -4.765 -15.707 1.00 0.00 H new ATOM 0 HD3 ARG A 792 28.579 -5.208 -15.039 1.00 0.00 H new ATOM 0 HE ARG A 792 28.522 -2.961 -13.928 1.00 0.00 H new ATOM 0 HH11 ARG A 792 31.158 -3.401 -16.229 1.00 0.00 H new ATOM 0 HH12 ARG A 792 31.071 -1.751 -16.854 1.00 0.00 H new ATOM 0 HH21 ARG A 792 28.284 -0.857 -14.879 1.00 0.00 H new ATOM 0 HH22 ARG A 792 29.450 -0.319 -16.093 1.00 0.00 H new ATOM 1576 N GLU A 793 30.088 -8.697 -16.273 1.00 0.00 N ATOM 1577 CA GLU A 793 30.666 -9.693 -17.136 1.00 0.00 C ATOM 1578 C GLU A 793 32.127 -9.845 -16.838 1.00 0.00 C ATOM 1579 O GLU A 793 32.805 -8.890 -16.421 1.00 0.00 O ATOM 1580 CB GLU A 793 30.494 -9.330 -18.595 1.00 0.00 C ATOM 1581 CG GLU A 793 29.097 -9.520 -19.119 1.00 0.00 C ATOM 1582 CD GLU A 793 28.763 -10.978 -19.294 1.00 0.00 C ATOM 1583 OE1 GLU A 793 29.237 -11.597 -20.289 1.00 0.00 O ATOM 1584 OE2 GLU A 793 28.052 -11.542 -18.458 1.00 0.00 O ATOM 0 H GLU A 793 29.705 -7.885 -16.756 1.00 0.00 H new ATOM 0 HA GLU A 793 30.146 -10.633 -16.949 1.00 0.00 H new ATOM 0 HB2 GLU A 793 30.784 -8.289 -18.735 1.00 0.00 H new ATOM 0 HB3 GLU A 793 31.178 -9.934 -19.191 1.00 0.00 H new ATOM 0 HG2 GLU A 793 28.385 -9.063 -18.432 1.00 0.00 H new ATOM 0 HG3 GLU A 793 28.993 -9.005 -20.074 1.00 0.00 H new ATOM 1591 N ALA A 794 32.619 -11.000 -17.130 1.00 0.00 N ATOM 1592 CA ALA A 794 33.987 -11.365 -16.849 1.00 0.00 C ATOM 1593 C ALA A 794 34.948 -10.592 -17.738 1.00 0.00 C ATOM 1594 O ALA A 794 36.135 -10.478 -17.459 1.00 0.00 O ATOM 1595 CB ALA A 794 34.149 -12.849 -17.040 1.00 0.00 C ATOM 0 H ALA A 794 32.080 -11.740 -17.580 1.00 0.00 H new ATOM 0 HA ALA A 794 34.224 -11.109 -15.816 1.00 0.00 H new ATOM 0 HB1 ALA A 794 35.180 -13.133 -16.830 1.00 0.00 H new ATOM 0 HB2 ALA A 794 33.481 -13.378 -16.360 1.00 0.00 H new ATOM 0 HB3 ALA A 794 33.903 -13.112 -18.069 1.00 0.00 H new ATOM 1601 N SER A 795 34.408 -10.056 -18.790 1.00 0.00 N ATOM 1602 CA SER A 795 35.126 -9.281 -19.737 1.00 0.00 C ATOM 1603 C SER A 795 34.967 -7.771 -19.471 1.00 0.00 C ATOM 1604 O SER A 795 35.497 -6.947 -20.214 1.00 0.00 O ATOM 1605 CB SER A 795 34.575 -9.652 -21.103 1.00 0.00 C ATOM 1606 OG SER A 795 33.140 -9.748 -21.035 1.00 0.00 O ATOM 0 H SER A 795 33.418 -10.154 -19.014 1.00 0.00 H new ATOM 0 HA SER A 795 36.194 -9.489 -19.672 1.00 0.00 H new ATOM 0 HB2 SER A 795 34.865 -8.902 -21.839 1.00 0.00 H new ATOM 0 HB3 SER A 795 34.998 -10.601 -21.431 1.00 0.00 H new ATOM 0 HG SER A 795 32.786 -9.986 -21.917 1.00 0.00 H new ATOM 1612 N GLU A 796 34.240 -7.410 -18.409 1.00 0.00 N ATOM 1613 CA GLU A 796 33.960 -6.004 -18.136 1.00 0.00 C ATOM 1614 C GLU A 796 34.255 -5.601 -16.697 1.00 0.00 C ATOM 1615 O GLU A 796 33.847 -4.525 -16.252 1.00 0.00 O ATOM 1616 CB GLU A 796 32.518 -5.663 -18.490 1.00 0.00 C ATOM 1617 CG GLU A 796 32.218 -5.724 -19.976 1.00 0.00 C ATOM 1618 CD GLU A 796 30.836 -5.250 -20.298 1.00 0.00 C ATOM 1619 OE1 GLU A 796 29.911 -6.089 -20.439 1.00 0.00 O ATOM 1620 OE2 GLU A 796 30.638 -4.026 -20.410 1.00 0.00 O ATOM 0 H GLU A 796 33.841 -8.064 -17.735 1.00 0.00 H new ATOM 0 HA GLU A 796 34.637 -5.431 -18.770 1.00 0.00 H new ATOM 0 HB2 GLU A 796 31.854 -6.351 -17.967 1.00 0.00 H new ATOM 0 HB3 GLU A 796 32.292 -4.661 -18.125 1.00 0.00 H new ATOM 0 HG2 GLU A 796 32.943 -5.115 -20.516 1.00 0.00 H new ATOM 0 HG3 GLU A 796 32.339 -6.749 -20.327 1.00 0.00 H new ATOM 1627 N CYS A 797 34.966 -6.420 -15.992 1.00 0.00 N ATOM 1628 CA CYS A 797 35.335 -6.106 -14.630 1.00 0.00 C ATOM 1629 C CYS A 797 36.705 -5.409 -14.603 1.00 0.00 C ATOM 1630 O CYS A 797 37.749 -6.030 -14.829 1.00 0.00 O ATOM 1631 CB CYS A 797 35.262 -7.358 -13.763 1.00 0.00 C ATOM 1632 SG CYS A 797 35.951 -8.840 -14.557 1.00 0.00 S ATOM 0 H CYS A 797 35.310 -7.319 -16.330 1.00 0.00 H new ATOM 0 HA CYS A 797 34.625 -5.400 -14.200 1.00 0.00 H new ATOM 0 HB2 CYS A 797 35.796 -7.175 -12.831 1.00 0.00 H new ATOM 0 HB3 CYS A 797 34.221 -7.548 -13.502 1.00 0.00 H new ATOM 0 HG CYS A 797 37.237 -8.874 -14.370 1.00 0.00 H new ATOM 1637 N GLU A 798 36.662 -4.115 -14.316 1.00 0.00 N ATOM 1638 CA GLU A 798 37.798 -3.160 -14.429 1.00 0.00 C ATOM 1639 C GLU A 798 38.954 -3.367 -13.416 1.00 0.00 C ATOM 1640 O GLU A 798 39.769 -2.455 -13.232 1.00 0.00 O ATOM 1641 CB GLU A 798 37.246 -1.752 -14.208 1.00 0.00 C ATOM 1642 CG GLU A 798 36.187 -1.313 -15.197 1.00 0.00 C ATOM 1643 CD GLU A 798 35.492 -0.060 -14.735 1.00 0.00 C ATOM 1644 OE1 GLU A 798 35.886 1.048 -15.130 1.00 0.00 O ATOM 1645 OE2 GLU A 798 34.540 -0.165 -13.934 1.00 0.00 O ATOM 0 H GLU A 798 35.808 -3.667 -13.983 1.00 0.00 H new ATOM 0 HA GLU A 798 38.227 -3.325 -15.417 1.00 0.00 H new ATOM 0 HB2 GLU A 798 36.827 -1.697 -13.203 1.00 0.00 H new ATOM 0 HB3 GLU A 798 38.074 -1.044 -14.248 1.00 0.00 H new ATOM 0 HG2 GLU A 798 36.645 -1.139 -16.170 1.00 0.00 H new ATOM 0 HG3 GLU A 798 35.455 -2.110 -15.327 1.00 0.00 H new ATOM 1652 N GLU A 799 39.084 -4.520 -12.819 1.00 0.00 N ATOM 1653 CA GLU A 799 40.065 -4.663 -11.756 1.00 0.00 C ATOM 1654 C GLU A 799 41.287 -5.487 -12.189 1.00 0.00 C ATOM 1655 O GLU A 799 41.146 -6.533 -12.821 1.00 0.00 O ATOM 1656 CB GLU A 799 39.412 -5.241 -10.499 1.00 0.00 C ATOM 1657 CG GLU A 799 40.286 -5.137 -9.264 1.00 0.00 C ATOM 1658 CD GLU A 799 40.723 -3.711 -9.020 1.00 0.00 C ATOM 1659 OE1 GLU A 799 39.905 -2.897 -8.556 1.00 0.00 O ATOM 1660 OE2 GLU A 799 41.896 -3.375 -9.312 1.00 0.00 O ATOM 0 H GLU A 799 38.544 -5.358 -13.035 1.00 0.00 H new ATOM 0 HA GLU A 799 40.439 -3.666 -11.522 1.00 0.00 H new ATOM 0 HB2 GLU A 799 38.472 -4.721 -10.315 1.00 0.00 H new ATOM 0 HB3 GLU A 799 39.167 -6.289 -10.675 1.00 0.00 H new ATOM 0 HG2 GLU A 799 39.739 -5.506 -8.396 1.00 0.00 H new ATOM 0 HG3 GLU A 799 41.163 -5.773 -9.382 1.00 0.00 H new ATOM 1667 N GLU A 800 42.473 -5.023 -11.814 1.00 0.00 N ATOM 1668 CA GLU A 800 43.719 -5.675 -12.161 1.00 0.00 C ATOM 1669 C GLU A 800 44.155 -6.633 -11.070 1.00 0.00 C ATOM 1670 O GLU A 800 45.000 -6.327 -10.214 1.00 0.00 O ATOM 1671 CB GLU A 800 44.844 -4.680 -12.544 1.00 0.00 C ATOM 1672 CG GLU A 800 45.089 -3.558 -11.539 1.00 0.00 C ATOM 1673 CD GLU A 800 46.226 -2.637 -11.925 1.00 0.00 C ATOM 1674 OE1 GLU A 800 46.170 -2.016 -13.020 1.00 0.00 O ATOM 1675 OE2 GLU A 800 47.177 -2.475 -11.122 1.00 0.00 O ATOM 0 H GLU A 800 42.592 -4.177 -11.257 1.00 0.00 H new ATOM 0 HA GLU A 800 43.525 -6.257 -13.062 1.00 0.00 H new ATOM 0 HB2 GLU A 800 45.771 -5.238 -12.675 1.00 0.00 H new ATOM 0 HB3 GLU A 800 44.601 -4.235 -13.509 1.00 0.00 H new ATOM 0 HG2 GLU A 800 44.177 -2.971 -11.433 1.00 0.00 H new ATOM 0 HG3 GLU A 800 45.302 -3.995 -10.563 1.00 0.00 H new ATOM 1682 N GLY A 801 43.484 -7.734 -11.044 1.00 0.00 N ATOM 1683 CA GLY A 801 43.819 -8.802 -10.125 1.00 0.00 C ATOM 1684 C GLY A 801 44.879 -9.730 -10.702 1.00 0.00 C ATOM 1685 O GLY A 801 45.572 -9.373 -11.675 1.00 0.00 O ATOM 0 H GLY A 801 42.689 -7.932 -11.651 1.00 0.00 H new ATOM 0 HA2 GLY A 801 44.179 -8.376 -9.188 1.00 0.00 H new ATOM 0 HA3 GLY A 801 42.922 -9.375 -9.891 1.00 0.00 H new ATOM 1689 N PHE A 802 45.004 -10.893 -10.140 1.00 0.00 N ATOM 1690 CA PHE A 802 45.957 -11.887 -10.613 1.00 0.00 C ATOM 1691 C PHE A 802 45.381 -12.701 -11.765 1.00 0.00 C ATOM 1692 O PHE A 802 44.328 -12.364 -12.339 1.00 0.00 O ATOM 1693 CB PHE A 802 46.345 -12.841 -9.483 1.00 0.00 C ATOM 1694 CG PHE A 802 47.162 -12.218 -8.413 1.00 0.00 C ATOM 1695 CD1 PHE A 802 48.531 -12.125 -8.549 1.00 0.00 C ATOM 1696 CD2 PHE A 802 46.576 -11.738 -7.267 1.00 0.00 C ATOM 1697 CE1 PHE A 802 49.291 -11.568 -7.563 1.00 0.00 C ATOM 1698 CE2 PHE A 802 47.336 -11.174 -6.283 1.00 0.00 C ATOM 1699 CZ PHE A 802 48.698 -11.086 -6.425 1.00 0.00 C ATOM 0 H PHE A 802 44.452 -11.194 -9.337 1.00 0.00 H new ATOM 0 HA PHE A 802 46.838 -11.349 -10.961 1.00 0.00 H new ATOM 0 HB2 PHE A 802 45.437 -13.249 -9.040 1.00 0.00 H new ATOM 0 HB3 PHE A 802 46.898 -13.680 -9.905 1.00 0.00 H new ATOM 0 HD1 PHE A 802 49.006 -12.497 -9.445 1.00 0.00 H new ATOM 0 HD2 PHE A 802 45.505 -11.807 -7.143 1.00 0.00 H new ATOM 0 HE1 PHE A 802 50.363 -11.507 -7.679 1.00 0.00 H new ATOM 0 HE2 PHE A 802 46.863 -10.795 -5.389 1.00 0.00 H new ATOM 0 HZ PHE A 802 49.298 -10.640 -5.646 1.00 0.00 H new ATOM 1709 N SER A 803 46.081 -13.744 -12.115 1.00 0.00 N ATOM 1710 CA SER A 803 45.656 -14.659 -13.107 1.00 0.00 C ATOM 1711 C SER A 803 45.687 -16.039 -12.483 1.00 0.00 C ATOM 1712 O SER A 803 46.655 -16.387 -11.796 1.00 0.00 O ATOM 1713 CB SER A 803 46.589 -14.593 -14.295 1.00 0.00 C ATOM 1714 OG SER A 803 46.730 -13.260 -14.734 1.00 0.00 O ATOM 0 H SER A 803 46.984 -13.976 -11.701 1.00 0.00 H new ATOM 0 HA SER A 803 44.651 -14.423 -13.458 1.00 0.00 H new ATOM 0 HB2 SER A 803 47.564 -14.998 -14.023 1.00 0.00 H new ATOM 0 HB3 SER A 803 46.201 -15.211 -15.105 1.00 0.00 H new ATOM 0 HG SER A 803 46.870 -13.248 -15.704 1.00 0.00 H new ATOM 1720 N ILE A 804 44.650 -16.792 -12.687 1.00 0.00 N ATOM 1721 CA ILE A 804 44.524 -18.098 -12.071 1.00 0.00 C ATOM 1722 C ILE A 804 44.155 -19.123 -13.123 1.00 0.00 C ATOM 1723 O ILE A 804 43.806 -18.761 -14.254 1.00 0.00 O ATOM 1724 CB ILE A 804 43.466 -18.136 -10.894 1.00 0.00 C ATOM 1725 CG1 ILE A 804 41.995 -17.993 -11.383 1.00 0.00 C ATOM 1726 CG2 ILE A 804 43.771 -17.070 -9.842 1.00 0.00 C ATOM 1727 CD1 ILE A 804 41.633 -16.661 -12.005 1.00 0.00 C ATOM 0 H ILE A 804 43.864 -16.529 -13.281 1.00 0.00 H new ATOM 0 HA ILE A 804 45.492 -18.333 -11.629 1.00 0.00 H new ATOM 0 HB ILE A 804 43.560 -19.125 -10.445 1.00 0.00 H new ATOM 0 HG12 ILE A 804 41.797 -18.779 -12.112 1.00 0.00 H new ATOM 0 HG13 ILE A 804 41.332 -18.169 -10.536 1.00 0.00 H new ATOM 0 HG21 ILE A 804 43.028 -17.121 -9.047 1.00 0.00 H new ATOM 0 HG22 ILE A 804 44.762 -17.245 -9.424 1.00 0.00 H new ATOM 0 HG23 ILE A 804 43.741 -16.083 -10.304 1.00 0.00 H new ATOM 0 HD11 ILE A 804 40.586 -16.674 -12.309 1.00 0.00 H new ATOM 0 HD12 ILE A 804 41.790 -15.865 -11.277 1.00 0.00 H new ATOM 0 HD13 ILE A 804 42.262 -16.484 -12.878 1.00 0.00 H new ATOM 1739 N CYS A 805 44.217 -20.366 -12.763 1.00 0.00 N ATOM 1740 CA CYS A 805 43.910 -21.442 -13.663 1.00 0.00 C ATOM 1741 C CYS A 805 42.592 -22.055 -13.276 1.00 0.00 C ATOM 1742 O CYS A 805 42.403 -22.515 -12.128 1.00 0.00 O ATOM 1743 CB CYS A 805 45.017 -22.484 -13.636 1.00 0.00 C ATOM 1744 SG CYS A 805 44.730 -23.915 -14.714 1.00 0.00 S ATOM 0 H CYS A 805 44.485 -20.670 -11.827 1.00 0.00 H new ATOM 0 HA CYS A 805 43.836 -21.055 -14.679 1.00 0.00 H new ATOM 0 HB2 CYS A 805 45.954 -22.008 -13.927 1.00 0.00 H new ATOM 0 HB3 CYS A 805 45.143 -22.836 -12.612 1.00 0.00 H new ATOM 0 HG CYS A 805 44.610 -24.987 -13.989 1.00 0.00 H new ATOM 1749 N VAL A 806 41.669 -22.032 -14.198 1.00 0.00 N ATOM 1750 CA VAL A 806 40.363 -22.546 -13.944 1.00 0.00 C ATOM 1751 C VAL A 806 40.039 -23.615 -14.980 1.00 0.00 C ATOM 1752 O VAL A 806 40.226 -23.400 -16.186 1.00 0.00 O ATOM 1753 CB VAL A 806 39.296 -21.420 -14.025 1.00 0.00 C ATOM 1754 CG1 VAL A 806 37.968 -21.872 -13.476 1.00 0.00 C ATOM 1755 CG2 VAL A 806 39.752 -20.138 -13.354 1.00 0.00 C ATOM 0 H VAL A 806 41.805 -21.658 -15.137 1.00 0.00 H new ATOM 0 HA VAL A 806 40.345 -22.969 -12.940 1.00 0.00 H new ATOM 0 HB VAL A 806 39.165 -21.198 -15.084 1.00 0.00 H new ATOM 0 HG11 VAL A 806 37.248 -21.057 -13.550 1.00 0.00 H new ATOM 0 HG12 VAL A 806 37.609 -22.727 -14.049 1.00 0.00 H new ATOM 0 HG13 VAL A 806 38.085 -22.159 -12.431 1.00 0.00 H new ATOM 0 HG21 VAL A 806 38.969 -19.384 -13.440 1.00 0.00 H new ATOM 0 HG22 VAL A 806 39.956 -20.331 -12.301 1.00 0.00 H new ATOM 0 HG23 VAL A 806 40.659 -19.776 -13.839 1.00 0.00 H new ATOM 1765 N GLU A 807 39.579 -24.748 -14.520 1.00 0.00 N ATOM 1766 CA GLU A 807 39.181 -25.808 -15.382 1.00 0.00 C ATOM 1767 C GLU A 807 37.763 -25.554 -15.818 1.00 0.00 C ATOM 1768 O GLU A 807 36.834 -25.570 -15.013 1.00 0.00 O ATOM 1769 CB GLU A 807 39.303 -27.170 -14.706 1.00 0.00 C ATOM 1770 CG GLU A 807 39.019 -28.338 -15.637 1.00 0.00 C ATOM 1771 CD GLU A 807 39.133 -29.660 -14.951 1.00 0.00 C ATOM 1772 OE1 GLU A 807 38.108 -30.182 -14.488 1.00 0.00 O ATOM 1773 OE2 GLU A 807 40.255 -30.212 -14.857 1.00 0.00 O ATOM 0 H GLU A 807 39.472 -24.954 -13.527 1.00 0.00 H new ATOM 0 HA GLU A 807 39.844 -25.832 -16.247 1.00 0.00 H new ATOM 0 HB2 GLU A 807 40.309 -27.276 -14.300 1.00 0.00 H new ATOM 0 HB3 GLU A 807 38.613 -27.211 -13.863 1.00 0.00 H new ATOM 0 HG2 GLU A 807 38.016 -28.233 -16.051 1.00 0.00 H new ATOM 0 HG3 GLU A 807 39.714 -28.307 -16.476 1.00 0.00 H new ATOM 1780 N VAL A 808 37.624 -25.252 -17.060 1.00 0.00 N ATOM 1781 CA VAL A 808 36.372 -24.927 -17.680 1.00 0.00 C ATOM 1782 C VAL A 808 36.421 -25.546 -19.046 1.00 0.00 C ATOM 1783 O VAL A 808 37.493 -25.585 -19.648 1.00 0.00 O ATOM 1784 CB VAL A 808 36.220 -23.406 -17.855 1.00 0.00 C ATOM 1785 CG1 VAL A 808 34.908 -23.011 -18.479 1.00 0.00 C ATOM 1786 CG2 VAL A 808 36.480 -22.662 -16.588 1.00 0.00 C ATOM 0 H VAL A 808 38.411 -25.221 -17.708 1.00 0.00 H new ATOM 0 HA VAL A 808 35.542 -25.286 -17.071 1.00 0.00 H new ATOM 0 HB VAL A 808 36.994 -23.112 -18.564 1.00 0.00 H new ATOM 0 HG11 VAL A 808 34.863 -21.926 -18.575 1.00 0.00 H new ATOM 0 HG12 VAL A 808 34.823 -23.467 -19.466 1.00 0.00 H new ATOM 0 HG13 VAL A 808 34.087 -23.354 -17.849 1.00 0.00 H new ATOM 0 HG21 VAL A 808 36.360 -21.593 -16.763 1.00 0.00 H new ATOM 0 HG22 VAL A 808 35.773 -22.986 -15.824 1.00 0.00 H new ATOM 0 HG23 VAL A 808 37.497 -22.863 -16.250 1.00 0.00 H new ATOM 1796 N ASN A 809 35.298 -26.082 -19.514 1.00 0.00 N ATOM 1797 CA ASN A 809 35.191 -26.748 -20.826 1.00 0.00 C ATOM 1798 C ASN A 809 35.945 -28.066 -20.832 1.00 0.00 C ATOM 1799 O ASN A 809 36.027 -28.748 -21.848 1.00 0.00 O ATOM 1800 CB ASN A 809 35.699 -25.853 -21.962 1.00 0.00 C ATOM 1801 CG ASN A 809 34.794 -24.683 -22.233 1.00 0.00 C ATOM 1802 OD1 ASN A 809 33.570 -24.754 -22.079 1.00 0.00 O ATOM 1803 ND2 ASN A 809 35.366 -23.599 -22.580 1.00 0.00 N ATOM 0 H ASN A 809 34.421 -26.071 -18.993 1.00 0.00 H new ATOM 0 HA ASN A 809 34.132 -26.945 -20.996 1.00 0.00 H new ATOM 0 HB2 ASN A 809 36.694 -25.486 -21.711 1.00 0.00 H new ATOM 0 HB3 ASN A 809 35.798 -26.448 -22.870 1.00 0.00 H new ATOM 0 HD21 ASN A 809 34.811 -22.758 -22.739 1.00 0.00 H new ATOM 0 HD22 ASN A 809 36.379 -23.572 -22.699 1.00 0.00 H new ATOM 1810 N GLY A 810 36.462 -28.437 -19.674 1.00 0.00 N ATOM 1811 CA GLY A 810 37.293 -29.610 -19.555 1.00 0.00 C ATOM 1812 C GLY A 810 38.757 -29.243 -19.687 1.00 0.00 C ATOM 1813 O GLY A 810 39.648 -30.079 -19.498 1.00 0.00 O ATOM 0 H GLY A 810 36.316 -27.934 -18.799 1.00 0.00 H new ATOM 0 HA2 GLY A 810 37.118 -30.090 -18.592 1.00 0.00 H new ATOM 0 HA3 GLY A 810 37.023 -30.333 -20.325 1.00 0.00 H new ATOM 1817 N LYS A 811 39.000 -27.985 -19.986 1.00 0.00 N ATOM 1818 CA LYS A 811 40.331 -27.467 -20.185 1.00 0.00 C ATOM 1819 C LYS A 811 40.711 -26.694 -18.967 1.00 0.00 C ATOM 1820 O LYS A 811 39.885 -26.408 -18.143 1.00 0.00 O ATOM 1821 CB LYS A 811 40.348 -26.472 -21.345 1.00 0.00 C ATOM 1822 CG LYS A 811 39.664 -26.932 -22.606 1.00 0.00 C ATOM 1823 CD LYS A 811 40.363 -28.089 -23.306 1.00 0.00 C ATOM 1824 CE LYS A 811 41.733 -27.672 -23.841 1.00 0.00 C ATOM 1825 NZ LYS A 811 42.379 -28.737 -24.633 1.00 0.00 N ATOM 0 H LYS A 811 38.266 -27.286 -20.099 1.00 0.00 H new ATOM 0 HA LYS A 811 41.006 -28.299 -20.386 1.00 0.00 H new ATOM 0 HB2 LYS A 811 39.876 -25.547 -21.014 1.00 0.00 H new ATOM 0 HB3 LYS A 811 41.385 -26.234 -21.581 1.00 0.00 H new ATOM 0 HG2 LYS A 811 38.644 -27.230 -22.365 1.00 0.00 H new ATOM 0 HG3 LYS A 811 39.596 -26.092 -23.297 1.00 0.00 H new ATOM 0 HD2 LYS A 811 40.480 -28.920 -22.610 1.00 0.00 H new ATOM 0 HD3 LYS A 811 39.743 -28.447 -24.128 1.00 0.00 H new ATOM 0 HE2 LYS A 811 41.622 -26.781 -24.459 1.00 0.00 H new ATOM 0 HE3 LYS A 811 42.379 -27.402 -23.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 43.304 -28.405 -24.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 42.511 -29.580 -24.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 41.778 -28.978 -25.447 1.00 0.00 H new ATOM 1839 N GLU A 812 41.927 -26.332 -18.889 1.00 0.00 N ATOM 1840 CA GLU A 812 42.398 -25.478 -17.821 1.00 0.00 C ATOM 1841 C GLU A 812 42.913 -24.208 -18.404 1.00 0.00 C ATOM 1842 O GLU A 812 44.023 -24.156 -18.937 1.00 0.00 O ATOM 1843 CB GLU A 812 43.417 -26.156 -16.907 1.00 0.00 C ATOM 1844 CG GLU A 812 42.787 -27.143 -15.950 1.00 0.00 C ATOM 1845 CD GLU A 812 43.771 -27.766 -15.010 1.00 0.00 C ATOM 1846 OE1 GLU A 812 44.091 -27.171 -13.950 1.00 0.00 O ATOM 1847 OE2 GLU A 812 44.233 -28.890 -15.282 1.00 0.00 O ATOM 0 H GLU A 812 42.647 -26.608 -19.556 1.00 0.00 H new ATOM 0 HA GLU A 812 41.554 -25.255 -17.168 1.00 0.00 H new ATOM 0 HB2 GLU A 812 44.158 -26.672 -17.518 1.00 0.00 H new ATOM 0 HB3 GLU A 812 43.949 -25.394 -16.337 1.00 0.00 H new ATOM 0 HG2 GLU A 812 42.014 -26.636 -15.372 1.00 0.00 H new ATOM 0 HG3 GLU A 812 42.294 -27.929 -16.522 1.00 0.00 H new ATOM 1854 N GLN A 813 42.077 -23.214 -18.362 1.00 0.00 N ATOM 1855 CA GLN A 813 42.338 -21.945 -18.970 1.00 0.00 C ATOM 1856 C GLN A 813 42.676 -20.918 -17.914 1.00 0.00 C ATOM 1857 O GLN A 813 42.105 -20.926 -16.814 1.00 0.00 O ATOM 1858 CB GLN A 813 41.087 -21.531 -19.750 1.00 0.00 C ATOM 1859 CG GLN A 813 41.147 -20.179 -20.432 1.00 0.00 C ATOM 1860 CD GLN A 813 39.893 -19.905 -21.237 1.00 0.00 C ATOM 1861 OE1 GLN A 813 38.940 -19.239 -20.640 1.00 0.00 O flip ATOM 1862 NE2 GLN A 813 39.795 -20.271 -22.407 1.00 0.00 N flip ATOM 0 H GLN A 813 41.173 -23.265 -17.892 1.00 0.00 H new ATOM 0 HA GLN A 813 43.191 -22.014 -19.645 1.00 0.00 H new ATOM 0 HB2 GLN A 813 40.888 -22.289 -20.507 1.00 0.00 H new ATOM 0 HB3 GLN A 813 40.239 -21.533 -19.065 1.00 0.00 H new ATOM 0 HG2 GLN A 813 41.277 -19.398 -19.683 1.00 0.00 H new ATOM 0 HG3 GLN A 813 42.017 -20.140 -21.088 1.00 0.00 H new ATOM 0 HE21 GLN A 813 40.557 -20.789 -22.845 1.00 0.00 H new ATOM 0 HE22 GLN A 813 38.952 -20.056 -22.940 1.00 0.00 H new ATOM 1871 N THR A 814 43.606 -20.065 -18.229 1.00 0.00 N ATOM 1872 CA THR A 814 43.979 -19.003 -17.349 1.00 0.00 C ATOM 1873 C THR A 814 43.003 -17.861 -17.530 1.00 0.00 C ATOM 1874 O THR A 814 42.668 -17.498 -18.665 1.00 0.00 O ATOM 1875 CB THR A 814 45.390 -18.498 -17.671 1.00 0.00 C ATOM 1876 OG1 THR A 814 46.304 -19.598 -17.660 1.00 0.00 O ATOM 1877 CG2 THR A 814 45.851 -17.458 -16.659 1.00 0.00 C ATOM 0 H THR A 814 44.127 -20.088 -19.106 1.00 0.00 H new ATOM 0 HA THR A 814 43.963 -19.373 -16.324 1.00 0.00 H new ATOM 0 HB THR A 814 45.366 -18.034 -18.657 1.00 0.00 H new ATOM 0 HG1 THR A 814 46.261 -20.068 -18.519 1.00 0.00 H new ATOM 0 HG21 THR A 814 46.855 -17.120 -16.916 1.00 0.00 H new ATOM 0 HG22 THR A 814 45.168 -16.609 -16.673 1.00 0.00 H new ATOM 0 HG23 THR A 814 45.861 -17.899 -15.662 1.00 0.00 H new ATOM 1885 N MET A 815 42.517 -17.339 -16.452 1.00 0.00 N ATOM 1886 CA MET A 815 41.627 -16.218 -16.513 1.00 0.00 C ATOM 1887 C MET A 815 42.142 -15.176 -15.599 1.00 0.00 C ATOM 1888 O MET A 815 43.037 -15.447 -14.777 1.00 0.00 O ATOM 1889 CB MET A 815 40.212 -16.577 -16.052 1.00 0.00 C ATOM 1890 CG MET A 815 39.653 -17.812 -16.672 1.00 0.00 C ATOM 1891 SD MET A 815 37.890 -17.969 -16.451 1.00 0.00 S ATOM 1892 CE MET A 815 37.653 -19.507 -17.296 1.00 0.00 C ATOM 0 H MET A 815 42.721 -17.671 -15.510 1.00 0.00 H new ATOM 0 HA MET A 815 41.578 -15.882 -17.549 1.00 0.00 H new ATOM 0 HB2 MET A 815 40.217 -16.700 -14.969 1.00 0.00 H new ATOM 0 HB3 MET A 815 39.548 -15.742 -16.275 1.00 0.00 H new ATOM 0 HG2 MET A 815 39.881 -17.812 -17.738 1.00 0.00 H new ATOM 0 HG3 MET A 815 40.146 -18.683 -16.241 1.00 0.00 H new ATOM 0 HE1 MET A 815 36.599 -19.625 -17.549 1.00 0.00 H new ATOM 0 HE2 MET A 815 38.248 -19.516 -18.209 1.00 0.00 H new ATOM 0 HE3 MET A 815 37.965 -20.328 -16.651 1.00 0.00 H new ATOM 1902 N SER A 816 41.618 -14.009 -15.717 1.00 0.00 N ATOM 1903 CA SER A 816 41.922 -12.995 -14.791 1.00 0.00 C ATOM 1904 C SER A 816 41.079 -13.249 -13.562 1.00 0.00 C ATOM 1905 O SER A 816 39.998 -13.843 -13.653 1.00 0.00 O ATOM 1906 CB SER A 816 41.646 -11.620 -15.383 1.00 0.00 C ATOM 1907 OG SER A 816 42.414 -11.425 -16.565 1.00 0.00 O ATOM 0 H SER A 816 40.970 -13.737 -16.457 1.00 0.00 H new ATOM 0 HA SER A 816 42.980 -13.011 -14.531 1.00 0.00 H new ATOM 0 HB2 SER A 816 40.585 -11.522 -15.611 1.00 0.00 H new ATOM 0 HB3 SER A 816 41.888 -10.848 -14.653 1.00 0.00 H new ATOM 0 HG SER A 816 42.225 -10.538 -16.935 1.00 0.00 H new ATOM 1913 N GLU A 817 41.592 -12.865 -12.446 1.00 0.00 N ATOM 1914 CA GLU A 817 40.962 -13.045 -11.162 1.00 0.00 C ATOM 1915 C GLU A 817 39.521 -12.518 -11.141 1.00 0.00 C ATOM 1916 O GLU A 817 38.587 -13.220 -10.740 1.00 0.00 O ATOM 1917 CB GLU A 817 41.808 -12.331 -10.177 1.00 0.00 C ATOM 1918 CG GLU A 817 41.437 -12.556 -8.770 1.00 0.00 C ATOM 1919 CD GLU A 817 42.563 -12.225 -7.883 1.00 0.00 C ATOM 1920 OE1 GLU A 817 43.241 -11.218 -8.124 1.00 0.00 O ATOM 1921 OE2 GLU A 817 42.772 -12.967 -6.928 1.00 0.00 O ATOM 0 H GLU A 817 42.497 -12.398 -12.388 1.00 0.00 H new ATOM 0 HA GLU A 817 40.885 -14.106 -10.925 1.00 0.00 H new ATOM 0 HB2 GLU A 817 42.844 -12.637 -10.319 1.00 0.00 H new ATOM 0 HB3 GLU A 817 41.760 -11.262 -10.385 1.00 0.00 H new ATOM 0 HG2 GLU A 817 40.572 -11.945 -8.513 1.00 0.00 H new ATOM 0 HG3 GLU A 817 41.146 -13.597 -8.626 1.00 0.00 H new ATOM 1928 N CYS A 818 39.352 -11.312 -11.620 1.00 0.00 N ATOM 1929 CA CYS A 818 38.052 -10.682 -11.690 1.00 0.00 C ATOM 1930 C CYS A 818 37.120 -11.440 -12.654 1.00 0.00 C ATOM 1931 O CYS A 818 35.935 -11.604 -12.388 1.00 0.00 O ATOM 1932 CB CYS A 818 38.235 -9.226 -12.113 1.00 0.00 C ATOM 1933 SG CYS A 818 39.333 -9.025 -13.559 1.00 0.00 S ATOM 0 H CYS A 818 40.114 -10.734 -11.975 1.00 0.00 H new ATOM 0 HA CYS A 818 37.577 -10.711 -10.709 1.00 0.00 H new ATOM 0 HB2 CYS A 818 37.260 -8.797 -12.344 1.00 0.00 H new ATOM 0 HB3 CYS A 818 38.642 -8.660 -11.275 1.00 0.00 H new ATOM 0 HG CYS A 818 40.143 -8.029 -13.354 1.00 0.00 H new ATOM 1938 N GLU A 819 37.712 -11.943 -13.721 1.00 0.00 N ATOM 1939 CA GLU A 819 37.046 -12.671 -14.780 1.00 0.00 C ATOM 1940 C GLU A 819 36.485 -13.983 -14.247 1.00 0.00 C ATOM 1941 O GLU A 819 35.272 -14.171 -14.231 1.00 0.00 O ATOM 1942 CB GLU A 819 38.068 -12.902 -15.906 1.00 0.00 C ATOM 1943 CG GLU A 819 37.615 -13.680 -17.126 1.00 0.00 C ATOM 1944 CD GLU A 819 38.678 -13.672 -18.198 1.00 0.00 C ATOM 1945 OE1 GLU A 819 38.346 -13.477 -19.386 1.00 0.00 O ATOM 1946 OE2 GLU A 819 39.883 -13.773 -17.865 1.00 0.00 O ATOM 0 H GLU A 819 38.715 -11.850 -13.878 1.00 0.00 H new ATOM 0 HA GLU A 819 36.201 -12.103 -15.170 1.00 0.00 H new ATOM 0 HB2 GLU A 819 38.421 -11.927 -16.243 1.00 0.00 H new ATOM 0 HB3 GLU A 819 38.926 -13.421 -15.478 1.00 0.00 H new ATOM 0 HG2 GLU A 819 37.387 -14.708 -16.843 1.00 0.00 H new ATOM 0 HG3 GLU A 819 36.695 -13.246 -17.518 1.00 0.00 H new ATOM 1953 N ALA A 820 37.366 -14.851 -13.750 1.00 0.00 N ATOM 1954 CA ALA A 820 36.971 -16.151 -13.214 1.00 0.00 C ATOM 1955 C ALA A 820 35.941 -15.994 -12.103 1.00 0.00 C ATOM 1956 O ALA A 820 34.990 -16.788 -11.989 1.00 0.00 O ATOM 1957 CB ALA A 820 38.173 -16.875 -12.672 1.00 0.00 C ATOM 0 H ALA A 820 38.369 -14.673 -13.708 1.00 0.00 H new ATOM 0 HA ALA A 820 36.529 -16.727 -14.027 1.00 0.00 H new ATOM 0 HB1 ALA A 820 37.866 -17.843 -12.275 1.00 0.00 H new ATOM 0 HB2 ALA A 820 38.899 -17.024 -13.471 1.00 0.00 H new ATOM 0 HB3 ALA A 820 38.626 -16.283 -11.876 1.00 0.00 H new ATOM 1963 N GLY A 821 36.133 -14.955 -11.289 1.00 0.00 N ATOM 1964 CA GLY A 821 35.222 -14.660 -10.217 1.00 0.00 C ATOM 1965 C GLY A 821 33.834 -14.370 -10.718 1.00 0.00 C ATOM 1966 O GLY A 821 32.848 -14.874 -10.158 1.00 0.00 O ATOM 0 H GLY A 821 36.919 -14.310 -11.364 1.00 0.00 H new ATOM 0 HA2 GLY A 821 35.189 -15.503 -9.527 1.00 0.00 H new ATOM 0 HA3 GLY A 821 35.590 -13.802 -9.654 1.00 0.00 H new ATOM 1970 N ALA A 822 33.750 -13.606 -11.793 1.00 0.00 N ATOM 1971 CA ALA A 822 32.482 -13.255 -12.380 1.00 0.00 C ATOM 1972 C ALA A 822 31.787 -14.480 -12.957 1.00 0.00 C ATOM 1973 O ALA A 822 30.561 -14.596 -12.856 1.00 0.00 O ATOM 1974 CB ALA A 822 32.636 -12.164 -13.414 1.00 0.00 C ATOM 0 H ALA A 822 34.559 -13.216 -12.277 1.00 0.00 H new ATOM 0 HA ALA A 822 31.847 -12.860 -11.587 1.00 0.00 H new ATOM 0 HB1 ALA A 822 31.661 -11.923 -13.837 1.00 0.00 H new ATOM 0 HB2 ALA A 822 33.057 -11.275 -12.945 1.00 0.00 H new ATOM 0 HB3 ALA A 822 33.301 -12.506 -14.207 1.00 0.00 H new ATOM 1980 N LEU A 823 32.563 -15.423 -13.526 1.00 0.00 N ATOM 1981 CA LEU A 823 31.977 -16.681 -14.015 1.00 0.00 C ATOM 1982 C LEU A 823 31.290 -17.438 -12.885 1.00 0.00 C ATOM 1983 O LEU A 823 30.189 -17.968 -13.071 1.00 0.00 O ATOM 1984 CB LEU A 823 32.974 -17.631 -14.728 1.00 0.00 C ATOM 1985 CG LEU A 823 33.401 -17.322 -16.183 1.00 0.00 C ATOM 1986 CD1 LEU A 823 32.220 -16.972 -17.067 1.00 0.00 C ATOM 1987 CD2 LEU A 823 34.480 -16.281 -16.263 1.00 0.00 C ATOM 0 H LEU A 823 33.571 -15.340 -13.655 1.00 0.00 H new ATOM 0 HA LEU A 823 31.253 -16.369 -14.768 1.00 0.00 H new ATOM 0 HB2 LEU A 823 33.879 -17.672 -14.122 1.00 0.00 H new ATOM 0 HB3 LEU A 823 32.539 -18.630 -14.719 1.00 0.00 H new ATOM 0 HG LEU A 823 33.830 -18.246 -16.571 1.00 0.00 H new ATOM 0 HD11 LEU A 823 32.571 -16.763 -18.078 1.00 0.00 H new ATOM 0 HD12 LEU A 823 31.523 -17.809 -17.091 1.00 0.00 H new ATOM 0 HD13 LEU A 823 31.716 -16.091 -16.669 1.00 0.00 H new ATOM 0 HD21 LEU A 823 34.739 -16.105 -17.307 1.00 0.00 H new ATOM 0 HD22 LEU A 823 34.124 -15.353 -15.816 1.00 0.00 H new ATOM 0 HD23 LEU A 823 35.361 -16.628 -15.724 1.00 0.00 H new ATOM 1999 N ARG A 824 31.918 -17.459 -11.709 1.00 0.00 N ATOM 2000 CA ARG A 824 31.337 -18.139 -10.539 1.00 0.00 C ATOM 2001 C ARG A 824 30.025 -17.468 -10.184 1.00 0.00 C ATOM 2002 O ARG A 824 28.994 -18.111 -10.028 1.00 0.00 O ATOM 2003 CB ARG A 824 32.251 -18.053 -9.297 1.00 0.00 C ATOM 2004 CG ARG A 824 33.698 -18.491 -9.473 1.00 0.00 C ATOM 2005 CD ARG A 824 34.431 -18.498 -8.131 1.00 0.00 C ATOM 2006 NE ARG A 824 34.319 -17.203 -7.406 1.00 0.00 N ATOM 2007 CZ ARG A 824 34.701 -16.979 -6.111 1.00 0.00 C ATOM 2008 NH1 ARG A 824 35.218 -17.963 -5.367 1.00 0.00 N ATOM 2009 NH2 ARG A 824 34.553 -15.769 -5.574 1.00 0.00 N ATOM 0 H ARG A 824 32.822 -17.019 -11.536 1.00 0.00 H new ATOM 0 HA ARG A 824 31.205 -19.188 -10.805 1.00 0.00 H new ATOM 0 HB2 ARG A 824 32.250 -17.021 -8.946 1.00 0.00 H new ATOM 0 HB3 ARG A 824 31.807 -18.659 -8.507 1.00 0.00 H new ATOM 0 HG2 ARG A 824 33.730 -19.487 -9.915 1.00 0.00 H new ATOM 0 HG3 ARG A 824 34.204 -17.819 -10.165 1.00 0.00 H new ATOM 0 HD2 ARG A 824 34.028 -19.295 -7.506 1.00 0.00 H new ATOM 0 HD3 ARG A 824 35.484 -18.726 -8.298 1.00 0.00 H new ATOM 0 HE ARG A 824 33.924 -16.415 -7.918 1.00 0.00 H new ATOM 0 HH11 ARG A 824 35.332 -18.896 -5.763 1.00 0.00 H new ATOM 0 HH12 ARG A 824 35.498 -17.780 -4.403 1.00 0.00 H new ATOM 0 HH21 ARG A 824 34.155 -15.010 -6.128 1.00 0.00 H new ATOM 0 HH22 ARG A 824 34.837 -15.601 -4.609 1.00 0.00 H new ATOM 2023 N CYS A 825 30.087 -16.167 -10.114 1.00 0.00 N ATOM 2024 CA CYS A 825 28.982 -15.327 -9.715 1.00 0.00 C ATOM 2025 C CYS A 825 27.778 -15.383 -10.643 1.00 0.00 C ATOM 2026 O CYS A 825 26.639 -15.437 -10.170 1.00 0.00 O ATOM 2027 CB CYS A 825 29.485 -13.922 -9.524 1.00 0.00 C ATOM 2028 SG CYS A 825 30.529 -13.772 -8.057 1.00 0.00 S ATOM 0 H CYS A 825 30.932 -15.642 -10.339 1.00 0.00 H new ATOM 0 HA CYS A 825 28.600 -15.719 -8.772 1.00 0.00 H new ATOM 0 HB2 CYS A 825 30.050 -13.616 -10.404 1.00 0.00 H new ATOM 0 HB3 CYS A 825 28.638 -13.242 -9.437 1.00 0.00 H new ATOM 0 HG CYS A 825 31.275 -12.713 -8.162 1.00 0.00 H new ATOM 2033 N ARG A 826 28.014 -15.399 -11.951 1.00 0.00 N ATOM 2034 CA ARG A 826 26.915 -15.467 -12.916 1.00 0.00 C ATOM 2035 C ARG A 826 26.220 -16.818 -12.880 1.00 0.00 C ATOM 2036 O ARG A 826 25.031 -16.924 -13.180 1.00 0.00 O ATOM 2037 CB ARG A 826 27.379 -15.141 -14.344 1.00 0.00 C ATOM 2038 CG ARG A 826 28.541 -15.959 -14.835 1.00 0.00 C ATOM 2039 CD ARG A 826 28.885 -15.637 -16.273 1.00 0.00 C ATOM 2040 NE ARG A 826 27.858 -16.098 -17.204 1.00 0.00 N ATOM 2041 CZ ARG A 826 27.893 -15.917 -18.528 1.00 0.00 C ATOM 2042 NH1 ARG A 826 28.874 -15.210 -19.073 1.00 0.00 N ATOM 2043 NH2 ARG A 826 26.943 -16.447 -19.298 1.00 0.00 N ATOM 0 H ARG A 826 28.945 -15.366 -12.367 1.00 0.00 H new ATOM 0 HA ARG A 826 26.195 -14.705 -12.618 1.00 0.00 H new ATOM 0 HB2 ARG A 826 26.540 -15.284 -15.025 1.00 0.00 H new ATOM 0 HB3 ARG A 826 27.651 -14.086 -14.390 1.00 0.00 H new ATOM 0 HG2 ARG A 826 29.409 -15.773 -14.203 1.00 0.00 H new ATOM 0 HG3 ARG A 826 28.303 -17.019 -14.746 1.00 0.00 H new ATOM 0 HD2 ARG A 826 29.014 -14.560 -16.381 1.00 0.00 H new ATOM 0 HD3 ARG A 826 29.838 -16.099 -16.529 1.00 0.00 H new ATOM 0 HE ARG A 826 27.056 -16.594 -16.816 1.00 0.00 H new ATOM 0 HH11 ARG A 826 29.600 -14.805 -18.482 1.00 0.00 H new ATOM 0 HH12 ARG A 826 28.902 -15.071 -20.083 1.00 0.00 H new ATOM 0 HH21 ARG A 826 26.190 -16.991 -18.877 1.00 0.00 H new ATOM 0 HH22 ARG A 826 26.969 -16.309 -20.308 1.00 0.00 H new ATOM 2057 N GLY A 827 26.943 -17.833 -12.480 1.00 0.00 N ATOM 2058 CA GLY A 827 26.370 -19.151 -12.453 1.00 0.00 C ATOM 2059 C GLY A 827 26.928 -20.044 -13.533 1.00 0.00 C ATOM 2060 O GLY A 827 26.342 -21.081 -13.856 1.00 0.00 O ATOM 0 H GLY A 827 27.914 -17.773 -12.173 1.00 0.00 H new ATOM 0 HA2 GLY A 827 26.555 -19.604 -11.479 1.00 0.00 H new ATOM 0 HA3 GLY A 827 25.289 -19.076 -12.570 1.00 0.00 H new ATOM 2064 N GLN A 828 28.043 -19.645 -14.110 1.00 0.00 N ATOM 2065 CA GLN A 828 28.702 -20.443 -15.125 1.00 0.00 C ATOM 2066 C GLN A 828 29.447 -21.603 -14.454 1.00 0.00 C ATOM 2067 O GLN A 828 29.857 -21.494 -13.302 1.00 0.00 O ATOM 2068 CB GLN A 828 29.665 -19.561 -15.944 1.00 0.00 C ATOM 2069 CG GLN A 828 30.371 -20.272 -17.095 1.00 0.00 C ATOM 2070 CD GLN A 828 29.405 -20.922 -18.059 1.00 0.00 C ATOM 2071 OE1 GLN A 828 29.054 -22.096 -17.903 1.00 0.00 O ATOM 2072 NE2 GLN A 828 28.977 -20.193 -19.043 1.00 0.00 N ATOM 0 H GLN A 828 28.515 -18.767 -13.892 1.00 0.00 H new ATOM 0 HA GLN A 828 27.961 -20.856 -15.810 1.00 0.00 H new ATOM 0 HB2 GLN A 828 29.106 -18.716 -16.347 1.00 0.00 H new ATOM 0 HB3 GLN A 828 30.420 -19.152 -15.272 1.00 0.00 H new ATOM 0 HG2 GLN A 828 30.990 -19.555 -17.635 1.00 0.00 H new ATOM 0 HG3 GLN A 828 31.041 -21.031 -16.691 1.00 0.00 H new ATOM 0 HE21 GLN A 828 29.291 -19.227 -19.136 1.00 0.00 H new ATOM 0 HE22 GLN A 828 28.326 -20.586 -19.723 1.00 0.00 H new ATOM 2081 N SER A 829 29.583 -22.709 -15.149 1.00 0.00 N ATOM 2082 CA SER A 829 30.281 -23.855 -14.614 1.00 0.00 C ATOM 2083 C SER A 829 31.791 -23.759 -14.922 1.00 0.00 C ATOM 2084 O SER A 829 32.215 -23.856 -16.081 1.00 0.00 O ATOM 2085 CB SER A 829 29.667 -25.137 -15.177 1.00 0.00 C ATOM 2086 OG SER A 829 28.272 -25.206 -14.866 1.00 0.00 O ATOM 0 H SER A 829 29.217 -22.839 -16.092 1.00 0.00 H new ATOM 0 HA SER A 829 30.173 -23.875 -13.530 1.00 0.00 H new ATOM 0 HB2 SER A 829 29.806 -25.169 -16.258 1.00 0.00 H new ATOM 0 HB3 SER A 829 30.181 -26.005 -14.763 1.00 0.00 H new ATOM 0 HG SER A 829 27.895 -26.032 -15.235 1.00 0.00 H new ATOM 2092 N ILE A 830 32.568 -23.505 -13.880 1.00 0.00 N ATOM 2093 CA ILE A 830 34.021 -23.352 -13.936 1.00 0.00 C ATOM 2094 C ILE A 830 34.572 -23.994 -12.668 1.00 0.00 C ATOM 2095 O ILE A 830 33.877 -24.022 -11.626 1.00 0.00 O ATOM 2096 CB ILE A 830 34.476 -21.823 -13.935 1.00 0.00 C ATOM 2097 CG1 ILE A 830 34.214 -21.079 -12.576 1.00 0.00 C ATOM 2098 CG2 ILE A 830 33.858 -21.061 -15.098 1.00 0.00 C ATOM 2099 CD1 ILE A 830 32.764 -20.831 -12.235 1.00 0.00 C ATOM 0 H ILE A 830 32.195 -23.395 -12.937 1.00 0.00 H new ATOM 0 HA ILE A 830 34.387 -23.809 -14.855 1.00 0.00 H new ATOM 0 HB ILE A 830 35.559 -21.843 -14.061 1.00 0.00 H new ATOM 0 HG12 ILE A 830 34.663 -21.661 -11.771 1.00 0.00 H new ATOM 0 HG13 ILE A 830 34.731 -20.120 -12.602 1.00 0.00 H new ATOM 0 HG21 ILE A 830 34.188 -20.022 -15.069 1.00 0.00 H new ATOM 0 HG22 ILE A 830 34.172 -21.515 -16.038 1.00 0.00 H new ATOM 0 HG23 ILE A 830 32.771 -21.099 -15.021 1.00 0.00 H new ATOM 0 HD11 ILE A 830 32.699 -20.313 -11.278 1.00 0.00 H new ATOM 0 HD12 ILE A 830 32.307 -20.218 -13.012 1.00 0.00 H new ATOM 0 HD13 ILE A 830 32.238 -21.783 -12.168 1.00 0.00 H new ATOM 2111 N SER A 831 35.745 -24.513 -12.726 1.00 0.00 N ATOM 2112 CA SER A 831 36.348 -25.110 -11.585 1.00 0.00 C ATOM 2113 C SER A 831 37.744 -24.549 -11.342 1.00 0.00 C ATOM 2114 O SER A 831 38.669 -24.891 -12.055 1.00 0.00 O ATOM 2115 CB SER A 831 36.425 -26.593 -11.822 1.00 0.00 C ATOM 2116 OG SER A 831 35.136 -27.155 -12.045 1.00 0.00 O ATOM 0 H SER A 831 36.318 -24.537 -13.569 1.00 0.00 H new ATOM 0 HA SER A 831 35.749 -24.891 -10.701 1.00 0.00 H new ATOM 0 HB2 SER A 831 37.063 -26.792 -12.683 1.00 0.00 H new ATOM 0 HB3 SER A 831 36.890 -27.076 -10.962 1.00 0.00 H new ATOM 0 HG SER A 831 35.221 -28.119 -12.197 1.00 0.00 H new ATOM 2122 N VAL A 832 37.892 -23.650 -10.378 1.00 0.00 N ATOM 2123 CA VAL A 832 39.213 -23.091 -10.075 1.00 0.00 C ATOM 2124 C VAL A 832 40.117 -24.184 -9.524 1.00 0.00 C ATOM 2125 O VAL A 832 39.938 -24.651 -8.393 1.00 0.00 O ATOM 2126 CB VAL A 832 39.160 -21.897 -9.081 1.00 0.00 C ATOM 2127 CG1 VAL A 832 40.573 -21.353 -8.809 1.00 0.00 C ATOM 2128 CG2 VAL A 832 38.264 -20.787 -9.623 1.00 0.00 C ATOM 0 H VAL A 832 37.132 -23.294 -9.799 1.00 0.00 H new ATOM 0 HA VAL A 832 39.614 -22.701 -11.010 1.00 0.00 H new ATOM 0 HB VAL A 832 38.740 -22.256 -8.142 1.00 0.00 H new ATOM 0 HG11 VAL A 832 40.513 -20.518 -8.111 1.00 0.00 H new ATOM 0 HG12 VAL A 832 41.190 -22.142 -8.379 1.00 0.00 H new ATOM 0 HG13 VAL A 832 41.018 -21.013 -9.744 1.00 0.00 H new ATOM 0 HG21 VAL A 832 38.240 -19.960 -8.913 1.00 0.00 H new ATOM 0 HG22 VAL A 832 38.657 -20.435 -10.577 1.00 0.00 H new ATOM 0 HG23 VAL A 832 37.254 -21.172 -9.767 1.00 0.00 H new ATOM 2138 N THR A 833 41.047 -24.616 -10.335 1.00 0.00 N ATOM 2139 CA THR A 833 41.925 -25.685 -9.958 1.00 0.00 C ATOM 2140 C THR A 833 43.130 -25.169 -9.199 1.00 0.00 C ATOM 2141 O THR A 833 43.633 -25.826 -8.276 1.00 0.00 O ATOM 2142 CB THR A 833 42.381 -26.468 -11.196 1.00 0.00 C ATOM 2143 OG1 THR A 833 42.825 -25.546 -12.211 1.00 0.00 O ATOM 2144 CG2 THR A 833 41.251 -27.321 -11.735 1.00 0.00 C ATOM 0 H THR A 833 41.214 -24.238 -11.268 1.00 0.00 H new ATOM 0 HA THR A 833 41.369 -26.352 -9.299 1.00 0.00 H new ATOM 0 HB THR A 833 43.204 -27.125 -10.913 1.00 0.00 H new ATOM 0 HG1 THR A 833 43.195 -26.046 -12.968 1.00 0.00 H new ATOM 0 HG21 THR A 833 41.595 -27.868 -12.613 1.00 0.00 H new ATOM 0 HG22 THR A 833 40.931 -28.028 -10.969 1.00 0.00 H new ATOM 0 HG23 THR A 833 40.413 -26.682 -12.011 1.00 0.00 H new ATOM 2152 N SER A 834 43.576 -23.988 -9.564 1.00 0.00 N ATOM 2153 CA SER A 834 44.756 -23.431 -8.978 1.00 0.00 C ATOM 2154 C SER A 834 44.777 -21.910 -9.083 1.00 0.00 C ATOM 2155 O SER A 834 44.208 -21.335 -10.008 1.00 0.00 O ATOM 2156 CB SER A 834 45.973 -24.077 -9.639 1.00 0.00 C ATOM 2157 OG SER A 834 45.740 -24.278 -11.031 1.00 0.00 O ATOM 0 H SER A 834 43.131 -23.399 -10.268 1.00 0.00 H new ATOM 0 HA SER A 834 44.773 -23.648 -7.910 1.00 0.00 H new ATOM 0 HB2 SER A 834 46.849 -23.443 -9.499 1.00 0.00 H new ATOM 0 HB3 SER A 834 46.190 -25.031 -9.160 1.00 0.00 H new ATOM 0 HG SER A 834 46.514 -23.962 -11.541 1.00 0.00 H new ATOM 2163 N ILE A 835 45.443 -21.266 -8.134 1.00 0.00 N ATOM 2164 CA ILE A 835 45.516 -19.811 -8.097 1.00 0.00 C ATOM 2165 C ILE A 835 46.762 -19.294 -8.809 1.00 0.00 C ATOM 2166 O ILE A 835 47.128 -18.112 -8.716 1.00 0.00 O ATOM 2167 CB ILE A 835 45.378 -19.247 -6.646 1.00 0.00 C ATOM 2168 CG1 ILE A 835 46.372 -19.851 -5.637 1.00 0.00 C ATOM 2169 CG2 ILE A 835 43.981 -19.464 -6.150 1.00 0.00 C ATOM 2170 CD1 ILE A 835 47.787 -19.394 -5.772 1.00 0.00 C ATOM 0 H ILE A 835 45.943 -21.731 -7.376 1.00 0.00 H new ATOM 0 HA ILE A 835 44.656 -19.433 -8.650 1.00 0.00 H new ATOM 0 HB ILE A 835 45.613 -18.185 -6.715 1.00 0.00 H new ATOM 0 HG12 ILE A 835 46.028 -19.616 -4.630 1.00 0.00 H new ATOM 0 HG13 ILE A 835 46.349 -20.936 -5.736 1.00 0.00 H new ATOM 0 HG21 ILE A 835 43.889 -19.069 -5.138 1.00 0.00 H new ATOM 0 HG22 ILE A 835 43.278 -18.950 -6.805 1.00 0.00 H new ATOM 0 HG23 ILE A 835 43.758 -20.531 -6.145 1.00 0.00 H new ATOM 0 HD11 ILE A 835 48.400 -19.880 -5.014 1.00 0.00 H new ATOM 0 HD12 ILE A 835 48.160 -19.654 -6.762 1.00 0.00 H new ATOM 0 HD13 ILE A 835 47.835 -18.313 -5.639 1.00 0.00 H new ATOM 2182 N ARG A 836 47.404 -20.196 -9.482 1.00 0.00 N ATOM 2183 CA ARG A 836 48.537 -19.920 -10.310 1.00 0.00 C ATOM 2184 C ARG A 836 48.053 -19.887 -11.736 1.00 0.00 C ATOM 2185 O ARG A 836 47.078 -20.573 -12.050 1.00 0.00 O ATOM 2186 CB ARG A 836 49.556 -21.027 -10.155 1.00 0.00 C ATOM 2187 CG ARG A 836 50.256 -21.010 -8.825 1.00 0.00 C ATOM 2188 CD ARG A 836 51.128 -22.219 -8.675 1.00 0.00 C ATOM 2189 NE ARG A 836 50.326 -23.457 -8.570 1.00 0.00 N ATOM 2190 CZ ARG A 836 50.485 -24.568 -9.314 1.00 0.00 C ATOM 2191 NH1 ARG A 836 51.426 -24.629 -10.245 1.00 0.00 N ATOM 2192 NH2 ARG A 836 49.695 -25.611 -9.113 1.00 0.00 N ATOM 0 H ARG A 836 47.144 -21.182 -9.470 1.00 0.00 H new ATOM 0 HA ARG A 836 48.999 -18.973 -10.032 1.00 0.00 H new ATOM 0 HB2 ARG A 836 49.060 -21.989 -10.284 1.00 0.00 H new ATOM 0 HB3 ARG A 836 50.298 -20.942 -10.949 1.00 0.00 H new ATOM 0 HG2 ARG A 836 50.859 -20.106 -8.736 1.00 0.00 H new ATOM 0 HG3 ARG A 836 49.521 -20.983 -8.021 1.00 0.00 H new ATOM 0 HD2 ARG A 836 51.801 -22.292 -9.529 1.00 0.00 H new ATOM 0 HD3 ARG A 836 51.751 -22.112 -7.787 1.00 0.00 H new ATOM 0 HE ARG A 836 49.584 -23.471 -7.870 1.00 0.00 H new ATOM 0 HH11 ARG A 836 52.039 -23.829 -10.404 1.00 0.00 H new ATOM 0 HH12 ARG A 836 51.537 -25.476 -10.803 1.00 0.00 H new ATOM 0 HH21 ARG A 836 48.970 -25.571 -8.397 1.00 0.00 H new ATOM 0 HH22 ARG A 836 49.812 -26.455 -9.674 1.00 0.00 H new ATOM 2206 N PRO A 837 48.664 -19.102 -12.614 1.00 0.00 N ATOM 2207 CA PRO A 837 48.256 -19.065 -14.002 1.00 0.00 C ATOM 2208 C PRO A 837 48.699 -20.334 -14.728 1.00 0.00 C ATOM 2209 O PRO A 837 49.718 -20.939 -14.379 1.00 0.00 O ATOM 2210 CB PRO A 837 48.972 -17.830 -14.582 1.00 0.00 C ATOM 2211 CG PRO A 837 49.623 -17.151 -13.415 1.00 0.00 C ATOM 2212 CD PRO A 837 49.790 -18.194 -12.353 1.00 0.00 C ATOM 0 HA PRO A 837 47.173 -19.008 -14.114 1.00 0.00 H new ATOM 0 HB2 PRO A 837 49.712 -18.121 -15.328 1.00 0.00 H new ATOM 0 HB3 PRO A 837 48.265 -17.165 -15.077 1.00 0.00 H new ATOM 0 HG2 PRO A 837 50.587 -16.730 -13.700 1.00 0.00 H new ATOM 0 HG3 PRO A 837 49.009 -16.326 -13.055 1.00 0.00 H new ATOM 0 HD2 PRO A 837 50.750 -18.705 -12.434 1.00 0.00 H new ATOM 0 HD3 PRO A 837 49.741 -17.765 -11.352 1.00 0.00 H new ATOM 2220 N CYS A 838 47.939 -20.747 -15.701 1.00 0.00 N ATOM 2221 CA CYS A 838 48.270 -21.915 -16.476 1.00 0.00 C ATOM 2222 C CYS A 838 49.012 -21.443 -17.717 1.00 0.00 C ATOM 2223 O CYS A 838 49.123 -20.233 -17.955 1.00 0.00 O ATOM 2224 CB CYS A 838 46.978 -22.656 -16.883 1.00 0.00 C ATOM 2225 SG CYS A 838 47.223 -24.267 -17.709 1.00 0.00 S ATOM 0 H CYS A 838 47.073 -20.287 -15.982 1.00 0.00 H new ATOM 0 HA CYS A 838 48.889 -22.601 -15.897 1.00 0.00 H new ATOM 0 HB2 CYS A 838 46.373 -22.813 -15.990 1.00 0.00 H new ATOM 0 HB3 CYS A 838 46.403 -22.010 -17.547 1.00 0.00 H new ATOM 0 HG CYS A 838 46.136 -24.602 -18.338 1.00 0.00 H new ATOM 2230 N ALA A 839 49.489 -22.362 -18.521 1.00 0.00 N ATOM 2231 CA ALA A 839 50.165 -22.023 -19.762 1.00 0.00 C ATOM 2232 C ALA A 839 49.145 -21.640 -20.836 1.00 0.00 C ATOM 2233 O ALA A 839 49.506 -21.271 -21.948 1.00 0.00 O ATOM 2234 CB ALA A 839 51.011 -23.191 -20.225 1.00 0.00 C ATOM 0 H ALA A 839 49.423 -23.364 -18.340 1.00 0.00 H new ATOM 0 HA ALA A 839 50.816 -21.167 -19.587 1.00 0.00 H new ATOM 0 HB1 ALA A 839 51.514 -22.929 -21.156 1.00 0.00 H new ATOM 0 HB2 ALA A 839 51.755 -23.426 -19.464 1.00 0.00 H new ATOM 0 HB3 ALA A 839 50.373 -24.060 -20.389 1.00 0.00 H new ATOM 2240 N ALA A 840 47.874 -21.746 -20.492 1.00 0.00 N ATOM 2241 CA ALA A 840 46.791 -21.397 -21.376 1.00 0.00 C ATOM 2242 C ALA A 840 46.365 -19.940 -21.179 1.00 0.00 C ATOM 2243 O ALA A 840 45.341 -19.655 -20.554 1.00 0.00 O ATOM 2244 CB ALA A 840 45.612 -22.335 -21.161 1.00 0.00 C ATOM 0 H ALA A 840 47.568 -22.081 -19.579 1.00 0.00 H new ATOM 0 HA ALA A 840 47.141 -21.505 -22.403 1.00 0.00 H new ATOM 0 HB1 ALA A 840 44.801 -22.060 -21.835 1.00 0.00 H new ATOM 0 HB2 ALA A 840 45.921 -23.360 -21.364 1.00 0.00 H new ATOM 0 HB3 ALA A 840 45.269 -22.257 -20.129 1.00 0.00 H new